*HEADER    TRANSPORT PROTEIN                       08-APR-09   2KHK              
*TITLE     NMR SOLUTION STRUCTURE OF THE B30-82 DOMAIN OF SUBUNIT B OF           
*TITLE    2 ESCHERICHIA COLI F1FO ATP SYNTHASE                                   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ATP SYNTHASE SUBUNIT B;                                    
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES IN UNP 30-82;                                     
*COMPND   5 SYNONYM: ATP SYNTHASE F(0) SECTOR SUBUNIT B, F-TYPE ATPASE           
*COMPND   6 SUBUNIT B, F-ATPASE SUBUNIT B, ATPASE SUBUNIT I;                     
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K-12;                          
*SOURCE   3 ORGANISM_TAXID: 83333;                                               
*SOURCE   4 STRAIN: K-12;                                                        
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: VECTOR;                               
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR: PET9D1-HIS3                                
*KEYWDS    B30-82, F1FO ATP SYNTHASE, NMR SPECTROSCOPY, ATP SYNTHESIS,           
*KEYWDS   2 CELL INNER MEMBRANE, CELL MEMBRANE, CF(0), HYDROGEN ION              
*KEYWDS   3 TRANSPORT, ION TRANSPORT, MEMBRANE, TRANSMEMBRANE,                   
*KEYWDS   4 TRANSPORT, TRANSPORT PROTEIN                                         
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    R.PRIYA, G.BIUKOVIC, S.GAYEN, S.VIVEKANANDAN, G.GRUBER                
*REVDAT   1   15-DEC-09 2KHK    0                                                


# Simulated annealing and violation analysis

read seq b30.seq

read upl b30.upl
read aco b30.aco #append

#The hbond command adds hydrogen bond between the HN of residue 1 to the O of residue2
hbond atom1=O residue1=10 atom2=H residue2=14
hbond atom1=O residue1=11 atom2=H residue2=15
hbond atom1=O residue1=12 atom2=H residue2=16
hbond atom1=O residue1=13 atom2=H residue2=17
hbond atom1=O residue1=14 atom2=H residue2=18
hbond atom1=O residue1=15 atom2=H residue2=19
hbond atom1=O residue1=16 atom2=H residue2=20
hbond atom1=O residue1=18 atom2=H residue2=22
hbond atom1=O residue1=19 atom2=H residue2=23
hbond atom1=O residue1=20 atom2=H residue2=24
hbond atom1=O residue1=21 atom2=H residue2=25
hbond atom1=O residue1=22 atom2=H residue2=26
hbond atom1=O residue1=23 atom2=H residue2=27
hbond atom1=O residue1=24 atom2=H residue2=28
hbond atom1=O residue1=25 atom2=H residue2=29
hbond atom1=O residue1=26 atom2=H residue2=30
hbond atom1=O residue1=27 atom2=H residue2=31
hbond atom1=O residue1=28 atom2=H residue2=32
hbond atom1=O residue1=29 atom2=H residue2=33
hbond atom1=O residue1=30 atom2=H residue2=34
hbond atom1=O residue1=31 atom2=H residue2=35
hbond atom1=O residue1=32 atom2=H residue2=36
hbond atom1=O residue1=33 atom2=H residue2=37
hbond atom1=O residue1=34 atom2=H residue2=38
hbond atom1=O residue1=35 atom2=H residue2=39
hbond atom1=O residue1=36 atom2=H residue2=40
hbond atom1=O residue1=37 atom2=H residue2=41
hbond atom1=O residue1=38 atom2=H residue2=42
hbond atom1=O residue1=39 atom2=H residue2=43
seed=5896
calc_all 50 

cut_upl=0.20
#overview 170 structures=10 cor

overview b30  structures=10 pdb

#dcostat dco
seqplot b30.ps
 13 ASP  HB2    14 GLY  H       4.84            #peak     3 #SUP  0.98  #QF  0.85
 13 ASP  HB3    14 GLY  H       4.84            #peak     3 #SUP  0.98  #QF  0.85
 32 ALA  QB     33 THR  H       4.27            #peak     4 #SUP  0.99  #QF  0.99
  2 ALA  H       2 ALA  QB      4.10            #peak     6 #SUP  1.00  #QF  0.99
  1 MET  HB2     2 ALA  H       5.03            #peak     7 #SUP  0.88  #QF  0.67
  1 MET  HB3     2 ALA  H       5.03            #peak     7 #SUP  0.88  #QF  0.67
  1 MET  HG2     2 ALA  H       5.50            #peak    10 #SUP  1.00  #QF  0.99
  1 MET  HG3     2 ALA  H       5.50            #peak    10 #SUP  1.00  #QF  0.99
  3 ALA  QB      4 ILE  H       3.83            #peak    14 #SUP  0.93  #QF  0.93
  4 ILE  H       4 ILE  HB      3.63            #peak    15 #SUP  0.93  #QF  0.93
  4 ILE  H       4 ILE  QD1     3.98            #peak    16 #SUP  0.92  #QF  0.92
  4 ILE  QD1     5 GLU  H       4.26            #peak    19 #SUP  0.82  #QF  0.82
  4 ILE  HB      5 GLU  H       4.18            #peak    20 #SUP  0.96  #QF  0.96
  3 ALA  H       3 ALA  QB      3.81            #peak    26 #SUP  1.00  #QF  0.99
 11 ILE  H      11 ILE  QD1     3.77            #peak    32 #SUP  0.95  #QF  0.95
 11 ILE  H      11 ILE  HG12    4.11            #peak    33 #SUP  0.98  #QF  0.98
 11 ILE  H      11 ILE  HB      3.74            #peak    34 #SUP  0.98  #QF  0.98
 11 ILE  H      11 ILE  HG13    4.11            #peak    35 #SUP  0.99  #QF  0.99
 10 GLU  H      10 GLU  HG2     5.50            #peak    37 #SUP  0.81  #QF  0.45
 10 GLU  H      10 GLU  HG3     5.50            #peak    37 #SUP  0.81  #QF  0.45
 11 ILE  QD1    12 ALA  H       4.23            #peak    40 #SUP  0.71  #QF  0.71
 46 ILE  QG2    47 ILE  H       5.50            #peak    41 #SUP  0.99  #QF  0.99
 12 ALA  H      12 ALA  QB      3.70            #peak    43 #SUP  0.99  #QF  0.99
 12 ALA  QB     13 ASP  H       4.00            #peak    45 #SUP  1.00
 16 ALA  H      16 ALA  QB      3.53            #peak    56 #SUP  0.97  #QF  0.96
 21 ALA  H      21 ALA  QB      3.79            #peak    56 #SUP  0.97  #QF  0.96
 16 ALA  QB     17 SER  H       4.05            #peak    58 #SUP  0.98  #QF  0.98
 18 ALA  QB     19 GLU  H       3.87            #peak    63 #SUP  1.00
 24 ASP  HB3    25 LEU  H       4.48            #peak    75 #SUP  0.97  #QF  0.89
 26 ASP  HB3    27 LEU  H       4.75            #peak    75 #SUP  0.97  #QF  0.89
 24 ASP  HB2    25 LEU  H       4.48            #peak    76 #SUP  1.00
  6 LYS  HA      7 ARG  H       3.43            #peak    80 #SUP  0.77  #QF  0.60
  6 LYS  QG      7 ARG  H       5.19            #peak    82 #SUP  1.00  #QF  0.59
 26 ASP  H      26 ASP  HB2     4.16            #peak    85 #SUP  1.00
 26 ASP  H      26 ASP  HB3     4.16            #peak    86 #SUP  0.76  #QF  0.76
 26 ASP  HB2    27 LEU  H       4.75            #peak    89 #SUP  1.00
 28 ALA  H      28 ALA  QB      3.55            #peak    97 #SUP  0.98  #QF  0.98
 30 ALA  QB     31 SER  H       4.35            #peak   101 #SUP  1.00
 31 SER  HB3    32 ALA  H       5.50            #peak   105 #SUP  1.00
 31 SER  HB2    32 ALA  H       5.50            #peak   106 #SUP  1.00
 33 THR  H      33 THR  HB      3.79            #peak   111 #SUP  0.84  #QF  0.84
 34 ASP  HB2    35 GLN  H       4.75            #peak   118 #SUP  0.98  #QF  0.86
 34 ASP  HB3    35 GLN  H       4.75            #peak   118 #SUP  0.98  #QF  0.86
 36 LEU  H      36 LEU  HB3     4.05            #peak   125 #SUP  0.72  #QF  0.29
 36 LEU  H      36 LEU  HB2     4.05            #peak   126 #SUP  0.99  #QF  0.99
 36 LEU  HB2    37 LYS  H       4.45            #peak   130 #SUP  0.96  #QF  0.26
 37 LYS  H      37 LYS  HB3     4.18            #peak   130 #SUP  0.96  #QF  0.26
 36 LEU  HB3    37 LYS  H       4.45            #peak   131 #SUP  0.78  #QF  0.78
 37 LYS  H      37 LYS  HB2     4.18            #peak   132 #SUP  0.97  #QF  0.97
 37 LYS  H      37 LYS  HG3     4.76            #peak   133 #SUP  0.94  #QF  0.94
 37 LYS  H      37 LYS  HG2     4.76            #peak   134 #SUP  0.96  #QF  0.96
 39 ALA  QB     40 LYS  H       3.84            #peak   144 #SUP  0.97  #QF  0.96
 40 LYS  H      40 LYS  HG3     4.40            #peak   144 #SUP  0.97  #QF  0.96
 40 LYS  H      40 LYS  HG2     4.40            #peak   149 #SUP  0.99  #QF  0.23
 46 ILE  H      46 ILE  HB      4.00            #peak   158 #SUP  0.75  #QF  0.62
 46 ILE  HB     47 ILE  H       4.43            #peak   158 #SUP  0.75  #QF  0.62
 47 ILE  H      47 ILE  HG12    5.50            #peak   159 #SUP  0.99  #QF  0.70
 46 ILE  H      46 ILE  QG2     5.11            #peak   160 #SUP  1.00  #QF  0.23
 46 ILE  H      46 ILE  QD1     4.64            #peak   161 #SUP  0.85  #QF  0.45
 11 ILE  HB     12 ALA  H       4.31            #peak   163 #SUP  0.78  #QF  0.39
 47 ILE  H      47 ILE  QG2     5.06            #peak   164 #SUP  1.00
 47 ILE  H      47 ILE  HG13    5.50            #peak   164 #SUP  1.00
 46 ILE  QD1    47 ILE  H       5.15            #peak   165 #SUP  0.85  #QF  0.23
 50 ALA  QB     51 ASN  H       5.50            #peak   170 #SUP  0.96  #QF  0.96
 12 ALA  HA     14 GLY  H       5.06            #peak   176 #SUP  0.42  #QF  0.20
 14 GLY  H      15 LEU  HA      5.50            #peak   176 #SUP  0.42  #QF  0.20
 18 ALA  H      19 GLU  HA      5.08            #peak   187 #SUP  0.33  #QF  0.33
 24 ASP  HA     27 LEU  H       4.18            #peak   196 #SUP  0.93  #QF  0.91
 28 ALA  QB     29 LYS  H       3.80            #peak   202 #SUP  0.99  #QF  0.96
 30 ALA  H      30 ALA  QB      3.84            #peak   206 #SUP  1.00  #QF  0.26
 39 ALA  H      39 ALA  QB      3.87            #peak   206 #SUP  1.00  #QF  0.26
 31 SER  HA     34 ASP  H       5.11            #peak   210 #SUP  0.54  #QF  0.54
 31 SER  HA     35 GLN  H       4.86            #peak   212 #SUP  0.45  #QF  0.45
 14 GLY  H      15 LEU  H       3.89            #peak   214 #SUP  0.59  #QF  0.59
 13 ASP  H      14 GLY  H       4.65            #peak   215 #SUP  0.96  #QF  0.96
  1 MET  H       1 MET  HG2     5.50            #peak   217 #SUP  1.00  #QF  0.95
  1 MET  H       1 MET  HG3     5.50            #peak   217 #SUP  1.00  #QF  0.95
  1 MET  H       2 ALA  H       5.50            #peak   218 #SUP  0.92  #QF  0.92
  4 ILE  H       5 GLU  H       3.85            #peak   220 #SUP  0.92  #QF  0.92
 21 ALA  QB     22 HIS  H       5.06            #peak   239 #SUP  1.00
 22 HIS  HB2    23 LYS  H       5.50            #peak   242 #SUP  1.00  #QF  0.97
 22 HIS  HB3    23 LYS  H       5.50            #peak   242 #SUP  1.00  #QF  0.97
 35 GLN  HB2    36 LEU  H       4.85            #peak   249 #SUP  0.95  #QF  0.75
 35 GLN  HB3    36 LEU  H       4.85            #peak   249 #SUP  0.95  #QF  0.75
 37 LYS  HG2    38 LYS  H       5.21            #peak   252 #SUP  0.73  #QF  0.31
 27 LEU  H      27 LEU  QB      3.84            #peak   253 #SUP  0.45  #QF  0.45
 37 LYS  HG3    38 LYS  H       5.21            #peak   254 #SUP  0.95  #QF  0.51
 38 LYS  H      39 ALA  QB      5.21            #peak   257 #SUP  0.81  #QF  0.70
  7 ARG  HA      8 GLN  H       3.50            #peak   260 #SUP  0.95  #QF  0.34
 41 ALA  QB     42 GLU  H       4.04            #peak   262 #SUP  1.00
 42 GLU  H      42 GLU  HB3     3.84            #peak   264 #SUP  0.96  #QF  0.96
 42 GLU  H      42 GLU  HB2     3.84            #peak   265 #SUP  0.98  #QF  0.22
 45 VAL  H      45 VAL  HB      3.98            #peak   277 #SUP  0.69  #QF  0.69
 45 VAL  HB     46 ILE  H       4.99            #peak   281 #SUP  0.71  #QF  0.71
 47 ILE  H      47 ILE  QD1     5.21            #peak   284 #SUP  0.93  #QF  0.83
 18 ALA  H      18 ALA  QB      3.88            #peak   285 #SUP  0.98  #QF  0.96
 12 ALA  H      13 ASP  H       4.54            #peak   286 #SUP  0.77  #QF  0.53
 24 ASP  H      25 LEU  H       5.11            #peak   287 #SUP  0.87  #QF  0.87
 35 GLN  H      36 LEU  H       4.45            #peak   288 #SUP  0.96  #QF  0.96
  3 ALA  HA      5 GLU  H       4.53            #peak   291 #SUP  0.48  #QF  0.48
 47 ILE  HA     48 GLU  H       3.55            #peak   308 #SUP  0.74  #QF  0.57
 47 ILE  HB     48 GLU  H       4.02            #peak   312 #SUP  0.61  #QF  0.61
 47 ILE  QD1    48 GLU  H       4.08            #peak   314 #SUP  0.76  #QF  0.76
 47 ILE  QG2    48 GLU  H       5.50            #peak   315 #SUP  1.00  #QF  0.99
 47 ILE  HG13   48 GLU  H       5.50            #peak   315 #SUP  1.00  #QF  0.99
 47 ILE  HG12   48 GLU  H       5.50            #peak   316 #SUP  1.00
 33 THR  H      33 THR  QG2     4.58            #peak   317 #SUP  0.96  #QF  0.96
 33 THR  QG2    34 ASP  H       5.02            #peak   319 #SUP  0.98  #QF  0.98
 24 ASP  HA     28 ALA  H       5.13            #peak   336 #SUP  0.26  #QF  0.26
  1 MET  H       1 MET  QB      3.69            #peak    11
  1 MET  H       1 MET  QG      4.78            #peak   217
  1 MET  QB      2 ALA  H       4.30            #peak     7
  4 ILE  H       4 ILE  QG1     4.49            #peak    17
  5 GLU  H       5 GLU  QB      3.43            #peak    27
  5 GLU  H       5 GLU  QG      4.43            #peak    22
  6 LYS  H       6 LYS  QB      3.56            #peak    29
  7 ARG  H       7 ARG  QB      3.69            #peak   226
  7 ARG  H       7 ARG  QG      4.46            #peak    83
  9 LYS  QD     10 GLU  H       4.91            #peak   231
 10 GLU  H      10 GLU  QG      4.82            #peak    37
 11 ILE  H      11 ILE  QG1     3.56            #peak    33
 11 ILE  QG1    12 ALA  H       5.34            #peak    41
 13 ASP  H      13 ASP  QB      3.61            #peak    47
 13 ASP  QB     14 GLY  H       4.13            #peak     3
 15 LEU  H      15 LEU  QB      3.40            #peak   125
 15 LEU  H      15 LEU  QQD     4.53            #peak   127
 15 LEU  QB     16 ALA  H       4.14            #peak    53
 15 LEU  QQD    16 ALA  H       4.62            #peak    54
 17 SER  H      17 SER  QB      3.67            #peak   328
 24 ASP  H      24 ASP  QB      3.59            #peak    72
 25 LEU  H      25 LEU  QB      3.05            #peak    78
 25 LEU  H      25 LEU  QQD     4.91            #peak    79
 25 LEU  QQD    26 ASP  H       4.47            #peak    81
 26 ASP  H      26 ASP  QB      3.36            #peak    86
 26 ASP  QB     27 LEU  H       4.18            #peak    75
 27 LEU  H      27 LEU  QQD     5.11            #peak    79
 27 LEU  QQD    28 ALA  H       4.62            #peak    93
 29 LYS  H      29 LYS  QB      3.59            #peak   199
 29 LYS  H      29 LYS  QG      3.97            #peak   201
 29 LYS  H      29 LYS  QD      5.30            #peak   200
 34 ASP  H      34 ASP  QB      3.57            #peak   116
 34 ASP  QB     35 GLN  H       4.08            #peak   118
 35 GLN  H      35 GLN  QB      3.52            #peak   121
 35 GLN  H      35 GLN  QG      4.46            #peak   120
 35 GLN  QB     36 LEU  H       4.16            #peak   249
 35 GLN  QG     36 LEU  H       4.85            #peak   123
 36 LEU  H      36 LEU  QQD     4.99            #peak   127
 36 LEU  QB     37 LYS  H       3.72            #peak   130
 37 LYS  H      37 LYS  QB      3.53            #peak   132
 37 LYS  H      37 LYS  QG      4.05            #peak   133
 37 LYS  H      37 LYS  QD      4.22            #peak   135
 38 LYS  H      38 LYS  QB      3.59            #peak   251
 38 LYS  H      38 LYS  QG      4.47            #peak   257
 40 LYS  H      40 LYS  QB      3.47            #peak   146
 40 LYS  H      40 LYS  QD      5.30            #peak   147
 40 LYS  H      40 LYS  QE      5.33            #peak   258
 40 LYS  QD     41 ALA  H       4.70            #peak   152
 40 LYS  QE     41 ALA  H       5.34            #peak   259
 42 GLU  H      42 GLU  QB      3.36            #peak   264
 46 ILE  H      46 ILE  QG1     4.43            #peak   186
 52 LYS  H      52 LYS  QG      4.90            #peak   311
 52 LYS  H      52 LYS  QD      4.82            #peak   310
# Torsion angle constraints 
# generated from CA secondary chemical shifts   
       
   1 MET   PHI -180.00  -30.00
   2 ALA   PHI -180.00  -30.00
   3 ALA   PHI -180.00  -30.00
   4 ILE   PHI -180.00  -30.00  
   5 GLU   PHI -180.00  -30.00
   6 LYS   PHI -180.00  -30.00  
   7 ARG   PHI -180.00  -30.00 
   8 GLN   PHI -180.00  -30.00
   9 LYS   PHI -180  -30.00
  10 GLU   PHI -97.10  -37.10
  10 GLU   PSI -73.81  -13.81
  11 ILE   PHI -99.91  -39.91
  11 ILE   PSI -74.33  -04.33
  12 ALA   PHI -93.09  -33.09
  12 ALA   PSI -69.26  -09.26
  13 ASP   PHI -104.24  -44.24
  13 ASP   PSI -56.57   04.57
  14 GLY   PHI  112.00   52.00
  14 GLY   PSI  -30.96   29.04
  15 LEU   PHI  -98.52  -38.52
  15 LEU   PSI  -60.53  -00.53
  16 ALA   PHI -93.34  -33.34
  16 ALA   PSI -67.73  -07.73
  17 SER   PHI -99.72  -39.72
  17 SER   PSI -59.41   00.59
  18 ALA   PHI -103.16  -43.16
  18 ALA   PSI -54.38   05.38
  19 GLU   PHI -103.45  -33.45
  19 GLU   PSI -57.24   03.24
  20 ARG   PHI -101.96  -41.96
  20 ARG   PSI -56.10   04.10
  21 ALA   PHI -95.98  -35.98 
  21 ALA   PHI -72.60  -12.60 
  22 HIS   PHI -95.08  -35.08 
  22 HIS   PHI -63.50  -03.50 
  23 LYS   PHI -97.25  -37.25
  23 LYS   PSI  -65.85  -05.85 
  24 ASP   PHI -103.5  -43.50
  24 ASP   PSI -58.23   02.23
  25 LEU   PHI -102.25  -42.25
  25 LEU   PSI -54.02   06.02
  26 ASP   PHI -99.21  -39.21 
  26 ASP   PSI -66.45  -06.45
  27 LEU   PHI -94.16  -34.16 
  27 LEU   PSI -65.75   -05.75
  28 ALA   PHI -98.65  -38.65
  28 ALA   PSI -60.92  -00.92
  29 LYS   PHI -102.23  -42.23
  29 LYS   PSI -55.27   05.27
  30 ALA   PHI -103.08  -33.08
  30 ALA   PSI -52.43   08.43
  31 SER   PHI -97.10  -37.10
  31 SER   PSI -72.03  -12.03
  32 ALA   PHI -98.36  -38.36
  32 ALA   PSI -69.41  -09.41
  33 THR   PHI -100.66  -40.66
  33 THR   PSI -65.99  -05.99
  34 ASP   PHI  -93.78  -33.78
  34 ASP   PSI  -69.09  -09.09
  35 GLN   PHI  -95.26  -35.26
  35 GLN   PSI  -68.48  -08.48
  36 LEU   PHI -96.62  -36.62
  36 LEU   PSI -63.38  -03.38
  37 LYS   PHI -96.58  -36.58
  37 LYS   PSI -60.56   00.56
  38 LYS   PHI -96.12   -36.12
  38 LYS   PSI -67.06  -07.06
  39 ALA   PHI -103.94  -43.94
  39 ALA   PSI -54.25   06.25
  40 LYS   PHI -97.47  -37.47
  40 LYS   PSI -60.90  -00.90
  41 ALA   PHI -102.68  -42.68 
  41 ALA   PHI -54.19    06.19
  42 GLU   PSI -106.12  -36.12
  42 GLU   PSI -57.10   03.90 
  43 ALA   PHI -110.46  -50.46
  43 ALA   PSI  -34.41   15.59 
  44 GLN   PHI -180.00  -30.00
  45 VAL   PHI -180.00  -30.00
  46 ILE   PHI -180.00  -30.00
  47 ILE   PHI -180.00  -30.00
  48 GLU   PHI -180.00  -30.00 
  49 GLN   PHI -180.00  -30.00
  50 ALA   PHI -180.00  -30.00
  51 ASN   PHI -180.00  -30.00
  52 LYS   PHI -180.00  -30.00
  
  
  

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1           H        MET   1   1.808   0.000   0.855
    2    HA   MET   1           HA       MET   1   1.765   0.841  -1.833
    3    HB2  MET   1           1HB      MET   1   3.832  -0.443  -0.080
    4    HB3  MET   1           2HB      MET   1   4.148  -0.215  -1.795
    5    HG2  MET   1           1HG      MET   1   4.252   2.058  -1.620
    6    HG3  MET   1           2HG      MET   1   3.187   2.109  -0.217
    7    HE1  MET   1           3HE      MET   1   5.836   3.923   1.143
    8    HE2  MET   1           1HE      MET   1   6.916   3.473  -0.178
    9    HE3  MET   1           2HE      MET   1   5.232   3.878  -0.514
   10    H    ALA   2           H        ALA   2   1.721  -2.338  -0.339
   11    HA   ALA   2           HA       ALA   2   1.842  -3.642  -2.950
   12    HB1  ALA   2           1HB      ALA   2   1.606  -5.713  -1.309
   13    HB2  ALA   2           2HB      ALA   2   3.149  -4.902  -1.577
   14    HB3  ALA   2           3HB      ALA   2   2.195  -4.530  -0.141
   15    H    ALA   3           H        ALA   3  -0.215  -3.931  -0.045
   16    HA   ALA   3           HA       ALA   3  -2.408  -4.882  -1.718
   17    HB1  ALA   3           1HB      ALA   3  -2.111  -4.717   1.277
   18    HB2  ALA   3           2HB      ALA   3  -3.534  -5.343   0.443
   19    HB3  ALA   3           3HB      ALA   3  -1.981  -6.161   0.272
   20    H    ILE   4           H        ILE   4  -3.652  -3.379  -2.622
   21    HA   ILE   4           HA       ILE   4  -3.864  -0.715  -1.660
   22    HB   ILE   4           HB       ILE   4  -5.671  -2.115  -3.634
   23   HG12  ILE   4          1HG1      ILE   4  -3.153  -0.509  -4.127
   24   HG13  ILE   4          2HG1      ILE   4  -3.290  -2.257  -4.278
   25   HG21  ILE   4          1HG2      ILE   4  -5.326   0.615  -4.236
   26   HG22  ILE   4          2HG2      ILE   4  -6.789  -0.201  -3.689
   27   HG23  ILE   4          3HG2      ILE   4  -5.686   0.512  -2.513
   28   HD11  ILE   4          3HD1      ILE   4  -5.242  -1.565  -5.937
   29   HD12  ILE   4          1HD1      ILE   4  -4.249  -0.114  -6.071
   30   HD13  ILE   4          2HD1      ILE   4  -3.560  -1.693  -6.449
   31    H    GLU   5           H        GLU   5  -6.458  -3.135  -2.064
   32    HA   GLU   5           HA       GLU   5  -7.467  -2.715   0.578
   33    HB2  GLU   5           1HB      GLU   5  -8.225  -0.729  -1.045
   34    HB3  GLU   5           2HB      GLU   5  -9.465  -1.901  -1.467
   35    HG2  GLU   5           1HG      GLU   5  -9.422  -1.962   1.293
   36    HG3  GLU   5           2HG      GLU   5  -9.188  -0.259   0.902
   37    H    LYS   6           H        LYS   6  -6.689  -5.018  -0.573
   38    HA   LYS   6           HA       LYS   6  -9.101  -6.580  -0.497
   39    HB2  LYS   6           1HB      LYS   6  -8.552  -5.714  -2.968
   40    HB3  LYS   6           2HB      LYS   6  -7.495  -7.119  -2.941
   41    HG2  LYS   6           1HG      LYS   6 -10.173  -7.688  -1.949
   42    HG3  LYS   6           2HG      LYS   6 -10.149  -7.115  -3.619
   43    HD2  LYS   6           1HD      LYS   6  -9.139  -8.984  -4.377
   44    HD3  LYS   6           2HD      LYS   6  -8.100  -9.119  -2.956
   45    HE2  LYS   6           1HE      LYS   6  -9.632 -11.002  -3.078
   46    HE3  LYS   6           2HE      LYS   6  -9.989 -10.005  -1.669
   47    HZ1  LYS   6           3HZ      LYS   6 -11.878 -10.827  -3.266
   48    HZ2  LYS   6           1HZ      LYS   6 -11.437  -9.456  -4.154
   49    HZ3  LYS   6           2HZ      LYS   6 -11.949  -9.295  -2.550
   50    H    ARG   7           H        ARG   7  -8.275  -7.737   1.186
   51    HA   ARG   7           HA       ARG   7  -6.545  -9.890   0.619
   52    HB2  ARG   7           1HB      ARG   7  -4.659  -9.277   2.099
   53    HB3  ARG   7           2HB      ARG   7  -4.780  -8.233   0.689
   54    HG2  ARG   7           1HG      ARG   7  -4.748  -6.481   2.037
   55    HG3  ARG   7           2HG      ARG   7  -6.297  -7.002   2.703
   56    HD2  ARG   7           1HD      ARG   7  -5.331  -7.996   4.533
   57    HD3  ARG   7           2HD      ARG   7  -3.803  -8.286   3.701
   58    HE   ARG   7           HE       ARG   7  -3.079  -6.217   4.373
   59   HH11  ARG   7          1HH1      ARG   7  -6.518  -6.449   4.858
   60   HH12  ARG   7          2HH1      ARG   7  -6.626  -4.962   5.741
   61   HH21  ARG   7          1HH2      ARG   7  -3.207  -4.258   5.533
   62   HH22  ARG   7          2HH2      ARG   7  -4.742  -3.716   6.123
   63    H    GLN   8           H        GLN   8  -6.787 -11.477   2.111
   64    HA   GLN   8           HA       GLN   8  -8.229 -10.770   4.582
   65    HB2  GLN   8           1HB      GLN   8  -9.557 -12.056   2.880
   66    HB3  GLN   8           2HB      GLN   8  -8.423 -13.385   3.085
   67    HG2  GLN   8           1HG      GLN   8  -9.025 -13.303   5.556
   68    HG3  GLN   8           2HG      GLN   8 -10.373 -12.275   5.072
   69   HE21  GLN   8          2HE2      GLN   8 -11.577 -14.083   6.067
   70   HE22  GLN   8          1HE2      GLN   8 -11.998 -15.426   5.065
   71    H    LYS   9           H        LYS   9  -6.490 -13.625   3.344
   72    HA   LYS   9           HA       LYS   9  -5.093 -13.782   5.926
   73    HB2  LYS   9           1HB      LYS   9  -6.145 -15.787   4.037
   74    HB3  LYS   9           2HB      LYS   9  -4.566 -16.162   4.714
   75    HG2  LYS   9           1HG      LYS   9  -6.196 -15.292   6.846
   76    HG3  LYS   9           2HG      LYS   9  -7.139 -16.444   5.898
   77    HD2  LYS   9           1HD      LYS   9  -4.329 -17.181   6.448
   78    HD3  LYS   9           2HD      LYS   9  -5.423 -17.173   7.833
   79    HE2  LYS   9           1HE      LYS   9  -6.076 -18.582   5.258
   80    HE3  LYS   9           2HE      LYS   9  -5.192 -19.363   6.567
   81    HZ1  LYS   9           3HZ      LYS   9  -7.085 -18.851   8.036
   82    HZ2  LYS   9           1HZ      LYS   9  -7.508 -19.877   6.760
   83    HZ3  LYS   9           2HZ      LYS   9  -7.937 -18.242   6.707
   84    H    GLU  10           H        GLU  10  -3.353 -12.445   5.582
   85    HA   GLU  10           HA       GLU  10  -1.760 -12.624   3.194
   86    HB2  GLU  10           1HB      GLU  10  -1.970 -10.859   5.469
   87    HB3  GLU  10           2HB      GLU  10  -0.288 -11.279   5.174
   88    HG2  GLU  10           1HG      GLU  10  -0.802 -10.674   2.722
   89    HG3  GLU  10           2HG      GLU  10  -2.214  -9.856   3.388
   90    H    ILE  11           H        ILE  11  -1.705 -14.000   6.389
   91    HA   ILE  11           HA       ILE  11   0.933 -14.752   6.680
   92    HB   ILE  11           HB       ILE  11   0.136 -16.638   8.039
   93   HG12  ILE  11          1HG1      ILE  11  -2.563 -16.460   8.230
   94   HG13  ILE  11          2HG1      ILE  11  -2.345 -16.110   6.518
   95   HG21  ILE  11          1HG2      ILE  11  -0.940 -15.353   9.728
   96   HG22  ILE  11          2HG2      ILE  11   0.168 -14.276   8.880
   97   HG23  ILE  11          3HG2      ILE  11  -1.562 -14.204   8.544
   98   HD11  ILE  11          3HD1      ILE  11  -0.733 -18.304   6.935
   99   HD12  ILE  11          1HD1      ILE  11  -2.144 -18.622   7.944
  100   HD13  ILE  11          2HD1      ILE  11  -2.345 -18.308   6.220
  101    H    ALA  12           H        ALA  12  -1.567 -16.198   4.681
  102    HA   ALA  12           HA       ALA  12  -0.250 -18.595   4.036
  103    HB1  ALA  12           1HB      ALA  12  -1.819 -17.646   1.826
  104    HB2  ALA  12           2HB      ALA  12  -2.139 -18.980   2.936
  105    HB3  ALA  12           3HB      ALA  12  -2.661 -17.346   3.346
  106    H    ASP  13           H        ASP  13  -0.495 -15.592   2.119
  107    HA   ASP  13           HA       ASP  13   1.257 -16.331   0.087
  108    HB2  ASP  13           1HB      ASP  13   0.203 -13.765   1.141
  109    HB3  ASP  13           2HB      ASP  13   1.648 -13.668   0.138
  110    H    GLY  14           H        GLY  14   1.911 -14.782   3.200
  111    HA2  GLY  14           1HA      GLY  14   4.679 -14.337   2.715
  112    HA3  GLY  14           2HA      GLY  14   3.887 -14.318   4.284
  113    H    LEU  15           H        LEU  15   2.859 -17.052   3.969
  114    HA   LEU  15           HA       LEU  15   5.086 -18.430   5.085
  115    HB2  LEU  15           1HB      LEU  15   2.249 -18.900   4.683
  116    HB3  LEU  15           2HB      LEU  15   3.209 -20.356   4.429
  117    HG   LEU  15           HG       LEU  15   2.379 -20.241   6.711
  118   HD11  LEU  15          1HD1      LEU  15   5.039 -20.637   5.927
  119   HD12  LEU  15          2HD1      LEU  15   4.236 -21.256   7.369
  120   HD13  LEU  15          3HD1      LEU  15   5.105 -19.723   7.434
  121   HD21  LEU  15          3HD2      LEU  15   3.699 -17.555   6.661
  122   HD22  LEU  15          1HD2      LEU  15   3.495 -18.431   8.178
  123   HD23  LEU  15          2HD2      LEU  15   2.083 -17.996   7.215
  124    H    ALA  16           H        ALA  16   3.289 -18.795   2.035
  125    HA   ALA  16           HA       ALA  16   4.969 -20.851   1.018
  126    HB1  ALA  16           1HB      ALA  16   3.111 -20.995  -0.213
  127    HB2  ALA  16           2HB      ALA  16   2.674 -19.312   0.088
  128    HB3  ALA  16           3HB      ALA  16   3.817 -19.711  -1.195
  129    H    SER  17           H        SER  17   4.955 -17.344   0.755
  130    HA   SER  17           HA       SER  17   6.934 -17.190  -1.285
  131    HB2  SER  17           1HB      SER  17   5.852 -15.186   0.694
  132    HB3  SER  17           2HB      SER  17   7.122 -14.776  -0.460
  133    HG   SER  17           HG       SER  17   5.542 -15.682  -2.065
  134    H    ALA  18           H        ALA  18   7.019 -17.068   2.243
  135    HA   ALA  18           HA       ALA  18   9.841 -16.545   2.361
  136    HB1  ALA  18           1HB      ALA  18   8.203 -15.850   4.117
  137    HB2  ALA  18           2HB      ALA  18   8.068 -17.547   4.580
  138    HB3  ALA  18           3HB      ALA  18   9.614 -16.713   4.730
  139    H    GLU  19           H        GLU  19   7.782 -19.376   2.429
  140    HA   GLU  19           HA       GLU  19   9.775 -21.193   3.345
  141    HB2  GLU  19           1HB      GLU  19   7.429 -21.739   3.595
  142    HB3  GLU  19           2HB      GLU  19   7.188 -21.655   1.855
  143    HG2  GLU  19           1HG      GLU  19   8.013 -23.714   1.504
  144    HG3  GLU  19           2HG      GLU  19   9.250 -23.548   2.749
  145    H    ARG  20           H        ARG  20   8.407 -20.530   0.124
  146    HA   ARG  20           HA       ARG  20  10.014 -22.301  -1.317
  147    HB2  ARG  20           1HB      ARG  20   8.410 -19.888  -1.970
  148    HB3  ARG  20           2HB      ARG  20   9.597 -20.402  -3.160
  149    HG2  ARG  20           1HG      ARG  20   8.362 -22.755  -2.563
  150    HG3  ARG  20           2HG      ARG  20   7.037 -21.597  -2.417
  151    HD2  ARG  20           1HD      ARG  20   8.792 -21.293  -4.773
  152    HD3  ARG  20           2HD      ARG  20   7.775 -22.733  -4.739
  153    HE   ARG  20           HE       ARG  20   6.221 -20.473  -4.108
  154   HH11  ARG  20          1HH1      ARG  20   7.868 -21.953  -6.795
  155   HH12  ARG  20          2HH1      ARG  20   6.800 -21.286  -7.985
  156   HH21  ARG  20          1HH2      ARG  20   4.808 -19.589  -5.666
  157   HH22  ARG  20          2HH2      ARG  20   5.061 -19.941  -7.342
  158    H    ALA  21           H        ALA  21  10.570 -18.949  -0.358
  159    HA   ALA  21           HA       ALA  21  12.981 -18.614  -1.820
  160    HB1  ALA  21           1HB      ALA  21  11.627 -17.127   0.385
  161    HB2  ALA  21           2HB      ALA  21  13.296 -16.736  -0.032
  162    HB3  ALA  21           3HB      ALA  21  12.028 -16.599  -1.250
  163    H    HIS  22           H        HIS  22  12.367 -19.239   1.637
  164    HA   HIS  22           HA       HIS  22  15.009 -19.428   2.473
  165    HB2  HIS  22           1HB      HIS  22  12.400 -20.409   3.485
  166    HB3  HIS  22           2HB      HIS  22  13.836 -21.195   4.135
  167    HD1  HIS  22           HD1      HIS  22  12.667 -17.607   3.591
  168    HD2  HIS  22           HD2      HIS  22  14.764 -19.928   6.325
  169    HE1  HIS  22           HE1      HIS  22  13.237 -16.059   5.489
  170    H    LYS  23           H        LYS  23  12.855 -21.987   1.278
  171    HA   LYS  23           HA       LYS  23  14.708 -24.098   1.546
  172    HB2  LYS  23           1HB      LYS  23  12.085 -23.687   0.304
  173    HB3  LYS  23           2HB      LYS  23  13.083 -24.865  -0.538
  174    HG2  LYS  23           1HG      LYS  23  13.296 -25.440   2.211
  175    HG3  LYS  23           2HG      LYS  23  11.586 -25.166   1.871
  176    HD2  LYS  23           1HD      LYS  23  11.637 -26.812   0.099
  177    HD3  LYS  23           2HD      LYS  23  13.376 -27.026   0.308
  178    HE2  LYS  23           1HE      LYS  23  13.114 -28.101   2.364
  179    HE3  LYS  23           2HE      LYS  23  11.475 -27.489   2.580
  180    HZ1  LYS  23           3HZ      LYS  23  10.745 -29.378   1.720
  181    HZ2  LYS  23           1HZ      LYS  23  12.318 -29.902   1.382
  182    HZ3  LYS  23           2HZ      LYS  23  11.469 -28.982   0.244
  183    H    ASP  24           H        ASP  24  13.876 -22.012  -1.201
  184    HA   ASP  24           HA       ASP  24  15.484 -23.215  -3.132
  185    HB2  ASP  24           1HB      ASP  24  13.767 -21.419  -3.523
  186    HB3  ASP  24           2HB      ASP  24  14.933 -20.252  -2.905
  187    H    LEU  25           H        LEU  25  16.260 -20.409  -1.072
  188    HA   LEU  25           HA       LEU  25  18.911 -20.110  -1.901
  189    HB2  LEU  25           1HB      LEU  25  17.226 -18.827  -0.152
  190    HB3  LEU  25           2HB      LEU  25  18.454 -19.501   0.917
  191    HG   LEU  25           HG       LEU  25  19.296 -17.930  -1.481
  192   HD11  LEU  25          1HD1      LEU  25  18.804 -16.535   1.107
  193   HD12  LEU  25          2HD1      LEU  25  17.473 -16.748  -0.029
  194   HD13  LEU  25          3HD1      LEU  25  18.924 -15.877  -0.524
  195   HD21  LEU  25          3HD2      LEU  25  21.225 -18.565  -0.528
  196   HD22  LEU  25          1HD2      LEU  25  20.457 -18.932   1.017
  197   HD23  LEU  25          2HD2      LEU  25  20.892 -17.269   0.622
  198    H    ASP  26           H        ASP  26  17.545 -21.986   0.780
  199    HA   ASP  26           HA       ASP  26  19.922 -22.862   1.935
  200    HB2  ASP  26           1HB      ASP  26  17.108 -23.760   1.929
  201    HB3  ASP  26           2HB      ASP  26  18.293 -24.995   2.345
  202    H    LEU  27           H        LEU  27  17.890 -24.623  -0.412
  203    HA   LEU  27           HA       LEU  27  19.606 -26.769  -0.829
  204    HB2  LEU  27           1HB      LEU  27  17.568 -25.456  -2.601
  205    HB3  LEU  27           2HB      LEU  27  18.463 -26.886  -3.108
  206    HG   LEU  27           HG       LEU  27  17.013 -27.022  -0.521
  207   HD11  LEU  27          1HD1      LEU  27  15.225 -27.861  -2.549
  208   HD12  LEU  27          2HD1      LEU  27  15.708 -26.203  -2.908
  209   HD13  LEU  27          3HD1      LEU  27  15.001 -26.596  -1.341
  210   HD21  LEU  27          3HD2      LEU  27  16.729 -29.313  -1.150
  211   HD22  LEU  27          1HD2      LEU  27  18.408 -28.867  -1.454
  212   HD23  LEU  27          2HD2      LEU  27  17.269 -28.982  -2.796
  213    H    ALA  28           H        ALA  28  19.518 -23.602  -2.383
  214    HA   ALA  28           HA       ALA  28  21.391 -24.104  -4.413
  215    HB1  ALA  28           1HB      ALA  28  21.767 -21.472  -3.923
  216    HB2  ALA  28           2HB      ALA  28  20.424 -22.123  -4.865
  217    HB3  ALA  28           3HB      ALA  28  20.197 -21.726  -3.161
  218    H    LYS  29           H        LYS  29  21.892 -22.469  -1.279
  219    HA   LYS  29           HA       LYS  29  24.652 -22.212  -1.433
  220    HB2  LYS  29           1HB      LYS  29  22.769 -22.472   0.897
  221    HB3  LYS  29           2HB      LYS  29  24.502 -22.305   1.145
  222    HG2  LYS  29           1HG      LYS  29  23.840 -20.283  -0.649
  223    HG3  LYS  29           2HG      LYS  29  22.529 -20.298   0.533
  224    HD2  LYS  29           1HD      LYS  29  24.117 -20.092   2.348
  225    HD3  LYS  29           2HD      LYS  29  25.468 -20.202   1.216
  226    HE2  LYS  29           1HE      LYS  29  25.411 -17.994   0.994
  227    HE3  LYS  29           2HE      LYS  29  23.805 -18.135   0.280
  228    HZ1  LYS  29           3HZ      LYS  29  22.946 -17.164   2.058
  229    HZ2  LYS  29           1HZ      LYS  29  24.496 -16.962   2.706
  230    HZ3  LYS  29           2HZ      LYS  29  23.598 -18.346   3.078
  231    H    ALA  30           H        ALA  30  22.757 -24.844   0.034
  232    HA   ALA  30           HA       ALA  30  24.881 -26.414   0.913
  233    HB1  ALA  30           1HB      ALA  30  22.352 -27.614  -0.160
  234    HB2  ALA  30           2HB      ALA  30  23.341 -28.141   1.202
  235    HB3  ALA  30           3HB      ALA  30  22.363 -26.680   1.337
  236    H    SER  31           H        SER  31  23.153 -26.517  -2.195
  237    HA   SER  31           HA       SER  31  24.545 -28.647  -3.335
  238    HB2  SER  31           1HB      SER  31  22.715 -28.088  -4.608
  239    HB3  SER  31           2HB      SER  31  22.963 -26.355  -4.396
  240    HG   SER  31           HG       SER  31  24.427 -28.105  -6.084
  241    H    ALA  32           H        ALA  32  25.252 -25.176  -3.384
  242    HA   ALA  32           HA       ALA  32  27.482 -25.286  -5.090
  243    HB1  ALA  32           1HB      ALA  32  27.036 -23.298  -2.871
  244    HB2  ALA  32           2HB      ALA  32  27.993 -23.076  -4.336
  245    HB3  ALA  32           3HB      ALA  32  26.238 -23.222  -4.442
  246    H    THR  33           H        THR  33  27.381 -25.083  -1.528
  247    HA   THR  33           HA       THR  33  30.091 -25.296  -1.028
  248    HB   THR  33           HB       THR  33  28.171 -26.719   0.775
  249    HG1  THR  33           HG1      THR  33  26.949 -24.958   0.491
  250   HG21  THR  33          3HG2      THR  33  30.548 -26.537   1.384
  251   HG22  THR  33          1HG2      THR  33  29.515 -25.660   2.512
  252   HG23  THR  33          2HG2      THR  33  30.431 -24.780   1.288
  253    H    ASP  34           H        ASP  34  27.718 -27.958  -1.110
  254    HA   ASP  34           HA       ASP  34  29.521 -30.049  -0.717
  255    HB2  ASP  34           1HB      ASP  34  26.766 -29.784  -1.287
  256    HB3  ASP  34           2HB      ASP  34  27.424 -30.877  -2.501
  257    H    GLN  35           H        GLN  35  28.346 -28.609  -3.743
  258    HA   GLN  35           HA       GLN  35  29.668 -30.304  -5.521
  259    HB2  GLN  35           1HB      GLN  35  28.703 -27.470  -5.706
  260    HB3  GLN  35           2HB      GLN  35  29.607 -28.185  -7.034
  261    HG2  GLN  35           1HG      GLN  35  27.360 -29.784  -6.006
  262    HG3  GLN  35           2HG      GLN  35  26.933 -28.276  -6.813
  263   HE21  GLN  35          2HE2      GLN  35  28.860 -31.211  -7.204
  264   HE22  GLN  35          1HE2      GLN  35  28.680 -31.314  -8.919
  265    H    LEU  36           H        LEU  36  30.730 -27.177  -4.192
  266    HA   LEU  36           HA       LEU  36  33.224 -27.102  -5.468
  267    HB2  LEU  36           1HB      LEU  36  32.283 -25.894  -2.876
  268    HB3  LEU  36           2HB      LEU  36  33.856 -25.551  -3.593
  269    HG   LEU  36           HG       LEU  36  31.231 -24.981  -4.961
  270   HD11  LEU  36          1HD1      LEU  36  31.059 -23.443  -3.304
  271   HD12  LEU  36          2HD1      LEU  36  32.147 -22.554  -4.369
  272   HD13  LEU  36          3HD1      LEU  36  32.793 -23.429  -2.981
  273   HD21  LEU  36          3HD2      LEU  36  32.695 -23.474  -6.318
  274   HD22  LEU  36          1HD2      LEU  36  33.014 -25.196  -6.530
  275   HD23  LEU  36          2HD2      LEU  36  34.089 -24.217  -5.531
  276    H    LYS  37           H        LYS  37  32.407 -28.145  -2.159
  277    HA   LYS  37           HA       LYS  37  34.932 -28.937  -1.343
  278    HB2  LYS  37           1HB      LYS  37  33.148 -28.833   0.250
  279    HB3  LYS  37           2HB      LYS  37  32.210 -30.031  -0.632
  280    HG2  LYS  37           1HG      LYS  37  34.872 -30.906   0.274
  281    HG3  LYS  37           2HG      LYS  37  33.688 -30.582   1.543
  282    HD2  LYS  37           1HD      LYS  37  32.088 -32.057   0.280
  283    HD3  LYS  37           2HD      LYS  37  33.440 -32.507  -0.763
  284    HE2  LYS  37           1HE      LYS  37  34.142 -33.995   0.728
  285    HE3  LYS  37           2HE      LYS  37  34.229 -32.752   1.975
  286    HZ1  LYS  37           3HZ      LYS  37  32.454 -33.612   2.949
  287    HZ2  LYS  37           1HZ      LYS  37  32.443 -34.869   1.816
  288    HZ3  LYS  37           2HZ      LYS  37  31.538 -33.469   1.534
  289    H    LYS  38           H        LYS  38  32.461 -30.819  -3.057
  290    HA   LYS  38           HA       LYS  38  33.818 -33.267  -3.107
  291    HB2  LYS  38           1HB      LYS  38  31.402 -32.822  -3.737
  292    HB3  LYS  38           2HB      LYS  38  31.998 -32.245  -5.287
  293    HG2  LYS  38           1HG      LYS  38  31.894 -34.328  -6.024
  294    HG3  LYS  38           2HG      LYS  38  33.206 -34.733  -4.915
  295    HD2  LYS  38           1HD      LYS  38  31.758 -35.560  -3.302
  296    HD3  LYS  38           2HD      LYS  38  30.379 -34.659  -3.936
  297    HE2  LYS  38           1HE      LYS  38  31.212 -36.341  -6.014
  298    HE3  LYS  38           2HE      LYS  38  31.265 -37.327  -4.554
  299    HZ1  LYS  38           3HZ      LYS  38  29.074 -37.080  -5.929
  300    HZ2  LYS  38           1HZ      LYS  38  28.903 -35.658  -5.029
  301    HZ3  LYS  38           2HZ      LYS  38  29.027 -37.148  -4.239
  302    H    ALA  39           H        ALA  39  33.627 -30.788  -5.667
  303    HA   ALA  39           HA       ALA  39  35.378 -31.937  -7.474
  304    HB1  ALA  39           1HB      ALA  39  35.863 -29.238  -7.751
  305    HB2  ALA  39           2HB      ALA  39  34.569 -30.148  -8.532
  306    HB3  ALA  39           3HB      ALA  39  34.258 -29.293  -7.021
  307    H    LYS  40           H        LYS  40  36.145 -29.579  -4.914
  308    HA   LYS  40           HA       LYS  40  38.884 -29.403  -5.352
  309    HB2  LYS  40           1HB      LYS  40  37.065 -28.873  -3.079
  310    HB3  LYS  40           2HB      LYS  40  38.762 -29.088  -2.669
  311    HG2  LYS  40           1HG      LYS  40  39.420 -27.206  -3.819
  312    HG3  LYS  40           2HG      LYS  40  38.006 -27.229  -4.876
  313    HD2  LYS  40           1HD      LYS  40  37.613 -25.432  -3.430
  314    HD3  LYS  40           2HD      LYS  40  36.650 -26.748  -2.753
  315    HE2  LYS  40           1HE      LYS  40  37.677 -26.347  -0.817
  316    HE3  LYS  40           2HE      LYS  40  39.128 -27.032  -1.546
  317    HZ1  LYS  40           3HZ      LYS  40  39.676 -24.767  -2.338
  318    HZ2  LYS  40           1HZ      LYS  40  39.657 -24.902  -0.651
  319    HZ3  LYS  40           2HZ      LYS  40  38.364 -24.166  -1.456
  320    H    ALA  41           H        ALA  41  37.265 -31.403  -2.876
  321    HA   ALA  41           HA       ALA  41  39.465 -32.815  -1.995
  322    HB1  ALA  41           1HB      ALA  41  37.972 -34.377  -1.054
  323    HB2  ALA  41           2HB      ALA  41  37.107 -32.840  -1.066
  324    HB3  ALA  41           3HB      ALA  41  36.746 -34.064  -2.283
  325    H    GLU  42           H        GLU  42  37.515 -33.331  -4.868
  326    HA   GLU  42           HA       GLU  42  38.607 -35.882  -5.516
  327    HB2  GLU  42           1HB      GLU  42  36.807 -33.924  -6.792
  328    HB3  GLU  42           2HB      GLU  42  37.727 -34.927  -7.905
  329    HG2  GLU  42           1HG      GLU  42  36.389 -36.314  -5.669
  330    HG3  GLU  42           2HG      GLU  42  35.352 -35.631  -6.919
  331    H    ALA  43           H        ALA  43  39.426 -32.562  -6.328
  332    HA   ALA  43           HA       ALA  43  41.177 -32.924  -8.429
  333    HB1  ALA  43           1HB      ALA  43  41.833 -30.773  -8.087
  334    HB2  ALA  43           2HB      ALA  43  40.381 -30.778  -7.085
  335    HB3  ALA  43           3HB      ALA  43  41.967 -30.973  -6.339
  336    H    GLN  44           H        GLN  44  41.692 -33.487  -5.003
  337    HA   GLN  44           HA       GLN  44  43.819 -35.275  -5.424
  338    HB2  GLN  44           1HB      GLN  44  45.147 -33.343  -5.983
  339    HB3  GLN  44           2HB      GLN  44  44.608 -32.498  -4.538
  340    HG2  GLN  44           1HG      GLN  44  46.147 -33.470  -3.256
  341    HG3  GLN  44           2HG      GLN  44  45.862 -35.060  -3.963
  342   HE21  GLN  44          2HE2      GLN  44  47.218 -35.815  -5.494
  343   HE22  GLN  44          1HE2      GLN  44  48.600 -34.959  -6.079
  344    H    VAL  45           H        VAL  45  43.478 -32.780  -2.913
  345    HA   VAL  45           HA       VAL  45  42.009 -34.327  -1.091
  346    HB   VAL  45           HB       VAL  45  43.937 -35.783  -0.976
  347   HG11  VAL  45          1HG1      VAL  45  45.395 -33.401  -1.314
  348   HG12  VAL  45          2HG1      VAL  45  45.861 -34.060   0.255
  349   HG13  VAL  45          3HG1      VAL  45  46.019 -35.046  -1.199
  350   HG21  VAL  45          3HG2      VAL  45  42.628 -35.038   1.114
  351   HG22  VAL  45          1HG2      VAL  45  44.159 -35.883   1.342
  352   HG23  VAL  45          2HG2      VAL  45  44.084 -34.131   1.522
  353    H    ILE  46           H        ILE  46  41.110 -32.878   0.209
  354    HA   ILE  46           HA       ILE  46  42.712 -30.675   1.263
  355    HB   ILE  46           HB       ILE  46  40.077 -30.239  -0.148
  356   HG12  ILE  46          1HG1      ILE  46  41.737 -28.621  -1.442
  357   HG13  ILE  46          2HG1      ILE  46  42.931 -29.799  -0.907
  358   HG21  ILE  46          1HG2      ILE  46  40.751 -27.792   0.284
  359   HG22  ILE  46          2HG2      ILE  46  40.069 -28.723   1.616
  360   HG23  ILE  46          3HG2      ILE  46  41.811 -28.460   1.526
  361   HD11  ILE  46          3HD1      ILE  46  40.868 -30.005  -2.967
  362   HD12  ILE  46          1HD1      ILE  46  42.410 -30.845  -2.808
  363   HD13  ILE  46          2HD1      ILE  46  41.000 -31.415  -1.915
  364    H    ILE  47           H        ILE  47  42.285 -30.285   3.345
  365    HA   ILE  47           HA       ILE  47  40.572 -31.929   4.835
  366    HB   ILE  47           HB       ILE  47  41.006 -30.413   6.722
  367   HG12  ILE  47          1HG1      ILE  47  42.535 -28.716   4.743
  368   HG13  ILE  47          2HG1      ILE  47  40.927 -28.314   5.337
  369   HG21  ILE  47          1HG2      ILE  47  43.636 -30.615   5.354
  370   HG22  ILE  47          2HG2      ILE  47  43.173 -31.078   6.991
  371   HG23  ILE  47          3HG2      ILE  47  42.719 -32.097   5.626
  372   HD11  ILE  47          3HD1      ILE  47  42.404 -27.053   6.635
  373   HD12  ILE  47          1HD1      ILE  47  41.938 -28.408   7.663
  374   HD13  ILE  47          2HD1      ILE  47  43.507 -28.411   6.856
  375    H    GLU  48           H        GLU  48  39.022 -30.714   6.517
  376    HA   GLU  48           HA       GLU  48  37.107 -29.184   4.881
  377    HB2  GLU  48           1HB      GLU  48  36.701 -31.303   6.966
  378    HB3  GLU  48           2HB      GLU  48  35.438 -30.123   6.646
  379    HG2  GLU  48           1HG      GLU  48  34.790 -31.190   4.817
  380    HG3  GLU  48           2HG      GLU  48  36.438 -31.265   4.195
  381    H    GLN  49           H        GLN  49  35.896 -27.529   5.914
  382    HA   GLN  49           HA       GLN  49  37.363 -26.270   8.105
  383    HB2  GLN  49           1HB      GLN  49  36.004 -24.261   7.523
  384    HB3  GLN  49           2HB      GLN  49  37.001 -24.851   6.200
  385    HG2  GLN  49           1HG      GLN  49  35.091 -25.881   5.158
  386    HG3  GLN  49           2HG      GLN  49  34.069 -25.443   6.526
  387   HE21  GLN  49          2HE2      GLN  49  34.643 -22.897   7.024
  388   HE22  GLN  49          1HE2      GLN  49  34.297 -21.894   5.660
  389    H    ALA  50           H        ALA  50  36.553 -25.991  10.101
  390    HA   ALA  50           HA       ALA  50  33.994 -27.246  10.705
  391    HB1  ALA  50           1HB      ALA  50  34.918 -27.802  12.650
  392    HB2  ALA  50           2HB      ALA  50  36.437 -27.164  12.020
  393    HB3  ALA  50           3HB      ALA  50  35.380 -26.134  12.986
  394    H    ASN  51           H        ASN  51  32.244 -26.005  10.544
  395    HA   ASN  51           HA       ASN  51  32.374 -23.145  10.868
  396    HB2  ASN  51           1HB      ASN  51  30.054 -25.019  10.365
  397    HB3  ASN  51           2HB      ASN  51  29.908 -23.265  10.431
  398   HD21  ASN  51          2HD2      ASN  51  29.039 -23.741   8.234
  399   HD22  ASN  51          1HD2      ASN  51  30.163 -23.754   6.922
  400    H    LYS  52           H        LYS  52  31.449 -25.894  12.786
  401    HA   LYS  52           HA       LYS  52  30.696 -24.067  14.973
  402    HB2  LYS  52           1HB      LYS  52  29.171 -26.156  13.797
  403    HB3  LYS  52           2HB      LYS  52  29.626 -26.683  15.412
  404    HG2  LYS  52           1HG      LYS  52  28.357 -24.016  14.857
  405    HG3  LYS  52           2HG      LYS  52  27.432 -25.473  15.228
  406    HD2  LYS  52           1HD      LYS  52  29.517 -25.195  17.154
  407    HD3  LYS  52           2HD      LYS  52  28.656 -23.660  17.028
  408    HE2  LYS  52           1HE      LYS  52  27.305 -26.328  17.400
  409    HE3  LYS  52           2HE      LYS  52  27.728 -25.246  18.726
  410    HZ1  LYS  52           3HZ      LYS  52  26.235 -23.623  17.946
  411    HZ2  LYS  52           1HZ      LYS  52  25.386 -25.084  17.869
  412    HZ3  LYS  52           2HZ      LYS  52  26.021 -24.399  16.459
  413    H    ARG  53           H        ARG  53  31.593 -27.498  14.554
  414    HA   ARG  53           HA       ARG  53  34.000 -27.237  16.048
  415    HB2  ARG  53           1HB      ARG  53  32.397 -27.075  17.907
  416    HB3  ARG  53           2HB      ARG  53  31.681 -28.606  17.421
  417    HG2  ARG  53           1HG      ARG  53  33.241 -29.788  18.479
  418    HG3  ARG  53           2HG      ARG  53  34.550 -28.797  17.830
  419    HD2  ARG  53           1HD      ARG  53  34.552 -28.593  20.219
  420    HD3  ARG  53           2HD      ARG  53  34.002 -27.067  19.528
  421    HE   ARG  53           HE       ARG  53  31.702 -28.428  20.019
  422   HH11  ARG  53          1HH1      ARG  53  34.462 -27.542  21.946
  423   HH12  ARG  53          2HH1      ARG  53  33.560 -27.433  23.422
  424   HH21  ARG  53          1HH2      ARG  53  30.504 -28.287  21.955
  425   HH22  ARG  53          2HH2      ARG  53  31.309 -27.857  23.426
  Start of MODEL    2
    1    H1   MET   1           H        MET   1 -18.661  -4.642  -4.521
    2    HA   MET   1           HA       MET   1 -18.266  -5.538  -1.837
    3    HB2  MET   1           1HB      MET   1 -20.241  -7.043  -1.763
    4    HB3  MET   1           2HB      MET   1 -20.668  -5.338  -1.711
    5    HG2  MET   1           1HG      MET   1 -21.864  -5.475  -3.577
    6    HG3  MET   1           2HG      MET   1 -20.600  -6.370  -4.418
    7    HE1  MET   1           3HE      MET   1 -21.929  -9.696  -4.840
    8    HE2  MET   1           1HE      MET   1 -22.398  -8.241  -5.721
    9    HE3  MET   1           2HE      MET   1 -20.733  -8.443  -5.176
   10    H    ALA   2           H        ALA   2 -16.540  -5.830  -3.800
   11    HA   ALA   2           HA       ALA   2 -16.931  -8.484  -4.985
   12    HB1  ALA   2           1HB      ALA   2 -16.031  -7.511  -6.767
   13    HB2  ALA   2           2HB      ALA   2 -15.597  -6.076  -5.837
   14    HB3  ALA   2           3HB      ALA   2 -14.502  -7.457  -5.889
   15    H    ALA   3           H        ALA   3 -15.093  -6.779  -2.596
   16    HA   ALA   3           HA       ALA   3 -13.684  -9.279  -1.948
   17    HB1  ALA   3           1HB      ALA   3 -12.544  -6.600  -2.452
   18    HB2  ALA   3           2HB      ALA   3 -11.880  -7.499  -1.087
   19    HB3  ALA   3           3HB      ALA   3 -11.846  -8.200  -2.705
   20    H    ILE   4           H        ILE   4 -14.619  -9.927  -0.113
   21    HA   ILE   4           HA       ILE   4 -15.683  -8.081   1.813
   22    HB   ILE   4           HB       ILE   4 -15.276 -11.058   2.110
   23   HG12  ILE   4          1HG1      ILE   4 -17.691  -9.526   1.117
   24   HG13  ILE   4          2HG1      ILE   4 -16.634 -10.527   0.127
   25   HG21  ILE   4          1HG2      ILE   4 -17.544 -10.076   3.498
   26   HG22  ILE   4          2HG2      ILE   4 -16.078 -10.797   4.160
   27   HG23  ILE   4          3HG2      ILE   4 -16.169  -9.053   3.912
   28   HD11  ILE   4          3HD1      ILE   4 -17.934 -12.256   0.559
   29   HD12  ILE   4          1HD1      ILE   4 -17.502 -12.134   2.264
   30   HD13  ILE   4          2HD1      ILE   4 -18.918 -11.280   1.649
   31    H    GLU   5           H        GLU   5 -13.153 -10.593   2.025
   32    HA   GLU   5           HA       GLU   5 -11.816  -8.923   4.053
   33    HB2  GLU   5           1HB      GLU   5 -12.169 -11.914   3.959
   34    HB3  GLU   5           2HB      GLU   5 -10.933 -11.149   4.947
   35    HG2  GLU   5           1HG      GLU   5 -13.213  -9.764   5.616
   36    HG3  GLU   5           2HG      GLU   5 -13.788 -11.417   5.403
   37    H    LYS   6           H        LYS   6 -10.163  -8.018   2.985
   38    HA   LYS   6           HA       LYS   6  -8.227  -9.810   1.715
   39    HB2  LYS   6           1HB      LYS   6  -9.897  -8.413   0.135
   40    HB3  LYS   6           2HB      LYS   6  -8.650  -7.197   0.376
   41    HG2  LYS   6           1HG      LYS   6  -7.088  -8.361  -0.798
   42    HG3  LYS   6           2HG      LYS   6  -7.784  -9.930  -0.384
   43    HD2  LYS   6           1HD      LYS   6  -9.655  -8.408  -1.942
   44    HD3  LYS   6           2HD      LYS   6  -8.099  -8.479  -2.773
   45    HE2  LYS   6           1HE      LYS   6  -9.495 -10.897  -1.644
   46    HE3  LYS   6           2HE      LYS   6  -9.701 -10.346  -3.305
   47    HZ1  LYS   6           3HZ      LYS   6  -7.073 -11.029  -2.110
   48    HZ2  LYS   6           1HZ      LYS   6  -7.404 -10.706  -3.737
   49    HZ3  LYS   6           2HZ      LYS   6  -8.005 -12.113  -3.015
   50    H    ARG   7           H        ARG   7  -8.400  -8.314   4.269
   51    HA   ARG   7           HA       ARG   7  -6.050  -6.569   3.926
   52    HB2  ARG   7           1HB      ARG   7  -8.457  -6.367   5.672
   53    HB3  ARG   7           2HB      ARG   7  -6.929  -5.767   6.304
   54    HG2  ARG   7           1HG      ARG   7  -7.522  -3.854   5.316
   55    HG3  ARG   7           2HG      ARG   7  -6.961  -4.636   3.836
   56    HD2  ARG   7           1HD      ARG   7  -9.094  -5.073   3.098
   57    HD3  ARG   7           2HD      ARG   7  -9.769  -5.082   4.727
   58    HE   ARG   7           HE       ARG   7 -10.139  -2.832   4.546
   59   HH11  ARG   7          1HH1      ARG   7  -7.902  -3.820   2.067
   60   HH12  ARG   7          2HH1      ARG   7  -7.913  -2.286   1.263
   61   HH21  ARG   7          1HH2      ARG   7 -10.162  -0.808   3.496
   62   HH22  ARG   7          2HH2      ARG   7  -9.198  -0.573   2.077
   63    H    GLN   8           H        GLN   8  -7.495  -9.179   5.755
   64    HA   GLN   8           HA       GLN   8  -4.959  -9.526   7.212
   65    HB2  GLN   8           1HB      GLN   8  -7.145  -9.147   8.506
   66    HB3  GLN   8           2HB      GLN   8  -7.584 -10.772   7.997
   67    HG2  GLN   8           1HG      GLN   8  -6.657 -11.255  10.005
   68    HG3  GLN   8           2HG      GLN   8  -5.211 -11.343   9.001
   69   HE21  GLN   8          2HE2      GLN   8  -4.351 -11.004  11.275
   70   HE22  GLN   8          1HE2      GLN   8  -4.057  -9.368  11.744
   71    H    LYS   9           H        LYS   9  -4.780 -10.423   4.735
   72    HA   LYS   9           HA       LYS   9  -4.798 -13.327   5.077
   73    HB2  LYS   9           1HB      LYS   9  -6.672 -12.026   3.466
   74    HB3  LYS   9           2HB      LYS   9  -5.457 -12.618   2.341
   75    HG2  LYS   9           1HG      LYS   9  -7.044 -14.328   2.482
   76    HG3  LYS   9           2HG      LYS   9  -5.706 -14.868   3.499
   77    HD2  LYS   9           1HD      LYS   9  -6.883 -14.201   5.490
   78    HD3  LYS   9           2HD      LYS   9  -8.172 -13.469   4.531
   79    HE2  LYS   9           1HE      LYS   9  -9.078 -15.515   5.145
   80    HE3  LYS   9           2HE      LYS   9  -8.452 -15.832   3.528
   81    HZ1  LYS   9           3HZ      LYS   9  -7.382 -16.708   6.130
   82    HZ2  LYS   9           1HZ      LYS   9  -6.358 -16.589   4.788
   83    HZ3  LYS   9           2HZ      LYS   9  -7.694 -17.624   4.743
   84    H    GLU  10           H        GLU  10  -2.761 -11.184   5.098
   85    HA   GLU  10           HA       GLU  10  -1.246 -11.613   2.660
   86    HB2  GLU  10           1HB      GLU  10  -1.303  -9.637   4.733
   87    HB3  GLU  10           2HB      GLU  10   0.328 -10.279   4.602
   88    HG2  GLU  10           1HG      GLU  10   0.187  -8.389   3.181
   89    HG3  GLU  10           2HG      GLU  10   0.232  -9.820   2.153
   90    H    ILE  11           H        ILE  11  -1.364 -12.797   5.914
   91    HA   ILE  11           HA       ILE  11   1.189 -13.759   6.320
   92    HB   ILE  11           HB       ILE  11   0.107 -15.593   7.663
   93   HG12  ILE  11          1HG1      ILE  11  -2.426 -14.213   6.746
   94   HG13  ILE  11          2HG1      ILE  11  -1.924 -15.841   6.302
   95   HG21  ILE  11          1HG2      ILE  11   0.400 -12.935   8.195
   96   HG22  ILE  11          2HG2      ILE  11  -1.301 -13.198   8.579
   97   HG23  ILE  11          3HG2      ILE  11  -0.058 -14.160   9.378
   98   HD11  ILE  11          3HD1      ILE  11  -3.175 -16.513   8.008
   99   HD12  ILE  11          1HD1      ILE  11  -1.881 -15.911   9.044
  100   HD13  ILE  11          2HD1      ILE  11  -3.273 -14.888   8.688
  101    H    ALA  12           H        ALA  12  -1.380 -15.086   4.326
  102    HA   ALA  12           HA       ALA  12  -0.237 -17.614   3.837
  103    HB1  ALA  12           1HB      ALA  12  -2.276 -17.818   2.976
  104    HB2  ALA  12           2HB      ALA  12  -2.470 -16.069   2.848
  105    HB3  ALA  12           3HB      ALA  12  -1.678 -16.965   1.552
  106    H    ASP  13           H        ASP  13  -0.314 -14.754   1.699
  107    HA   ASP  13           HA       ASP  13   1.382 -15.689  -0.269
  108    HB2  ASP  13           1HB      ASP  13   0.528 -13.022   0.677
  109    HB3  ASP  13           2HB      ASP  13   2.014 -13.052  -0.270
  110    H    GLY  14           H        GLY  14   2.237 -13.902   2.685
  111    HA2  GLY  14           1HA      GLY  14   5.028 -13.864   2.173
  112    HA3  GLY  14           2HA      GLY  14   4.260 -13.583   3.729
  113    H    LEU  15           H        LEU  15   2.916 -16.199   3.700
  114    HA   LEU  15           HA       LEU  15   4.924 -17.693   5.021
  115    HB2  LEU  15           1HB      LEU  15   2.698 -17.997   5.734
  116    HB3  LEU  15           2HB      LEU  15   2.140 -18.342   4.098
  117    HG   LEU  15           HG       LEU  15   4.107 -20.276   4.986
  118   HD11  LEU  15          1HD1      LEU  15   2.537 -21.375   6.613
  119   HD12  LEU  15          2HD1      LEU  15   1.657 -19.849   6.678
  120   HD13  LEU  15          3HD1      LEU  15   3.340 -19.918   7.200
  121   HD21  LEU  15          3HD2      LEU  15   1.209 -20.619   4.237
  122   HD22  LEU  15          1HD2      LEU  15   2.488 -21.832   4.173
  123   HD23  LEU  15          2HD2      LEU  15   2.519 -20.458   3.067
  124    H    ALA  16           H        ALA  16   3.270 -18.185   1.907
  125    HA   ALA  16           HA       ALA  16   4.847 -20.449   1.189
  126    HB1  ALA  16           1HB      ALA  16   3.875 -19.877  -1.144
  127    HB2  ALA  16           2HB      ALA  16   2.787 -20.415   0.135
  128    HB3  ALA  16           3HB      ALA  16   2.901 -18.701  -0.261
  129    H    SER  17           H        SER  17   5.024 -16.994   0.519
  130    HA   SER  17           HA       SER  17   7.050 -17.125  -1.447
  131    HB2  SER  17           1HB      SER  17   5.888 -15.093  -1.396
  132    HB3  SER  17           2HB      SER  17   6.025 -14.948   0.356
  133    HG   SER  17           HG       SER  17   7.783 -14.193  -1.623
  134    H    ALA  18           H        ALA  18   7.128 -16.844   2.066
  135    HA   ALA  18           HA       ALA  18   9.991 -16.540   2.164
  136    HB1  ALA  18           1HB      ALA  18   9.766 -16.331   4.471
  137    HB2  ALA  18           2HB      ALA  18   8.264 -15.648   3.849
  138    HB3  ALA  18           3HB      ALA  18   8.281 -17.283   4.510
  139    H    GLU  19           H        GLU  19   7.659 -19.144   2.613
  140    HA   GLU  19           HA       GLU  19   9.441 -21.065   3.648
  141    HB2  GLU  19           1HB      GLU  19   6.974 -21.266   3.734
  142    HB3  GLU  19           2HB      GLU  19   6.951 -21.521   1.995
  143    HG2  GLU  19           1HG      GLU  19   8.383 -23.535   2.350
  144    HG3  GLU  19           2HG      GLU  19   8.158 -23.313   4.085
  145    H    ARG  20           H        ARG  20   8.243 -20.598   0.323
  146    HA   ARG  20           HA       ARG  20   9.805 -22.591  -0.870
  147    HB2  ARG  20           1HB      ARG  20   8.562 -20.068  -1.949
  148    HB3  ARG  20           2HB      ARG  20   9.469 -21.170  -2.977
  149    HG2  ARG  20           1HG      ARG  20   7.878 -22.981  -2.108
  150    HG3  ARG  20           2HG      ARG  20   6.878 -21.637  -1.553
  151    HD2  ARG  20           1HD      ARG  20   5.982 -21.923  -3.627
  152    HD3  ARG  20           2HD      ARG  20   7.280 -20.801  -4.033
  153    HE   ARG  20           HE       ARG  20   8.395 -23.282  -4.305
  154   HH11  ARG  20          1HH1      ARG  20   5.626 -21.651  -5.644
  155   HH12  ARG  20          2HH1      ARG  20   5.679 -22.516  -7.144
  156   HH21  ARG  20          1HH2      ARG  20   8.475 -24.427  -6.276
  157   HH22  ARG  20          2HH2      ARG  20   7.299 -24.095  -7.503
  158    H    ALA  21           H        ALA  21  10.451 -19.147  -0.355
  159    HA   ALA  21           HA       ALA  21  12.868 -18.984  -1.754
  160    HB1  ALA  21           1HB      ALA  21  11.649 -17.014  -1.008
  161    HB2  ALA  21           2HB      ALA  21  11.993 -17.422   0.673
  162    HB3  ALA  21           3HB      ALA  21  13.310 -16.983  -0.414
  163    H    HIS  22           H        HIS  22  12.388 -19.363   1.764
  164    HA   HIS  22           HA       HIS  22  15.042 -19.734   2.470
  165    HB2  HIS  22           1HB      HIS  22  12.442 -20.202   3.696
  166    HB3  HIS  22           2HB      HIS  22  13.641 -21.384   4.212
  167    HD1  HIS  22           HD1      HIS  22  14.899 -20.685   6.210
  168    HD2  HIS  22           HD2      HIS  22  13.613 -17.419   3.987
  169    HE1  HIS  22           HE1      HIS  22  15.647 -18.658   7.498
  170    H    LYS  23           H        LYS  23  12.643 -22.143   1.469
  171    HA   LYS  23           HA       LYS  23  14.182 -24.438   1.866
  172    HB2  LYS  23           1HB      LYS  23  11.683 -24.181   1.220
  173    HB3  LYS  23           2HB      LYS  23  12.270 -24.170  -0.437
  174    HG2  LYS  23           1HG      LYS  23  11.585 -26.392   0.147
  175    HG3  LYS  23           2HG      LYS  23  13.340 -26.359  -0.035
  176    HD2  LYS  23           1HD      LYS  23  12.491 -25.786   2.686
  177    HD3  LYS  23           2HD      LYS  23  11.936 -27.364   2.124
  178    HE2  LYS  23           1HE      LYS  23  14.084 -28.158   1.826
  179    HE3  LYS  23           2HE      LYS  23  14.769 -26.543   1.655
  180    HZ1  LYS  23           3HZ      LYS  23  14.310 -26.199   4.044
  181    HZ2  LYS  23           1HZ      LYS  23  15.420 -27.442   3.754
  182    HZ3  LYS  23           2HZ      LYS  23  13.822 -27.814   4.164
  183    H    ASP  24           H        ASP  24  13.656 -22.682  -1.198
  184    HA   ASP  24           HA       ASP  24  15.440 -24.092  -2.770
  185    HB2  ASP  24           1HB      ASP  24  14.465 -21.251  -2.854
  186    HB3  ASP  24           2HB      ASP  24  15.653 -21.824  -4.022
  187    H    LEU  25           H        LEU  25  16.054 -21.379  -0.599
  188    HA   LEU  25           HA       LEU  25  18.732 -20.920  -1.323
  189    HB2  LEU  25           1HB      LEU  25  16.909 -20.092   0.769
  190    HB3  LEU  25           2HB      LEU  25  18.545 -20.316   1.384
  191    HG   LEU  25           HG       LEU  25  18.127 -17.994   0.757
  192   HD11  LEU  25          1HD1      LEU  25  20.194 -17.672  -0.114
  193   HD12  LEU  25          2HD1      LEU  25  19.980 -18.890  -1.370
  194   HD13  LEU  25          3HD1      LEU  25  20.350 -19.384   0.282
  195   HD21  LEU  25          3HD2      LEU  25  18.151 -18.369  -2.113
  196   HD22  LEU  25          1HD2      LEU  25  17.083 -17.385  -1.111
  197   HD23  LEU  25          2HD2      LEU  25  16.724 -19.093  -1.370
  198    H    ASP  26           H        ASP  26  17.353 -22.855   1.327
  199    HA   ASP  26           HA       ASP  26  19.753 -23.785   2.401
  200    HB2  ASP  26           1HB      ASP  26  16.918 -24.592   2.514
  201    HB3  ASP  26           2HB      ASP  26  18.071 -25.878   2.858
  202    H    LEU  27           H        LEU  27  17.595 -25.466   0.108
  203    HA   LEU  27           HA       LEU  27  19.162 -27.692  -0.364
  204    HB2  LEU  27           1HB      LEU  27  16.950 -26.347  -1.669
  205    HB3  LEU  27           2HB      LEU  27  18.028 -27.120  -2.830
  206    HG   LEU  27           HG       LEU  27  17.640 -29.084  -0.937
  207   HD11  LEU  27          1HD1      LEU  27  15.841 -27.543  -0.005
  208   HD12  LEU  27          2HD1      LEU  27  15.368 -29.202  -0.373
  209   HD13  LEU  27          3HD1      LEU  27  14.936 -27.897  -1.477
  210   HD21  LEU  27          3HD2      LEU  27  16.008 -28.665  -3.436
  211   HD22  LEU  27          1HD2      LEU  27  16.393 -30.198  -2.652
  212   HD23  LEU  27          2HD2      LEU  27  17.671 -29.255  -3.420
  213    H    ALA  28           H        ALA  28  19.135 -24.643  -2.208
  214    HA   ALA  28           HA       ALA  28  21.140 -25.282  -4.031
  215    HB1  ALA  28           1HB      ALA  28  20.001 -22.750  -2.978
  216    HB2  ALA  28           2HB      ALA  28  21.508 -22.666  -3.891
  217    HB3  ALA  28           3HB      ALA  28  20.066 -23.363  -4.630
  218    H    LYS  29           H        LYS  29  21.369 -23.934  -0.774
  219    HA   LYS  29           HA       LYS  29  24.122 -23.360  -0.802
  220    HB2  LYS  29           1HB      LYS  29  22.617 -22.469   0.905
  221    HB3  LYS  29           2HB      LYS  29  22.329 -24.091   1.521
  222    HG2  LYS  29           1HG      LYS  29  24.480 -24.264   2.411
  223    HG3  LYS  29           2HG      LYS  29  25.085 -22.917   1.443
  224    HD2  LYS  29           1HD      LYS  29  24.850 -21.932   3.516
  225    HD3  LYS  29           2HD      LYS  29  23.303 -21.539   2.761
  226    HE2  LYS  29           1HE      LYS  29  22.247 -22.556   4.428
  227    HE3  LYS  29           2HE      LYS  29  23.030 -24.073   3.990
  228    HZ1  LYS  29           3HZ      LYS  29  23.489 -22.415   6.241
  229    HZ2  LYS  29           1HZ      LYS  29  24.923 -22.611   5.364
  230    HZ3  LYS  29           2HZ      LYS  29  24.081 -23.968   5.922
  231    H    ALA  30           H        ALA  30  22.391 -26.189   0.506
  232    HA   ALA  30           HA       ALA  30  24.609 -27.658   1.310
  233    HB1  ALA  30           1HB      ALA  30  23.048 -29.105   1.940
  234    HB2  ALA  30           2HB      ALA  30  21.847 -28.071   1.166
  235    HB3  ALA  30           3HB      ALA  30  22.575 -29.403   0.267
  236    H    SER  31           H        SER  31  22.857 -27.829  -1.790
  237    HA   SER  31           HA       SER  31  24.436 -29.764  -3.013
  238    HB2  SER  31           1HB      SER  31  22.283 -28.166  -3.764
  239    HB3  SER  31           2HB      SER  31  23.564 -27.715  -4.889
  240    HG   SER  31           HG       SER  31  22.991 -29.472  -5.889
  241    H    ALA  32           H        ALA  32  24.746 -26.222  -3.177
  242    HA   ALA  32           HA       ALA  32  26.975 -26.080  -4.826
  243    HB1  ALA  32           1HB      ALA  32  27.216 -23.855  -4.136
  244    HB2  ALA  32           2HB      ALA  32  25.493 -24.190  -3.961
  245    HB3  ALA  32           3HB      ALA  32  26.538 -24.183  -2.541
  246    H    THR  33           H        THR  33  26.865 -26.193  -1.269
  247    HA   THR  33           HA       THR  33  29.593 -26.072  -0.769
  248    HB   THR  33           HB       THR  33  27.571 -27.675   0.809
  249    HG1  THR  33           HG1      THR  33  28.166 -24.920   0.683
  250   HG21  THR  33          3HG2      THR  33  29.454 -26.475   2.494
  251   HG22  THR  33          1HG2      THR  33  30.387 -27.151   1.159
  252   HG23  THR  33          2HG2      THR  33  29.316 -28.188   2.101
  253    H    ASP  34           H        ASP  34  27.585 -29.017  -0.970
  254    HA   ASP  34           HA       ASP  34  29.612 -30.889  -0.757
  255    HB2  ASP  34           1HB      ASP  34  26.860 -30.866  -1.810
  256    HB3  ASP  34           2HB      ASP  34  27.891 -32.131  -2.473
  257    H    GLN  35           H        GLN  35  28.284 -29.429  -3.716
  258    HA   GLN  35           HA       GLN  35  29.871 -30.785  -5.560
  259    HB2  GLN  35           1HB      GLN  35  28.545 -28.088  -5.605
  260    HB3  GLN  35           2HB      GLN  35  29.513 -28.643  -6.964
  261    HG2  GLN  35           1HG      GLN  35  28.060 -30.634  -7.135
  262    HG3  GLN  35           2HG      GLN  35  27.056 -29.972  -5.846
  263   HE21  GLN  35          2HE2      GLN  35  25.284 -29.975  -7.281
  264   HE22  GLN  35          1HE2      GLN  35  25.112 -28.753  -8.490
  265    H    LEU  36           H        LEU  36  30.397 -27.477  -4.322
  266    HA   LEU  36           HA       LEU  36  32.889 -27.040  -5.431
  267    HB2  LEU  36           1HB      LEU  36  31.365 -25.952  -3.166
  268    HB3  LEU  36           2HB      LEU  36  33.110 -25.722  -3.068
  269    HG   LEU  36           HG       LEU  36  31.909 -23.793  -4.047
  270   HD11  LEU  36          1HD1      LEU  36  34.022 -23.605  -4.787
  271   HD12  LEU  36          2HD1      LEU  36  33.316 -24.043  -6.342
  272   HD13  LEU  36          3HD1      LEU  36  34.088 -25.276  -5.346
  273   HD21  LEU  36          3HD2      LEU  36  31.500 -25.198  -6.606
  274   HD22  LEU  36          1HD2      LEU  36  30.552 -23.921  -5.845
  275   HD23  LEU  36          2HD2      LEU  36  30.362 -25.593  -5.317
  276    H    LYS  37           H        LYS  37  32.080 -28.594  -2.355
  277    HA   LYS  37           HA       LYS  37  34.646 -28.905  -1.329
  278    HB2  LYS  37           1HB      LYS  37  32.454 -29.402  -0.170
  279    HB3  LYS  37           2HB      LYS  37  32.419 -30.925  -1.049
  280    HG2  LYS  37           1HG      LYS  37  33.722 -31.871   0.466
  281    HG3  LYS  37           2HG      LYS  37  34.959 -30.635   0.226
  282    HD2  LYS  37           1HD      LYS  37  33.207 -29.237   1.704
  283    HD3  LYS  37           2HD      LYS  37  32.873 -30.861   2.309
  284    HE2  LYS  37           1HE      LYS  37  34.551 -30.146   3.729
  285    HE3  LYS  37           2HE      LYS  37  35.455 -31.038   2.506
  286    HZ1  LYS  37           3HZ      LYS  37  36.441 -29.180   1.758
  287    HZ2  LYS  37           1HZ      LYS  37  36.058 -28.563   3.286
  288    HZ3  LYS  37           2HZ      LYS  37  35.065 -28.217   1.961
  289    H    LYS  38           H        LYS  38  32.767 -31.258  -3.242
  290    HA   LYS  38           HA       LYS  38  34.779 -33.177  -3.492
  291    HB2  LYS  38           1HB      LYS  38  32.226 -33.190  -4.158
  292    HB3  LYS  38           2HB      LYS  38  32.853 -32.724  -5.733
  293    HG2  LYS  38           1HG      LYS  38  33.657 -34.770  -6.160
  294    HG3  LYS  38           2HG      LYS  38  34.227 -35.002  -4.505
  295    HD2  LYS  38           1HD      LYS  38  31.695 -35.215  -3.947
  296    HD3  LYS  38           2HD      LYS  38  31.524 -35.536  -5.674
  297    HE2  LYS  38           1HE      LYS  38  33.674 -37.034  -4.353
  298    HE3  LYS  38           2HE      LYS  38  32.051 -37.421  -3.781
  299    HZ1  LYS  38           3HZ      LYS  38  33.148 -38.576  -5.890
  300    HZ2  LYS  38           1HZ      LYS  38  32.409 -37.266  -6.666
  301    HZ3  LYS  38           2HZ      LYS  38  31.479 -38.338  -5.746
  302    H    ALA  39           H        ALA  39  33.848 -30.611  -5.783
  303    HA   ALA  39           HA       ALA  39  35.741 -31.085  -7.743
  304    HB1  ALA  39           1HB      ALA  39  34.092 -28.805  -6.920
  305    HB2  ALA  39           2HB      ALA  39  35.553 -28.375  -7.810
  306    HB3  ALA  39           3HB      ALA  39  34.379 -29.481  -8.523
  307    H    LYS  40           H        LYS  40  36.029 -29.021  -4.863
  308    HA   LYS  40           HA       LYS  40  38.602 -28.051  -5.337
  309    HB2  LYS  40           1HB      LYS  40  36.807 -28.287  -3.014
  310    HB3  LYS  40           2HB      LYS  40  38.517 -28.209  -2.613
  311    HG2  LYS  40           1HG      LYS  40  38.092 -26.212  -4.529
  312    HG3  LYS  40           2HG      LYS  40  36.735 -26.109  -3.405
  313    HD2  LYS  40           1HD      LYS  40  38.244 -24.783  -2.314
  314    HD3  LYS  40           2HD      LYS  40  38.661 -26.347  -1.611
  315    HE2  LYS  40           1HE      LYS  40  40.718 -25.401  -2.209
  316    HE3  LYS  40           2HE      LYS  40  40.365 -26.547  -3.501
  317    HZ1  LYS  40           3HZ      LYS  40  39.609 -24.745  -4.883
  318    HZ2  LYS  40           1HZ      LYS  40  41.171 -24.403  -4.331
  319    HZ3  LYS  40           2HZ      LYS  40  39.840 -23.627  -3.635
  320    H    ALA  41           H        ALA  41  37.633 -30.810  -3.292
  321    HA   ALA  41           HA       ALA  41  40.141 -31.700  -2.563
  322    HB1  ALA  41           1HB      ALA  41  37.738 -33.419  -3.167
  323    HB2  ALA  41           2HB      ALA  41  39.125 -33.872  -2.176
  324    HB3  ALA  41           3HB      ALA  41  38.045 -32.583  -1.644
  325    H    GLU  42           H        GLU  42  38.209 -32.913  -5.311
  326    HA   GLU  42           HA       GLU  42  40.115 -34.609  -6.392
  327    HB2  GLU  42           1HB      GLU  42  37.723 -33.199  -7.429
  328    HB3  GLU  42           2HB      GLU  42  38.857 -33.799  -8.632
  329    HG2  GLU  42           1HG      GLU  42  38.634 -36.038  -7.817
  330    HG3  GLU  42           2HG      GLU  42  37.656 -35.493  -6.456
  331    H    ALA  43           H        ALA  43  39.693 -31.139  -6.827
  332    HA   ALA  43           HA       ALA  43  41.615 -30.846  -8.896
  333    HB1  ALA  43           1HB      ALA  43  39.935 -29.159  -8.594
  334    HB2  ALA  43           2HB      ALA  43  40.484 -28.845  -6.947
  335    HB3  ALA  43           3HB      ALA  43  41.518 -28.432  -8.315
  336    H    GLN  44           H        GLN  44  41.804 -30.975  -5.420
  337    HA   GLN  44           HA       GLN  44  44.723 -30.860  -5.615
  338    HB2  GLN  44           1HB      GLN  44  43.478 -28.653  -4.801
  339    HB3  GLN  44           2HB      GLN  44  43.465 -29.520  -3.271
  340    HG2  GLN  44           1HG      GLN  44  45.659 -29.234  -2.943
  341    HG3  GLN  44           2HG      GLN  44  46.053 -29.513  -4.639
  342   HE21  GLN  44          2HE2      GLN  44  47.437 -27.807  -4.850
  343   HE22  GLN  44          1HE2      GLN  44  46.930 -26.157  -4.785
  344    H    VAL  45           H        VAL  45  44.894 -33.047  -5.240
  345    HA   VAL  45           HA       VAL  45  43.498 -34.411  -3.174
  346    HB   VAL  45           HB       VAL  45  46.071 -35.269  -4.501
  347   HG11  VAL  45          1HG1      VAL  45  45.857 -36.875  -2.936
  348   HG12  VAL  45          2HG1      VAL  45  44.145 -36.538  -2.672
  349   HG13  VAL  45          3HG1      VAL  45  44.650 -37.522  -4.046
  350   HG21  VAL  45          3HG2      VAL  45  44.728 -34.977  -6.345
  351   HG22  VAL  45          1HG2      VAL  45  44.315 -36.632  -5.894
  352   HG23  VAL  45          2HG2      VAL  45  43.243 -35.304  -5.451
  353    H    ILE  46           H        ILE  46  43.811 -33.353  -1.225
  354    HA   ILE  46           HA       ILE  46  46.501 -33.662  -0.073
  355    HB   ILE  46           HB       ILE  46  46.104 -31.280  -0.588
  356   HG12  ILE  46          1HG1      ILE  46  46.540 -30.420   1.729
  357   HG13  ILE  46          2HG1      ILE  46  46.159 -32.024   2.344
  358   HG21  ILE  46          1HG2      ILE  46  44.364 -30.023   0.387
  359   HG22  ILE  46          2HG2      ILE  46  43.599 -31.473  -0.260
  360   HG23  ILE  46          3HG2      ILE  46  43.914 -31.340   1.470
  361   HD11  ILE  46          3HD1      ILE  46  48.595 -31.500   2.089
  362   HD12  ILE  46          1HD1      ILE  46  48.048 -32.972   1.286
  363   HD13  ILE  46          2HD1      ILE  46  48.338 -31.509   0.344
  364    H    ILE  47           H        ILE  47  46.591 -34.442   1.980
  365    HA   ILE  47           HA       ILE  47  44.048 -34.835   3.406
  366    HB   ILE  47           HB       ILE  47  44.639 -36.956   2.350
  367   HG12  ILE  47          1HG1      ILE  47  45.306 -37.247   5.270
  368   HG13  ILE  47          2HG1      ILE  47  43.699 -36.748   4.752
  369   HG21  ILE  47          1HG2      ILE  47  47.001 -36.722   2.081
  370   HG22  ILE  47          2HG2      ILE  47  47.244 -36.624   3.825
  371   HG23  ILE  47          3HG2      ILE  47  46.711 -38.138   3.092
  372   HD11  ILE  47          3HD1      ILE  47  44.862 -39.185   3.527
  373   HD12  ILE  47          1HD1      ILE  47  44.300 -39.272   5.196
  374   HD13  ILE  47          2HD1      ILE  47  43.186 -38.797   3.913
  375    H    GLU  48           H        GLU  48  44.137 -34.735   5.636
  376    HA   GLU  48           HA       GLU  48  46.750 -34.145   6.844
  377    HB2  GLU  48           1HB      GLU  48  45.564 -32.400   8.248
  378    HB3  GLU  48           2HB      GLU  48  45.822 -31.986   6.559
  379    HG2  GLU  48           1HG      GLU  48  43.274 -33.308   7.029
  380    HG3  GLU  48           2HG      GLU  48  43.453 -31.801   7.926
  381    H    GLN  49           H        GLN  49  47.039 -35.840   8.154
  382    HA   GLN  49           HA       GLN  49  45.094 -37.445   9.298
  383    HB2  GLN  49           1HB      GLN  49  47.503 -38.011   9.161
  384    HB3  GLN  49           2HB      GLN  49  47.830 -36.841  10.433
  385    HG2  GLN  49           1HG      GLN  49  47.793 -38.979  11.440
  386    HG3  GLN  49           2HG      GLN  49  46.307 -38.157  11.915
  387   HE21  GLN  49          2HE2      GLN  49  45.554 -40.317  12.402
  388   HE22  GLN  49          1HE2      GLN  49  44.904 -41.295  11.135
  389    H    ALA  50           H        ALA  50  43.527 -36.906  10.653
  390    HA   ALA  50           HA       ALA  50  43.828 -34.624  12.428
  391    HB1  ALA  50           1HB      ALA  50  41.434 -36.416  12.045
  392    HB2  ALA  50           2HB      ALA  50  41.468 -34.844  12.845
  393    HB3  ALA  50           3HB      ALA  50  41.757 -34.956  11.109
  394    H    ASN  51           H        ASN  51  44.302 -34.751  14.525
  395    HA   ASN  51           HA       ASN  51  43.498 -36.883  16.212
  396    HB2  ASN  51           1HB      ASN  51  46.101 -37.107  14.889
  397    HB3  ASN  51           2HB      ASN  51  46.203 -37.213  16.644
  398   HD21  ASN  51          2HD2      ASN  51  46.508 -39.197  14.410
  399   HD22  ASN  51          1HD2      ASN  51  45.478 -40.510  14.858
  400    H    LYS  52           H        LYS  52  43.658 -36.330  18.344
  401    HA   LYS  52           HA       LYS  52  44.160 -33.613  18.971
  402    HB2  LYS  52           1HB      LYS  52  43.759 -34.315  21.315
  403    HB3  LYS  52           2HB      LYS  52  42.506 -34.868  20.212
  404    HG2  LYS  52           1HG      LYS  52  43.436 -37.091  20.198
  405    HG3  LYS  52           2HG      LYS  52  44.797 -36.560  21.190
  406    HD2  LYS  52           1HD      LYS  52  42.151 -35.967  22.317
  407    HD3  LYS  52           2HD      LYS  52  42.515 -37.687  22.157
  408    HE2  LYS  52           1HE      LYS  52  44.502 -35.804  23.375
  409    HE3  LYS  52           2HE      LYS  52  43.174 -36.456  24.335
  410    HZ1  LYS  52           3HZ      LYS  52  43.940 -38.702  23.675
  411    HZ2  LYS  52           1HZ      LYS  52  45.067 -37.854  24.609
  412    HZ3  LYS  52           2HZ      LYS  52  45.290 -37.998  22.939
  413    H    ARG  53           H        ARG  53  45.688 -32.812  20.570
  414    HA   ARG  53           HA       ARG  53  48.172 -34.383  20.711
  415    HB2  ARG  53           1HB      ARG  53  47.806 -31.523  19.860
  416    HB3  ARG  53           2HB      ARG  53  49.332 -32.078  20.537
  417    HG2  ARG  53           1HG      ARG  53  49.431 -33.804  18.756
  418    HG3  ARG  53           2HG      ARG  53  47.982 -33.090  18.045
  419    HD2  ARG  53           1HD      ARG  53  50.032 -31.111  18.601
  420    HD3  ARG  53           2HD      ARG  53  50.602 -32.376  17.514
  421    HE   ARG  53           HE       ARG  53  48.176 -31.662  16.500
  422   HH11  ARG  53          1HH1      ARG  53  51.099 -29.949  17.303
  423   HH12  ARG  53          2HH1      ARG  53  50.880 -28.739  16.082
  424   HH21  ARG  53          1HH2      ARG  53  47.877 -30.075  14.889
  425   HH22  ARG  53          2HH2      ARG  53  49.047 -28.811  14.710
  Start of MODEL    3
    1    H1   MET   1           H        MET   1 -21.163 -13.402   1.107
    2    HA   MET   1           HA       MET   1 -20.657 -10.635   1.603
    3    HB2  MET   1           1HB      MET   1 -22.218 -12.800   2.913
    4    HB3  MET   1           2HB      MET   1 -21.772 -11.417   3.904
    5    HG2  MET   1           1HG      MET   1 -23.165 -10.012   2.822
    6    HG3  MET   1           2HG      MET   1 -22.944 -10.812   1.268
    7    HE1  MET   1           3HE      MET   1 -26.420 -10.849   3.857
    8    HE2  MET   1           1HE      MET   1 -25.127 -11.514   4.856
    9    HE3  MET   1           2HE      MET   1 -24.897  -9.974   4.029
   10    H    ALA   2           H        ALA   2 -18.414 -10.440   1.837
   11    HA   ALA   2           HA       ALA   2 -16.905 -11.971   3.698
   12    HB1  ALA   2           1HB      ALA   2 -16.391  -9.490   2.113
   13    HB2  ALA   2           2HB      ALA   2 -15.259  -9.989   3.372
   14    HB3  ALA   2           3HB      ALA   2 -15.603 -11.066   2.018
   15    H    ALA   3           H        ALA   3 -15.478 -10.476   5.297
   16    HA   ALA   3           HA       ALA   3 -17.403  -8.971   6.948
   17    HB1  ALA   3           1HB      ALA   3 -17.136 -10.620   8.435
   18    HB2  ALA   3           2HB      ALA   3 -15.695 -11.241   7.630
   19    HB3  ALA   3           3HB      ALA   3 -15.563  -9.886   8.751
   20    H    ILE   4           H        ILE   4 -16.767  -7.028   7.718
   21    HA   ILE   4           HA       ILE   4 -14.508  -5.759   6.571
   22    HB   ILE   4           HB       ILE   4 -15.084  -3.832   7.946
   23   HG12  ILE   4          1HG1      ILE   4 -17.345  -4.314   9.321
   24   HG13  ILE   4          2HG1      ILE   4 -16.581  -5.892   9.474
   25   HG21  ILE   4          1HG2      ILE   4 -17.470  -3.578   7.218
   26   HG22  ILE   4          2HG2      ILE   4 -16.354  -4.075   5.948
   27   HG23  ILE   4          3HG2      ILE   4 -17.421  -5.262   6.698
   28   HD11  ILE   4          3HD1      ILE   4 -15.172  -5.146  11.009
   29   HD12  ILE   4          1HD1      ILE   4 -14.718  -3.756  10.023
   30   HD13  ILE   4          2HD1      ILE   4 -16.142  -3.674  11.061
   31    H    GLU   5           H        GLU   5 -15.049  -7.430   9.571
   32    HA   GLU   5           HA       GLU   5 -12.682  -6.399  10.853
   33    HB2  GLU   5           1HB      GLU   5 -13.223  -7.876  12.669
   34    HB3  GLU   5           2HB      GLU   5 -14.709  -7.117  12.116
   35    HG2  GLU   5           1HG      GLU   5 -14.729  -9.359  10.623
   36    HG3  GLU   5           2HG      GLU   5 -13.887  -9.937  12.059
   37    H    LYS   6           H        LYS   6 -13.530  -9.111   8.857
   38    HA   LYS   6           HA       LYS   6 -11.408 -10.842   9.481
   39    HB2  LYS   6           1HB      LYS   6 -13.548 -11.163   7.985
   40    HB3  LYS   6           2HB      LYS   6 -12.474 -10.651   6.691
   41    HG2  LYS   6           1HG      LYS   6 -11.567 -12.666   6.569
   42    HG3  LYS   6           2HG      LYS   6 -11.195 -12.658   8.295
   43    HD2  LYS   6           1HD      LYS   6 -13.675 -13.239   8.627
   44    HD3  LYS   6           2HD      LYS   6 -13.672 -13.635   6.907
   45    HE2  LYS   6           1HE      LYS   6 -11.987 -15.304   7.230
   46    HE3  LYS   6           2HE      LYS   6 -11.747 -14.811   8.905
   47    HZ1  LYS   6           3HZ      LYS   6 -13.194 -16.864   8.387
   48    HZ2  LYS   6           1HZ      LYS   6 -14.395 -15.734   8.009
   49    HZ3  LYS   6           2HZ      LYS   6 -13.722 -15.766   9.560
   50    H    ARG   7           H        ARG   7  -9.425 -11.224   8.427
   51    HA   ARG   7           HA       ARG   7  -8.226  -8.801   7.318
   52    HB2  ARG   7           1HB      ARG   7  -7.059 -11.350   8.429
   53    HB3  ARG   7           2HB      ARG   7  -6.079 -10.139   7.613
   54    HG2  ARG   7           1HG      ARG   7  -7.791  -9.090   9.748
   55    HG3  ARG   7           2HG      ARG   7  -6.541 -10.217  10.280
   56    HD2  ARG   7           1HD      ARG   7  -5.429  -8.199  10.379
   57    HD3  ARG   7           2HD      ARG   7  -4.983  -8.778   8.775
   58    HE   ARG   7           HE       ARG   7  -7.181  -7.295   8.285
   59   HH11  ARG   7          1HH1      ARG   7  -4.239  -6.668  10.038
   60   HH12  ARG   7          2HH1      ARG   7  -4.246  -4.969   9.699
   61   HH21  ARG   7          1HH2      ARG   7  -7.201  -5.059   7.832
   62   HH22  ARG   7          2HH2      ARG   7  -5.931  -4.054   8.445
   63    H    GLN   8           H        GLN   8  -6.276  -9.531   5.733
   64    HA   GLN   8           HA       GLN   8  -7.653 -10.717   3.453
   65    HB2  GLN   8           1HB      GLN   8  -4.932  -9.408   3.531
   66    HB3  GLN   8           2HB      GLN   8  -5.886  -9.780   2.102
   67    HG2  GLN   8           1HG      GLN   8  -7.484  -8.113   2.624
   68    HG3  GLN   8           2HG      GLN   8  -6.811  -7.881   4.237
   69   HE21  GLN   8          2HE2      GLN   8  -4.258  -7.504   3.981
   70   HE22  GLN   8          1HE2      GLN   8  -3.876  -6.194   2.922
   71    H    LYS   9           H        LYS   9  -5.680 -11.746   1.939
   72    HA   LYS   9           HA       LYS   9  -4.938 -14.139   3.448
   73    HB2  LYS   9           1HB      LYS   9  -4.802 -13.672   0.465
   74    HB3  LYS   9           2HB      LYS   9  -4.641 -15.212   1.299
   75    HG2  LYS   9           1HG      LYS   9  -7.135 -13.533   1.380
   76    HG3  LYS   9           2HG      LYS   9  -6.852 -14.816   0.201
   77    HD2  LYS   9           1HD      LYS   9  -6.490 -15.464   3.079
   78    HD3  LYS   9           2HD      LYS   9  -8.138 -15.259   2.480
   79    HE2  LYS   9           1HE      LYS   9  -7.309 -16.851   0.570
   80    HE3  LYS   9           2HE      LYS   9  -6.090 -17.308   1.759
   81    HZ1  LYS   9           3HZ      LYS   9  -8.604 -18.335   1.573
   82    HZ2  LYS   9           1HZ      LYS   9  -8.731 -17.245   2.860
   83    HZ3  LYS   9           2HZ      LYS   9  -7.574 -18.477   2.907
   84    H    GLU  10           H        GLU  10  -3.320 -12.371   4.376
   85    HA   GLU  10           HA       GLU  10  -0.929 -12.127   2.736
   86    HB2  GLU  10           1HB      GLU  10  -2.030 -10.770   5.065
   87    HB3  GLU  10           2HB      GLU  10  -0.326 -11.153   5.267
   88    HG2  GLU  10           1HG      GLU  10  -0.981 -10.009   2.661
   89    HG3  GLU  10           2HG      GLU  10  -1.316  -8.941   4.023
   90    H    ILE  11           H        ILE  11  -2.057 -13.816   5.604
   91    HA   ILE  11           HA       ILE  11   0.316 -14.797   6.621
   92    HB   ILE  11           HB       ILE  11  -2.313 -16.276   6.459
   93   HG12  ILE  11          1HG1      ILE  11  -1.693 -15.128   9.027
   94   HG13  ILE  11          2HG1      ILE  11  -1.648 -13.878   7.789
   95   HG21  ILE  11          1HG2      ILE  11   0.260 -16.839   7.792
   96   HG22  ILE  11          2HG2      ILE  11  -1.195 -17.112   8.748
   97   HG23  ILE  11          3HG2      ILE  11  -0.983 -17.945   7.208
   98   HD11  ILE  11          3HD1      ILE  11  -3.845 -14.017   8.771
   99   HD12  ILE  11          1HD1      ILE  11  -3.905 -14.523   7.082
  100   HD13  ILE  11          2HD1      ILE  11  -3.945 -15.730   8.367
  101    H    ALA  12           H        ALA  12  -1.842 -16.595   4.415
  102    HA   ALA  12           HA       ALA  12  -0.149 -18.707   3.861
  103    HB1  ALA  12           1HB      ALA  12  -1.463 -19.064   1.842
  104    HB2  ALA  12           2HB      ALA  12  -2.504 -18.648   3.204
  105    HB3  ALA  12           3HB      ALA  12  -2.132 -17.437   1.977
  106    H    ASP  13           H        ASP  13  -0.374 -15.570   2.227
  107    HA   ASP  13           HA       ASP  13   1.399 -16.049   0.135
  108    HB2  ASP  13           1HB      ASP  13   0.296 -13.680   1.486
  109    HB3  ASP  13           2HB      ASP  13   1.852 -13.412   0.704
  110    H    GLY  14           H        GLY  14   2.114 -14.505   3.275
  111    HA2  GLY  14           1HA      GLY  14   4.896 -14.357   2.894
  112    HA3  GLY  14           2HA      GLY  14   4.077 -14.308   4.448
  113    H    LEU  15           H        LEU  15   2.857 -16.955   4.050
  114    HA   LEU  15           HA       LEU  15   4.889 -18.517   5.242
  115    HB2  LEU  15           1HB      LEU  15   2.376 -18.747   5.506
  116    HB3  LEU  15           2HB      LEU  15   2.389 -19.581   3.953
  117    HG   LEU  15           HG       LEU  15   4.312 -20.805   5.673
  118   HD11  LEU  15          1HD1      LEU  15   3.268 -20.173   7.632
  119   HD12  LEU  15          2HD1      LEU  15   2.475 -21.706   7.271
  120   HD13  LEU  15          3HD1      LEU  15   1.661 -20.186   6.905
  121   HD21  LEU  15          3HD2      LEU  15   1.647 -21.826   4.703
  122   HD22  LEU  15          1HD2      LEU  15   3.048 -22.783   5.184
  123   HD23  LEU  15          2HD2      LEU  15   3.116 -21.790   3.728
  124    H    ALA  16           H        ALA  16   3.307 -18.805   2.058
  125    HA   ALA  16           HA       ALA  16   5.073 -20.826   1.124
  126    HB1  ALA  16           1HB      ALA  16   2.679 -19.793   0.275
  127    HB2  ALA  16           2HB      ALA  16   3.806 -19.216  -0.952
  128    HB3  ALA  16           3HB      ALA  16   3.676 -20.942  -0.616
  129    H    SER  17           H        SER  17   5.051 -17.319   0.931
  130    HA   SER  17           HA       SER  17   7.089 -17.067  -1.021
  131    HB2  SER  17           1HB      SER  17   5.458 -15.264  -0.318
  132    HB3  SER  17           2HB      SER  17   6.427 -15.059   1.141
  133    HG   SER  17           HG       SER  17   6.867 -13.716  -0.871
  134    H    ALA  18           H        ALA  18   7.119 -17.209   2.505
  135    HA   ALA  18           HA       ALA  18   9.959 -16.761   2.681
  136    HB1  ALA  18           1HB      ALA  18   9.602 -17.348   5.097
  137    HB2  ALA  18           2HB      ALA  18   8.653 -15.983   4.507
  138    HB3  ALA  18           3HB      ALA  18   7.892 -17.560   4.719
  139    H    GLU  19           H        GLU  19   7.780 -19.524   2.745
  140    HA   GLU  19           HA       GLU  19   9.670 -21.451   3.577
  141    HB2  GLU  19           1HB      GLU  19   7.252 -21.848   3.664
  142    HB3  GLU  19           2HB      GLU  19   7.174 -21.803   1.908
  143    HG2  GLU  19           1HG      GLU  19   8.672 -23.771   1.836
  144    HG3  GLU  19           2HG      GLU  19   8.599 -23.845   3.596
  145    H    ARG  20           H        ARG  20   8.409 -20.713   0.322
  146    HA   ARG  20           HA       ARG  20  10.112 -22.440  -1.076
  147    HB2  ARG  20           1HB      ARG  20   8.071 -21.364  -2.012
  148    HB3  ARG  20           2HB      ARG  20   8.939 -19.836  -2.066
  149    HG2  ARG  20           1HG      ARG  20  10.624 -21.524  -3.415
  150    HG3  ARG  20           2HG      ARG  20   9.026 -22.105  -3.887
  151    HD2  ARG  20           1HD      ARG  20   8.657 -19.445  -4.117
  152    HD3  ARG  20           2HD      ARG  20  10.378 -19.554  -4.489
  153    HE   ARG  20           HE       ARG  20   9.841 -20.527  -6.486
  154   HH11  ARG  20          1HH1      ARG  20   7.084 -20.701  -4.368
  155   HH12  ARG  20          2HH1      ARG  20   6.019 -21.311  -5.591
  156   HH21  ARG  20          1HH2      ARG  20   8.449 -21.329  -8.105
  157   HH22  ARG  20          2HH2      ARG  20   6.797 -21.669  -7.716
  158    H    ALA  21           H        ALA  21  10.506 -19.061  -0.122
  159    HA   ALA  21           HA       ALA  21  12.891 -18.560  -1.533
  160    HB1  ALA  21           1HB      ALA  21  11.821 -17.302   0.989
  161    HB2  ALA  21           2HB      ALA  21  13.183 -16.681   0.055
  162    HB3  ALA  21           3HB      ALA  21  11.574 -16.741  -0.665
  163    H    HIS  22           H        HIS  22  12.367 -19.490   1.868
  164    HA   HIS  22           HA       HIS  22  15.066 -19.646   2.594
  165    HB2  HIS  22           1HB      HIS  22  13.041 -19.672   4.129
  166    HB3  HIS  22           2HB      HIS  22  12.874 -21.380   3.735
  167    HD1  HIS  22           HD1      HIS  22  16.037 -19.447   4.574
  168    HD2  HIS  22           HD2      HIS  22  13.744 -22.609   5.990
  169    HE1  HIS  22           HE1      HIS  22  17.333 -20.406   6.504
  170    H    LYS  23           H        LYS  23  12.851 -22.296   1.699
  171    HA   LYS  23           HA       LYS  23  14.696 -24.365   1.724
  172    HB2  LYS  23           1HB      LYS  23  12.118 -23.896   0.290
  173    HB3  LYS  23           2HB      LYS  23  13.098 -25.282  -0.172
  174    HG2  LYS  23           1HG      LYS  23  13.112 -25.841   2.338
  175    HG3  LYS  23           2HG      LYS  23  11.760 -24.712   2.443
  176    HD2  LYS  23           1HD      LYS  23  10.343 -26.198   1.567
  177    HD3  LYS  23           2HD      LYS  23  11.447 -26.574   0.242
  178    HE2  LYS  23           1HE      LYS  23  12.395 -28.333   1.351
  179    HE3  LYS  23           2HE      LYS  23  12.098 -27.632   2.941
  180    HZ1  LYS  23           3HZ      LYS  23  10.662 -29.632   1.795
  181    HZ2  LYS  23           1HZ      LYS  23   9.683 -28.276   1.536
  182    HZ3  LYS  23           2HZ      LYS  23  10.160 -28.687   3.106
  183    H    ASP  24           H        ASP  24  13.872 -22.129  -0.891
  184    HA   ASP  24           HA       ASP  24  15.424 -23.325  -2.903
  185    HB2  ASP  24           1HB      ASP  24  13.694 -21.602  -3.322
  186    HB3  ASP  24           2HB      ASP  24  14.740 -20.396  -2.578
  187    H    LEU  25           H        LEU  25  16.190 -20.549  -0.799
  188    HA   LEU  25           HA       LEU  25  18.788 -20.110  -1.665
  189    HB2  LEU  25           1HB      LEU  25  17.140 -19.324   0.555
  190    HB3  LEU  25           2HB      LEU  25  18.789 -19.626   1.098
  191    HG   LEU  25           HG       LEU  25  19.030 -18.055  -1.211
  192   HD11  LEU  25          1HD1      LEU  25  17.190 -16.588   0.610
  193   HD12  LEU  25          2HD1      LEU  25  16.503 -17.659  -0.611
  194   HD13  LEU  25          3HD1      LEU  25  17.544 -16.321  -1.097
  195   HD21  LEU  25          3HD2      LEU  25  20.607 -17.552   0.322
  196   HD22  LEU  25          1HD2      LEU  25  19.525 -17.833   1.686
  197   HD23  LEU  25          2HD2      LEU  25  19.447 -16.310   0.799
  198    H    ASP  26           H        ASP  26  17.702 -22.117   1.070
  199    HA   ASP  26           HA       ASP  26  20.175 -23.042   1.911
  200    HB2  ASP  26           1HB      ASP  26  17.611 -23.478   2.693
  201    HB3  ASP  26           2HB      ASP  26  17.994 -25.035   1.962
  202    H    LEU  27           H        LEU  27  17.974 -24.524  -0.462
  203    HA   LEU  27           HA       LEU  27  19.486 -26.757  -1.097
  204    HB2  LEU  27           1HB      LEU  27  17.215 -26.459  -1.875
  205    HB3  LEU  27           2HB      LEU  27  17.710 -25.094  -2.876
  206    HG   LEU  27           HG       LEU  27  19.252 -26.911  -4.002
  207   HD11  LEU  27          1HD1      LEU  27  18.783 -28.747  -2.558
  208   HD12  LEU  27          2HD1      LEU  27  18.015 -29.080  -4.110
  209   HD13  LEU  27          3HD1      LEU  27  17.043 -28.526  -2.747
  210   HD21  LEU  27          3HD2      LEU  27  17.773 -26.924  -5.750
  211   HD22  LEU  27          1HD2      LEU  27  17.148 -25.563  -4.818
  212   HD23  LEU  27          2HD2      LEU  27  16.368 -27.141  -4.706
  213    H    ALA  28           H        ALA  28  19.548 -23.549  -2.635
  214    HA   ALA  28           HA       ALA  28  21.526 -24.101  -4.535
  215    HB1  ALA  28           1HB      ALA  28  21.792 -21.400  -3.718
  216    HB2  ALA  28           2HB      ALA  28  20.975 -22.042  -5.144
  217    HB3  ALA  28           3HB      ALA  28  20.081 -21.825  -3.639
  218    H    LYS  29           H        LYS  29  21.867 -22.528  -1.352
  219    HA   LYS  29           HA       LYS  29  24.612 -22.205  -1.339
  220    HB2  LYS  29           1HB      LYS  29  22.635 -21.684   0.433
  221    HB3  LYS  29           2HB      LYS  29  23.406 -23.050   1.228
  222    HG2  LYS  29           1HG      LYS  29  25.522 -21.433   0.475
  223    HG3  LYS  29           2HG      LYS  29  24.277 -20.301   1.006
  224    HD2  LYS  29           1HD      LYS  29  24.035 -21.710   3.079
  225    HD3  LYS  29           2HD      LYS  29  25.474 -22.591   2.558
  226    HE2  LYS  29           1HE      LYS  29  26.836 -20.958   3.240
  227    HE3  LYS  29           2HE      LYS  29  25.844 -19.708   2.490
  228    HZ1  LYS  29           3HZ      LYS  29  26.129 -20.111   5.157
  229    HZ2  LYS  29           1HZ      LYS  29  24.640 -20.846   4.832
  230    HZ3  LYS  29           2HZ      LYS  29  24.888 -19.223   4.427
  231    H    ALA  30           H        ALA  30  22.784 -24.951   0.018
  232    HA   ALA  30           HA       ALA  30  24.958 -26.508   0.781
  233    HB1  ALA  30           1HB      ALA  30  23.443 -28.378   0.822
  234    HB2  ALA  30           2HB      ALA  30  22.603 -26.942   1.408
  235    HB3  ALA  30           3HB      ALA  30  22.308 -27.530  -0.229
  236    H    SER  31           H        SER  31  23.147 -26.566  -2.284
  237    HA   SER  31           HA       SER  31  24.587 -28.605  -3.529
  238    HB2  SER  31           1HB      SER  31  22.623 -28.009  -4.637
  239    HB3  SER  31           2HB      SER  31  22.980 -26.284  -4.551
  240    HG   SER  31           HG       SER  31  23.530 -26.683  -6.572
  241    H    ALA  32           H        ALA  32  25.190 -25.126  -3.398
  242    HA   ALA  32           HA       ALA  32  27.342 -25.059  -5.210
  243    HB1  ALA  32           1HB      ALA  32  26.014 -23.230  -3.473
  244    HB2  ALA  32           2HB      ALA  32  27.757 -23.062  -3.257
  245    HB3  ALA  32           3HB      ALA  32  27.046 -22.889  -4.862
  246    H    THR  33           H        THR  33  27.496 -24.839  -1.650
  247    HA   THR  33           HA       THR  33  30.241 -25.175  -1.403
  248    HB   THR  33           HB       THR  33  28.776 -24.454   0.452
  249    HG1  THR  33           HG1      THR  33  30.312 -25.121   1.744
  250   HG21  THR  33          3HG2      THR  33  27.531 -26.087   1.749
  251   HG22  THR  33          1HG2      THR  33  28.030 -27.374   0.652
  252   HG23  THR  33          2HG2      THR  33  26.964 -26.091   0.080
  253    H    ASP  34           H        ASP  34  27.717 -27.552  -1.842
  254    HA   ASP  34           HA       ASP  34  29.236 -29.834  -1.116
  255    HB2  ASP  34           1HB      ASP  34  26.754 -29.800  -1.256
  256    HB3  ASP  34           2HB      ASP  34  26.881 -29.678  -3.008
  257    H    GLN  35           H        GLN  35  28.346 -28.539  -4.319
  258    HA   GLN  35           HA       GLN  35  29.843 -30.326  -5.845
  259    HB2  GLN  35           1HB      GLN  35  28.100 -28.531  -6.557
  260    HB3  GLN  35           2HB      GLN  35  29.492 -27.463  -6.674
  261    HG2  GLN  35           1HG      GLN  35  30.094 -28.321  -8.625
  262    HG3  GLN  35           2HG      GLN  35  29.978 -29.971  -8.016
  263   HE21  GLN  35          2HE2      GLN  35  29.088 -28.457 -10.529
  264   HE22  GLN  35          1HE2      GLN  35  27.456 -28.979 -10.752
  265    H    LEU  36           H        LEU  36  30.745 -27.132  -4.579
  266    HA   LEU  36           HA       LEU  36  33.323 -27.043  -5.686
  267    HB2  LEU  36           1HB      LEU  36  31.750 -25.500  -3.868
  268    HB3  LEU  36           2HB      LEU  36  33.368 -25.704  -3.199
  269    HG   LEU  36           HG       LEU  36  33.115 -23.620  -4.487
  270   HD11  LEU  36          1HD1      LEU  36  35.206 -23.723  -5.440
  271   HD12  LEU  36          2HD1      LEU  36  34.962 -25.353  -6.064
  272   HD13  LEU  36          3HD1      LEU  36  35.256 -25.103  -4.343
  273   HD21  LEU  36          3HD2      LEU  36  32.534 -23.529  -6.705
  274   HD22  LEU  36          1HD2      LEU  36  31.524 -24.867  -6.157
  275   HD23  LEU  36          2HD2      LEU  36  33.029 -25.194  -7.017
  276    H    LYS  37           H        LYS  37  32.343 -27.878  -2.359
  277    HA   LYS  37           HA       LYS  37  34.812 -28.622  -1.373
  278    HB2  LYS  37           1HB      LYS  37  32.732 -28.413  -0.031
  279    HB3  LYS  37           2HB      LYS  37  32.164 -29.928  -0.719
  280    HG2  LYS  37           1HG      LYS  37  33.056 -30.818   1.132
  281    HG3  LYS  37           2HG      LYS  37  34.572 -30.693   0.235
  282    HD2  LYS  37           1HD      LYS  37  35.373 -29.347   1.812
  283    HD3  LYS  37           2HD      LYS  37  34.099 -28.181   1.448
  284    HE2  LYS  37           1HE      LYS  37  32.656 -29.795   2.944
  285    HE3  LYS  37           2HE      LYS  37  34.233 -30.254   3.585
  286    HZ1  LYS  37           3HZ      LYS  37  33.542 -28.526   4.951
  287    HZ2  LYS  37           1HZ      LYS  37  32.908 -27.617   3.672
  288    HZ3  LYS  37           2HZ      LYS  37  34.583 -27.755   3.863
  289    H    LYS  38           H        LYS  38  32.486 -30.562  -3.201
  290    HA   LYS  38           HA       LYS  38  33.933 -32.997  -3.021
  291    HB2  LYS  38           1HB      LYS  38  31.499 -32.789  -3.589
  292    HB3  LYS  38           2HB      LYS  38  31.971 -32.176  -5.168
  293    HG2  LYS  38           1HG      LYS  38  32.868 -34.230  -5.828
  294    HG3  LYS  38           2HG      LYS  38  32.930 -34.835  -4.170
  295    HD2  LYS  38           1HD      LYS  38  31.099 -35.936  -5.140
  296    HD3  LYS  38           2HD      LYS  38  30.383 -34.634  -4.187
  297    HE2  LYS  38           1HE      LYS  38  29.238 -34.544  -6.220
  298    HE3  LYS  38           2HE      LYS  38  30.450 -33.271  -6.357
  299    HZ1  LYS  38           3HZ      LYS  38  31.441 -35.773  -7.294
  300    HZ2  LYS  38           1HZ      LYS  38  31.369 -34.281  -8.089
  301    HZ3  LYS  38           2HZ      LYS  38  30.036 -35.323  -8.122
  302    H    ALA  39           H        ALA  39  33.737 -30.483  -5.520
  303    HA   ALA  39           HA       ALA  39  35.329 -31.650  -7.463
  304    HB1  ALA  39           1HB      ALA  39  34.528 -28.904  -6.773
  305    HB2  ALA  39           2HB      ALA  39  35.983 -29.047  -7.759
  306    HB3  ALA  39           3HB      ALA  39  34.467 -29.754  -8.318
  307    H    LYS  40           H        LYS  40  36.354 -29.471  -4.835
  308    HA   LYS  40           HA       LYS  40  39.122 -29.684  -5.428
  309    HB2  LYS  40           1HB      LYS  40  39.472 -28.566  -3.287
  310    HB3  LYS  40           2HB      LYS  40  38.178 -27.785  -4.187
  311    HG2  LYS  40           1HG      LYS  40  36.545 -29.081  -2.817
  312    HG3  LYS  40           2HG      LYS  40  37.902 -29.647  -1.840
  313    HD2  LYS  40           1HD      LYS  40  37.368 -26.724  -2.296
  314    HD3  LYS  40           2HD      LYS  40  36.608 -27.622  -0.980
  315    HE2  LYS  40           1HE      LYS  40  39.502 -28.017  -1.187
  316    HE3  LYS  40           2HE      LYS  40  39.028 -26.354  -0.844
  317    HZ1  LYS  40           3HZ      LYS  40  38.914 -28.672   0.847
  318    HZ2  LYS  40           1HZ      LYS  40  37.464 -27.800   0.828
  319    HZ3  LYS  40           2HZ      LYS  40  38.908 -27.032   1.261
  320    H    ALA  41           H        ALA  41  36.954 -31.404  -3.252
  321    HA   ALA  41           HA       ALA  41  38.783 -32.785  -1.695
  322    HB1  ALA  41           1HB      ALA  41  36.715 -33.215  -0.910
  323    HB2  ALA  41           2HB      ALA  41  35.985 -33.204  -2.516
  324    HB3  ALA  41           3HB      ALA  41  36.843 -34.636  -1.947
  325    H    GLU  42           H        GLU  42  37.252 -33.944  -4.706
  326    HA   GLU  42           HA       GLU  42  38.943 -36.228  -4.895
  327    HB2  GLU  42           1HB      GLU  42  37.949 -36.515  -7.127
  328    HB3  GLU  42           2HB      GLU  42  36.726 -36.230  -5.898
  329    HG2  GLU  42           1HG      GLU  42  35.936 -34.806  -7.450
  330    HG3  GLU  42           2HG      GLU  42  37.101 -33.715  -6.703
  331    H    ALA  43           H        ALA  43  38.968 -33.011  -6.336
  332    HA   ALA  43           HA       ALA  43  40.899 -33.317  -8.283
  333    HB1  ALA  43           1HB      ALA  43  41.380 -30.922  -7.978
  334    HB2  ALA  43           2HB      ALA  43  39.649 -31.261  -8.017
  335    HB3  ALA  43           3HB      ALA  43  40.451 -30.943  -6.479
  336    H    GLN  44           H        GLN  44  41.288 -33.044  -4.807
  337    HA   GLN  44           HA       GLN  44  44.206 -33.183  -5.125
  338    HB2  GLN  44           1HB      GLN  44  44.406 -32.335  -2.903
  339    HB3  GLN  44           2HB      GLN  44  43.222 -31.335  -3.734
  340    HG2  GLN  44           1HG      GLN  44  41.451 -32.804  -2.673
  341    HG3  GLN  44           2HG      GLN  44  42.742 -33.446  -1.658
  342   HE21  GLN  44          2HE2      GLN  44  42.119 -32.647   0.271
  343   HE22  GLN  44          1HE2      GLN  44  42.007 -30.962   0.638
  344    H    VAL  45           H        VAL  45  45.344 -34.906  -4.428
  345    HA   VAL  45           HA       VAL  45  43.816 -37.114  -3.213
  346    HB   VAL  45           HB       VAL  45  46.331 -37.291  -4.879
  347   HG11  VAL  45          1HG1      VAL  45  46.548 -39.304  -3.956
  348   HG12  VAL  45          2HG1      VAL  45  44.996 -39.159  -3.127
  349   HG13  VAL  45          3HG1      VAL  45  45.060 -39.765  -4.782
  350   HG21  VAL  45          3HG2      VAL  45  44.827 -36.869  -6.525
  351   HG22  VAL  45          1HG2      VAL  45  44.494 -38.590  -6.326
  352   HG23  VAL  45          2HG2      VAL  45  43.452 -37.395  -5.555
  353    H    ILE  46           H        ILE  46  47.242 -36.141  -3.448
  354    HA   ILE  46           HA       ILE  46  47.657 -37.064  -0.711
  355    HB   ILE  46           HB       ILE  46  49.726 -36.017  -2.641
  356   HG12  ILE  46          1HG1      ILE  46  50.096 -38.729  -2.514
  357   HG13  ILE  46          2HG1      ILE  46  48.341 -38.606  -2.490
  358   HG21  ILE  46          1HG2      ILE  46  49.823 -37.383   0.016
  359   HG22  ILE  46          2HG2      ILE  46  51.157 -37.556  -1.123
  360   HG23  ILE  46          3HG2      ILE  46  50.697 -35.957  -0.541
  361   HD11  ILE  46          3HD1      ILE  46  49.360 -36.863  -4.498
  362   HD12  ILE  46          1HD1      ILE  46  50.070 -38.465  -4.702
  363   HD13  ILE  46          2HD1      ILE  46  48.317 -38.274  -4.672
  364    H    ILE  47           H        ILE  47  48.747 -34.223  -2.578
  365    HA   ILE  47           HA       ILE  47  47.743 -32.363  -0.669
  366    HB   ILE  47           HB       ILE  47  49.635 -33.139   0.650
  367   HG12  ILE  47          1HG1      ILE  47  50.699 -30.542  -0.285
  368   HG13  ILE  47          2HG1      ILE  47  48.994 -30.554   0.152
  369   HG21  ILE  47          1HG2      ILE  47  51.634 -33.641  -0.196
  370   HG22  ILE  47          2HG2      ILE  47  50.906 -33.431  -1.788
  371   HG23  ILE  47          3HG2      ILE  47  51.757 -32.089  -1.024
  372   HD11  ILE  47          3HD1      ILE  47  50.046 -29.953   2.117
  373   HD12  ILE  47          1HD1      ILE  47  49.793 -31.686   2.321
  374   HD13  ILE  47          2HD1      ILE  47  51.383 -31.075   1.864
  375    H    GLU  48           H        GLU  48  47.810 -30.258  -1.415
  376    HA   GLU  48           HA       GLU  48  48.694 -29.968  -4.191
  377    HB2  GLU  48           1HB      GLU  48  46.378 -29.170  -2.830
  378    HB3  GLU  48           2HB      GLU  48  47.270 -27.685  -3.129
  379    HG2  GLU  48           1HG      GLU  48  46.071 -27.784  -5.047
  380    HG3  GLU  48           2HG      GLU  48  47.480 -28.716  -5.550
  381    H    GLN  49           H        GLN  49  50.793 -29.391  -4.230
  382    HA   GLN  49           HA       GLN  49  52.022 -27.719  -2.291
  383    HB2  GLN  49           1HB      GLN  49  53.935 -27.688  -3.881
  384    HB3  GLN  49           2HB      GLN  49  53.361 -29.308  -3.510
  385    HG2  GLN  49           1HG      GLN  49  52.075 -28.153  -5.849
  386    HG3  GLN  49           2HG      GLN  49  53.825 -28.292  -6.012
  387   HE21  GLN  49          2HE2      GLN  49  50.908 -29.876  -6.308
  388   HE22  GLN  49          1HE2      GLN  49  51.493 -31.498  -6.414
  389    H    ALA  50           H        ALA  50  52.621 -25.573  -2.391
  390    HA   ALA  50           HA       ALA  50  52.113 -23.945  -4.692
  391    HB1  ALA  50           1HB      ALA  50  50.316 -23.588  -2.296
  392    HB2  ALA  50           2HB      ALA  50  50.391 -22.522  -3.699
  393    HB3  ALA  50           3HB      ALA  50  49.825 -24.183  -3.882
  394    H    ASN  51           H        ASN  51  54.432 -24.340  -3.324
  395    HA   ASN  51           HA       ASN  51  54.992 -22.611  -1.208
  396    HB2  ASN  51           1HB      ASN  51  56.481 -24.445  -2.066
  397    HB3  ASN  51           2HB      ASN  51  56.915 -23.390  -3.408
  398   HD21  ASN  51          2HD2      ASN  51  58.537 -22.014  -3.141
  399   HD22  ASN  51          1HD2      ASN  51  59.302 -21.648  -1.636
  400    H    LYS  52           H        LYS  52  54.748 -20.485  -1.141
  401    HA   LYS  52           HA       LYS  52  54.442 -18.837  -3.404
  402    HB2  LYS  52           1HB      LYS  52  53.819 -18.524  -0.831
  403    HB3  LYS  52           2HB      LYS  52  55.342 -17.644  -0.828
  404    HG2  LYS  52           1HG      LYS  52  54.381 -15.872  -1.740
  405    HG3  LYS  52           2HG      LYS  52  53.756 -16.841  -3.077
  406    HD2  LYS  52           1HD      LYS  52  51.778 -16.151  -2.182
  407    HD3  LYS  52           2HD      LYS  52  52.026 -17.602  -1.208
  408    HE2  LYS  52           1HE      LYS  52  52.599 -16.405   0.670
  409    HE3  LYS  52           2HE      LYS  52  53.160 -15.014  -0.257
  410    HZ1  LYS  52           3HZ      LYS  52  50.513 -15.630   0.724
  411    HZ2  LYS  52           1HZ      LYS  52  50.551 -15.069  -0.871
  412    HZ3  LYS  52           2HZ      LYS  52  51.216 -14.133   0.370
  413    H    ARG  53           H        ARG  53  55.813 -16.906  -3.876
  414    HA   ARG  53           HA       ARG  53  58.638 -17.177  -3.268
  415    HB2  ARG  53           1HB      ARG  53  57.827 -18.504  -5.454
  416    HB3  ARG  53           2HB      ARG  53  58.052 -16.912  -6.166
  417    HG2  ARG  53           1HG      ARG  53  60.307 -16.967  -5.924
  418    HG3  ARG  53           2HG      ARG  53  60.238 -17.959  -4.466
  419    HD2  ARG  53           1HD      ARG  53  60.539 -19.820  -5.646
  420    HD3  ARG  53           2HD      ARG  53  59.204 -19.411  -6.723
  421    HE   ARG  53           HE       ARG  53  61.396 -17.861  -7.466
  422   HH11  ARG  53          1HH1      ARG  53  60.469 -21.216  -7.373
  423   HH12  ARG  53          2HH1      ARG  53  61.463 -21.663  -8.720
  424   HH21  ARG  53          1HH2      ARG  53  62.707 -18.437  -9.241
  425   HH22  ARG  53          2HH2      ARG  53  62.736 -20.081  -9.782
  Start of MODEL    4
    1    H1   MET   1           H        MET   1  -0.654   3.180  -8.963
    2    HA   MET   1           HA       MET   1  -1.703   1.659  -6.681
    3    HB2  MET   1           1HB      MET   1  -3.061   3.747  -8.156
    4    HB3  MET   1           2HB      MET   1  -3.920   2.219  -8.295
    5    HG2  MET   1           1HG      MET   1  -4.115   2.034  -5.923
    6    HG3  MET   1           2HG      MET   1  -3.062   3.426  -5.679
    7    HE1  MET   1           3HE      MET   1  -7.323   3.667  -5.253
    8    HE2  MET   1           1HE      MET   1  -6.364   2.195  -5.416
    9    HE3  MET   1           2HE      MET   1  -5.949   3.385  -4.183
   10    H    ALA   2           H        ALA   2  -0.747  -0.225  -7.439
   11    HA   ALA   2           HA       ALA   2  -2.000  -1.343  -9.853
   12    HB1  ALA   2           1HB      ALA   2   0.156  -2.481 -10.369
   13    HB2  ALA   2           2HB      ALA   2   0.209  -0.726 -10.537
   14    HB3  ALA   2           3HB      ALA   2   0.918  -1.498  -9.119
   15    H    ALA   3           H        ALA   3  -3.144  -1.882  -7.526
   16    HA   ALA   3           HA       ALA   3  -2.182  -4.579  -6.825
   17    HB1  ALA   3           1HB      ALA   3  -2.689  -4.273  -4.600
   18    HB2  ALA   3           2HB      ALA   3  -2.116  -2.667  -5.052
   19    HB3  ALA   3           3HB      ALA   3  -3.846  -2.984  -4.929
   20    H    ILE   4           H        ILE   4  -3.606  -4.961  -8.822
   21    HA   ILE   4           HA       ILE   4  -6.426  -4.744  -8.574
   22    HB   ILE   4           HB       ILE   4  -4.860  -6.622 -10.347
   23   HG12  ILE   4          1HG1      ILE   4  -5.922  -4.356 -11.729
   24   HG13  ILE   4          2HG1      ILE   4  -4.989  -3.780 -10.352
   25   HG21  ILE   4          1HG2      ILE   4  -7.141  -7.300 -10.251
   26   HG22  ILE   4          2HG2      ILE   4  -7.704  -5.639 -10.426
   27   HG23  ILE   4          3HG2      ILE   4  -6.911  -6.448 -11.777
   28   HD11  ILE   4          3HD1      ILE   4  -3.263  -3.933 -11.760
   29   HD12  ILE   4          1HD1      ILE   4  -3.318  -5.652 -11.371
   30   HD13  ILE   4          2HD1      ILE   4  -4.104  -5.053 -12.832
   31    H    GLU   5           H        GLU   5  -4.204  -7.510  -8.247
   32    HA   GLU   5           HA       GLU   5  -6.058  -9.471  -7.632
   33    HB2  GLU   5           1HB      GLU   5  -3.190  -9.117  -7.361
   34    HB3  GLU   5           2HB      GLU   5  -3.850 -10.058  -6.031
   35    HG2  GLU   5           1HG      GLU   5  -4.960 -10.957  -8.517
   36    HG3  GLU   5           2HG      GLU   5  -3.199 -10.944  -8.601
   37    H    LYS   6           H        LYS   6  -7.267  -9.973  -5.908
   38    HA   LYS   6           HA       LYS   6  -7.086  -8.216  -3.566
   39    HB2  LYS   6           1HB      LYS   6  -9.260  -9.326  -5.062
   40    HB3  LYS   6           2HB      LYS   6  -9.361  -9.905  -3.405
   41    HG2  LYS   6           1HG      LYS   6  -8.863  -7.279  -2.990
   42    HG3  LYS   6           2HG      LYS   6  -9.778  -7.213  -4.498
   43    HD2  LYS   6           1HD      LYS   6 -11.508  -8.663  -3.400
   44    HD3  LYS   6           2HD      LYS   6 -10.628  -8.453  -1.884
   45    HE2  LYS   6           1HE      LYS   6 -11.583  -6.124  -3.528
   46    HE3  LYS   6           2HE      LYS   6 -12.599  -6.896  -2.311
   47    HZ1  LYS   6           3HZ      LYS   6 -10.254  -6.463  -1.009
   48    HZ2  LYS   6           1HZ      LYS   6 -11.640  -5.500  -0.889
   49    HZ3  LYS   6           2HZ      LYS   6 -10.410  -5.079  -1.970
   50    H    ARG   7           H        ARG   7  -5.509  -9.135  -2.314
   51    HA   ARG   7           HA       ARG   7  -5.240 -11.916  -1.862
   52    HB2  ARG   7           1HB      ARG   7  -3.754 -11.231   0.012
   53    HB3  ARG   7           2HB      ARG   7  -3.355 -10.455  -1.515
   54    HG2  ARG   7           1HG      ARG   7  -4.063  -8.386  -0.806
   55    HG3  ARG   7           2HG      ARG   7  -5.151  -9.058   0.410
   56    HD2  ARG   7           1HD      ARG   7  -3.546  -9.130   1.976
   57    HD3  ARG   7           2HD      ARG   7  -2.333  -9.715   0.838
   58    HE   ARG   7           HE       ARG   7  -1.594  -7.570   0.608
   59   HH11  ARG   7          1HH1      ARG   7  -4.827  -7.502   1.896
   60   HH12  ARG   7          2HH1      ARG   7  -4.832  -5.787   2.144
   61   HH21  ARG   7          1HH2      ARG   7  -1.587  -5.312   0.930
   62   HH22  ARG   7          2HH2      ARG   7  -2.989  -4.543   1.594
   63    H    GLN   8           H        GLN   8  -5.980 -13.226  -0.250
   64    HA   GLN   8           HA       GLN   8  -8.170 -12.143   1.372
   65    HB2  GLN   8           1HB      GLN   8  -8.182 -14.312  -0.217
   66    HB3  GLN   8           2HB      GLN   8  -7.662 -15.064   1.285
   67    HG2  GLN   8           1HG      GLN   8  -9.822 -15.234   1.767
   68    HG3  GLN   8           2HG      GLN   8  -9.765 -13.502   2.091
   69   HE21  GLN   8          2HE2      GLN   8  -9.537 -12.494  -0.449
   70   HE22  GLN   8          1HE2      GLN   8 -10.977 -12.839  -1.340
   71    H    LYS   9           H        LYS   9  -5.647 -14.637   1.772
   72    HA   LYS   9           HA       LYS   9  -5.387 -13.775   4.578
   73    HB2  LYS   9           1HB      LYS   9  -6.254 -16.061   4.342
   74    HB3  LYS   9           2HB      LYS   9  -4.851 -16.498   3.375
   75    HG2  LYS   9           1HG      LYS   9  -3.937 -17.189   5.278
   76    HG3  LYS   9           2HG      LYS   9  -3.730 -15.480   5.672
   77    HD2  LYS   9           1HD      LYS   9  -6.295 -16.901   6.293
   78    HD3  LYS   9           2HD      LYS   9  -4.909 -17.021   7.380
   79    HE2  LYS   9           1HE      LYS   9  -4.853 -14.586   7.576
   80    HE3  LYS   9           2HE      LYS   9  -6.225 -14.460   6.477
   81    HZ1  LYS   9           3HZ      LYS   9  -6.186 -15.050   9.280
   82    HZ2  LYS   9           1HZ      LYS   9  -7.093 -16.174   8.398
   83    HZ3  LYS   9           2HZ      LYS   9  -7.466 -14.526   8.306
   84    H    GLU  10           H        GLU  10  -3.659 -12.489   4.726
   85    HA   GLU  10           HA       GLU  10  -1.436 -12.574   2.984
   86    HB2  GLU  10           1HB      GLU  10  -2.389 -10.810   4.878
   87    HB3  GLU  10           2HB      GLU  10  -0.910 -11.408   5.616
   88    HG2  GLU  10           1HG      GLU  10  -0.438 -10.789   2.860
   89    HG3  GLU  10           2HG      GLU  10  -1.179  -9.411   3.673
   90    H    ILE  11           H        ILE  11  -2.155 -14.147   6.011
   91    HA   ILE  11           HA       ILE  11   0.384 -14.874   6.867
   92    HB   ILE  11           HB       ILE  11  -2.133 -16.533   7.060
   93   HG12  ILE  11          1HG1      ILE  11  -0.984 -14.588   9.068
   94   HG13  ILE  11          2HG1      ILE  11  -2.288 -14.189   7.956
   95   HG21  ILE  11          1HG2      ILE  11  -0.615 -18.046   7.781
   96   HG22  ILE  11          2HG2      ILE  11   0.586 -16.817   8.172
   97   HG23  ILE  11          3HG2      ILE  11  -0.752 -17.126   9.278
   98   HD11  ILE  11          3HD1      ILE  11  -3.671 -14.870   9.546
   99   HD12  ILE  11          1HD1      ILE  11  -3.148 -16.512   9.170
  100   HD13  ILE  11          2HD1      ILE  11  -2.365 -15.612  10.469
  101    H    ALA  12           H        ALA  12  -1.843 -16.929   4.976
  102    HA   ALA  12           HA       ALA  12  -0.025 -18.948   4.386
  103    HB1  ALA  12           1HB      ALA  12  -2.169 -18.151   2.451
  104    HB2  ALA  12           2HB      ALA  12  -1.588 -19.764   2.868
  105    HB3  ALA  12           3HB      ALA  12  -2.571 -18.856   4.017
  106    H    ASP  13           H        ASP  13  -0.803 -16.012   2.553
  107    HA   ASP  13           HA       ASP  13   0.732 -16.481   0.290
  108    HB2  ASP  13           1HB      ASP  13  -0.321 -14.073   1.661
  109    HB3  ASP  13           2HB      ASP  13   0.994 -13.806   0.520
  110    H    GLY  14           H        GLY  14   1.698 -14.694   3.227
  111    HA2  GLY  14           1HA      GLY  14   4.396 -14.363   2.425
  112    HA3  GLY  14           2HA      GLY  14   3.776 -14.176   4.059
  113    H    LEU  15           H        LEU  15   2.721 -16.928   4.112
  114    HA   LEU  15           HA       LEU  15   4.961 -18.206   5.239
  115    HB2  LEU  15           1HB      LEU  15   2.555 -18.631   5.791
  116    HB3  LEU  15           2HB      LEU  15   2.430 -19.525   4.278
  117    HG   LEU  15           HG       LEU  15   4.584 -20.434   6.052
  118   HD11  LEU  15          1HD1      LEU  15   2.620 -19.738   7.569
  119   HD12  LEU  15          2HD1      LEU  15   3.303 -21.353   7.754
  120   HD13  LEU  15          3HD1      LEU  15   1.792 -21.131   6.874
  121   HD21  LEU  15          3HD2      LEU  15   3.761 -22.601   5.383
  122   HD22  LEU  15          1HD2      LEU  15   3.885 -21.559   3.966
  123   HD23  LEU  15          2HD2      LEU  15   2.309 -21.875   4.693
  124    H    ALA  16           H        ALA  16   3.215 -18.858   2.203
  125    HA   ALA  16           HA       ALA  16   5.051 -20.855   1.332
  126    HB1  ALA  16           1HB      ALA  16   2.639 -19.570   0.299
  127    HB2  ALA  16           2HB      ALA  16   3.805 -20.010  -0.950
  128    HB3  ALA  16           3HB      ALA  16   3.189 -21.240   0.153
  129    H    SER  17           H        SER  17   4.678 -17.401   0.699
  130    HA   SER  17           HA       SER  17   6.594 -17.200  -1.355
  131    HB2  SER  17           1HB      SER  17   4.917 -15.443  -0.840
  132    HB3  SER  17           2HB      SER  17   5.789 -15.076   0.648
  133    HG   SER  17           HG       SER  17   7.595 -14.522  -0.641
  134    H    ALA  18           H        ALA  18   6.856 -17.128   2.144
  135    HA   ALA  18           HA       ALA  18   9.652 -16.391   2.093
  136    HB1  ALA  18           1HB      ALA  18   9.557 -16.372   4.445
  137    HB2  ALA  18           2HB      ALA  18   8.000 -15.742   3.906
  138    HB3  ALA  18           3HB      ALA  18   8.128 -17.406   4.476
  139    H    GLU  19           H        GLU  19   7.739 -19.289   2.834
  140    HA   GLU  19           HA       GLU  19   9.821 -20.974   3.595
  141    HB2  GLU  19           1HB      GLU  19   7.478 -21.577   3.893
  142    HB3  GLU  19           2HB      GLU  19   7.255 -21.656   2.151
  143    HG2  GLU  19           1HG      GLU  19   8.061 -23.726   2.029
  144    HG3  GLU  19           2HG      GLU  19   9.416 -23.358   3.095
  145    H    ARG  20           H        ARG  20   8.439 -20.422   0.368
  146    HA   ARG  20           HA       ARG  20  10.027 -22.244  -1.035
  147    HB2  ARG  20           1HB      ARG  20   8.014 -21.087  -1.939
  148    HB3  ARG  20           2HB      ARG  20   8.958 -19.608  -2.055
  149    HG2  ARG  20           1HG      ARG  20  10.219 -20.386  -3.815
  150    HG3  ARG  20           2HG      ARG  20   9.932 -22.079  -3.408
  151    HD2  ARG  20           1HD      ARG  20   7.442 -20.780  -3.982
  152    HD3  ARG  20           2HD      ARG  20   8.578 -20.499  -5.301
  153    HE   ARG  20           HE       ARG  20   8.452 -23.240  -4.441
  154   HH11  ARG  20          1HH1      ARG  20   7.052 -20.818  -6.514
  155   HH12  ARG  20          2HH1      ARG  20   6.408 -21.967  -7.640
  156   HH21  ARG  20          1HH2      ARG  20   7.609 -24.762  -5.916
  157   HH22  ARG  20          2HH2      ARG  20   6.725 -24.210  -7.298
  158    H    ALA  21           H        ALA  21  10.523 -18.754  -0.523
  159    HA   ALA  21           HA       ALA  21  12.931 -18.489  -1.883
  160    HB1  ALA  21           1HB      ALA  21  12.105 -16.995   0.602
  161    HB2  ALA  21           2HB      ALA  21  13.283 -16.471  -0.602
  162    HB3  ALA  21           3HB      ALA  21  11.579 -16.607  -1.036
  163    H    HIS  22           H        HIS  22  12.434 -19.102   1.594
  164    HA   HIS  22           HA       HIS  22  15.084 -19.279   2.370
  165    HB2  HIS  22           1HB      HIS  22  12.522 -20.375   3.404
  166    HB3  HIS  22           2HB      HIS  22  14.007 -21.085   4.032
  167    HD1  HIS  22           HD1      HIS  22  14.988 -19.915   5.977
  168    HD2  HIS  22           HD2      HIS  22  12.532 -17.415   3.745
  169    HE1  HIS  22           HE1      HIS  22  14.901 -17.747   7.249
  170    H    LYS  23           H        LYS  23  12.953 -21.934   1.322
  171    HA   LYS  23           HA       LYS  23  14.827 -23.992   1.476
  172    HB2  LYS  23           1HB      LYS  23  12.229 -23.955   0.931
  173    HB3  LYS  23           2HB      LYS  23  12.814 -24.023  -0.726
  174    HG2  LYS  23           1HG      LYS  23  14.001 -26.076  -0.261
  175    HG3  LYS  23           2HG      LYS  23  13.534 -25.990   1.439
  176    HD2  LYS  23           1HD      LYS  23  11.128 -25.793   0.099
  177    HD3  LYS  23           2HD      LYS  23  12.039 -26.959  -0.864
  178    HE2  LYS  23           1HE      LYS  23  11.241 -28.435   0.638
  179    HE3  LYS  23           2HE      LYS  23  12.581 -27.852   1.625
  180    HZ1  LYS  23           3HZ      LYS  23  10.662 -26.068   2.193
  181    HZ2  LYS  23           1HZ      LYS  23  10.975 -27.454   3.113
  182    HZ3  LYS  23           2HZ      LYS  23   9.737 -27.465   1.961
  183    H    ASP  24           H        ASP  24  13.962 -21.941  -1.297
  184    HA   ASP  24           HA       ASP  24  15.661 -23.071  -3.185
  185    HB2  ASP  24           1HB      ASP  24  13.857 -21.251  -3.477
  186    HB3  ASP  24           2HB      ASP  24  15.134 -20.110  -3.063
  187    H    LEU  25           H        LEU  25  16.291 -20.389  -0.939
  188    HA   LEU  25           HA       LEU  25  18.935 -19.898  -1.769
  189    HB2  LEU  25           1HB      LEU  25  17.273 -18.589  -0.183
  190    HB3  LEU  25           2HB      LEU  25  18.149 -19.468   1.068
  191    HG   LEU  25           HG       LEU  25  19.600 -17.815  -0.974
  192   HD11  LEU  25          1HD1      LEU  25  17.780 -16.842   1.010
  193   HD12  LEU  25          2HD1      LEU  25  18.756 -15.940  -0.149
  194   HD13  LEU  25          3HD1      LEU  25  19.427 -16.367   1.425
  195   HD21  LEU  25          3HD2      LEU  25  21.294 -17.720   0.772
  196   HD22  LEU  25          1HD2      LEU  25  20.888 -19.392   0.385
  197   HD23  LEU  25          2HD2      LEU  25  20.252 -18.647   1.852
  198    H    ASP  26           H        ASP  26  17.640 -21.889   0.871
  199    HA   ASP  26           HA       ASP  26  20.077 -22.727   1.949
  200    HB2  ASP  26           1HB      ASP  26  18.121 -23.150   3.217
  201    HB3  ASP  26           2HB      ASP  26  17.349 -24.006   1.885
  202    H    LEU  27           H        LEU  27  17.998 -24.399  -0.416
  203    HA   LEU  27           HA       LEU  27  19.637 -26.591  -0.885
  204    HB2  LEU  27           1HB      LEU  27  17.260 -25.583  -1.915
  205    HB3  LEU  27           2HB      LEU  27  18.341 -25.671  -3.305
  206    HG   LEU  27           HG       LEU  27  18.643 -28.127  -2.040
  207   HD11  LEU  27          1HD1      LEU  27  16.544 -28.975  -1.512
  208   HD12  LEU  27          2HD1      LEU  27  15.699 -27.641  -2.297
  209   HD13  LEU  27          3HD1      LEU  27  16.537 -27.376  -0.768
  210   HD21  LEU  27          3HD2      LEU  27  17.305 -28.935  -4.012
  211   HD22  LEU  27          1HD2      LEU  27  18.672 -27.892  -4.400
  212   HD23  LEU  27          2HD2      LEU  27  17.033 -27.241  -4.424
  213    H    ALA  28           H        ALA  28  19.529 -23.493  -2.632
  214    HA   ALA  28           HA       ALA  28  21.484 -23.999  -4.529
  215    HB1  ALA  28           1HB      ALA  28  20.637 -21.458  -3.171
  216    HB2  ALA  28           2HB      ALA  28  21.867 -21.481  -4.435
  217    HB3  ALA  28           3HB      ALA  28  20.229 -22.033  -4.788
  218    H    LYS  29           H        LYS  29  21.893 -22.562  -1.296
  219    HA   LYS  29           HA       LYS  29  24.660 -22.214  -1.397
  220    HB2  LYS  29           1HB      LYS  29  22.683 -21.733   0.454
  221    HB3  LYS  29           2HB      LYS  29  23.633 -22.989   1.237
  222    HG2  LYS  29           1HG      LYS  29  25.657 -21.493   0.607
  223    HG3  LYS  29           2HG      LYS  29  24.438 -20.227   0.444
  224    HD2  LYS  29           1HD      LYS  29  23.759 -20.490   2.719
  225    HD3  LYS  29           2HD      LYS  29  24.745 -21.942   2.904
  226    HE2  LYS  29           1HE      LYS  29  26.646 -20.211   2.153
  227    HE3  LYS  29           2HE      LYS  29  25.529 -19.088   2.926
  228    HZ1  LYS  29           3HZ      LYS  29  25.986 -21.469   4.463
  229    HZ2  LYS  29           1HZ      LYS  29  26.061 -19.846   4.936
  230    HZ3  LYS  29           2HZ      LYS  29  27.398 -20.576   4.202
  231    H    ALA  30           H        ALA  30  22.825 -24.905   0.057
  232    HA   ALA  30           HA       ALA  30  24.967 -26.492   0.810
  233    HB1  ALA  30           1HB      ALA  30  22.735 -27.006   1.531
  234    HB2  ALA  30           2HB      ALA  30  22.226 -27.322  -0.128
  235    HB3  ALA  30           3HB      ALA  30  23.382 -28.396   0.659
  236    H    SER  31           H        SER  31  23.335 -26.276  -2.319
  237    HA   SER  31           HA       SER  31  24.646 -28.433  -3.560
  238    HB2  SER  31           1HB      SER  31  22.811 -26.371  -4.323
  239    HB3  SER  31           2HB      SER  31  24.103 -26.451  -5.521
  240    HG   SER  31           HG       SER  31  23.682 -28.704  -5.687
  241    H    ALA  32           H        ALA  32  25.390 -24.960  -3.515
  242    HA   ALA  32           HA       ALA  32  27.654 -25.060  -5.167
  243    HB1  ALA  32           1HB      ALA  32  27.055 -23.128  -2.929
  244    HB2  ALA  32           2HB      ALA  32  28.230 -22.885  -4.222
  245    HB3  ALA  32           3HB      ALA  32  26.509 -22.977  -4.600
  246    H    THR  33           H        THR  33  27.472 -24.986  -1.605
  247    HA   THR  33           HA       THR  33  30.181 -25.235  -1.068
  248    HB   THR  33           HB       THR  33  28.308 -26.701   0.719
  249    HG1  THR  33           HG1      THR  33  27.180 -24.927   1.257
  250   HG21  THR  33          3HG2      THR  33  30.443 -24.609   1.147
  251   HG22  THR  33          1HG2      THR  33  30.605 -26.344   1.410
  252   HG23  THR  33          2HG2      THR  33  29.526 -25.394   2.432
  253    H    ASP  34           H        ASP  34  27.773 -27.871  -1.109
  254    HA   ASP  34           HA       ASP  34  29.505 -29.997  -0.757
  255    HB2  ASP  34           1HB      ASP  34  26.909 -29.935  -0.902
  256    HB3  ASP  34           2HB      ASP  34  27.161 -30.219  -2.622
  257    H    GLN  35           H        GLN  35  28.550 -28.396  -3.769
  258    HA   GLN  35           HA       GLN  35  29.842 -30.110  -5.558
  259    HB2  GLN  35           1HB      GLN  35  28.214 -28.317  -6.171
  260    HB3  GLN  35           2HB      GLN  35  29.473 -27.127  -5.871
  261    HG2  GLN  35           1HG      GLN  35  30.540 -29.061  -7.632
  262    HG3  GLN  35           2HG      GLN  35  28.944 -28.613  -8.232
  263   HE21  GLN  35          2HE2      GLN  35  31.829 -27.069  -6.855
  264   HE22  GLN  35          1HE2      GLN  35  31.844 -25.732  -7.949
  265    H    LEU  36           H        LEU  36  31.011 -26.957  -4.358
  266    HA   LEU  36           HA       LEU  36  33.561 -27.073  -5.429
  267    HB2  LEU  36           1HB      LEU  36  32.241 -25.244  -4.023
  268    HB3  LEU  36           2HB      LEU  36  33.240 -25.894  -2.724
  269    HG   LEU  36           HG       LEU  36  35.076 -25.441  -4.711
  270   HD11  LEU  36          1HD1      LEU  36  32.871 -23.424  -4.911
  271   HD12  LEU  36          2HD1      LEU  36  33.736 -24.259  -6.200
  272   HD13  LEU  36          3HD1      LEU  36  34.542 -22.992  -5.275
  273   HD21  LEU  36          3HD2      LEU  36  36.000 -24.007  -3.204
  274   HD22  LEU  36          1HD2      LEU  36  34.829 -24.800  -2.150
  275   HD23  LEU  36          2HD2      LEU  36  34.464 -23.219  -2.841
  276    H    LYS  37           H        LYS  37  32.411 -28.261  -2.293
  277    HA   LYS  37           HA       LYS  37  34.850 -29.082  -1.231
  278    HB2  LYS  37           1HB      LYS  37  32.363 -29.076  -0.281
  279    HB3  LYS  37           2HB      LYS  37  32.441 -30.770  -0.750
  280    HG2  LYS  37           1HG      LYS  37  33.055 -30.626   1.538
  281    HG3  LYS  37           2HG      LYS  37  34.522 -30.970   0.618
  282    HD2  LYS  37           1HD      LYS  37  34.227 -28.151   0.770
  283    HD3  LYS  37           2HD      LYS  37  34.001 -28.808   2.392
  284    HE2  LYS  37           1HE      LYS  37  36.118 -29.948   2.277
  285    HE3  LYS  37           2HE      LYS  37  36.324 -29.479   0.590
  286    HZ1  LYS  37           3HZ      LYS  37  37.627 -28.065   2.026
  287    HZ2  LYS  37           1HZ      LYS  37  36.255 -27.637   2.919
  288    HZ3  LYS  37           2HZ      LYS  37  36.396 -27.157   1.303
  289    H    LYS  38           H        LYS  38  32.459 -31.096  -2.952
  290    HA   LYS  38           HA       LYS  38  33.984 -33.417  -3.093
  291    HB2  LYS  38           1HB      LYS  38  31.494 -32.914  -3.763
  292    HB3  LYS  38           2HB      LYS  38  32.182 -32.656  -5.360
  293    HG2  LYS  38           1HG      LYS  38  32.793 -34.864  -5.604
  294    HG3  LYS  38           2HG      LYS  38  32.823 -35.156  -3.863
  295    HD2  LYS  38           1HD      LYS  38  30.211 -34.388  -5.004
  296    HD3  LYS  38           2HD      LYS  38  30.829 -35.971  -5.481
  297    HE2  LYS  38           1HE      LYS  38  30.506 -34.992  -2.645
  298    HE3  LYS  38           2HE      LYS  38  29.408 -36.090  -3.479
  299    HZ1  LYS  38           3HZ      LYS  38  31.845 -36.670  -2.148
  300    HZ2  LYS  38           1HZ      LYS  38  31.915 -37.194  -3.755
  301    HZ3  LYS  38           2HZ      LYS  38  30.673 -37.735  -2.742
  302    H    ALA  39           H        ALA  39  33.832 -30.673  -5.326
  303    HA   ALA  39           HA       ALA  39  35.403 -31.669  -7.385
  304    HB1  ALA  39           1HB      ALA  39  34.115 -29.510  -7.363
  305    HB2  ALA  39           2HB      ALA  39  35.452 -28.808  -6.450
  306    HB3  ALA  39           3HB      ALA  39  35.724 -29.422  -8.081
  307    H    LYS  40           H        LYS  40  36.460 -29.735  -4.581
  308    HA   LYS  40           HA       LYS  40  39.207 -29.838  -5.156
  309    HB2  LYS  40           1HB      LYS  40  37.885 -28.376  -3.455
  310    HB3  LYS  40           2HB      LYS  40  38.160 -29.713  -2.345
  311    HG2  LYS  40           1HG      LYS  40  40.603 -28.971  -3.677
  312    HG3  LYS  40           2HG      LYS  40  39.867 -27.580  -2.879
  313    HD2  LYS  40           1HD      LYS  40  40.082 -30.179  -1.421
  314    HD3  LYS  40           2HD      LYS  40  41.501 -29.139  -1.564
  315    HE2  LYS  40           1HE      LYS  40  39.583 -27.357  -0.812
  316    HE3  LYS  40           2HE      LYS  40  39.067 -28.811   0.042
  317    HZ1  LYS  40           3HZ      LYS  40  41.762 -28.708   0.453
  318    HZ2  LYS  40           1HZ      LYS  40  40.568 -28.256   1.563
  319    HZ3  LYS  40           2HZ      LYS  40  41.285 -27.090   0.570
  320    H    ALA  41           H        ALA  41  37.248 -31.822  -2.941
  321    HA   ALA  41           HA       ALA  41  39.245 -33.478  -1.971
  322    HB1  ALA  41           1HB      ALA  41  36.339 -33.549  -2.128
  323    HB2  ALA  41           2HB      ALA  41  37.072 -35.154  -2.151
  324    HB3  ALA  41           3HB      ALA  41  37.417 -34.046  -0.823
  325    H    GLU  42           H        GLU  42  37.428 -33.689  -4.986
  326    HA   GLU  42           HA       GLU  42  38.509 -36.235  -5.729
  327    HB2  GLU  42           1HB      GLU  42  36.362 -35.602  -6.609
  328    HB3  GLU  42           2HB      GLU  42  37.024 -34.125  -7.297
  329    HG2  GLU  42           1HG      GLU  42  38.463 -36.385  -8.302
  330    HG3  GLU  42           2HG      GLU  42  36.732 -36.626  -8.529
  331    H    ALA  43           H        ALA  43  39.189 -32.869  -6.587
  332    HA   ALA  43           HA       ALA  43  41.132 -33.376  -8.552
  333    HB1  ALA  43           1HB      ALA  43  41.243 -31.150  -8.704
  334    HB2  ALA  43           2HB      ALA  43  39.934 -31.135  -7.521
  335    HB3  ALA  43           3HB      ALA  43  41.607 -30.961  -6.988
  336    H    GLN  44           H        GLN  44  41.277 -33.411  -5.079
  337    HA   GLN  44           HA       GLN  44  44.008 -33.058  -4.658
  338    HB2  GLN  44           1HB      GLN  44  42.101 -33.266  -2.944
  339    HB3  GLN  44           2HB      GLN  44  42.347 -35.002  -3.072
  340    HG2  GLN  44           1HG      GLN  44  44.695 -34.693  -2.398
  341    HG3  GLN  44           2HG      GLN  44  44.386 -32.969  -2.199
  342   HE21  GLN  44          2HE2      GLN  44  44.268 -32.485  -0.135
  343   HE22  GLN  44          1HE2      GLN  44  43.469 -33.409   1.087
  344    H    VAL  45           H        VAL  45  42.252 -35.769  -5.923
  345    HA   VAL  45           HA       VAL  45  44.785 -37.262  -6.133
  346    HB   VAL  45           HB       VAL  45  43.545 -39.362  -5.954
  347   HG11  VAL  45          1HG1      VAL  45  42.596 -37.992  -3.526
  348   HG12  VAL  45          2HG1      VAL  45  43.657 -39.390  -3.702
  349   HG13  VAL  45          3HG1      VAL  45  44.300 -37.761  -3.915
  350   HG21  VAL  45          3HG2      VAL  45  41.363 -39.357  -6.400
  351   HG22  VAL  45          1HG2      VAL  45  41.108 -38.628  -4.814
  352   HG23  VAL  45          2HG2      VAL  45  41.274 -37.603  -6.240
  353    H    ILE  46           H        ILE  46  44.699 -38.936  -7.907
  354    HA   ILE  46           HA       ILE  46  43.061 -38.011 -10.171
  355    HB   ILE  46           HB       ILE  46  45.008 -38.504 -11.666
  356   HG12  ILE  46          1HG1      ILE  46  47.026 -38.093  -9.628
  357   HG13  ILE  46          2HG1      ILE  46  46.105 -39.560  -9.314
  358   HG21  ILE  46          1HG2      ILE  46  44.374 -36.218 -10.989
  359   HG22  ILE  46          2HG2      ILE  46  45.494 -36.332  -9.633
  360   HG23  ILE  46          3HG2      ILE  46  46.104 -36.384 -11.287
  361   HD11  ILE  46          3HD1      ILE  46  46.857 -40.598 -11.200
  362   HD12  ILE  46          1HD1      ILE  46  47.126 -39.084 -12.062
  363   HD13  ILE  46          2HD1      ILE  46  48.254 -39.596 -10.807
  364    H    ILE  47           H        ILE  47  43.351 -39.689 -12.060
  365    HA   ILE  47           HA       ILE  47  43.078 -42.381 -10.890
  366    HB   ILE  47           HB       ILE  47  41.610 -41.255 -13.278
  367   HG12  ILE  47          1HG1      ILE  47  40.412 -42.166 -10.667
  368   HG13  ILE  47          2HG1      ILE  47  40.937 -40.504 -10.914
  369   HG21  ILE  47          1HG2      ILE  47  40.369 -43.594 -12.517
  370   HG22  ILE  47          2HG2      ILE  47  41.448 -43.392 -13.896
  371   HG23  ILE  47          3HG2      ILE  47  42.084 -43.971 -12.357
  372   HD11  ILE  47          3HD1      ILE  47  39.416 -40.471 -12.932
  373   HD12  ILE  47          1HD1      ILE  47  38.756 -41.993 -12.334
  374   HD13  ILE  47          2HD1      ILE  47  38.633 -40.532 -11.353
  375    H    GLU  48           H        GLU  48  43.316 -41.112 -14.209
  376    HA   GLU  48           HA       GLU  48  45.938 -42.046 -14.679
  377    HB2  GLU  48           1HB      GLU  48  43.908 -44.048 -14.804
  378    HB3  GLU  48           2HB      GLU  48  44.490 -43.753 -16.437
  379    HG2  GLU  48           1HG      GLU  48  46.816 -44.066 -15.570
  380    HG3  GLU  48           2HG      GLU  48  46.105 -44.579 -14.041
  381    H    GLN  49           H        GLN  49  46.437 -40.340 -15.912
  382    HA   GLN  49           HA       GLN  49  44.822 -39.891 -18.332
  383    HB2  GLN  49           1HB      GLN  49  44.596 -38.121 -16.491
  384    HB3  GLN  49           2HB      GLN  49  46.255 -37.681 -16.874
  385    HG2  GLN  49           1HG      GLN  49  45.510 -37.335 -19.244
  386    HG3  GLN  49           2HG      GLN  49  43.854 -37.535 -18.673
  387   HE21  GLN  49          2HE2      GLN  49  43.067 -36.024 -17.088
  388   HE22  GLN  49          1HE2      GLN  49  43.697 -34.417 -17.049
  389    H    ALA  50           H        ALA  50  45.964 -40.343 -20.083
  390    HA   ALA  50           HA       ALA  50  48.652 -39.330 -20.395
  391    HB1  ALA  50           1HB      ALA  50  49.770 -41.186 -19.931
  392    HB2  ALA  50           2HB      ALA  50  48.262 -42.007 -19.528
  393    HB3  ALA  50           3HB      ALA  50  48.870 -42.043 -21.183
  394    H    ASN  51           H        ASN  51  49.532 -40.116 -22.625
  395    HA   ASN  51           HA       ASN  51  47.339 -39.768 -24.541
  396    HB2  ASN  51           1HB      ASN  51  49.161 -38.109 -24.615
  397    HB3  ASN  51           2HB      ASN  51  50.319 -39.400 -24.923
  398   HD21  ASN  51          2HD2      ASN  51  47.257 -38.143 -26.199
  399   HD22  ASN  51          1HD2      ASN  51  47.676 -38.336 -27.864
  400    H    LYS  52           H        LYS  52  46.891 -41.232 -26.101
  401    HA   LYS  52           HA       LYS  52  48.400 -43.752 -26.015
  402    HB2  LYS  52           1HB      LYS  52  46.368 -44.733 -27.089
  403    HB3  LYS  52           2HB      LYS  52  46.080 -44.065 -25.487
  404    HG2  LYS  52           1HG      LYS  52  45.154 -42.037 -26.516
  405    HG3  LYS  52           2HG      LYS  52  45.405 -42.750 -28.112
  406    HD2  LYS  52           1HD      LYS  52  43.671 -44.209 -27.883
  407    HD3  LYS  52           2HD      LYS  52  43.880 -44.350 -26.136
  408    HE2  LYS  52           1HE      LYS  52  41.842 -43.208 -26.442
  409    HE3  LYS  52           2HE      LYS  52  43.013 -41.973 -25.983
  410    HZ1  LYS  52           3HZ      LYS  52  42.442 -40.888 -27.811
  411    HZ2  LYS  52           1HZ      LYS  52  41.459 -42.160 -28.339
  412    HZ3  LYS  52           2HZ      LYS  52  43.102 -42.138 -28.741
  413    H    ARG  53           H        ARG  53  48.731 -44.907 -28.038
  414    HA   ARG  53           HA       ARG  53  49.637 -45.017 -30.124
  415    HB2  ARG  53           1HB      ARG  53  47.102 -43.636 -30.346
  416    HB3  ARG  53           2HB      ARG  53  48.218 -43.108 -31.598
  417    HG2  ARG  53           1HG      ARG  53  47.625 -46.000 -31.036
  418    HG3  ARG  53           2HG      ARG  53  46.727 -45.031 -32.206
  419    HD2  ARG  53           1HD      ARG  53  49.513 -44.668 -32.671
  420    HD3  ARG  53           2HD      ARG  53  49.185 -46.397 -32.558
  421    HE   ARG  53           HE       ARG  53  47.304 -45.063 -34.233
  422   HH11  ARG  53          1HH1      ARG  53  50.532 -46.363 -34.130
  423   HH12  ARG  53          2HH1      ARG  53  50.610 -46.653 -35.836
  424   HH21  ARG  53          1HH2      ARG  53  47.394 -45.441 -36.481
  425   HH22  ARG  53          2HH2      ARG  53  48.825 -46.127 -37.172
  Start of MODEL    5
    1    H1   MET   1           H        MET   1  -8.726  -6.915  10.427
    2    HA   MET   1           HA       MET   1  -7.609  -9.395  11.239
    3    HB2  MET   1           1HB      MET   1  -8.608  -9.545  13.472
    4    HB3  MET   1           2HB      MET   1  -7.416  -8.254  13.391
    5    HG2  MET   1           1HG      MET   1 -10.084  -7.316  12.767
    6    HG3  MET   1           2HG      MET   1  -9.993  -8.066  14.359
    7    HE1  MET   1           3HE      MET   1 -11.001  -5.587  14.147
    8    HE2  MET   1           1HE      MET   1 -10.161  -4.578  15.325
    9    HE3  MET   1           2HE      MET   1 -10.018  -4.227  13.603
   10    H    ALA   2           H        ALA   2  -9.297  -8.572   9.172
   11    HA   ALA   2           HA       ALA   2 -11.337 -10.500   9.315
   12    HB1  ALA   2           1HB      ALA   2 -13.137  -8.486   9.025
   13    HB2  ALA   2           2HB      ALA   2 -12.844  -9.363  10.527
   14    HB3  ALA   2           3HB      ALA   2 -12.054  -7.813  10.244
   15    H    ALA   3           H        ALA   3 -11.275  -7.222   7.910
   16    HA   ALA   3           HA       ALA   3 -10.485  -8.143   5.328
   17    HB1  ALA   3           1HB      ALA   3 -12.983  -8.811   5.645
   18    HB2  ALA   3           2HB      ALA   3 -13.283  -7.100   5.334
   19    HB3  ALA   3           3HB      ALA   3 -12.452  -8.083   4.128
   20    H    ILE   4           H        ILE   4  -9.443  -6.196   6.947
   21    HA   ILE   4           HA       ILE   4 -10.419  -3.593   6.474
   22    HB   ILE   4           HB       ILE   4  -8.265  -2.791   7.245
   23   HG12  ILE   4          1HG1      ILE   4  -6.774  -5.027   7.903
   24   HG13  ILE   4          2HG1      ILE   4  -7.391  -5.416   6.301
   25   HG21  ILE   4          1HG2      ILE   4  -8.142  -4.008   9.409
   26   HG22  ILE   4          2HG2      ILE   4  -9.776  -3.529   8.953
   27   HG23  ILE   4          3HG2      ILE   4  -9.260  -5.203   8.751
   28   HD11  ILE   4          3HD1      ILE   4  -6.491  -3.250   5.497
   29   HD12  ILE   4          1HD1      ILE   4  -5.762  -3.014   7.085
   30   HD13  ILE   4          2HD1      ILE   4  -5.258  -4.370   6.075
   31    H    GLU   5           H        GLU   5  -8.501  -5.756   4.565
   32    HA   GLU   5           HA       GLU   5  -8.479  -3.791   2.404
   33    HB2  GLU   5           1HB      GLU   5  -6.114  -4.768   3.822
   34    HB3  GLU   5           2HB      GLU   5  -6.025  -5.011   2.083
   35    HG2  GLU   5           1HG      GLU   5  -6.906  -2.452   2.203
   36    HG3  GLU   5           2HG      GLU   5  -5.910  -2.540   3.655
   37    H    LYS   6           H        LYS   6  -7.695  -4.871   0.317
   38    HA   LYS   6           HA       LYS   6  -9.359  -7.063  -0.243
   39    HB2  LYS   6           1HB      LYS   6  -7.408  -5.430  -1.690
   40    HB3  LYS   6           2HB      LYS   6  -7.479  -7.092  -2.261
   41    HG2  LYS   6           1HG      LYS   6  -9.156  -6.373  -3.542
   42    HG3  LYS   6           2HG      LYS   6 -10.123  -6.455  -2.068
   43    HD2  LYS   6           1HD      LYS   6  -9.836  -4.137  -1.648
   44    HD3  LYS   6           2HD      LYS   6  -8.580  -4.000  -2.881
   45    HE2  LYS   6           1HE      LYS   6 -11.430  -4.764  -3.485
   46    HE3  LYS   6           2HE      LYS   6 -10.839  -3.104  -3.532
   47    HZ1  LYS   6           3HZ      LYS   6  -9.453  -5.192  -5.074
   48    HZ2  LYS   6           1HZ      LYS   6  -9.534  -3.527  -5.360
   49    HZ3  LYS   6           2HZ      LYS   6 -10.874  -4.506  -5.684
   50    H    ARG   7           H        ARG   7  -6.144  -6.887   0.987
   51    HA   ARG   7           HA       ARG   7  -5.466  -9.610   0.280
   52    HB2  ARG   7           1HB      ARG   7  -4.075  -7.517   1.952
   53    HB3  ARG   7           2HB      ARG   7  -3.442  -9.142   1.723
   54    HG2  ARG   7           1HG      ARG   7  -2.803  -8.744  -0.410
   55    HG3  ARG   7           2HG      ARG   7  -4.137  -7.631  -0.719
   56    HD2  ARG   7           1HD      ARG   7  -2.972  -5.829  -0.008
   57    HD3  ARG   7           2HD      ARG   7  -2.145  -6.734   1.259
   58    HE   ARG   7           HE       ARG   7  -0.397  -7.027  -0.174
   59   HH11  ARG   7          1HH1      ARG   7  -3.241  -6.267  -2.033
   60   HH12  ARG   7          2HH1      ARG   7  -2.392  -6.183  -3.541
   61   HH21  ARG   7          1HH2      ARG   7   0.732  -6.919  -2.153
   62   HH22  ARG   7          2HH2      ARG   7  -0.133  -6.555  -3.608
   63    H    GLN   8           H        GLN   8  -6.917 -10.957   1.287
   64    HA   GLN   8           HA       GLN   8  -7.386 -10.704   4.142
   65    HB2  GLN   8           1HB      GLN   8  -9.201 -11.312   2.513
   66    HB3  GLN   8           2HB      GLN   8  -8.383 -12.849   2.263
   67    HG2  GLN   8           1HG      GLN   8  -8.914 -13.630   4.360
   68    HG3  GLN   8           2HG      GLN   8  -9.118 -12.011   5.027
   69   HE21  GLN   8          2HE2      GLN   8 -10.669 -14.717   3.804
   70   HE22  GLN   8          1HE2      GLN   8 -12.253 -14.050   3.627
   71    H    LYS   9           H        LYS   9  -6.228 -13.282   1.964
   72    HA   LYS   9           HA       LYS   9  -5.129 -14.773   4.174
   73    HB2  LYS   9           1HB      LYS   9  -5.045 -15.185   1.184
   74    HB3  LYS   9           2HB      LYS   9  -4.275 -16.275   2.330
   75    HG2  LYS   9           1HG      LYS   9  -7.075 -15.727   2.942
   76    HG3  LYS   9           2HG      LYS   9  -6.824 -16.507   1.379
   77    HD2  LYS   9           1HD      LYS   9  -5.209 -17.673   3.505
   78    HD3  LYS   9           2HD      LYS   9  -6.943 -17.775   3.823
   79    HE2  LYS   9           1HE      LYS   9  -7.313 -19.190   2.089
   80    HE3  LYS   9           2HE      LYS   9  -6.050 -18.471   1.091
   81    HZ1  LYS   9           3HZ      LYS   9  -5.813 -20.852   2.208
   82    HZ2  LYS   9           1HZ      LYS   9  -5.174 -19.914   3.463
   83    HZ3  LYS   9           2HZ      LYS   9  -4.484 -19.847   1.920
   84    H    GLU  10           H        GLU  10  -3.651 -13.172   4.984
   85    HA   GLU  10           HA       GLU  10  -1.372 -12.497   3.301
   86    HB2  GLU  10           1HB      GLU  10  -2.696 -11.154   5.329
   87    HB3  GLU  10           2HB      GLU  10  -1.209 -11.690   6.100
   88    HG2  GLU  10           1HG      GLU  10   0.104 -10.605   4.372
   89    HG3  GLU  10           2HG      GLU  10  -1.371 -10.106   3.546
   90    H    ILE  11           H        ILE  11  -2.072 -14.257   6.294
   91    HA   ILE  11           HA       ILE  11   0.505 -14.964   7.028
   92    HB   ILE  11           HB       ILE  11  -1.926 -16.733   7.301
   93   HG12  ILE  11          1HG1      ILE  11  -1.508 -15.405   9.709
   94   HG13  ILE  11          2HG1      ILE  11  -1.275 -14.155   8.491
   95   HG21  ILE  11          1HG2      ILE  11   0.664 -16.574   8.832
   96   HG22  ILE  11          2HG2      ILE  11  -0.737 -17.515   9.343
   97   HG23  ILE  11          3HG2      ILE  11   0.090 -17.912   7.837
   98   HD11  ILE  11          3HD1      ILE  11  -3.514 -13.972   8.864
   99   HD12  ILE  11          1HD1      ILE  11  -3.512 -15.127   7.532
  100   HD13  ILE  11          2HD1      ILE  11  -3.715 -15.694   9.190
  101    H    ALA  12           H        ALA  12  -1.770 -16.947   5.121
  102    HA   ALA  12           HA       ALA  12  -0.002 -18.994   4.473
  103    HB1  ALA  12           1HB      ALA  12  -2.192 -18.028   2.651
  104    HB2  ALA  12           2HB      ALA  12  -1.558 -19.665   2.823
  105    HB3  ALA  12           3HB      ALA  12  -2.503 -18.944   4.126
  106    H    ASP  13           H        ASP  13  -0.740 -16.014   2.683
  107    HA   ASP  13           HA       ASP  13   0.798 -16.448   0.425
  108    HB2  ASP  13           1HB      ASP  13  -0.183 -14.044   1.864
  109    HB3  ASP  13           2HB      ASP  13   1.115 -13.793   0.700
  110    H    GLY  14           H        GLY  14   1.806 -14.706   3.377
  111    HA2  GLY  14           1HA      GLY  14   4.506 -14.428   2.594
  112    HA3  GLY  14           2HA      GLY  14   3.892 -14.275   4.234
  113    H    LEU  15           H        LEU  15   2.786 -17.008   4.209
  114    HA   LEU  15           HA       LEU  15   5.002 -18.358   5.298
  115    HB2  LEU  15           1HB      LEU  15   2.591 -18.756   5.842
  116    HB3  LEU  15           2HB      LEU  15   2.445 -19.600   4.301
  117    HG   LEU  15           HG       LEU  15   4.280 -21.150   5.179
  118   HD11  LEU  15          1HD1      LEU  15   4.184 -19.314   7.320
  119   HD12  LEU  15          2HD1      LEU  15   5.156 -20.778   7.178
  120   HD13  LEU  15          3HD1      LEU  15   3.557 -20.849   7.919
  121   HD21  LEU  15          3HD2      LEU  15   1.448 -21.016   6.097
  122   HD22  LEU  15          1HD2      LEU  15   2.504 -22.264   6.757
  123   HD23  LEU  15          2HD2      LEU  15   2.232 -22.170   5.017
  124    H    ALA  16           H        ALA  16   3.253 -18.872   2.239
  125    HA   ALA  16           HA       ALA  16   5.042 -20.887   1.311
  126    HB1  ALA  16           1HB      ALA  16   3.776 -19.793  -0.921
  127    HB2  ALA  16           2HB      ALA  16   3.278 -21.213   0.000
  128    HB3  ALA  16           3HB      ALA  16   2.616 -19.627   0.398
  129    H    SER  17           H        SER  17   4.708 -17.415   0.694
  130    HA   SER  17           HA       SER  17   6.650 -17.196  -1.314
  131    HB2  SER  17           1HB      SER  17   6.427 -14.897  -1.088
  132    HB3  SER  17           2HB      SER  17   4.910 -15.458  -0.385
  133    HG   SER  17           HG       SER  17   6.395 -13.858   0.795
  134    H    ALA  18           H        ALA  18   6.911 -17.158   2.195
  135    HA   ALA  18           HA       ALA  18   9.712 -16.489   2.178
  136    HB1  ALA  18           1HB      ALA  18   8.115 -17.589   4.481
  137    HB2  ALA  18           2HB      ALA  18   9.614 -16.662   4.548
  138    HB3  ALA  18           3HB      ALA  18   8.121 -15.886   4.022
  139    H    GLU  19           H        GLU  19   7.767 -19.411   2.536
  140    HA   GLU  19           HA       GLU  19   9.829 -21.159   3.300
  141    HB2  GLU  19           1HB      GLU  19   7.359 -21.629   3.394
  142    HB3  GLU  19           2HB      GLU  19   7.399 -21.872   1.654
  143    HG2  GLU  19           1HG      GLU  19   7.610 -24.023   2.335
  144    HG3  GLU  19           2HG      GLU  19   9.314 -23.572   2.286
  145    H    ARG  20           H        ARG  20   8.540 -20.338   0.095
  146    HA   ARG  20           HA       ARG  20  10.173 -22.080  -1.385
  147    HB2  ARG  20           1HB      ARG  20   8.123 -20.386  -1.985
  148    HB3  ARG  20           2HB      ARG  20   9.490 -19.522  -2.676
  149    HG2  ARG  20           1HG      ARG  20   9.443 -22.374  -3.313
  150    HG3  ARG  20           2HG      ARG  20   8.060 -21.468  -3.931
  151    HD2  ARG  20           1HD      ARG  20   9.371 -20.122  -5.270
  152    HD3  ARG  20           2HD      ARG  20  10.814 -20.376  -4.289
  153    HE   ARG  20           HE       ARG  20  10.153 -22.829  -5.396
  154   HH11  ARG  20          1HH1      ARG  20  11.108 -19.670  -6.504
  155   HH12  ARG  20          2HH1      ARG  20  11.889 -20.264  -7.932
  156   HH21  ARG  20          1HH2      ARG  20  11.179 -23.623  -7.272
  157   HH22  ARG  20          2HH2      ARG  20  11.928 -22.512  -8.368
  158    H    ALA  21           H        ALA  21  10.617 -18.687  -0.452
  159    HA   ALA  21           HA       ALA  21  13.026 -18.247  -1.826
  160    HB1  ALA  21           1HB      ALA  21  12.144 -16.270  -1.132
  161    HB2  ALA  21           2HB      ALA  21  11.599 -16.925   0.413
  162    HB3  ALA  21           3HB      ALA  21  13.300 -16.526   0.176
  163    H    HIS  22           H        HIS  22  12.506 -19.028   1.618
  164    HA   HIS  22           HA       HIS  22  15.178 -19.265   2.349
  165    HB2  HIS  22           1HB      HIS  22  12.616 -19.902   3.499
  166    HB3  HIS  22           2HB      HIS  22  13.763 -21.193   3.843
  167    HD1  HIS  22           HD1      HIS  22  14.677 -20.824   6.102
  168    HD2  HIS  22           HD2      HIS  22  14.242 -17.256   4.020
  169    HE1  HIS  22           HE1      HIS  22  15.579 -19.041   7.628
  170    H    LYS  23           H        LYS  23  12.936 -21.842   1.335
  171    HA   LYS  23           HA       LYS  23  14.713 -23.974   1.444
  172    HB2  LYS  23           1HB      LYS  23  12.169 -23.949   0.988
  173    HB3  LYS  23           2HB      LYS  23  12.617 -23.746  -0.701
  174    HG2  LYS  23           1HG      LYS  23  12.266 -26.050  -0.391
  175    HG3  LYS  23           2HG      LYS  23  14.017 -25.832  -0.452
  176    HD2  LYS  23           1HD      LYS  23  13.936 -25.734   2.089
  177    HD3  LYS  23           2HD      LYS  23  12.279 -26.328   1.954
  178    HE2  LYS  23           1HE      LYS  23  14.325 -27.814   0.431
  179    HE3  LYS  23           2HE      LYS  23  14.431 -27.930   2.186
  180    HZ1  LYS  23           3HZ      LYS  23  12.700 -29.294   0.484
  181    HZ2  LYS  23           1HZ      LYS  23  11.750 -28.243   1.409
  182    HZ3  LYS  23           2HZ      LYS  23  12.762 -29.361   2.173
  183    H    ASP  24           H        ASP  24  13.953 -21.862  -1.317
  184    HA   ASP  24           HA       ASP  24  15.616 -23.038  -3.204
  185    HB2  ASP  24           1HB      ASP  24  13.903 -21.137  -3.490
  186    HB3  ASP  24           2HB      ASP  24  15.220 -20.058  -3.039
  187    H    LEU  25           H        LEU  25  16.359 -20.316  -1.027
  188    HA   LEU  25           HA       LEU  25  19.011 -19.945  -1.795
  189    HB2  LEU  25           1HB      LEU  25  17.270 -19.004   0.244
  190    HB3  LEU  25           2HB      LEU  25  18.794 -19.470   0.997
  191    HG   LEU  25           HG       LEU  25  19.752 -18.001  -1.025
  192   HD11  LEU  25          1HD1      LEU  25  18.191 -16.838  -2.085
  193   HD12  LEU  25          2HD1      LEU  25  17.853 -15.992  -0.575
  194   HD13  LEU  25          3HD1      LEU  25  16.938 -17.439  -0.998
  195   HD21  LEU  25          3HD2      LEU  25  19.779 -16.090   0.595
  196   HD22  LEU  25          1HD2      LEU  25  20.359 -17.623   1.247
  197   HD23  LEU  25          2HD2      LEU  25  18.739 -17.051   1.648
  198    H    ASP  26           H        ASP  26  17.657 -22.012   0.751
  199    HA   ASP  26           HA       ASP  26  20.065 -22.963   1.801
  200    HB2  ASP  26           1HB      ASP  26  17.820 -23.283   2.835
  201    HB3  ASP  26           2HB      ASP  26  17.457 -24.481   1.595
  202    H    LEU  27           H        LEU  27  17.958 -24.467  -0.650
  203    HA   LEU  27           HA       LEU  27  19.575 -26.665  -1.212
  204    HB2  LEU  27           1HB      LEU  27  17.345 -25.272  -2.501
  205    HB3  LEU  27           2HB      LEU  27  18.403 -26.127  -3.622
  206    HG   LEU  27           HG       LEU  27  18.034 -28.198  -2.280
  207   HD11  LEU  27          1HD1      LEU  27  17.309 -26.806  -0.237
  208   HD12  LEU  27          2HD1      LEU  27  16.470 -28.321  -0.569
  209   HD13  LEU  27          3HD1      LEU  27  15.722 -26.785  -1.006
  210   HD21  LEU  27          3HD2      LEU  27  15.372 -27.160  -3.150
  211   HD22  LEU  27          1HD2      LEU  27  16.099 -28.746  -3.407
  212   HD23  LEU  27          2HD2      LEU  27  16.667 -27.356  -4.332
  213    H    ALA  28           H        ALA  28  19.430 -23.518  -2.873
  214    HA   ALA  28           HA       ALA  28  21.399 -23.990  -4.780
  215    HB1  ALA  28           1HB      ALA  28  19.906 -22.051  -4.826
  216    HB2  ALA  28           2HB      ALA  28  20.744 -21.374  -3.429
  217    HB3  ALA  28           3HB      ALA  28  21.598 -21.569  -4.959
  218    H    LYS  29           H        LYS  29  21.813 -22.210  -1.712
  219    HA   LYS  29           HA       LYS  29  24.561 -21.939  -1.789
  220    HB2  LYS  29           1HB      LYS  29  22.659 -22.212   0.531
  221    HB3  LYS  29           2HB      LYS  29  24.377 -21.921   0.766
  222    HG2  LYS  29           1HG      LYS  29  24.150 -19.871  -0.632
  223    HG3  LYS  29           2HG      LYS  29  22.406 -20.140  -0.647
  224    HD2  LYS  29           1HD      LYS  29  22.198 -19.722   1.635
  225    HD3  LYS  29           2HD      LYS  29  23.912 -20.012   1.941
  226    HE2  LYS  29           1HE      LYS  29  23.802 -17.888   0.113
  227    HE3  LYS  29           2HE      LYS  29  22.557 -17.554   1.316
  228    HZ1  LYS  29           3HZ      LYS  29  25.463 -17.872   1.712
  229    HZ2  LYS  29           1HZ      LYS  29  24.388 -18.098   2.998
  230    HZ3  LYS  29           2HZ      LYS  29  24.457 -16.605   2.206
  231    H    ALA  30           H        ALA  30  22.721 -24.510  -0.138
  232    HA   ALA  30           HA       ALA  30  24.834 -26.031   0.777
  233    HB1  ALA  30           1HB      ALA  30  22.748 -26.687   1.549
  234    HB2  ALA  30           2HB      ALA  30  22.054 -26.744  -0.071
  235    HB3  ALA  30           3HB      ALA  30  23.186 -27.994   0.448
  236    H    SER  31           H        SER  31  23.140 -26.360  -2.340
  237    HA   SER  31           HA       SER  31  24.617 -28.470  -3.376
  238    HB2  SER  31           1HB      SER  31  22.540 -27.508  -4.387
  239    HB3  SER  31           2HB      SER  31  23.501 -26.147  -4.965
  240    HG   SER  31           HG       SER  31  23.770 -28.880  -5.673
  241    H    ALA  32           H        ALA  32  25.218 -24.980  -3.661
  242    HA   ALA  32           HA       ALA  32  27.466 -25.072  -5.294
  243    HB1  ALA  32           1HB      ALA  32  27.901 -22.965  -3.502
  244    HB2  ALA  32           2HB      ALA  32  27.134 -22.886  -5.089
  245    HB3  ALA  32           3HB      ALA  32  26.150 -23.123  -3.644
  246    H    THR  33           H        THR  33  27.435 -24.783  -1.735
  247    HA   THR  33           HA       THR  33  30.156 -25.042  -1.303
  248    HB   THR  33           HB       THR  33  29.296 -26.209   0.929
  249    HG1  THR  33           HG1      THR  33  27.173 -25.989   1.264
  250   HG21  THR  33          3HG2      THR  33  30.135 -23.769   0.350
  251   HG22  THR  33          1HG2      THR  33  29.385 -24.135   1.903
  252   HG23  THR  33          2HG2      THR  33  28.438 -23.373   0.625
  253    H    ASP  34           H        ASP  34  27.703 -27.628  -1.251
  254    HA   ASP  34           HA       ASP  34  29.356 -29.779  -0.731
  255    HB2  ASP  34           1HB      ASP  34  26.951 -30.029  -0.755
  256    HB3  ASP  34           2HB      ASP  34  26.889 -29.652  -2.475
  257    H    GLN  35           H        GLN  35  28.461 -28.451  -3.909
  258    HA   GLN  35           HA       GLN  35  29.904 -30.231  -5.489
  259    HB2  GLN  35           1HB      GLN  35  28.228 -28.328  -6.125
  260    HB3  GLN  35           2HB      GLN  35  29.678 -27.340  -6.245
  261    HG2  GLN  35           1HG      GLN  35  30.443 -29.456  -7.708
  262    HG3  GLN  35           2HG      GLN  35  28.704 -29.502  -7.989
  263   HE21  GLN  35          2HE2      GLN  35  28.178 -28.526  -9.796
  264   HE22  GLN  35          1HE2      GLN  35  28.897 -27.090 -10.432
  265    H    LEU  36           H        LEU  36  30.912 -27.129  -4.089
  266    HA   LEU  36           HA       LEU  36  33.460 -26.987  -5.201
  267    HB2  LEU  36           1HB      LEU  36  32.209 -25.911  -2.718
  268    HB3  LEU  36           2HB      LEU  36  33.950 -25.750  -2.940
  269    HG   LEU  36           HG       LEU  36  32.077 -24.797  -5.070
  270   HD11  LEU  36          1HD1      LEU  36  32.230 -22.541  -3.938
  271   HD12  LEU  36          2HD1      LEU  36  32.731 -23.407  -2.486
  272   HD13  LEU  36          3HD1      LEU  36  31.145 -23.716  -3.194
  273   HD21  LEU  36          3HD2      LEU  36  33.904 -23.220  -5.479
  274   HD22  LEU  36          1HD2      LEU  36  34.464 -24.891  -5.551
  275   HD23  LEU  36          2HD2      LEU  36  34.802 -23.908  -4.126
  276    H    LYS  37           H        LYS  37  32.532 -28.269  -2.005
  277    HA   LYS  37           HA       LYS  37  35.043 -29.181  -1.228
  278    HB2  LYS  37           1HB      LYS  37  32.390 -30.467  -0.561
  279    HB3  LYS  37           2HB      LYS  37  33.882 -30.601   0.361
  280    HG2  LYS  37           1HG      LYS  37  33.523 -27.899   0.265
  281    HG3  LYS  37           2HG      LYS  37  31.862 -28.491   0.344
  282    HD2  LYS  37           1HD      LYS  37  32.478 -29.850   2.315
  283    HD3  LYS  37           2HD      LYS  37  34.102 -29.160   2.254
  284    HE2  LYS  37           1HE      LYS  37  33.368 -27.056   2.892
  285    HE3  LYS  37           2HE      LYS  37  31.710 -27.369   2.381
  286    HZ1  LYS  37           3HZ      LYS  37  33.004 -28.727   4.679
  287    HZ2  LYS  37           1HZ      LYS  37  31.368 -28.775   4.249
  288    HZ3  LYS  37           2HZ      LYS  37  32.049 -27.339   4.828
  289    H    LYS  38           H        LYS  38  32.480 -30.883  -3.000
  290    HA   LYS  38           HA       LYS  38  33.703 -33.380  -3.184
  291    HB2  LYS  38           1HB      LYS  38  31.574 -31.942  -4.633
  292    HB3  LYS  38           2HB      LYS  38  32.352 -33.232  -5.541
  293    HG2  LYS  38           1HG      LYS  38  31.849 -34.302  -3.010
  294    HG3  LYS  38           2HG      LYS  38  30.399 -33.394  -3.443
  295    HD2  LYS  38           1HD      LYS  38  29.861 -35.327  -4.491
  296    HD3  LYS  38           2HD      LYS  38  30.862 -34.644  -5.775
  297    HE2  LYS  38           1HE      LYS  38  32.628 -35.934  -4.019
  298    HE3  LYS  38           2HE      LYS  38  31.261 -37.029  -4.218
  299    HZ1  LYS  38           3HZ      LYS  38  32.875 -37.485  -5.901
  300    HZ2  LYS  38           1HZ      LYS  38  32.929 -35.863  -6.378
  301    HZ3  LYS  38           2HZ      LYS  38  31.531 -36.777  -6.645
  302    H    ALA  39           H        ALA  39  33.868 -30.626  -5.428
  303    HA   ALA  39           HA       ALA  39  35.525 -31.803  -7.345
  304    HB1  ALA  39           1HB      ALA  39  35.881 -28.915  -6.796
  305    HB2  ALA  39           2HB      ALA  39  35.603 -29.755  -8.321
  306    HB3  ALA  39           3HB      ALA  39  34.259 -29.464  -7.217
  307    H    LYS  40           H        LYS  40  36.405 -29.749  -4.570
  308    HA   LYS  40           HA       LYS  40  39.168 -29.790  -4.942
  309    HB2  LYS  40           1HB      LYS  40  37.317 -29.098  -2.789
  310    HB3  LYS  40           2HB      LYS  40  38.856 -29.707  -2.196
  311    HG2  LYS  40           1HG      LYS  40  38.594 -27.473  -4.194
  312    HG3  LYS  40           2HG      LYS  40  38.744 -27.233  -2.451
  313    HD2  LYS  40           1HD      LYS  40  40.954 -27.323  -2.673
  314    HD3  LYS  40           2HD      LYS  40  40.802 -29.003  -3.193
  315    HE2  LYS  40           1HE      LYS  40  41.916 -28.091  -4.983
  316    HE3  LYS  40           2HE      LYS  40  40.242 -27.917  -5.508
  317    HZ1  LYS  40           3HZ      LYS  40  40.811 -25.641  -4.066
  318    HZ2  LYS  40           1HZ      LYS  40  40.660 -25.768  -5.747
  319    HZ3  LYS  40           2HZ      LYS  40  42.182 -25.905  -5.022
  320    H    ALA  41           H        ALA  41  37.191 -31.863  -2.818
  321    HA   ALA  41           HA       ALA  41  39.206 -33.499  -1.853
  322    HB1  ALA  41           1HB      ALA  41  37.091 -33.675  -0.843
  323    HB2  ALA  41           2HB      ALA  41  36.297 -34.037  -2.377
  324    HB3  ALA  41           3HB      ALA  41  37.359 -35.231  -1.630
  325    H    GLU  42           H        GLU  42  37.316 -33.813  -4.834
  326    HA   GLU  42           HA       GLU  42  38.415 -36.298  -5.626
  327    HB2  GLU  42           1HB      GLU  42  36.291 -35.229  -6.497
  328    HB3  GLU  42           2HB      GLU  42  37.312 -34.172  -7.462
  329    HG2  GLU  42           1HG      GLU  42  38.259 -36.705  -8.030
  330    HG3  GLU  42           2HG      GLU  42  36.512 -36.914  -7.927
  331    H    ALA  43           H        ALA  43  39.367 -32.957  -6.165
  332    HA   ALA  43           HA       ALA  43  41.232 -33.275  -8.192
  333    HB1  ALA  43           1HB      ALA  43  42.165 -31.381  -6.225
  334    HB2  ALA  43           2HB      ALA  43  41.554 -31.101  -7.856
  335    HB3  ALA  43           3HB      ALA  43  40.431 -31.213  -6.501
  336    H    GLN  44           H        GLN  44  41.508 -33.954  -4.761
  337    HA   GLN  44           HA       GLN  44  43.680 -35.718  -5.120
  338    HB2  GLN  44           1HB      GLN  44  44.854 -33.518  -5.401
  339    HB3  GLN  44           2HB      GLN  44  44.410 -33.130  -3.744
  340    HG2  GLN  44           1HG      GLN  44  45.582 -35.486  -3.317
  341    HG3  GLN  44           2HG      GLN  44  46.443 -35.006  -4.778
  342   HE21  GLN  44          2HE2      GLN  44  48.396 -34.539  -3.945
  343   HE22  GLN  44          1HE2      GLN  44  48.690 -33.307  -2.771
  344    H    VAL  45           H        VAL  45  42.845 -33.390  -2.550
  345    HA   VAL  45           HA       VAL  45  41.383 -35.198  -0.974
  346    HB   VAL  45           HB       VAL  45  43.477 -36.383  -0.670
  347   HG11  VAL  45          1HG1      VAL  45  44.639 -33.893   0.556
  348   HG12  VAL  45          2HG1      VAL  45  45.462 -35.403   0.161
  349   HG13  VAL  45          3HG1      VAL  45  44.899 -34.340  -1.130
  350   HG21  VAL  45          3HG2      VAL  45  41.840 -36.047   1.239
  351   HG22  VAL  45          1HG2      VAL  45  43.479 -36.520   1.687
  352   HG23  VAL  45          2HG2      VAL  45  42.967 -34.842   1.863
  353    H    ILE  46           H        ILE  46  43.523 -32.409  -1.064
  354    HA   ILE  46           HA       ILE  46  42.708 -31.192   1.334
  355    HB   ILE  46           HB       ILE  46  44.704 -30.466   0.127
  356   HG12  ILE  46          1HG1      ILE  46  42.869 -28.093   0.107
  357   HG13  ILE  46          2HG1      ILE  46  43.218 -28.920   1.621
  358   HG21  ILE  46          1HG2      ILE  46  44.744 -29.768  -2.008
  359   HG22  ILE  46          2HG2      ILE  46  43.188 -30.588  -2.117
  360   HG23  ILE  46          3HG2      ILE  46  43.249 -28.847  -1.841
  361   HD11  ILE  46          3HD1      ILE  46  44.725 -26.931   0.354
  362   HD12  ILE  46          1HD1      ILE  46  45.140 -27.848   1.802
  363   HD13  ILE  46          2HD1      ILE  46  45.656 -28.422   0.216
  364    H    ILE  47           H        ILE  47  41.132 -29.706   1.818
  365    HA   ILE  47           HA       ILE  47  39.152 -29.131  -0.283
  366    HB   ILE  47           HB       ILE  47  37.371 -29.308   1.457
  367   HG12  ILE  47          1HG1      ILE  47  39.466 -30.762   3.077
  368   HG13  ILE  47          2HG1      ILE  47  38.987 -29.097   3.388
  369   HG21  ILE  47          1HG2      ILE  47  38.652 -31.330  -0.006
  370   HG22  ILE  47          2HG2      ILE  47  38.290 -32.020   1.575
  371   HG23  ILE  47          3HG2      ILE  47  36.997 -31.322   0.601
  372   HD11  ILE  47          3HD1      ILE  47  36.820 -31.095   3.253
  373   HD12  ILE  47          1HD1      ILE  47  37.907 -31.183   4.638
  374   HD13  ILE  47          2HD1      ILE  47  37.017 -29.697   4.308
  375    H    GLU  48           H        GLU  48  37.553 -27.384   0.587
  376    HA   GLU  48           HA       GLU  48  39.179 -25.260   1.819
  377    HB2  GLU  48           1HB      GLU  48  37.862 -25.279  -0.635
  378    HB3  GLU  48           2HB      GLU  48  36.812 -24.334   0.411
  379    HG2  GLU  48           1HG      GLU  48  38.452 -22.973  -0.829
  380    HG3  GLU  48           2HG      GLU  48  38.587 -22.810   0.920
  381    H    GLN  49           H        GLN  49  38.653 -25.230   3.925
  382    HA   GLN  49           HA       GLN  49  36.140 -24.260   4.755
  383    HB2  GLN  49           1HB      GLN  49  35.643 -26.718   4.232
  384    HB3  GLN  49           2HB      GLN  49  36.623 -27.098   5.642
  385    HG2  GLN  49           1HG      GLN  49  34.202 -27.051   6.106
  386    HG3  GLN  49           2HG      GLN  49  35.125 -25.908   7.081
  387   HE21  GLN  49          2HE2      GLN  49  33.348 -24.612   7.475
  388   HE22  GLN  49          1HE2      GLN  49  32.641 -23.610   6.259
  389    H    ALA  50           H        ALA  50  38.502 -23.222   5.272
  390    HA   ALA  50           HA       ALA  50  38.638 -23.169   8.097
  391    HB1  ALA  50           1HB      ALA  50  41.114 -23.949   8.132
  392    HB2  ALA  50           2HB      ALA  50  39.823 -25.152   8.165
  393    HB3  ALA  50           3HB      ALA  50  40.676 -24.816   6.659
  394    H    ASN  51           H        ASN  51  39.364 -21.220   8.679
  395    HA   ASN  51           HA       ASN  51  41.565 -19.887   7.561
  396    HB2  ASN  51           1HB      ASN  51  39.227 -19.673   5.982
  397    HB3  ASN  51           2HB      ASN  51  39.444 -18.116   6.776
  398   HD21  ASN  51          2HD2      ASN  51  39.976 -17.074   4.877
  399   HD22  ASN  51          1HD2      ASN  51  41.486 -17.320   4.073
  400    H    LYS  52           H        LYS  52  42.247 -18.944   9.362
  401    HA   LYS  52           HA       LYS  52  40.388 -17.222  10.838
  402    HB2  LYS  52           1HB      LYS  52  41.744 -19.625  11.835
  403    HB3  LYS  52           2HB      LYS  52  41.991 -18.204  12.842
  404    HG2  LYS  52           1HG      LYS  52  39.622 -17.923  13.122
  405    HG3  LYS  52           2HG      LYS  52  39.294 -19.226  11.977
  406    HD2  LYS  52           1HD      LYS  52  39.500 -20.767  13.572
  407    HD3  LYS  52           2HD      LYS  52  41.066 -20.121  14.070
  408    HE2  LYS  52           1HE      LYS  52  40.145 -18.771  15.685
  409    HE3  LYS  52           2HE      LYS  52  38.591 -18.662  14.860
  410    HZ1  LYS  52           3HZ      LYS  52  39.344 -20.399  16.926
  411    HZ2  LYS  52           1HZ      LYS  52  39.013 -21.334  15.555
  412    HZ3  LYS  52           2HZ      LYS  52  37.843 -20.272  16.158
  413    H    ARG  53           H        ARG  53  41.271 -15.362  11.643
  414    HA   ARG  53           HA       ARG  53  44.055 -14.936  11.978
  415    HB2  ARG  53           1HB      ARG  53  44.370 -13.288  10.156
  416    HB3  ARG  53           2HB      ARG  53  44.106 -14.921   9.559
  417    HG2  ARG  53           1HG      ARG  53  42.703 -13.843   8.162
  418    HG3  ARG  53           2HG      ARG  53  41.585 -14.051   9.512
  419    HD2  ARG  53           1HD      ARG  53  41.665 -11.846  10.097
  420    HD3  ARG  53           2HD      ARG  53  43.313 -11.638   9.506
  421    HE   ARG  53           HE       ARG  53  42.468 -11.037   7.465
  422   HH11  ARG  53          1HH1      ARG  53  39.961 -12.569   9.334
  423   HH12  ARG  53          2HH1      ARG  53  38.706 -12.192   8.201
  424   HH21  ARG  53          1HH2      ARG  53  40.824 -10.535   5.966
  425   HH22  ARG  53          2HH2      ARG  53  39.198 -11.036   6.285
  Start of MODEL    6
    1    H1   MET   1           H        MET   1 -10.730  -2.305 -14.557
    2    HA   MET   1           HA       MET   1 -12.576  -2.501 -12.304
    3    HB2  MET   1           1HB      MET   1 -13.093  -2.147 -15.261
    4    HB3  MET   1           2HB      MET   1 -14.335  -2.171 -14.017
    5    HG2  MET   1           1HG      MET   1 -14.075  -0.005 -13.695
    6    HG3  MET   1           2HG      MET   1 -12.384  -0.257 -13.270
    7    HE1  MET   1           3HE      MET   1 -12.924   2.522 -14.441
    8    HE2  MET   1           1HE      MET   1 -13.246   2.639 -16.172
    9    HE3  MET   1           2HE      MET   1 -14.443   1.911 -15.100
   10    H    ALA   2           H        ALA   2 -13.152  -4.436 -11.590
   11    HA   ALA   2           HA       ALA   2 -14.100  -6.485 -13.317
   12    HB1  ALA   2           1HB      ALA   2 -11.819  -7.593 -11.840
   13    HB2  ALA   2           2HB      ALA   2 -12.389  -7.931 -13.475
   14    HB3  ALA   2           3HB      ALA   2 -11.392  -6.510 -13.165
   15    H    ALA   3           H        ALA   3 -14.963  -8.306 -12.159
   16    HA   ALA   3           HA       ALA   3 -14.845  -8.451  -9.311
   17    HB1  ALA   3           1HB      ALA   3 -17.409  -7.417 -10.517
   18    HB2  ALA   3           2HB      ALA   3 -17.164  -7.867  -8.829
   19    HB3  ALA   3           3HB      ALA   3 -16.293  -6.493  -9.511
   20    H    ILE   4           H        ILE   4 -14.238 -10.564 -10.265
   21    HA   ILE   4           HA       ILE   4 -16.631 -12.197 -10.814
   22    HB   ILE   4           HB       ILE   4 -13.824 -12.671 -11.826
   23   HG12  ILE   4          1HG1      ILE   4 -15.301 -12.450 -14.049
   24   HG13  ILE   4          2HG1      ILE   4 -16.250 -11.407 -12.995
   25   HG21  ILE   4          1HG2      ILE   4 -15.775 -14.238 -13.164
   26   HG22  ILE   4          2HG2      ILE   4 -14.420 -14.778 -12.174
   27   HG23  ILE   4          3HG2      ILE   4 -15.987 -14.464 -11.428
   28   HD11  ILE   4          3HD1      ILE   4 -13.869 -10.383 -12.480
   29   HD12  ILE   4          1HD1      ILE   4 -13.523 -11.035 -14.081
   30   HD13  ILE   4          2HD1      ILE   4 -14.831  -9.872 -13.866
   31    H    GLU   5           H        GLU   5 -13.371 -12.216  -9.405
   32    HA   GLU   5           HA       GLU   5 -14.188 -13.590  -7.080
   33    HB2  GLU   5           1HB      GLU   5 -14.353 -15.512  -8.576
   34    HB3  GLU   5           2HB      GLU   5 -12.704 -15.248  -9.126
   35    HG2  GLU   5           1HG      GLU   5 -11.831 -16.316  -7.380
   36    HG3  GLU   5           2HG      GLU   5 -12.908 -15.515  -6.237
   37    H    LYS   6           H        LYS   6 -12.770 -13.141  -5.518
   38    HA   LYS   6           HA       LYS   6  -9.938 -12.926  -6.063
   39    HB2  LYS   6           1HB      LYS   6 -11.591 -10.594  -6.055
   40    HB3  LYS   6           2HB      LYS   6 -10.555 -10.548  -4.635
   41    HG2  LYS   6           1HG      LYS   6  -8.774 -11.263  -6.548
   42    HG3  LYS   6           2HG      LYS   6  -9.886 -10.251  -7.474
   43    HD2  LYS   6           1HD      LYS   6  -8.683  -9.398  -4.848
   44    HD3  LYS   6           2HD      LYS   6  -7.932  -9.056  -6.408
   45    HE2  LYS   6           1HE      LYS   6 -10.720  -8.334  -6.438
   46    HE3  LYS   6           2HE      LYS   6  -9.893  -7.554  -5.091
   47    HZ1  LYS   6           3HZ      LYS   6  -8.489  -7.480  -7.626
   48    HZ2  LYS   6           1HZ      LYS   6  -8.691  -6.268  -6.463
   49    HZ3  LYS   6           2HZ      LYS   6  -9.925  -6.587  -7.574
   50    H    ARG   7           H        ARG   7  -9.415 -14.404  -4.540
   51    HA   ARG   7           HA       ARG   7 -10.040 -13.702  -1.756
   52    HB2  ARG   7           1HB      ARG   7 -10.520 -16.287  -3.162
   53    HB3  ARG   7           2HB      ARG   7  -9.995 -16.343  -1.485
   54    HG2  ARG   7           1HG      ARG   7 -11.951 -15.514  -0.698
   55    HG3  ARG   7           2HG      ARG   7 -12.237 -14.525  -2.131
   56    HD2  ARG   7           1HD      ARG   7 -13.560 -16.084  -2.997
   57    HD3  ARG   7           2HD      ARG   7 -12.288 -17.295  -2.849
   58    HE   ARG   7           HE       ARG   7 -13.589 -16.806  -0.360
   59   HH11  ARG   7          1HH1      ARG   7 -13.886 -18.489  -3.393
   60   HH12  ARG   7          2HH1      ARG   7 -14.914 -19.728  -2.754
   61   HH21  ARG   7          1HH2      ARG   7 -14.942 -18.432   0.493
   62   HH22  ARG   7          2HH2      ARG   7 -15.515 -19.694  -0.543
   63    H    GLN   8           H        GLN   8  -8.097 -13.069  -1.034
   64    HA   GLN   8           HA       GLN   8  -5.944 -15.021  -1.020
   65    HB2  GLN   8           1HB      GLN   8  -5.858 -12.451  -2.509
   66    HB3  GLN   8           2HB      GLN   8  -4.417 -12.905  -1.611
   67    HG2  GLN   8           1HG      GLN   8  -4.218 -14.949  -2.837
   68    HG3  GLN   8           2HG      GLN   8  -5.769 -14.677  -3.628
   69   HE21  GLN   8          2HE2      GLN   8  -2.637 -13.081  -3.158
   70   HE22  GLN   8          1HE2      GLN   8  -2.516 -12.465  -4.768
   71    H    LYS   9           H        LYS   9  -4.569 -14.823   0.719
   72    HA   LYS   9           HA       LYS   9  -5.216 -12.672   2.628
   73    HB2  LYS   9           1HB      LYS   9  -4.386 -15.515   3.240
   74    HB3  LYS   9           2HB      LYS   9  -4.699 -14.262   4.434
   75    HG2  LYS   9           1HG      LYS   9  -6.933 -14.468   4.263
   76    HG3  LYS   9           2HG      LYS   9  -6.881 -14.777   2.526
   77    HD2  LYS   9           1HD      LYS   9  -6.722 -17.020   2.797
   78    HD3  LYS   9           2HD      LYS   9  -5.739 -16.881   4.256
   79    HE2  LYS   9           1HE      LYS   9  -7.557 -16.764   5.633
   80    HE3  LYS   9           2HE      LYS   9  -8.573 -16.006   4.408
   81    HZ1  LYS   9           3HZ      LYS   9  -9.347 -18.217   4.796
   82    HZ2  LYS   9           1HZ      LYS   9  -7.805 -18.869   4.558
   83    HZ3  LYS   9           2HZ      LYS   9  -8.641 -18.178   3.260
   84    H    GLU  10           H        GLU  10  -3.418 -12.315   4.256
   85    HA   GLU  10           HA       GLU  10  -0.933 -11.994   2.780
   86    HB2  GLU  10           1HB      GLU  10  -1.721 -10.051   3.962
   87    HB3  GLU  10           2HB      GLU  10  -1.856 -10.958   5.462
   88    HG2  GLU  10           1HG      GLU  10   0.490 -11.112   5.691
   89    HG3  GLU  10           2HG      GLU  10   0.758 -10.538   4.047
   90    H    ILE  11           H        ILE  11  -2.231 -13.825   5.448
   91    HA   ILE  11           HA       ILE  11   0.152 -14.653   6.664
   92    HB   ILE  11           HB       ILE  11  -2.437 -16.192   6.425
   93   HG12  ILE  11          1HG1      ILE  11  -2.088 -15.086   9.002
   94   HG13  ILE  11          2HG1      ILE  11  -1.740 -13.796   7.856
   95   HG21  ILE  11          1HG2      ILE  11  -0.772 -17.716   7.109
   96   HG22  ILE  11          2HG2      ILE  11  -0.030 -16.538   8.191
   97   HG23  ILE  11          3HG2      ILE  11  -1.606 -17.225   8.583
   98   HD11  ILE  11          3HD1      ILE  11  -4.109 -15.247   7.096
   99   HD12  ILE  11          1HD1      ILE  11  -4.233 -14.628   8.742
  100   HD13  ILE  11          2HD1      ILE  11  -3.891 -13.526   7.408
  101    H    ALA  12           H        ALA  12  -1.876 -16.597   4.460
  102    HA   ALA  12           HA       ALA  12  -0.019 -18.616   4.004
  103    HB1  ALA  12           1HB      ALA  12  -1.527 -18.302   1.635
  104    HB2  ALA  12           2HB      ALA  12  -1.785 -19.447   2.952
  105    HB3  ALA  12           3HB      ALA  12  -2.574 -17.870   2.988
  106    H    ASP  13           H        ASP  13  -0.508 -15.558   2.303
  107    HA   ASP  13           HA       ASP  13   1.187 -15.971   0.134
  108    HB2  ASP  13           1HB      ASP  13  -0.291 -14.044   0.254
  109    HB3  ASP  13           2HB      ASP  13   0.599 -13.412   1.637
  110    H    GLY  14           H        GLY  14   1.962 -14.392   3.242
  111    HA2  GLY  14           1HA      GLY  14   4.730 -14.140   2.696
  112    HA3  GLY  14           2HA      GLY  14   3.978 -14.019   4.280
  113    H    LEU  15           H        LEU  15   2.816 -16.720   4.076
  114    HA   LEU  15           HA       LEU  15   4.900 -18.158   5.306
  115    HB2  LEU  15           1HB      LEU  15   2.127 -18.486   4.841
  116    HB3  LEU  15           2HB      LEU  15   2.933 -19.947   4.276
  117    HG   LEU  15           HG       LEU  15   4.050 -19.436   6.780
  118   HD11  LEU  15          1HD1      LEU  15   2.279 -17.837   7.253
  119   HD12  LEU  15          2HD1      LEU  15   2.103 -19.279   8.252
  120   HD13  LEU  15          3HD1      LEU  15   1.061 -19.046   6.849
  121   HD21  LEU  15          3HD2      LEU  15   1.788 -21.320   6.132
  122   HD22  LEU  15          1HD2      LEU  15   3.005 -21.498   7.396
  123   HD23  LEU  15          2HD2      LEU  15   3.474 -21.609   5.699
  124    H    ALA  16           H        ALA  16   3.347 -18.649   2.134
  125    HA   ALA  16           HA       ALA  16   5.199 -20.635   1.296
  126    HB1  ALA  16           1HB      ALA  16   2.789 -19.547   0.334
  127    HB2  ALA  16           2HB      ALA  16   3.989 -19.325  -0.940
  128    HB3  ALA  16           3HB      ALA  16   3.679 -20.936  -0.291
  129    H    SER  17           H        SER  17   4.998 -17.145   0.880
  130    HA   SER  17           HA       SER  17   7.033 -16.891  -1.058
  131    HB2  SER  17           1HB      SER  17   5.342 -15.124  -0.436
  132    HB3  SER  17           2HB      SER  17   6.283 -14.832   1.026
  133    HG   SER  17           HG       SER  17   6.666 -13.689  -1.236
  134    H    ALA  18           H        ALA  18   7.083 -17.008   2.454
  135    HA   ALA  18           HA       ALA  18   9.906 -16.401   2.604
  136    HB1  ALA  18           1HB      ALA  18   8.105 -17.417   4.796
  137    HB2  ALA  18           2HB      ALA  18   9.664 -16.610   4.975
  138    HB3  ALA  18           3HB      ALA  18   8.273 -15.716   4.360
  139    H    GLU  19           H        GLU  19   7.835 -19.246   3.070
  140    HA   GLU  19           HA       GLU  19   9.851 -21.042   3.821
  141    HB2  GLU  19           1HB      GLU  19   7.359 -21.405   3.986
  142    HB3  GLU  19           2HB      GLU  19   7.362 -21.737   2.259
  143    HG2  GLU  19           1HG      GLU  19   7.420 -23.836   3.265
  144    HG3  GLU  19           2HG      GLU  19   9.085 -23.536   2.771
  145    H    ARG  20           H        ARG  20   8.413 -20.443   0.617
  146    HA   ARG  20           HA       ARG  20   9.904 -22.243  -0.862
  147    HB2  ARG  20           1HB      ARG  20   7.977 -20.885  -1.697
  148    HB3  ARG  20           2HB      ARG  20   9.050 -19.495  -1.783
  149    HG2  ARG  20           1HG      ARG  20  10.003 -21.898  -3.180
  150    HG3  ARG  20           2HG      ARG  20   8.544 -21.159  -3.843
  151    HD2  ARG  20           1HD      ARG  20  10.091 -18.972  -3.418
  152    HD3  ARG  20           2HD      ARG  20  11.316 -20.180  -3.801
  153    HE   ARG  20           HE       ARG  20   9.478 -18.976  -5.613
  154   HH11  ARG  20          1HH1      ARG  20  11.215 -21.916  -4.937
  155   HH12  ARG  20          2HH1      ARG  20  11.235 -22.438  -6.589
  156   HH21  ARG  20          1HH2      ARG  20   9.497 -19.652  -7.792
  157   HH22  ARG  20          2HH2      ARG  20  10.258 -21.149  -8.212
  158    H    ALA  21           H        ALA  21  10.645 -18.805  -0.276
  159    HA   ALA  21           HA       ALA  21  13.091 -18.718  -1.601
  160    HB1  ALA  21           1HB      ALA  21  11.820 -16.752  -0.758
  161    HB2  ALA  21           2HB      ALA  21  12.374 -17.148   0.869
  162    HB3  ALA  21           3HB      ALA  21  13.542 -16.707  -0.377
  163    H    HIS  22           H        HIS  22  12.440 -19.360   1.840
  164    HA   HIS  22           HA       HIS  22  15.059 -19.679   2.701
  165    HB2  HIS  22           1HB      HIS  22  12.398 -20.519   3.658
  166    HB3  HIS  22           2HB      HIS  22  13.743 -21.487   4.254
  167    HD1  HIS  22           HD1      HIS  22  12.868 -17.789   3.989
  168    HD2  HIS  22           HD2      HIS  22  14.855 -20.450   6.485
  169    HE1  HIS  22           HE1      HIS  22  13.597 -16.431   5.976
  170    H    LYS  23           H        LYS  23  12.803 -22.295   1.804
  171    HA   LYS  23           HA       LYS  23  14.602 -24.397   1.898
  172    HB2  LYS  23           1HB      LYS  23  11.996 -23.898   0.627
  173    HB3  LYS  23           2HB      LYS  23  12.959 -25.144  -0.156
  174    HG2  LYS  23           1HG      LYS  23  12.374 -26.601   1.398
  175    HG3  LYS  23           2HG      LYS  23  13.052 -25.565   2.656
  176    HD2  LYS  23           1HD      LYS  23  11.031 -24.721   3.235
  177    HD3  LYS  23           2HD      LYS  23  10.423 -24.756   1.578
  178    HE2  LYS  23           1HE      LYS  23   9.197 -26.503   2.245
  179    HE3  LYS  23           2HE      LYS  23  10.701 -27.420   2.171
  180    HZ1  LYS  23           3HZ      LYS  23  10.412 -26.001   4.636
  181    HZ2  LYS  23           1HZ      LYS  23  10.731 -27.640   4.368
  182    HZ3  LYS  23           2HZ      LYS  23   9.136 -27.080   4.375
  183    H    ASP  24           H        ASP  24  13.713 -22.417  -0.925
  184    HA   ASP  24           HA       ASP  24  15.326 -23.622  -2.821
  185    HB2  ASP  24           1HB      ASP  24  13.639 -21.858  -3.291
  186    HB3  ASP  24           2HB      ASP  24  14.735 -20.663  -2.605
  187    H    LEU  25           H        LEU  25  16.142 -20.796  -0.803
  188    HA   LEU  25           HA       LEU  25  18.746 -20.421  -1.646
  189    HB2  LEU  25           1HB      LEU  25  17.095 -19.496   0.452
  190    HB3  LEU  25           2HB      LEU  25  18.620 -20.001   1.177
  191    HG   LEU  25           HG       LEU  25  18.602 -17.612   0.653
  192   HD11  LEU  25          1HD1      LEU  25  20.489 -18.816  -1.317
  193   HD12  LEU  25          2HD1      LEU  25  20.651 -19.212   0.394
  194   HD13  LEU  25          3HD1      LEU  25  20.757 -17.533  -0.136
  195   HD21  LEU  25          3HD2      LEU  25  17.061 -17.796  -1.298
  196   HD22  LEU  25          1HD2      LEU  25  18.408 -18.437  -2.239
  197   HD23  LEU  25          2HD2      LEU  25  18.484 -16.797  -1.595
  198    H    ASP  26           H        ASP  26  17.610 -22.435   1.060
  199    HA   ASP  26           HA       ASP  26  20.085 -23.394   1.897
  200    HB2  ASP  26           1HB      ASP  26  17.407 -23.856   2.557
  201    HB3  ASP  26           2HB      ASP  26  18.035 -25.434   2.090
  202    H    LEU  27           H        LEU  27  17.892 -24.639  -0.587
  203    HA   LEU  27           HA       LEU  27  19.317 -26.987  -1.181
  204    HB2  LEU  27           1HB      LEU  27  17.015 -25.688  -2.111
  205    HB3  LEU  27           2HB      LEU  27  18.060 -25.875  -3.519
  206    HG   LEU  27           HG       LEU  27  16.456 -27.716  -3.298
  207   HD11  LEU  27          1HD1      LEU  27  18.232 -28.512  -4.467
  208   HD12  LEU  27          2HD1      LEU  27  18.355 -29.558  -3.053
  209   HD13  LEU  27          3HD1      LEU  27  19.388 -28.135  -3.190
  210   HD21  LEU  27          3HD2      LEU  27  16.499 -29.243  -1.479
  211   HD22  LEU  27          1HD2      LEU  27  16.383 -27.624  -0.789
  212   HD23  LEU  27          2HD2      LEU  27  17.927 -28.476  -0.783
  213    H    ALA  28           H        ALA  28  19.291 -23.872  -2.923
  214    HA   ALA  28           HA       ALA  28  21.273 -24.449  -4.775
  215    HB1  ALA  28           1HB      ALA  28  20.489 -21.833  -3.510
  216    HB2  ALA  28           2HB      ALA  28  21.631 -21.963  -4.848
  217    HB3  ALA  28           3HB      ALA  28  19.961 -22.490  -5.059
  218    H    LYS  29           H        LYS  29  21.663 -22.761  -1.656
  219    HA   LYS  29           HA       LYS  29  24.409 -22.445  -1.700
  220    HB2  LYS  29           1HB      LYS  29  22.448 -21.862   0.085
  221    HB3  LYS  29           2HB      LYS  29  23.265 -23.175   0.923
  222    HG2  LYS  29           1HG      LYS  29  25.247 -21.410  -0.076
  223    HG3  LYS  29           2HG      LYS  29  24.014 -20.449   0.743
  224    HD2  LYS  29           1HD      LYS  29  24.283 -21.664   2.763
  225    HD3  LYS  29           2HD      LYS  29  25.254 -22.905   1.967
  226    HE2  LYS  29           1HE      LYS  29  26.832 -20.894   1.417
  227    HE3  LYS  29           2HE      LYS  29  26.002 -20.127   2.770
  228    HZ1  LYS  29           3HZ      LYS  29  27.763 -21.147   3.802
  229    HZ2  LYS  29           1HZ      LYS  29  27.757 -22.486   2.768
  230    HZ3  LYS  29           2HZ      LYS  29  26.573 -22.337   3.966
  231    H    ALA  30           H        ALA  30  22.596 -25.121  -0.191
  232    HA   ALA  30           HA       ALA  30  24.727 -26.660   0.651
  233    HB1  ALA  30           1HB      ALA  30  23.086 -28.623   0.174
  234    HB2  ALA  30           2HB      ALA  30  22.678 -27.416   1.394
  235    HB3  ALA  30           3HB      ALA  30  21.946 -27.332  -0.208
  236    H    SER  31           H        SER  31  23.071 -26.793  -2.498
  237    HA   SER  31           HA       SER  31  24.559 -28.849  -3.637
  238    HB2  SER  31           1HB      SER  31  22.514 -27.220  -4.482
  239    HB3  SER  31           2HB      SER  31  23.849 -26.705  -5.514
  240    HG   SER  31           HG       SER  31  23.850 -28.596  -6.480
  241    H    ALA  32           H        ALA  32  25.142 -25.346  -3.724
  242    HA   ALA  32           HA       ALA  32  27.413 -25.351  -5.335
  243    HB1  ALA  32           1HB      ALA  32  27.741 -23.327  -3.386
  244    HB2  ALA  32           2HB      ALA  32  27.145 -23.171  -5.039
  245    HB3  ALA  32           3HB      ALA  32  26.015 -23.473  -3.719
  246    H    THR  33           H        THR  33  27.226 -25.409  -1.776
  247    HA   THR  33           HA       THR  33  29.961 -25.566  -1.265
  248    HB   THR  33           HB       THR  33  27.811 -26.886   0.398
  249    HG1  THR  33           HG1      THR  33  27.143 -24.941   0.875
  250   HG21  THR  33          3HG2      THR  33  30.405 -25.615   1.264
  251   HG22  THR  33          1HG2      THR  33  30.224 -27.340   0.948
  252   HG23  THR  33          2HG2      THR  33  29.297 -26.579   2.241
  253    H    ASP  34           H        ASP  34  27.593 -28.164  -1.751
  254    HA   ASP  34           HA       ASP  34  29.305 -30.325  -1.262
  255    HB2  ASP  34           1HB      ASP  34  26.734 -29.960  -2.730
  256    HB3  ASP  34           2HB      ASP  34  27.627 -31.458  -2.982
  257    H    GLN  35           H        GLN  35  28.523 -28.645  -4.288
  258    HA   GLN  35           HA       GLN  35  30.082 -30.276  -5.974
  259    HB2  GLN  35           1HB      GLN  35  28.313 -28.698  -6.743
  260    HB3  GLN  35           2HB      GLN  35  29.388 -27.360  -6.361
  261    HG2  GLN  35           1HG      GLN  35  29.785 -27.573  -8.590
  262    HG3  GLN  35           2HG      GLN  35  31.032 -28.643  -7.951
  263   HE21  GLN  35          2HE2      GLN  35  30.692 -29.280 -10.336
  264   HE22  GLN  35          1HE2      GLN  35  29.606 -30.597 -10.601
  265    H    LEU  36           H        LEU  36  30.811 -27.199  -4.356
  266    HA   LEU  36           HA       LEU  36  33.407 -26.883  -5.378
  267    HB2  LEU  36           1HB      LEU  36  31.988 -25.177  -4.165
  268    HB3  LEU  36           2HB      LEU  36  32.476 -25.968  -2.667
  269    HG   LEU  36           HG       LEU  36  34.897 -25.483  -3.686
  270   HD11  LEU  36          1HD1      LEU  36  34.818 -23.158  -4.645
  271   HD12  LEU  36          2HD1      LEU  36  33.087 -23.399  -4.881
  272   HD13  LEU  36          3HD1      LEU  36  34.243 -24.442  -5.710
  273   HD21  LEU  36          3HD2      LEU  36  34.146 -23.038  -2.506
  274   HD22  LEU  36          1HD2      LEU  36  34.931 -24.420  -1.740
  275   HD23  LEU  36          2HD2      LEU  36  33.171 -24.294  -1.741
  276    H    LYS  37           H        LYS  37  32.401 -28.088  -2.173
  277    HA   LYS  37           HA       LYS  37  34.910 -28.859  -1.266
  278    HB2  LYS  37           1HB      LYS  37  32.740 -28.755   0.046
  279    HB3  LYS  37           2HB      LYS  37  32.349 -30.327  -0.638
  280    HG2  LYS  37           1HG      LYS  37  33.266 -30.943   1.361
  281    HG3  LYS  37           2HG      LYS  37  34.691 -30.991   0.321
  282    HD2  LYS  37           1HD      LYS  37  35.515 -28.968   1.164
  283    HD3  LYS  37           2HD      LYS  37  33.952 -28.513   1.845
  284    HE2  LYS  37           1HE      LYS  37  34.350 -29.608   3.754
  285    HE3  LYS  37           2HE      LYS  37  34.971 -31.025   2.910
  286    HZ1  LYS  37           3HZ      LYS  37  36.419 -28.651   3.859
  287    HZ2  LYS  37           1HZ      LYS  37  37.023 -29.513   2.535
  288    HZ3  LYS  37           2HZ      LYS  37  36.818 -30.286   4.024
  289    H    LYS  38           H        LYS  38  32.553 -30.665  -3.187
  290    HA   LYS  38           HA       LYS  38  33.900 -33.134  -3.188
  291    HB2  LYS  38           1HB      LYS  38  31.584 -32.981  -3.874
  292    HB3  LYS  38           2HB      LYS  38  32.011 -31.923  -5.213
  293    HG2  LYS  38           1HG      LYS  38  32.633 -33.627  -6.530
  294    HG3  LYS  38           2HG      LYS  38  33.388 -34.514  -5.204
  295    HD2  LYS  38           1HD      LYS  38  30.408 -34.303  -5.615
  296    HD3  LYS  38           2HD      LYS  38  31.394 -35.643  -6.205
  297    HE2  LYS  38           1HE      LYS  38  31.706 -34.950  -3.352
  298    HE3  LYS  38           2HE      LYS  38  30.150 -35.636  -3.817
  299    HZ1  LYS  38           3HZ      LYS  38  31.292 -37.530  -4.764
  300    HZ2  LYS  38           1HZ      LYS  38  31.733 -37.342  -3.141
  301    HZ3  LYS  38           2HZ      LYS  38  32.797 -36.866  -4.367
  302    H    ALA  39           H        ALA  39  33.806 -30.629  -5.729
  303    HA   ALA  39           HA       ALA  39  35.692 -31.764  -7.427
  304    HB1  ALA  39           1HB      ALA  39  35.391 -28.797  -7.062
  305    HB2  ALA  39           2HB      ALA  39  35.790 -29.690  -8.530
  306    HB3  ALA  39           3HB      ALA  39  34.162 -29.779  -7.858
  307    H    LYS  40           H        LYS  40  36.138 -29.632  -4.647
  308    HA   LYS  40           HA       LYS  40  38.899 -29.172  -4.994
  309    HB2  LYS  40           1HB      LYS  40  37.676 -27.732  -3.533
  310    HB3  LYS  40           2HB      LYS  40  37.121 -29.086  -2.558
  311    HG2  LYS  40           1HG      LYS  40  39.005 -29.152  -1.341
  312    HG3  LYS  40           2HG      LYS  40  40.038 -28.792  -2.727
  313    HD2  LYS  40           1HD      LYS  40  40.297 -26.787  -1.752
  314    HD3  LYS  40           2HD      LYS  40  38.694 -26.438  -2.404
  315    HE2  LYS  40           1HE      LYS  40  38.307 -25.909  -0.227
  316    HE3  LYS  40           2HE      LYS  40  37.947 -27.633  -0.151
  317    HZ1  LYS  40           3HZ      LYS  40  40.719 -26.856   0.290
  318    HZ2  LYS  40           1HZ      LYS  40  39.799 -28.062   1.040
  319    HZ3  LYS  40           2HZ      LYS  40  39.620 -26.447   1.509
  320    H    ALA  41           H        ALA  41  37.280 -31.331  -2.655
  321    HA   ALA  41           HA       ALA  41  39.531 -32.642  -1.725
  322    HB1  ALA  41           1HB      ALA  41  36.984 -34.158  -2.086
  323    HB2  ALA  41           2HB      ALA  41  38.107 -34.154  -0.726
  324    HB3  ALA  41           3HB      ALA  41  37.036 -32.778  -0.989
  325    H    GLU  42           H        GLU  42  37.678 -33.199  -4.654
  326    HA   GLU  42           HA       GLU  42  38.905 -35.685  -5.314
  327    HB2  GLU  42           1HB      GLU  42  37.080 -33.767  -6.645
  328    HB3  GLU  42           2HB      GLU  42  38.033 -34.797  -7.705
  329    HG2  GLU  42           1HG      GLU  42  36.808 -36.274  -5.527
  330    HG3  GLU  42           2HG      GLU  42  35.628 -35.437  -6.535
  331    H    ALA  43           H        ALA  43  39.351 -32.367  -6.527
  332    HA   ALA  43           HA       ALA  43  41.442 -32.923  -8.301
  333    HB1  ALA  43           1HB      ALA  43  40.259 -30.538  -7.091
  334    HB2  ALA  43           2HB      ALA  43  41.965 -30.365  -7.505
  335    HB3  ALA  43           3HB      ALA  43  40.799 -30.825  -8.746
  336    H    GLN  44           H        GLN  44  41.437 -32.326  -4.845
  337    HA   GLN  44           HA       GLN  44  44.316 -32.147  -4.688
  338    HB2  GLN  44           1HB      GLN  44  42.067 -31.654  -2.929
  339    HB3  GLN  44           2HB      GLN  44  43.318 -32.584  -2.115
  340    HG2  GLN  44           1HG      GLN  44  44.968 -30.874  -2.746
  341    HG3  GLN  44           2HG      GLN  44  43.679 -29.933  -3.494
  342   HE21  GLN  44          2HE2      GLN  44  44.874 -28.503  -1.780
  343   HE22  GLN  44          1HE2      GLN  44  44.078 -28.412  -0.250
  344    H    VAL  45           H        VAL  45  45.346 -33.580  -2.878
  345    HA   VAL  45           HA       VAL  45  45.554 -36.172  -3.813
  346    HB   VAL  45           HB       VAL  45  47.208 -35.120  -2.320
  347   HG11  VAL  45          1HG1      VAL  45  46.869 -34.821  -0.013
  348   HG12  VAL  45          2HG1      VAL  45  45.414 -34.178  -0.777
  349   HG13  VAL  45          3HG1      VAL  45  45.385 -35.773  -0.023
  350   HG21  VAL  45          3HG2      VAL  45  46.564 -37.754  -2.498
  351   HG22  VAL  45          1HG2      VAL  45  47.983 -37.124  -1.662
  352   HG23  VAL  45          2HG2      VAL  45  46.521 -37.505  -0.753
  353    H    ILE  46           H        ILE  46  44.529 -38.063  -3.452
  354    HA   ILE  46           HA       ILE  46  41.897 -38.138  -2.573
  355    HB   ILE  46           HB       ILE  46  42.943 -39.873  -3.997
  356   HG12  ILE  46          1HG1      ILE  46  41.855 -41.267  -1.575
  357   HG13  ILE  46          2HG1      ILE  46  40.829 -40.163  -2.483
  358   HG21  ILE  46          1HG2      ILE  46  44.684 -41.112  -3.360
  359   HG22  ILE  46          2HG2      ILE  46  44.853 -39.984  -2.015
  360   HG23  ILE  46          3HG2      ILE  46  43.952 -41.484  -1.799
  361   HD11  ILE  46          3HD1      ILE  46  42.001 -42.775  -3.318
  362   HD12  ILE  46          1HD1      ILE  46  40.335 -42.206  -3.422
  363   HD13  ILE  46          2HD1      ILE  46  41.555 -41.572  -4.528
  364    H    ILE  47           H        ILE  47  40.897 -38.925  -0.702
  365    HA   ILE  47           HA       ILE  47  41.907 -38.102   1.732
  366    HB   ILE  47           HB       ILE  47  39.920 -40.338   1.315
  367   HG12  ILE  47          1HG1      ILE  47  39.222 -38.338   0.115
  368   HG13  ILE  47          2HG1      ILE  47  38.214 -38.557   1.541
  369   HG21  ILE  47          1HG2      ILE  47  40.515 -40.409   3.567
  370   HG22  ILE  47          2HG2      ILE  47  40.667 -38.656   3.679
  371   HG23  ILE  47          3HG2      ILE  47  39.072 -39.395   3.550
  372   HD11  ILE  47          3HD1      ILE  47  38.624 -36.351   1.759
  373   HD12  ILE  47          1HD1      ILE  47  40.063 -36.949   2.584
  374   HD13  ILE  47          2HD1      ILE  47  40.161 -36.437   0.899
  375    H    GLU  48           H        GLU  48  43.096 -38.999   3.343
  376    HA   GLU  48           HA       GLU  48  44.453 -41.515   2.713
  377    HB2  GLU  48           1HB      GLU  48  46.023 -40.822   4.535
  378    HB3  GLU  48           2HB      GLU  48  45.956 -39.710   3.176
  379    HG2  GLU  48           1HG      GLU  48  44.874 -38.079   4.384
  380    HG3  GLU  48           2HG      GLU  48  44.225 -39.228   5.554
  381    H    GLN  49           H        GLN  49  42.254 -40.080   4.982
  382    HA   GLN  49           HA       GLN  49  42.478 -41.737   7.177
  383    HB2  GLN  49           1HB      GLN  49  40.073 -40.420   5.931
  384    HB3  GLN  49           2HB      GLN  49  39.963 -41.335   7.428
  385    HG2  GLN  49           1HG      GLN  49  41.554 -39.836   8.485
  386    HG3  GLN  49           2HG      GLN  49  41.722 -38.935   6.979
  387   HE21  GLN  49          2HE2      GLN  49  40.420 -37.266   6.654
  388   HE22  GLN  49          1HE2      GLN  49  39.005 -36.899   7.574
  389    H    ALA  50           H        ALA  50  41.013 -43.505   7.861
  390    HA   ALA  50           HA       ALA  50  41.149 -45.673   6.059
  391    HB1  ALA  50           1HB      ALA  50  40.417 -46.986   7.792
  392    HB2  ALA  50           2HB      ALA  50  41.048 -45.598   8.679
  393    HB3  ALA  50           3HB      ALA  50  39.313 -45.754   8.405
  394    H    ASN  51           H        ASN  51  39.647 -46.634   4.772
  395    HA   ASN  51           HA       ASN  51  36.866 -46.129   4.889
  396    HB2  ASN  51           1HB      ASN  51  38.358 -44.129   3.559
  397    HB3  ASN  51           2HB      ASN  51  37.545 -45.064   2.307
  398   HD21  ASN  51          2HD2      ASN  51  36.081 -43.525   1.740
  399   HD22  ASN  51          1HD2      ASN  51  34.815 -42.980   2.782
  400    H    LYS  52           H        LYS  52  35.709 -47.511   3.574
  401    HA   LYS  52           HA       LYS  52  37.326 -49.355   1.941
  402    HB2  LYS  52           1HB      LYS  52  35.129 -49.801   3.883
  403    HB3  LYS  52           2HB      LYS  52  35.117 -50.809   2.441
  404    HG2  LYS  52           1HG      LYS  52  36.909 -51.996   3.095
  405    HG3  LYS  52           2HG      LYS  52  37.714 -50.593   3.802
  406    HD2  LYS  52           1HD      LYS  52  35.885 -50.757   5.624
  407    HD3  LYS  52           2HD      LYS  52  35.644 -52.395   5.010
  408    HE2  LYS  52           1HE      LYS  52  37.285 -53.001   6.395
  409    HE3  LYS  52           2HE      LYS  52  38.382 -52.208   5.266
  410    HZ1  LYS  52           3HZ      LYS  52  37.917 -51.543   7.916
  411    HZ2  LYS  52           1HZ      LYS  52  37.241 -50.294   6.997
  412    HZ3  LYS  52           2HZ      LYS  52  38.870 -50.705   6.797
  413    H    ARG  53           H        ARG  53  36.091 -50.434   0.169
  414    HA   ARG  53           HA       ARG  53  34.303 -48.481  -1.115
  415    HB2  ARG  53           1HB      ARG  53  34.975 -49.695  -3.241
  416    HB3  ARG  53           2HB      ARG  53  36.234 -48.753  -2.454
  417    HG2  ARG  53           1HG      ARG  53  37.516 -50.543  -2.124
  418    HG3  ARG  53           2HG      ARG  53  36.160 -51.515  -1.547
  419    HD2  ARG  53           1HD      ARG  53  36.524 -52.662  -3.454
  420    HD3  ARG  53           2HD      ARG  53  35.554 -51.373  -4.164
  421    HE   ARG  53           HE       ARG  53  38.337 -50.732  -4.106
  422   HH11  ARG  53          1HH1      ARG  53  35.888 -52.492  -5.846
  423   HH12  ARG  53          2HH1      ARG  53  36.737 -52.439  -7.355
  424   HH21  ARG  53          1HH2      ARG  53  39.464 -50.655  -6.087
  425   HH22  ARG  53          2HH2      ARG  53  38.772 -51.394  -7.491
  Start of MODEL    7
    1    H1   MET   1           H        MET   1  -4.975 -16.917  -9.827
    2    HA   MET   1           HA       MET   1  -5.777 -19.534 -10.105
    3    HB2  MET   1           1HB      MET   1  -3.750 -20.158  -8.887
    4    HB3  MET   1           2HB      MET   1  -3.428 -18.846 -10.013
    5    HG2  MET   1           1HG      MET   1  -2.421 -17.848  -8.303
    6    HG3  MET   1           2HG      MET   1  -4.046 -17.502  -7.716
    7    HE1  MET   1           3HE      MET   1  -2.614 -17.134  -5.510
    8    HE2  MET   1           1HE      MET   1  -2.033 -18.446  -4.484
    9    HE3  MET   1           2HE      MET   1  -1.111 -17.968  -5.910
   10    H    ALA   2           H        ALA   2  -5.860 -21.249  -8.408
   11    HA   ALA   2           HA       ALA   2  -7.283 -20.291  -6.010
   12    HB1  ALA   2           1HB      ALA   2  -8.930 -21.863  -6.234
   13    HB2  ALA   2           2HB      ALA   2  -8.578 -21.536  -7.931
   14    HB3  ALA   2           3HB      ALA   2  -7.906 -22.968  -7.151
   15    H    ALA   3           H        ALA   3  -5.578 -20.425  -4.594
   16    HA   ALA   3           HA       ALA   3  -3.636 -22.396  -4.448
   17    HB1  ALA   3           1HB      ALA   3  -2.915 -21.141  -2.766
   18    HB2  ALA   3           2HB      ALA   3  -4.373 -20.162  -2.935
   19    HB3  ALA   3           3HB      ALA   3  -4.347 -21.517  -1.806
   20    H    ILE   4           H        ILE   4  -3.495 -24.397  -3.569
   21    HA   ILE   4           HA       ILE   4  -5.897 -25.851  -3.107
   22    HB   ILE   4           HB       ILE   4  -3.042 -26.678  -2.567
   23   HG12  ILE   4          1HG1      ILE   4  -4.321 -27.897  -4.858
   24   HG13  ILE   4          2HG1      ILE   4  -4.326 -26.143  -5.005
   25   HG21  ILE   4          1HG2      ILE   4  -5.647 -28.110  -2.441
   26   HG22  ILE   4          2HG2      ILE   4  -4.226 -28.986  -3.006
   27   HG23  ILE   4          3HG2      ILE   4  -4.229 -28.252  -1.403
   28   HD11  ILE   4          3HD1      ILE   4  -2.297 -27.737  -5.783
   29   HD12  ILE   4          1HD1      ILE   4  -2.114 -26.042  -5.332
   30   HD13  ILE   4          2HD1      ILE   4  -1.774 -27.309  -4.154
   31    H    GLU   5           H        GLU   5  -3.171 -25.004  -0.967
   32    HA   GLU   5           HA       GLU   5  -4.961 -25.445   1.331
   33    HB2  GLU   5           1HB      GLU   5  -1.993 -25.782   1.003
   34    HB3  GLU   5           2HB      GLU   5  -2.702 -25.556   2.595
   35    HG2  GLU   5           1HG      GLU   5  -4.155 -27.525   2.160
   36    HG3  GLU   5           2HG      GLU   5  -3.268 -27.786   0.659
   37    H    LYS   6           H        LYS   6  -4.976 -23.943   3.024
   38    HA   LYS   6           HA       LYS   6  -3.449 -21.490   2.767
   39    HB2  LYS   6           1HB      LYS   6  -5.561 -20.105   2.934
   40    HB3  LYS   6           2HB      LYS   6  -5.267 -20.865   1.376
   41    HG2  LYS   6           1HG      LYS   6  -6.848 -22.648   1.963
   42    HG3  LYS   6           2HG      LYS   6  -7.163 -21.844   3.502
   43    HD2  LYS   6           1HD      LYS   6  -8.206 -20.020   2.463
   44    HD3  LYS   6           2HD      LYS   6  -7.529 -20.421   0.883
   45    HE2  LYS   6           1HE      LYS   6  -8.899 -22.608   1.134
   46    HE3  LYS   6           2HE      LYS   6  -9.793 -21.711   2.360
   47    HZ1  LYS   6           3HZ      LYS   6  -9.527 -20.104   0.073
   48    HZ2  LYS   6           1HZ      LYS   6 -10.941 -20.724   0.765
   49    HZ3  LYS   6           2HZ      LYS   6 -10.112 -21.617  -0.408
   50    H    ARG   7           H        ARG   7  -3.260 -20.357   4.683
   51    HA   ARG   7           HA       ARG   7  -4.223 -21.785   7.052
   52    HB2  ARG   7           1HB      ARG   7  -1.752 -20.629   6.382
   53    HB3  ARG   7           2HB      ARG   7  -2.435 -19.594   7.629
   54    HG2  ARG   7           1HG      ARG   7  -1.134 -21.199   8.751
   55    HG3  ARG   7           2HG      ARG   7  -2.813 -21.686   8.987
   56    HD2  ARG   7           1HD      ARG   7  -1.523 -23.637   8.461
   57    HD3  ARG   7           2HD      ARG   7  -2.560 -23.265   7.085
   58    HE   ARG   7           HE       ARG   7  -0.689 -22.893   5.821
   59   HH11  ARG   7          1HH1      ARG   7   0.190 -22.884   9.190
   60   HH12  ARG   7          2HH1      ARG   7   1.894 -22.826   8.879
   61   HH21  ARG   7          1HH2      ARG   7   1.551 -22.818   5.399
   62   HH22  ARG   7          2HH2      ARG   7   2.666 -22.788   6.723
   63    H    GLN   8           H        GLN   8  -4.494 -18.763   5.362
   64    HA   GLN   8           HA       GLN   8  -6.839 -17.997   6.688
   65    HB2  GLN   8           1HB      GLN   8  -4.396 -17.255   8.036
   66    HB3  GLN   8           2HB      GLN   8  -5.279 -15.820   7.531
   67    HG2  GLN   8           1HG      GLN   8  -6.947 -16.163   8.997
   68    HG3  GLN   8           2HG      GLN   8  -6.894 -17.915   8.813
   69   HE21  GLN   8          2HE2      GLN   8  -5.831 -15.203  10.620
   70   HE22  GLN   8          1HE2      GLN   8  -4.955 -16.069  11.831
   71    H    LYS   9           H        LYS   9  -4.038 -16.037   5.694
   72    HA   LYS   9           HA       LYS   9  -4.930 -15.499   3.089
   73    HB2  LYS   9           1HB      LYS   9  -6.242 -13.974   5.161
   74    HB3  LYS   9           2HB      LYS   9  -5.321 -12.910   4.106
   75    HG2  LYS   9           1HG      LYS   9  -7.026 -14.960   2.817
   76    HG3  LYS   9           2HG      LYS   9  -7.830 -13.597   3.600
   77    HD2  LYS   9           1HD      LYS   9  -7.370 -12.314   1.846
   78    HD3  LYS   9           2HD      LYS   9  -5.643 -12.586   2.092
   79    HE2  LYS   9           1HE      LYS   9  -5.888 -13.392  -0.037
   80    HE3  LYS   9           2HE      LYS   9  -6.164 -14.865   0.891
   81    HZ1  LYS   9           3HZ      LYS   9  -7.958 -13.429  -0.814
   82    HZ2  LYS   9           1HZ      LYS   9  -8.632 -13.727   0.710
   83    HZ3  LYS   9           2HZ      LYS   9  -8.063 -15.013  -0.229
   84    H    GLU  10           H        GLU  10  -3.721 -13.250   5.571
   85    HA   GLU  10           HA       GLU  10  -1.564 -12.385   3.934
   86    HB2  GLU  10           1HB      GLU  10  -2.537 -11.834   6.675
   87    HB3  GLU  10           2HB      GLU  10  -0.828 -11.540   6.390
   88    HG2  GLU  10           1HG      GLU  10  -1.863 -10.312   4.242
   89    HG3  GLU  10           2HG      GLU  10  -3.194 -10.109   5.379
   90    H    ILE  11           H        ILE  11  -1.536 -14.138   7.044
   91    HA   ILE  11           HA       ILE  11   1.149 -14.764   7.127
   92    HB   ILE  11           HB       ILE  11   0.461 -16.780   8.480
   93   HG12  ILE  11          1HG1      ILE  11  -2.309 -15.675   7.966
   94   HG13  ILE  11          2HG1      ILE  11  -1.683 -17.190   7.326
   95   HG21  ILE  11          1HG2      ILE  11  -1.056 -14.904   9.929
   96   HG22  ILE  11          2HG2      ILE  11   0.653 -15.292  10.113
   97   HG23  ILE  11          3HG2      ILE  11   0.156 -13.992   9.030
   98   HD11  ILE  11          3HD1      ILE  11  -2.924 -16.658   9.844
   99   HD12  ILE  11          1HD1      ILE  11  -2.470 -18.202   9.123
  100   HD13  ILE  11          2HD1      ILE  11  -1.304 -17.306  10.097
  101    H    ALA  12           H        ALA  12  -1.427 -16.327   5.333
  102    HA   ALA  12           HA       ALA  12  -0.034 -18.672   4.611
  103    HB1  ALA  12           1HB      ALA  12  -2.583 -17.734   4.258
  104    HB2  ALA  12           2HB      ALA  12  -1.935 -17.709   2.617
  105    HB3  ALA  12           3HB      ALA  12  -1.926 -19.208   3.547
  106    H    ASP  13           H        ASP  13  -0.638 -15.703   2.724
  107    HA   ASP  13           HA       ASP  13   0.916 -16.356   0.513
  108    HB2  ASP  13           1HB      ASP  13  -0.602 -14.187   1.282
  109    HB3  ASP  13           2HB      ASP  13   1.026 -13.517   1.224
  110    H    GLY  14           H        GLY  14   1.842 -14.678   3.501
  111    HA2  GLY  14           1HA      GLY  14   4.536 -14.212   2.708
  112    HA3  GLY  14           2HA      GLY  14   3.907 -14.116   4.347
  113    H    LEU  15           H        LEU  15   2.913 -16.881   4.288
  114    HA   LEU  15           HA       LEU  15   5.238 -18.158   5.287
  115    HB2  LEU  15           1HB      LEU  15   2.398 -18.859   4.894
  116    HB3  LEU  15           2HB      LEU  15   3.527 -20.211   4.963
  117    HG   LEU  15           HG       LEU  15   3.450 -18.115   7.113
  118   HD11  LEU  15          1HD1      LEU  15   2.129 -20.262   8.161
  119   HD12  LEU  15          2HD1      LEU  15   1.474 -20.185   6.526
  120   HD13  LEU  15          3HD1      LEU  15   1.369 -18.779   7.585
  121   HD21  LEU  15          3HD2      LEU  15   4.987 -19.380   8.108
  122   HD22  LEU  15          1HD2      LEU  15   5.129 -20.263   6.587
  123   HD23  LEU  15          2HD2      LEU  15   4.045 -20.849   7.848
  124    H    ALA  16           H        ALA  16   3.291 -18.698   2.358
  125    HA   ALA  16           HA       ALA  16   5.005 -20.727   1.328
  126    HB1  ALA  16           1HB      ALA  16   3.024 -21.000   0.304
  127    HB2  ALA  16           2HB      ALA  16   2.606 -19.290   0.427
  128    HB3  ALA  16           3HB      ALA  16   3.676 -19.846  -0.860
  129    H    SER  17           H        SER  17   4.739 -17.244   0.854
  130    HA   SER  17           HA       SER  17   6.554 -17.062  -1.310
  131    HB2  SER  17           1HB      SER  17   5.542 -15.065   0.707
  132    HB3  SER  17           2HB      SER  17   6.724 -14.620  -0.524
  133    HG   SER  17           HG       SER  17   5.154 -15.478  -2.070
  134    H    ALA  18           H        ALA  18   6.950 -16.881   2.190
  135    HA   ALA  18           HA       ALA  18   9.755 -16.252   2.030
  136    HB1  ALA  18           1HB      ALA  18   8.194 -17.192   4.430
  137    HB2  ALA  18           2HB      ALA  18   9.749 -16.359   4.424
  138    HB3  ALA  18           3HB      ALA  18   8.293 -15.512   3.902
  139    H    GLU  19           H        GLU  19   7.792 -19.129   2.519
  140    HA   GLU  19           HA       GLU  19   9.882 -20.861   3.302
  141    HB2  GLU  19           1HB      GLU  19   7.618 -21.513   3.728
  142    HB3  GLU  19           2HB      GLU  19   7.200 -21.388   2.025
  143    HG2  GLU  19           1HG      GLU  19   8.383 -23.333   1.475
  144    HG3  GLU  19           2HG      GLU  19   9.254 -23.337   3.008
  145    H    ARG  20           H        ARG  20   8.323 -20.350   0.140
  146    HA   ARG  20           HA       ARG  20   9.825 -22.135  -1.354
  147    HB2  ARG  20           1HB      ARG  20   7.819 -20.447  -1.937
  148    HB3  ARG  20           2HB      ARG  20   9.156 -19.542  -2.632
  149    HG2  ARG  20           1HG      ARG  20   9.517 -21.066  -4.279
  150    HG3  ARG  20           2HG      ARG  20   8.957 -22.422  -3.299
  151    HD2  ARG  20           1HD      ARG  20   7.147 -20.283  -4.405
  152    HD3  ARG  20           2HD      ARG  20   7.462 -21.817  -5.215
  153    HE   ARG  20           HE       ARG  20   6.627 -22.393  -2.624
  154   HH11  ARG  20          1HH1      ARG  20   5.351 -20.941  -5.519
  155   HH12  ARG  20          2HH1      ARG  20   3.715 -21.406  -5.188
  156   HH21  ARG  20          1HH2      ARG  20   4.477 -23.012  -2.177
  157   HH22  ARG  20          2HH2      ARG  20   3.219 -22.584  -3.287
  158    H    ALA  21           H        ALA  21  10.516 -18.745  -0.580
  159    HA   ALA  21           HA       ALA  21  12.891 -18.550  -2.093
  160    HB1  ALA  21           1HB      ALA  21  12.187 -16.465  -1.559
  161    HB2  ALA  21           2HB      ALA  21  11.579 -16.954   0.023
  162    HB3  ALA  21           3HB      ALA  21  13.307 -16.694  -0.216
  163    H    HIS  22           H        HIS  22  12.355 -19.189   1.368
  164    HA   HIS  22           HA       HIS  22  15.021 -19.417   2.138
  165    HB2  HIS  22           1HB      HIS  22  12.441 -20.008   3.274
  166    HB3  HIS  22           2HB      HIS  22  13.577 -21.295   3.665
  167    HD1  HIS  22           HD1      HIS  22  12.629 -17.881   4.584
  168    HD2  HIS  22           HD2      HIS  22  15.921 -20.363   5.093
  169    HE1  HIS  22           HE1      HIS  22  13.989 -16.825   6.416
  170    H    LYS  23           H        LYS  23  12.769 -22.008   1.184
  171    HA   LYS  23           HA       LYS  23  14.570 -24.130   1.343
  172    HB2  LYS  23           1HB      LYS  23  11.999 -24.110   0.942
  173    HB3  LYS  23           2HB      LYS  23  12.430 -24.032  -0.761
  174    HG2  LYS  23           1HG      LYS  23  12.103 -26.302  -0.325
  175    HG3  LYS  23           2HG      LYS  23  13.856 -26.095  -0.332
  176    HD2  LYS  23           1HD      LYS  23  13.876 -26.025   2.100
  177    HD3  LYS  23           2HD      LYS  23  12.116 -26.161   2.134
  178    HE2  LYS  23           1HE      LYS  23  12.305 -28.373   2.118
  179    HE3  LYS  23           2HE      LYS  23  13.094 -28.284   0.545
  180    HZ1  LYS  23           3HZ      LYS  23  15.061 -27.616   2.301
  181    HZ2  LYS  23           1HZ      LYS  23  14.856 -29.130   1.576
  182    HZ3  LYS  23           2HZ      LYS  23  14.222 -28.838   3.116
  183    H    ASP  24           H        ASP  24  13.697 -22.135  -1.472
  184    HA   ASP  24           HA       ASP  24  15.321 -23.364  -3.360
  185    HB2  ASP  24           1HB      ASP  24  13.617 -21.662  -3.900
  186    HB3  ASP  24           2HB      ASP  24  14.635 -20.424  -3.170
  187    H    LEU  25           H        LEU  25  16.078 -20.531  -1.335
  188    HA   LEU  25           HA       LEU  25  18.710 -20.180  -2.200
  189    HB2  LEU  25           1HB      LEU  25  17.321 -18.608  -0.809
  190    HB3  LEU  25           2HB      LEU  25  17.698 -19.625   0.580
  191    HG   LEU  25           HG       LEU  25  20.186 -19.116  -0.226
  192   HD11  LEU  25          1HD1      LEU  25  18.532 -17.237  -1.694
  193   HD12  LEU  25          2HD1      LEU  25  20.244 -17.620  -1.873
  194   HD13  LEU  25          3HD1      LEU  25  19.728 -16.432  -0.677
  195   HD21  LEU  25          3HD2      LEU  25  19.384 -18.681   1.995
  196   HD22  LEU  25          1HD2      LEU  25  18.424 -17.314   1.429
  197   HD23  LEU  25          2HD2      LEU  25  20.185 -17.229   1.392
  198    H    ASP  26           H        ASP  26  17.480 -21.968   0.620
  199    HA   ASP  26           HA       ASP  26  19.877 -22.843   1.677
  200    HB2  ASP  26           1HB      ASP  26  17.343 -23.211   2.398
  201    HB3  ASP  26           2HB      ASP  26  17.600 -24.767   1.614
  202    H    LEU  27           H        LEU  27  17.867 -24.478  -0.766
  203    HA   LEU  27           HA       LEU  27  19.521 -26.694  -1.161
  204    HB2  LEU  27           1HB      LEU  27  17.193 -25.571  -2.353
  205    HB3  LEU  27           2HB      LEU  27  18.323 -25.998  -3.636
  206    HG   LEU  27           HG       LEU  27  16.804 -27.823  -3.287
  207   HD11  LEU  27          1HD1      LEU  27  19.216 -28.857  -1.903
  208   HD12  LEU  27          2HD1      LEU  27  19.426 -28.116  -3.489
  209   HD13  LEU  27          3HD1      LEU  27  18.346 -29.496  -3.297
  210   HD21  LEU  27          3HD2      LEU  27  16.118 -28.614  -1.291
  211   HD22  LEU  27          1HD2      LEU  27  16.634 -27.027  -0.719
  212   HD23  LEU  27          2HD2      LEU  27  17.705 -28.418  -0.545
  213    H    ALA  28           H        ALA  28  19.439 -23.576  -2.859
  214    HA   ALA  28           HA       ALA  28  21.378 -24.067  -4.780
  215    HB1  ALA  28           1HB      ALA  28  20.820 -21.474  -3.344
  216    HB2  ALA  28           2HB      ALA  28  21.697 -21.642  -4.865
  217    HB3  ALA  28           3HB      ALA  28  19.988 -22.068  -4.781
  218    H    LYS  29           H        LYS  29  21.838 -22.607  -1.558
  219    HA   LYS  29           HA       LYS  29  24.616 -22.366  -1.677
  220    HB2  LYS  29           1HB      LYS  29  22.602 -22.487   0.515
  221    HB3  LYS  29           2HB      LYS  29  24.296 -22.683   0.948
  222    HG2  LYS  29           1HG      LYS  29  23.970 -20.449  -0.830
  223    HG3  LYS  29           2HG      LYS  29  22.901 -20.297   0.567
  224    HD2  LYS  29           1HD      LYS  29  24.651 -20.220   2.065
  225    HD3  LYS  29           2HD      LYS  29  25.749 -21.087   0.988
  226    HE2  LYS  29           1HE      LYS  29  26.442 -19.201  -0.016
  227    HE3  LYS  29           2HE      LYS  29  24.820 -18.512  -0.055
  228    HZ1  LYS  29           3HZ      LYS  29  25.049 -17.855   2.235
  229    HZ2  LYS  29           1HZ      LYS  29  26.355 -17.243   1.349
  230    HZ3  LYS  29           2HZ      LYS  29  26.567 -18.594   2.345
  231    H    ALA  30           H        ALA  30  22.627 -25.006  -0.365
  232    HA   ALA  30           HA       ALA  30  24.692 -26.647   0.533
  233    HB1  ALA  30           1HB      ALA  30  22.971 -27.892   1.170
  234    HB2  ALA  30           2HB      ALA  30  21.893 -26.831   0.262
  235    HB3  ALA  30           3HB      ALA  30  22.578 -28.261  -0.509
  236    H    SER  31           H        SER  31  23.158 -26.458  -2.657
  237    HA   SER  31           HA       SER  31  24.518 -28.627  -3.823
  238    HB2  SER  31           1HB      SER  31  22.513 -26.999  -4.642
  239    HB3  SER  31           2HB      SER  31  23.851 -26.347  -5.588
  240    HG   SER  31           HG       SER  31  24.239 -28.655  -6.148
  241    H    ALA  32           H        ALA  32  25.212 -25.138  -3.919
  242    HA   ALA  32           HA       ALA  32  27.530 -25.261  -5.470
  243    HB1  ALA  32           1HB      ALA  32  28.072 -23.109  -4.013
  244    HB2  ALA  32           2HB      ALA  32  26.827 -23.109  -5.263
  245    HB3  ALA  32           3HB      ALA  32  26.376 -23.300  -3.568
  246    H    THR  33           H        THR  33  27.141 -25.388  -1.943
  247    HA   THR  33           HA       THR  33  29.874 -25.500  -1.298
  248    HB   THR  33           HB       THR  33  27.645 -26.788   0.284
  249    HG1  THR  33           HG1      THR  33  28.438 -24.079   0.024
  250   HG21  THR  33          3HG2      THR  33  30.322 -25.634   1.075
  251   HG22  THR  33          1HG2      THR  33  29.860 -27.335   1.100
  252   HG23  THR  33          2HG2      THR  33  29.092 -26.196   2.206
  253    H    ASP  34           H        ASP  34  27.494 -28.096  -1.782
  254    HA   ASP  34           HA       ASP  34  29.147 -30.264  -1.210
  255    HB2  ASP  34           1HB      ASP  34  26.638 -30.283  -1.605
  256    HB3  ASP  34           2HB      ASP  34  26.997 -30.275  -3.329
  257    H    GLN  35           H        GLN  35  28.541 -28.652  -4.318
  258    HA   GLN  35           HA       GLN  35  30.162 -30.310  -5.892
  259    HB2  GLN  35           1HB      GLN  35  28.883 -27.679  -6.175
  260    HB3  GLN  35           2HB      GLN  35  30.330 -27.889  -7.152
  261    HG2  GLN  35           1HG      GLN  35  29.396 -29.821  -8.222
  262    HG3  GLN  35           2HG      GLN  35  27.997 -29.788  -7.150
  263   HE21  GLN  35          2HE2      GLN  35  27.588 -29.828  -9.814
  264   HE22  GLN  35          1HE2      GLN  35  27.004 -28.297 -10.361
  265    H    LEU  36           H        LEU  36  30.906 -27.134  -4.454
  266    HA   LEU  36           HA       LEU  36  33.543 -26.922  -5.259
  267    HB2  LEU  36           1HB      LEU  36  32.140 -25.195  -4.082
  268    HB3  LEU  36           2HB      LEU  36  32.501 -26.037  -2.576
  269    HG   LEU  36           HG       LEU  36  34.998 -25.580  -3.647
  270   HD11  LEU  36          1HD1      LEU  36  34.038 -24.140  -5.374
  271   HD12  LEU  36          2HD1      LEU  36  35.044 -23.223  -4.253
  272   HD13  LEU  36          3HD1      LEU  36  33.287 -23.144  -4.128
  273   HD21  LEU  36          3HD2      LEU  36  35.176 -23.880  -1.880
  274   HD22  LEU  36          1HD2      LEU  36  34.380 -25.348  -1.314
  275   HD23  LEU  36          2HD2      LEU  36  33.422 -23.915  -1.686
  276    H    LYS  37           H        LYS  37  32.261 -28.428  -2.307
  277    HA   LYS  37           HA       LYS  37  34.736 -29.179  -1.209
  278    HB2  LYS  37           1HB      LYS  37  32.535 -29.151  -0.007
  279    HB3  LYS  37           2HB      LYS  37  32.099 -30.618  -0.874
  280    HG2  LYS  37           1HG      LYS  37  32.852 -31.419   1.157
  281    HG3  LYS  37           2HG      LYS  37  34.273 -31.583   0.123
  282    HD2  LYS  37           1HD      LYS  37  35.452 -30.221   1.431
  283    HD3  LYS  37           2HD      LYS  37  34.207 -28.974   1.337
  284    HE2  LYS  37           1HE      LYS  37  33.233 -29.608   3.294
  285    HE3  LYS  37           2HE      LYS  37  33.661 -31.305   3.083
  286    HZ1  LYS  37           3HZ      LYS  37  35.684 -31.010   4.042
  287    HZ2  LYS  37           1HZ      LYS  37  34.842 -29.793   4.861
  288    HZ3  LYS  37           2HZ      LYS  37  35.831 -29.400   3.546
  289    H    LYS  38           H        LYS  38  32.454 -30.996  -3.242
  290    HA   LYS  38           HA       LYS  38  33.811 -33.416  -3.339
  291    HB2  LYS  38           1HB      LYS  38  31.859 -32.025  -5.096
  292    HB3  LYS  38           2HB      LYS  38  32.735 -33.382  -5.794
  293    HG2  LYS  38           1HG      LYS  38  31.693 -34.911  -4.482
  294    HG3  LYS  38           2HG      LYS  38  31.507 -33.791  -3.131
  295    HD2  LYS  38           1HD      LYS  38  29.605 -32.811  -4.044
  296    HD3  LYS  38           2HD      LYS  38  29.976 -33.380  -5.673
  297    HE2  LYS  38           1HE      LYS  38  29.674 -35.740  -4.643
  298    HE3  LYS  38           2HE      LYS  38  28.826 -34.886  -3.355
  299    HZ1  LYS  38           3HZ      LYS  38  27.688 -33.835  -5.537
  300    HZ2  LYS  38           1HZ      LYS  38  27.067 -35.163  -4.692
  301    HZ3  LYS  38           2HZ      LYS  38  28.003 -35.407  -6.078
  302    H    ALA  39           H        ALA  39  34.007 -30.732  -5.681
  303    HA   ALA  39           HA       ALA  39  35.990 -31.797  -7.311
  304    HB1  ALA  39           1HB      ALA  39  34.978 -29.070  -6.750
  305    HB2  ALA  39           2HB      ALA  39  36.532 -29.203  -7.576
  306    HB3  ALA  39           3HB      ALA  39  35.095 -29.947  -8.276
  307    H    LYS  40           H        LYS  40  36.350 -29.644  -4.499
  308    HA   LYS  40           HA       LYS  40  39.120 -29.400  -4.536
  309    HB2  LYS  40           1HB      LYS  40  36.984 -29.048  -2.532
  310    HB3  LYS  40           2HB      LYS  40  38.586 -29.341  -1.868
  311    HG2  LYS  40           1HG      LYS  40  39.338 -27.472  -3.490
  312    HG3  LYS  40           2HG      LYS  40  37.622 -27.058  -3.537
  313    HD2  LYS  40           1HD      LYS  40  38.181 -25.774  -1.760
  314    HD3  LYS  40           2HD      LYS  40  37.964 -27.289  -0.880
  315    HE2  LYS  40           1HE      LYS  40  40.063 -27.097  -0.175
  316    HE3  LYS  40           2HE      LYS  40  40.589 -27.351  -1.838
  317    HZ1  LYS  40           3HZ      LYS  40  40.754 -25.010  -0.263
  318    HZ2  LYS  40           1HZ      LYS  40  39.838 -24.695  -1.650
  319    HZ3  LYS  40           2HZ      LYS  40  41.408 -25.309  -1.795
  320    H    ALA  41           H        ALA  41  37.197 -31.645  -2.534
  321    HA   ALA  41           HA       ALA  41  39.285 -33.097  -1.450
  322    HB1  ALA  41           1HB      ALA  41  37.358 -35.005  -1.724
  323    HB2  ALA  41           2HB      ALA  41  37.422 -33.808  -0.429
  324    HB3  ALA  41           3HB      ALA  41  36.416 -33.518  -1.849
  325    H    GLU  42           H        GLU  42  37.538 -33.685  -4.488
  326    HA   GLU  42           HA       GLU  42  38.876 -36.043  -5.208
  327    HB2  GLU  42           1HB      GLU  42  36.766 -34.920  -6.231
  328    HB3  GLU  42           2HB      GLU  42  37.915 -34.059  -7.245
  329    HG2  GLU  42           1HG      GLU  42  37.851 -35.779  -8.632
  330    HG3  GLU  42           2HG      GLU  42  38.695 -36.720  -7.405
  331    H    ALA  43           H        ALA  43  39.670 -32.654  -5.716
  332    HA   ALA  43           HA       ALA  43  42.059 -33.373  -7.235
  333    HB1  ALA  43           1HB      ALA  43  42.270 -31.061  -7.760
  334    HB2  ALA  43           2HB      ALA  43  40.568 -31.487  -7.947
  335    HB3  ALA  43           3HB      ALA  43  41.106 -30.609  -6.514
  336    H    GLN  44           H        GLN  44  41.518 -33.688  -4.201
  337    HA   GLN  44           HA       GLN  44  43.423 -31.978  -2.932
  338    HB2  GLN  44           1HB      GLN  44  41.491 -33.000  -1.749
  339    HB3  GLN  44           2HB      GLN  44  42.246 -34.577  -1.934
  340    HG2  GLN  44           1HG      GLN  44  43.708 -34.222  -0.270
  341    HG3  GLN  44           2HG      GLN  44  43.934 -32.525  -0.687
  342   HE21  GLN  44          2HE2      GLN  44  42.083 -31.084  -0.152
  343   HE22  GLN  44          1HE2      GLN  44  41.246 -31.376   1.330
  344    H    VAL  45           H        VAL  45  43.472 -35.261  -4.211
  345    HA   VAL  45           HA       VAL  45  46.167 -35.750  -3.287
  346    HB   VAL  45           HB       VAL  45  44.471 -37.374  -5.189
  347   HG11  VAL  45          1HG1      VAL  45  47.138 -37.806  -3.919
  348   HG12  VAL  45          2HG1      VAL  45  46.092 -39.189  -4.245
  349   HG13  VAL  45          3HG1      VAL  45  46.610 -38.143  -5.567
  350   HG21  VAL  45          3HG2      VAL  45  44.905 -37.687  -2.219
  351   HG22  VAL  45          1HG2      VAL  45  43.417 -37.153  -3.000
  352   HG23  VAL  45          2HG2      VAL  45  44.004 -38.797  -3.251
  353    H    ILE  46           H        ILE  46  44.551 -35.003  -6.338
  354    HA   ILE  46           HA       ILE  46  47.203 -34.578  -7.553
  355    HB   ILE  46           HB       ILE  46  44.657 -35.331  -8.992
  356   HG12  ILE  46          1HG1      ILE  46  46.419 -37.360  -9.446
  357   HG13  ILE  46          2HG1      ILE  46  46.831 -36.923  -7.791
  358   HG21  ILE  46          1HG2      ILE  46  46.661 -35.829 -10.726
  359   HG22  ILE  46          2HG2      ILE  46  45.756 -34.318 -10.677
  360   HG23  ILE  46          3HG2      ILE  46  47.319 -34.435  -9.870
  361   HD11  ILE  46          3HD1      ILE  46  44.165 -37.023  -7.575
  362   HD12  ILE  46          1HD1      ILE  46  44.405 -38.194  -8.871
  363   HD13  ILE  46          2HD1      ILE  46  45.217 -38.415  -7.321
  364    H    ILE  47           H        ILE  47  47.564 -32.703  -8.677
  365    HA   ILE  47           HA       ILE  47  45.998 -30.443  -7.987
  366    HB   ILE  47           HB       ILE  47  47.495 -29.156  -9.394
  367   HG12  ILE  47          1HG1      ILE  47  49.352 -31.067 -10.316
  368   HG13  ILE  47          2HG1      ILE  47  47.764 -31.669 -10.778
  369   HG21  ILE  47          1HG2      ILE  47  49.474 -29.506  -8.198
  370   HG22  ILE  47          2HG2      ILE  47  48.209 -30.132  -7.141
  371   HG23  ILE  47          3HG2      ILE  47  49.203 -31.244  -8.083
  372   HD11  ILE  47          3HD1      ILE  47  47.619 -29.030 -11.475
  373   HD12  ILE  47          1HD1      ILE  47  49.299 -29.433 -11.828
  374   HD13  ILE  47          2HD1      ILE  47  47.995 -30.365 -12.564
  375    H    GLU  48           H        GLU  48  44.646 -29.164  -9.224
  376    HA   GLU  48           HA       GLU  48  44.141 -29.524 -11.971
  377    HB2  GLU  48           1HB      GLU  48  43.128 -31.638 -10.785
  378    HB3  GLU  48           2HB      GLU  48  41.827 -30.533 -10.364
  379    HG2  GLU  48           1HG      GLU  48  41.214 -30.211 -12.583
  380    HG3  GLU  48           2HG      GLU  48  42.755 -30.811 -13.194
  381    H    GLN  49           H        GLN  49  44.299 -27.257 -11.798
  382    HA   GLN  49           HA       GLN  49  42.344 -25.813 -10.227
  383    HB2  GLN  49           1HB      GLN  49  44.780 -25.146 -11.751
  384    HB3  GLN  49           2HB      GLN  49  43.532 -23.908 -11.756
  385    HG2  GLN  49           1HG      GLN  49  43.968 -23.318  -9.660
  386    HG3  GLN  49           2HG      GLN  49  43.990 -24.992  -9.108
  387   HE21  GLN  49          2HE2      GLN  49  45.911 -22.489 -10.660
  388   HE22  GLN  49          1HE2      GLN  49  47.448 -23.102 -10.163
  389    H    ALA  50           H        ALA  50  40.434 -26.626 -11.262
  390    HA   ALA  50           HA       ALA  50  39.711 -25.036 -13.594
  391    HB1  ALA  50           1HB      ALA  50  39.761 -28.028 -13.550
  392    HB2  ALA  50           2HB      ALA  50  38.602 -27.163 -14.560
  393    HB3  ALA  50           3HB      ALA  50  40.332 -26.919 -14.797
  394    H    ASN  51           H        ASN  51  37.781 -24.146 -13.279
  395    HA   ASN  51           HA       ASN  51  35.697 -25.602 -11.864
  396    HB2  ASN  51           1HB      ASN  51  35.275 -23.406 -10.518
  397    HB3  ASN  51           2HB      ASN  51  36.505 -24.536  -9.961
  398   HD21  ASN  51          2HD2      ASN  51  38.703 -24.042 -10.325
  399   HD22  ASN  51          1HD2      ASN  51  39.216 -22.412 -10.583
  400    H    LYS  52           H        LYS  52  34.351 -25.607 -13.595
  401    HA   LYS  52           HA       LYS  52  33.868 -23.169 -15.096
  402    HB2  LYS  52           1HB      LYS  52  34.020 -25.540 -16.081
  403    HB3  LYS  52           2HB      LYS  52  32.401 -25.777 -15.434
  404    HG2  LYS  52           1HG      LYS  52  31.455 -24.605 -17.076
  405    HG3  LYS  52           2HG      LYS  52  32.666 -23.324 -16.983
  406    HD2  LYS  52           1HD      LYS  52  33.000 -24.211 -19.106
  407    HD3  LYS  52           2HD      LYS  52  34.225 -25.033 -18.137
  408    HE2  LYS  52           1HE      LYS  52  31.897 -26.592 -17.950
  409    HE3  LYS  52           2HE      LYS  52  32.048 -26.141 -19.647
  410    HZ1  LYS  52           3HZ      LYS  52  33.599 -27.988 -18.123
  411    HZ2  LYS  52           1HZ      LYS  52  34.579 -26.846 -18.896
  412    HZ3  LYS  52           2HZ      LYS  52  33.506 -27.791 -19.800
  413    H    ARG  53           H        ARG  53  32.152 -21.859 -14.885
  414    HA   ARG  53           HA       ARG  53  30.251 -20.925 -14.055
  415    HB2  ARG  53           1HB      ARG  53  29.355 -23.132 -15.060
  416    HB3  ARG  53           2HB      ARG  53  29.247 -23.680 -13.392
  417    HG2  ARG  53           1HG      ARG  53  27.861 -21.598 -12.955
  418    HG3  ARG  53           2HG      ARG  53  27.770 -21.425 -14.709
  419    HD2  ARG  53           1HD      ARG  53  26.119 -22.906 -14.781
  420    HD3  ARG  53           2HD      ARG  53  27.164 -24.121 -14.046
  421    HE   ARG  53           HE       ARG  53  26.067 -23.807 -12.065
  422   HH11  ARG  53          1HH1      ARG  53  25.393 -21.118 -14.171
  423   HH12  ARG  53          2HH1      ARG  53  24.204 -20.425 -13.120
  424   HH21  ARG  53          1HH2      ARG  53  24.503 -22.904 -10.672
  425   HH22  ARG  53          2HH2      ARG  53  23.699 -21.440 -11.129
  Start of MODEL    8
    1    H1   MET   1           H        MET   1  -1.006 -22.772  18.235
    2    HA   MET   1           HA       MET   1  -1.148 -20.599  16.426
    3    HB2  MET   1           1HB      MET   1  -1.100 -23.127  15.928
    4    HB3  MET   1           2HB      MET   1  -2.834 -23.082  16.217
    5    HG2  MET   1           1HG      MET   1  -2.829 -21.171  14.476
    6    HG3  MET   1           2HG      MET   1  -1.252 -21.814  14.026
    7    HE1  MET   1           3HE      MET   1  -1.960 -23.410  11.333
    8    HE2  MET   1           1HE      MET   1  -3.556 -22.664  11.244
    9    HE3  MET   1           2HE      MET   1  -2.189 -21.747  11.878
   10    H    ALA   2           H        ALA   2  -2.337 -18.875  17.056
   11    HA   ALA   2           HA       ALA   2  -5.171 -19.040  16.905
   12    HB1  ALA   2           1HB      ALA   2  -4.029 -18.448  19.634
   13    HB2  ALA   2           2HB      ALA   2  -5.729 -18.358  19.174
   14    HB3  ALA   2           3HB      ALA   2  -4.897 -19.913  19.177
   15    H    ALA   3           H        ALA   3  -3.855 -17.544  15.314
   16    HA   ALA   3           HA       ALA   3  -2.889 -15.058  16.078
   17    HB1  ALA   3           1HB      ALA   3  -3.810 -14.393  13.711
   18    HB2  ALA   3           2HB      ALA   3  -2.464 -15.522  13.874
   19    HB3  ALA   3           3HB      ALA   3  -4.093 -16.129  13.572
   20    H    ILE   4           H        ILE   4  -3.948 -13.761  17.455
   21    HA   ILE   4           HA       ILE   4  -6.779 -13.527  17.563
   22    HB   ILE   4           HB       ILE   4  -4.699 -11.665  18.716
   23   HG12  ILE   4          1HG1      ILE   4  -5.892 -13.288  20.703
   24   HG13  ILE   4          2HG1      ILE   4  -5.418 -14.363  19.392
   25   HG21  ILE   4          1HG2      ILE   4  -7.644 -11.810  18.887
   26   HG22  ILE   4          2HG2      ILE   4  -6.781 -11.494  20.391
   27   HG23  ILE   4          3HG2      ILE   4  -6.565 -10.421  19.009
   28   HD11  ILE   4          3HD1      ILE   4  -3.195 -13.964  19.686
   29   HD12  ILE   4          1HD1      ILE   4  -3.456 -12.350  20.346
   30   HD13  ILE   4          2HD1      ILE   4  -3.770 -13.772  21.342
   31    H    GLU   5           H        GLU   5  -4.210 -11.518  16.186
   32    HA   GLU   5           HA       GLU   5  -6.221  -9.707  15.069
   33    HB2  GLU   5           1HB      GLU   5  -4.084  -8.925  16.293
   34    HB3  GLU   5           2HB      GLU   5  -3.245  -9.368  14.813
   35    HG2  GLU   5           1HG      GLU   5  -3.634  -7.140  14.467
   36    HG3  GLU   5           2HG      GLU   5  -5.032  -7.862  13.671
   37    H    LYS   6           H        LYS   6  -6.974 -11.315  13.545
   38    HA   LYS   6           HA       LYS   6  -5.118 -11.940  11.366
   39    HB2  LYS   6           1HB      LYS   6  -7.340 -13.305  12.579
   40    HB3  LYS   6           2HB      LYS   6  -7.649 -13.088  10.861
   41    HG2  LYS   6           1HG      LYS   6  -5.876 -14.405  10.234
   42    HG3  LYS   6           2HG      LYS   6  -4.999 -14.129  11.740
   43    HD2  LYS   6           1HD      LYS   6  -5.712 -16.217  12.221
   44    HD3  LYS   6           2HD      LYS   6  -7.193 -15.378  12.688
   45    HE2  LYS   6           1HE      LYS   6  -6.999 -16.037   9.834
   46    HE3  LYS   6           2HE      LYS   6  -7.059 -17.434  10.908
   47    HZ1  LYS   6           3HZ      LYS   6  -8.980 -15.294  11.400
   48    HZ2  LYS   6           1HZ      LYS   6  -9.164 -16.969  11.550
   49    HZ3  LYS   6           2HZ      LYS   6  -9.229 -16.245  10.023
   50    H    ARG   7           H        ARG   7  -5.181 -10.880   9.496
   51    HA   ARG   7           HA       ARG   7  -7.165  -8.817   9.093
   52    HB2  ARG   7           1HB      ARG   7  -4.583  -9.584   7.830
   53    HB3  ARG   7           2HB      ARG   7  -5.729  -8.683   6.847
   54    HG2  ARG   7           1HG      ARG   7  -4.716  -6.894   7.731
   55    HG3  ARG   7           2HG      ARG   7  -5.755  -7.218   9.120
   56    HD2  ARG   7           1HD      ARG   7  -4.046  -8.046  10.379
   57    HD3  ARG   7           2HD      ARG   7  -3.172  -8.666   8.979
   58    HE   ARG   7           HE       ARG   7  -3.252  -5.792   9.147
   59   HH11  ARG   7          1HH1      ARG   7  -1.557  -8.687  10.076
   60   HH12  ARG   7          2HH1      ARG   7  -0.045  -7.879  10.327
   61   HH21  ARG   7          1HH2      ARG   7  -1.267  -4.716   9.474
   62   HH22  ARG   7          2HH2      ARG   7   0.118  -5.619   9.985
   63    H    GLN   8           H        GLN   8  -5.878 -11.139   6.729
   64    HA   GLN   8           HA       GLN   8  -8.579 -12.025   6.090
   65    HB2  GLN   8           1HB      GLN   8  -7.219 -10.058   4.552
   66    HB3  GLN   8           2HB      GLN   8  -7.259 -11.539   3.605
   67    HG2  GLN   8           1HG      GLN   8  -9.824 -11.226   4.712
   68    HG3  GLN   8           2HG      GLN   8  -9.340  -9.649   4.091
   69   HE21  GLN   8          2HE2      GLN   8  -8.074  -9.988   1.879
   70   HE22  GLN   8          1HE2      GLN   8  -8.957 -10.914   0.719
   71    H    LYS   9           H        LYS   9  -5.333 -12.193   4.617
   72    HA   LYS   9           HA       LYS   9  -4.860 -14.873   5.366
   73    HB2  LYS   9           1HB      LYS   9  -6.738 -15.068   3.616
   74    HB3  LYS   9           2HB      LYS   9  -5.516 -14.606   2.440
   75    HG2  LYS   9           1HG      LYS   9  -5.722 -16.995   2.473
   76    HG3  LYS   9           2HG      LYS   9  -4.154 -16.542   3.147
   77    HD2  LYS   9           1HD      LYS   9  -4.626 -17.577   5.059
   78    HD3  LYS   9           2HD      LYS   9  -6.122 -16.656   5.234
   79    HE2  LYS   9           1HE      LYS   9  -5.886 -19.070   3.454
   80    HE3  LYS   9           2HE      LYS   9  -6.352 -19.178   5.150
   81    HZ1  LYS   9           3HZ      LYS   9  -7.904 -17.199   3.899
   82    HZ2  LYS   9           1HZ      LYS   9  -8.414 -18.653   4.597
   83    HZ3  LYS   9           2HZ      LYS   9  -7.979 -18.606   2.963
   84    H    GLU  10           H        GLU  10  -3.327 -12.618   5.504
   85    HA   GLU  10           HA       GLU  10  -1.519 -12.441   3.279
   86    HB2  GLU  10           1HB      GLU  10  -1.645 -11.221   6.013
   87    HB3  GLU  10           2HB      GLU  10  -0.160 -11.113   5.079
   88    HG2  GLU  10           1HG      GLU  10  -0.983  -9.539   3.736
   89    HG3  GLU  10           2HG      GLU  10  -2.526 -10.371   3.555
   90    H    ILE  11           H        ILE  11  -1.552 -14.032   6.414
   91    HA   ILE  11           HA       ILE  11   1.105 -14.787   6.635
   92    HB   ILE  11           HB       ILE  11   0.334 -16.674   8.004
   93   HG12  ILE  11          1HG1      ILE  11  -2.363 -16.470   8.265
   94   HG13  ILE  11          2HG1      ILE  11  -2.179 -16.131   6.548
   95   HG21  ILE  11          1HG2      ILE  11  -0.887 -13.970   8.381
   96   HG22  ILE  11          2HG2      ILE  11  -1.193 -15.260   9.543
   97   HG23  ILE  11          3HG2      ILE  11   0.458 -14.719   9.241
   98   HD11  ILE  11          3HD1      ILE  11  -1.873 -18.274   6.099
   99   HD12  ILE  11          1HD1      ILE  11  -0.597 -18.407   7.308
  100   HD13  ILE  11          2HD1      ILE  11  -2.283 -18.621   7.778
  101    H    ALA  12           H        ALA  12  -1.457 -16.159   4.674
  102    HA   ALA  12           HA       ALA  12  -0.183 -18.571   3.972
  103    HB1  ALA  12           1HB      ALA  12  -2.023 -17.152   2.091
  104    HB2  ALA  12           2HB      ALA  12  -1.885 -18.876   2.437
  105    HB3  ALA  12           3HB      ALA  12  -2.634 -17.798   3.615
  106    H    ASP  13           H        ASP  13  -0.413 -15.496   2.180
  107    HA   ASP  13           HA       ASP  13   1.233 -16.226   0.044
  108    HB2  ASP  13           1HB      ASP  13   0.131 -13.737   1.132
  109    HB3  ASP  13           2HB      ASP  13   1.666 -13.522   0.296
  110    H    GLY  14           H        GLY  14   2.043 -14.587   3.093
  111    HA2  GLY  14           1HA      GLY  14   4.802 -14.282   2.519
  112    HA3  GLY  14           2HA      GLY  14   4.064 -14.196   4.112
  113    H    LEU  15           H        LEU  15   2.937 -16.906   3.888
  114    HA   LEU  15           HA       LEU  15   5.133 -18.329   4.994
  115    HB2  LEU  15           1HB      LEU  15   2.285 -18.891   4.408
  116    HB3  LEU  15           2HB      LEU  15   3.355 -20.280   4.585
  117    HG   LEU  15           HG       LEU  15   3.093 -18.133   6.680
  118   HD11  LEU  15          1HD1      LEU  15   1.433 -19.324   7.763
  119   HD12  LEU  15          2HD1      LEU  15   1.759 -20.803   6.860
  120   HD13  LEU  15          3HD1      LEU  15   0.949 -19.450   6.072
  121   HD21  LEU  15          3HD2      LEU  15   3.796 -20.826   7.497
  122   HD22  LEU  15          1HD2      LEU  15   4.600 -19.294   7.837
  123   HD23  LEU  15          2HD2      LEU  15   4.945 -20.156   6.338
  124    H    ALA  16           H        ALA  16   3.282 -18.748   1.981
  125    HA   ALA  16           HA       ALA  16   4.915 -20.842   0.983
  126    HB1  ALA  16           1HB      ALA  16   3.663 -19.419  -1.152
  127    HB2  ALA  16           2HB      ALA  16   3.255 -20.999  -0.479
  128    HB3  ALA  16           3HB      ALA  16   2.539 -19.539   0.203
  129    H    SER  17           H        SER  17   4.918 -17.339   0.549
  130    HA   SER  17           HA       SER  17   6.882 -17.261  -1.485
  131    HB2  SER  17           1HB      SER  17   6.994 -14.894  -1.067
  132    HB3  SER  17           2HB      SER  17   5.310 -15.388  -0.892
  133    HG   SER  17           HG       SER  17   6.951 -14.253   0.922
  134    H    ALA  18           H        ALA  18   7.067 -17.022   2.042
  135    HA   ALA  18           HA       ALA  18   9.906 -16.621   2.071
  136    HB1  ALA  18           1HB      ALA  18   9.723 -16.808   4.477
  137    HB2  ALA  18           2HB      ALA  18   8.436 -15.775   3.855
  138    HB3  ALA  18           3HB      ALA  18   8.082 -17.436   4.329
  139    H    GLU  19           H        GLU  19   7.762 -19.365   2.165
  140    HA   GLU  19           HA       GLU  19   9.645 -21.249   3.162
  141    HB2  GLU  19           1HB      GLU  19   7.256 -21.685   3.295
  142    HB3  GLU  19           2HB      GLU  19   7.124 -21.644   1.542
  143    HG2  GLU  19           1HG      GLU  19   7.097 -23.915   2.188
  144    HG3  GLU  19           2HG      GLU  19   8.675 -23.605   1.468
  145    H    ARG  20           H        ARG  20   8.430 -20.588  -0.122
  146    HA   ARG  20           HA       ARG  20  10.068 -22.414  -1.464
  147    HB2  ARG  20           1HB      ARG  20   8.979 -19.782  -2.481
  148    HB3  ARG  20           2HB      ARG  20   9.591 -21.094  -3.480
  149    HG2  ARG  20           1HG      ARG  20   7.591 -22.136  -1.745
  150    HG3  ARG  20           2HG      ARG  20   6.965 -20.686  -2.533
  151    HD2  ARG  20           1HD      ARG  20   7.770 -21.658  -4.711
  152    HD3  ARG  20           2HD      ARG  20   8.094 -23.154  -3.837
  153    HE   ARG  20           HE       ARG  20   5.443 -22.361  -3.351
  154   HH11  ARG  20          1HH1      ARG  20   7.451 -23.588  -5.918
  155   HH12  ARG  20          2HH1      ARG  20   6.147 -24.384  -6.734
  156   HH21  ARG  20          1HH2      ARG  20   3.718 -23.406  -4.417
  157   HH22  ARG  20          2HH2      ARG  20   4.023 -24.279  -5.880
  158    H    ALA  21           H        ALA  21  10.583 -18.986  -0.713
  159    HA   ALA  21           HA       ALA  21  13.066 -18.743  -2.033
  160    HB1  ALA  21           1HB      ALA  21  11.738 -16.800  -1.432
  161    HB2  ALA  21           2HB      ALA  21  11.964 -17.154   0.281
  162    HB3  ALA  21           3HB      ALA  21  13.346 -16.694  -0.713
  163    H    HIS  22           H        HIS  22  12.325 -19.154   1.433
  164    HA   HIS  22           HA       HIS  22  14.926 -19.342   2.372
  165    HB2  HIS  22           1HB      HIS  22  12.843 -19.190   3.767
  166    HB3  HIS  22           2HB      HIS  22  12.570 -20.900   3.449
  167    HD1  HIS  22           HD1      HIS  22  15.132 -18.639   5.090
  168    HD2  HIS  22           HD2      HIS  22  13.856 -22.592   5.157
  169    HE1  HIS  22           HE1      HIS  22  16.378 -19.715   6.991
  170    H    LYS  23           H        LYS  23  12.761 -22.009   1.426
  171    HA   LYS  23           HA       LYS  23  14.580 -24.092   1.816
  172    HB2  LYS  23           1HB      LYS  23  12.036 -24.149   1.299
  173    HB3  LYS  23           2HB      LYS  23  12.538 -24.148  -0.386
  174    HG2  LYS  23           1HG      LYS  23  14.082 -26.133   0.505
  175    HG3  LYS  23           2HG      LYS  23  12.753 -26.268   1.659
  176    HD2  LYS  23           1HD      LYS  23  11.162 -26.560  -0.097
  177    HD3  LYS  23           2HD      LYS  23  12.362 -26.160  -1.328
  178    HE2  LYS  23           1HE      LYS  23  13.623 -28.172  -0.757
  179    HE3  LYS  23           2HE      LYS  23  12.444 -28.564   0.494
  180    HZ1  LYS  23           3HZ      LYS  23  11.093 -29.464  -1.002
  181    HZ2  LYS  23           1HZ      LYS  23  12.364 -29.372  -2.114
  182    HZ3  LYS  23           2HZ      LYS  23  11.211 -28.138  -2.045
  183    H    ASP  24           H        ASP  24  13.903 -22.162  -1.082
  184    HA   ASP  24           HA       ASP  24  15.602 -23.512  -2.846
  185    HB2  ASP  24           1HB      ASP  24  13.899 -21.819  -3.511
  186    HB3  ASP  24           2HB      ASP  24  14.944 -20.559  -2.859
  187    H    LEU  25           H        LEU  25  16.232 -20.665  -0.810
  188    HA   LEU  25           HA       LEU  25  18.879 -20.232  -1.580
  189    HB2  LEU  25           1HB      LEU  25  17.483 -18.681  -0.239
  190    HB3  LEU  25           2HB      LEU  25  17.678 -19.756   1.144
  191    HG   LEU  25           HG       LEU  25  20.166 -18.769  -0.114
  192   HD11  LEU  25          1HD1      LEU  25  18.718 -16.925   1.736
  193   HD12  LEU  25          2HD1      LEU  25  18.429 -16.845  -0.001
  194   HD13  LEU  25          3HD1      LEU  25  20.054 -16.589   0.634
  195   HD21  LEU  25          3HD2      LEU  25  19.285 -19.921   2.349
  196   HD22  LEU  25          1HD2      LEU  25  20.055 -18.368   2.672
  197   HD23  LEU  25          2HD2      LEU  25  20.930 -19.618   1.788
  198    H    ASP  26           H        ASP  26  17.584 -22.176   1.098
  199    HA   ASP  26           HA       ASP  26  20.032 -23.015   2.159
  200    HB2  ASP  26           1HB      ASP  26  17.218 -23.899   2.333
  201    HB3  ASP  26           2HB      ASP  26  18.422 -25.129   2.709
  202    H    LEU  27           H        LEU  27  17.905 -24.654  -0.180
  203    HA   LEU  27           HA       LEU  27  19.518 -26.895  -0.609
  204    HB2  LEU  27           1HB      LEU  27  17.209 -26.786  -1.341
  205    HB3  LEU  27           2HB      LEU  27  17.611 -25.511  -2.489
  206    HG   LEU  27           HG       LEU  27  19.115 -27.213  -3.627
  207   HD11  LEU  27          1HD1      LEU  27  19.332 -29.260  -2.803
  208   HD12  LEU  27          2HD1      LEU  27  17.583 -29.478  -2.756
  209   HD13  LEU  27          3HD1      LEU  27  18.417 -28.742  -1.387
  210   HD21  LEU  27          3HD2      LEU  27  16.909 -28.485  -4.441
  211   HD22  LEU  27          1HD2      LEU  27  17.290 -26.829  -4.912
  212   HD23  LEU  27          2HD2      LEU  27  16.159 -27.132  -3.594
  213    H    ALA  28           H        ALA  28  19.376 -23.818  -2.382
  214    HA   ALA  28           HA       ALA  28  21.283 -24.401  -4.332
  215    HB1  ALA  28           1HB      ALA  28  20.162 -22.474  -4.818
  216    HB2  ALA  28           2HB      ALA  28  20.196 -21.900  -3.150
  217    HB3  ALA  28           3HB      ALA  28  21.645 -21.791  -4.150
  218    H    LYS  29           H        LYS  29  21.761 -22.604  -1.284
  219    HA   LYS  29           HA       LYS  29  24.503 -22.284  -1.434
  220    HB2  LYS  29           1HB      LYS  29  22.679 -21.516   0.344
  221    HB3  LYS  29           2HB      LYS  29  23.308 -22.901   1.227
  222    HG2  LYS  29           1HG      LYS  29  25.610 -21.676   0.508
  223    HG3  LYS  29           2HG      LYS  29  24.531 -20.290   0.683
  224    HD2  LYS  29           1HD      LYS  29  25.420 -20.553   2.819
  225    HD3  LYS  29           2HD      LYS  29  23.861 -21.374   2.925
  226    HE2  LYS  29           1HE      LYS  29  25.283 -22.897   3.924
  227    HE3  LYS  29           2HE      LYS  29  25.220 -23.484   2.263
  228    HZ1  LYS  29           3HZ      LYS  29  27.378 -23.078   1.975
  229    HZ2  LYS  29           1HZ      LYS  29  27.479 -22.939   3.658
  230    HZ3  LYS  29           2HZ      LYS  29  27.299 -21.554   2.704
  231    H    ALA  30           H        ALA  30  22.722 -24.928   0.158
  232    HA   ALA  30           HA       ALA  30  24.885 -26.419   1.037
  233    HB1  ALA  30           1HB      ALA  30  23.398 -28.293   1.168
  234    HB2  ALA  30           2HB      ALA  30  22.496 -26.838   1.597
  235    HB3  ALA  30           3HB      ALA  30  22.296 -27.562   0.001
  236    H    SER  31           H        SER  31  23.284 -26.459  -2.122
  237    HA   SER  31           HA       SER  31  24.764 -28.611  -3.200
  238    HB2  SER  31           1HB      SER  31  23.446 -26.316  -4.672
  239    HB3  SER  31           2HB      SER  31  23.922 -27.864  -5.370
  240    HG   SER  31           HG       SER  31  22.349 -28.875  -4.206
  241    H    ALA  32           H        ALA  32  25.311 -25.137  -3.095
  242    HA   ALA  32           HA       ALA  32  27.479 -25.052  -4.902
  243    HB1  ALA  32           1HB      ALA  32  26.164 -23.080  -4.159
  244    HB2  ALA  32           2HB      ALA  32  26.967 -23.186  -2.592
  245    HB3  ALA  32           3HB      ALA  32  27.909 -22.853  -4.046
  246    H    THR  33           H        THR  33  27.468 -24.995  -1.334
  247    HA   THR  33           HA       THR  33  30.242 -25.173  -1.007
  248    HB   THR  33           HB       THR  33  28.230 -26.318   0.929
  249    HG1  THR  33           HG1      THR  33  29.059 -23.602   0.654
  250   HG21  THR  33          3HG2      THR  33  31.018 -26.072   1.001
  251   HG22  THR  33          1HG2      THR  33  29.947 -26.464   2.345
  252   HG23  THR  33          2HG2      THR  33  30.404 -24.788   2.042
  253    H    ASP  34           H        ASP  34  27.766 -27.705  -1.153
  254    HA   ASP  34           HA       ASP  34  29.430 -29.888  -0.584
  255    HB2  ASP  34           1HB      ASP  34  26.973 -30.025  -0.571
  256    HB3  ASP  34           2HB      ASP  34  26.951 -29.810  -2.319
  257    H    GLN  35           H        GLN  35  28.504 -28.439  -3.691
  258    HA   GLN  35           HA       GLN  35  29.929 -30.251  -5.313
  259    HB2  GLN  35           1HB      GLN  35  28.186 -28.854  -6.248
  260    HB3  GLN  35           2HB      GLN  35  29.078 -27.398  -5.828
  261    HG2  GLN  35           1HG      GLN  35  30.697 -29.129  -7.449
  262    HG3  GLN  35           2HG      GLN  35  29.151 -28.810  -8.233
  263   HE21  GLN  35          2HE2      GLN  35  32.072 -27.883  -8.540
  264   HE22  GLN  35          1HE2      GLN  35  31.921 -26.174  -8.740
  265    H    LEU  36           H        LEU  36  30.809 -27.121  -3.914
  266    HA   LEU  36           HA       LEU  36  33.296 -26.818  -5.160
  267    HB2  LEU  36           1HB      LEU  36  31.849 -25.273  -3.551
  268    HB3  LEU  36           2HB      LEU  36  32.975 -25.909  -2.353
  269    HG   LEU  36           HG       LEU  36  34.680 -25.097  -4.315
  270   HD11  LEU  36          1HD1      LEU  36  32.605 -24.124  -5.460
  271   HD12  LEU  36          2HD1      LEU  36  34.012 -23.077  -5.270
  272   HD13  LEU  36          3HD1      LEU  36  32.634 -22.909  -4.182
  273   HD21  LEU  36          3HD2      LEU  36  35.426 -24.252  -2.394
  274   HD22  LEU  36          1HD2      LEU  36  33.804 -24.182  -1.707
  275   HD23  LEU  36          2HD2      LEU  36  34.392 -22.858  -2.713
  276    H    LYS  37           H        LYS  37  32.477 -28.278  -2.023
  277    HA   LYS  37           HA       LYS  37  35.102 -28.986  -1.304
  278    HB2  LYS  37           1HB      LYS  37  33.196 -28.921   0.274
  279    HB3  LYS  37           2HB      LYS  37  32.515 -30.339  -0.513
  280    HG2  LYS  37           1HG      LYS  37  35.291 -30.551   0.495
  281    HG3  LYS  37           2HG      LYS  37  33.991 -30.492   1.687
  282    HD2  LYS  37           1HD      LYS  37  33.054 -32.276  -0.201
  283    HD3  LYS  37           2HD      LYS  37  34.779 -32.639  -0.113
  284    HE2  LYS  37           1HE      LYS  37  34.579 -32.824   2.341
  285    HE3  LYS  37           2HE      LYS  37  32.845 -32.540   2.200
  286    HZ1  LYS  37           3HZ      LYS  37  33.472 -34.604   0.454
  287    HZ2  LYS  37           1HZ      LYS  37  32.591 -34.703   1.895
  288    HZ3  LYS  37           2HZ      LYS  37  34.263 -34.957   1.907
  289    H    LYS  38           H        LYS  38  32.536 -30.865  -2.892
  290    HA   LYS  38           HA       LYS  38  33.946 -33.267  -3.144
  291    HB2  LYS  38           1HB      LYS  38  31.430 -32.369  -3.828
  292    HB3  LYS  38           2HB      LYS  38  32.170 -32.672  -5.394
  293    HG2  LYS  38           1HG      LYS  38  32.445 -34.938  -4.968
  294    HG3  LYS  38           2HG      LYS  38  32.291 -34.727  -3.223
  295    HD2  LYS  38           1HD      LYS  38  30.216 -35.558  -3.664
  296    HD3  LYS  38           2HD      LYS  38  29.886 -33.845  -3.933
  297    HE2  LYS  38           1HE      LYS  38  30.008 -34.088  -6.275
  298    HE3  LYS  38           2HE      LYS  38  30.753 -35.680  -6.149
  299    HZ1  LYS  38           3HZ      LYS  38  28.087 -35.301  -4.996
  300    HZ2  LYS  38           1HZ      LYS  38  28.771 -36.678  -5.704
  301    HZ3  LYS  38           2HZ      LYS  38  28.219 -35.411  -6.679
  302    H    ALA  39           H        ALA  39  33.648 -30.544  -5.409
  303    HA   ALA  39           HA       ALA  39  35.188 -31.621  -7.482
  304    HB1  ALA  39           1HB      ALA  39  35.539 -29.212  -8.137
  305    HB2  ALA  39           2HB      ALA  39  33.859 -29.715  -7.942
  306    HB3  ALA  39           3HB      ALA  39  34.650 -28.772  -6.679
  307    H    LYS  40           H        LYS  40  36.135 -29.606  -4.719
  308    HA   LYS  40           HA       LYS  40  38.854 -29.354  -5.414
  309    HB2  LYS  40           1HB      LYS  40  37.418 -28.104  -3.620
  310    HB3  LYS  40           2HB      LYS  40  37.942 -29.405  -2.559
  311    HG2  LYS  40           1HG      LYS  40  40.194 -28.353  -3.981
  312    HG3  LYS  40           2HG      LYS  40  39.309 -27.043  -3.195
  313    HD2  LYS  40           1HD      LYS  40  40.192 -29.574  -1.811
  314    HD3  LYS  40           2HD      LYS  40  41.089 -28.054  -1.776
  315    HE2  LYS  40           1HE      LYS  40  39.317 -26.948  -0.630
  316    HE3  LYS  40           2HE      LYS  40  38.226 -28.310  -0.877
  317    HZ1  LYS  40           3HZ      LYS  40  38.989 -28.427   1.339
  318    HZ2  LYS  40           1HZ      LYS  40  40.603 -28.198   0.888
  319    HZ3  LYS  40           2HZ      LYS  40  39.813 -29.642   0.500
  320    H    ALA  41           H        ALA  41  37.350 -31.461  -2.955
  321    HA   ALA  41           HA       ALA  41  39.597 -32.935  -2.285
  322    HB1  ALA  41           1HB      ALA  41  37.269 -32.941  -1.218
  323    HB2  ALA  41           2HB      ALA  41  36.870 -34.177  -2.411
  324    HB3  ALA  41           3HB      ALA  41  38.164 -34.460  -1.247
  325    H    GLU  42           H        GLU  42  37.238 -33.522  -4.867
  326    HA   GLU  42           HA       GLU  42  38.354 -35.971  -5.739
  327    HB2  GLU  42           1HB      GLU  42  36.058 -35.248  -6.287
  328    HB3  GLU  42           2HB      GLU  42  36.713 -33.971  -7.302
  329    HG2  GLU  42           1HG      GLU  42  37.726 -36.625  -7.963
  330    HG3  GLU  42           2HG      GLU  42  35.981 -36.460  -8.147
  331    H    ALA  43           H        ALA  43  38.929 -32.611  -6.621
  332    HA   ALA  43           HA       ALA  43  40.537 -33.078  -8.885
  333    HB1  ALA  43           1HB      ALA  43  40.173 -30.777  -7.017
  334    HB2  ALA  43           2HB      ALA  43  41.476 -30.743  -8.205
  335    HB3  ALA  43           3HB      ALA  43  39.802 -30.899  -8.737
  336    H    GLN  44           H        GLN  44  41.248 -33.019  -5.452
  337    HA   GLN  44           HA       GLN  44  44.106 -33.346  -5.986
  338    HB2  GLN  44           1HB      GLN  44  42.979 -31.797  -4.158
  339    HB3  GLN  44           2HB      GLN  44  42.988 -33.284  -3.219
  340    HG2  GLN  44           1HG      GLN  44  45.428 -33.460  -3.621
  341    HG3  GLN  44           2HG      GLN  44  45.368 -31.889  -4.417
  342   HE21  GLN  44          2HE2      GLN  44  46.945 -32.460  -2.175
  343   HE22  GLN  44          1HE2      GLN  44  46.371 -31.512  -0.850
  344    H    VAL  45           H        VAL  45  45.302 -35.049  -4.914
  345    HA   VAL  45           HA       VAL  45  44.038 -37.586  -5.204
  346    HB   VAL  45           HB       VAL  45  46.715 -37.005  -3.932
  347   HG11  VAL  45          1HG1      VAL  45  46.119 -39.233  -3.463
  348   HG12  VAL  45          2HG1      VAL  45  45.451 -39.480  -5.078
  349   HG13  VAL  45          3HG1      VAL  45  47.194 -39.322  -4.858
  350   HG21  VAL  45          3HG2      VAL  45  47.555 -37.601  -6.269
  351   HG22  VAL  45          1HG2      VAL  45  45.907 -37.282  -6.811
  352   HG23  VAL  45          2HG2      VAL  45  46.849 -36.000  -6.049
  353    H    ILE  46           H        ILE  46  43.319 -39.012  -3.694
  354    HA   ILE  46           HA       ILE  46  42.605 -37.975  -1.124
  355    HB   ILE  46           HB       ILE  46  42.376 -40.834  -2.059
  356   HG12  ILE  46          1HG1      ILE  46  39.884 -39.774  -2.358
  357   HG13  ILE  46          2HG1      ILE  46  40.887 -38.404  -2.824
  358   HG21  ILE  46          1HG2      ILE  46  40.300 -39.767  -0.330
  359   HG22  ILE  46          2HG2      ILE  46  41.253 -41.242  -0.177
  360   HG23  ILE  46          3HG2      ILE  46  41.898 -39.710   0.413
  361   HD11  ILE  46          3HD1      ILE  46  40.350 -40.907  -4.222
  362   HD12  ILE  46          1HD1      ILE  46  40.840 -39.333  -4.849
  363   HD13  ILE  46          2HD1      ILE  46  42.051 -40.441  -4.202
  364    H    ILE  47           H        ILE  47  44.870 -37.541  -0.465
  365    HA   ILE  47           HA       ILE  47  46.040 -39.932   0.799
  366    HB   ILE  47           HB       ILE  47  48.269 -38.791   0.590
  367   HG12  ILE  47          1HG1      ILE  47  47.042 -37.152  -1.606
  368   HG13  ILE  47          2HG1      ILE  47  47.061 -36.544   0.045
  369   HG21  ILE  47          1HG2      ILE  47  46.694 -39.909  -1.658
  370   HG22  ILE  47          2HG2      ILE  47  48.259 -39.192  -2.037
  371   HG23  ILE  47          3HG2      ILE  47  48.154 -40.520  -0.881
  372   HD11  ILE  47          3HD1      ILE  47  49.249 -36.841  -1.891
  373   HD12  ILE  47          1HD1      ILE  47  49.016 -35.658  -0.603
  374   HD13  ILE  47          2HD1      ILE  47  49.636 -37.266  -0.223
  375    H    GLU  48           H        GLU  48  47.724 -39.122   2.541
  376    HA   GLU  48           HA       GLU  48  46.228 -37.867   4.572
  377    HB2  GLU  48           1HB      GLU  48  48.183 -38.059   5.934
  378    HB3  GLU  48           2HB      GLU  48  48.107 -39.491   4.918
  379    HG2  GLU  48           1HG      GLU  48  49.696 -38.262   3.354
  380    HG3  GLU  48           2HG      GLU  48  49.942 -37.133   4.684
  381    H    GLN  49           H        GLN  49  47.783 -36.081   5.865
  382    HA   GLN  49           HA       GLN  49  47.918 -33.826   3.976
  383    HB2  GLN  49           1HB      GLN  49  47.518 -32.405   6.025
  384    HB3  GLN  49           2HB      GLN  49  46.166 -33.411   5.524
  385    HG2  GLN  49           1HG      GLN  49  46.643 -35.004   7.261
  386    HG3  GLN  49           2HG      GLN  49  48.102 -34.123   7.714
  387   HE21  GLN  49          2HE2      GLN  49  47.816 -31.933   8.523
  388   HE22  GLN  49          1HE2      GLN  49  46.392 -31.552   9.425
  389    H    ALA  50           H        ALA  50  49.734 -32.623   3.858
  390    HA   ALA  50           HA       ALA  50  51.675 -32.355   5.864
  391    HB1  ALA  50           1HB      ALA  50  53.491 -33.697   4.605
  392    HB2  ALA  50           2HB      ALA  50  52.370 -34.557   5.661
  393    HB3  ALA  50           3HB      ALA  50  52.129 -34.579   3.914
  394    H    ASN  51           H        ASN  51  53.860 -31.592   4.826
  395    HA   ASN  51           HA       ASN  51  53.124 -29.682   2.730
  396    HB2  ASN  51           1HB      ASN  51  54.913 -28.314   3.484
  397    HB3  ASN  51           2HB      ASN  51  54.128 -28.920   4.940
  398   HD21  ASN  51          2HD2      ASN  51  56.940 -29.106   2.906
  399   HD22  ASN  51          1HD2      ASN  51  57.950 -29.934   4.036
  400    H    LYS  52           H        LYS  52  54.097 -29.625   0.773
  401    HA   LYS  52           HA       LYS  52  56.116 -31.702   0.231
  402    HB2  LYS  52           1HB      LYS  52  55.296 -31.652  -2.110
  403    HB3  LYS  52           2HB      LYS  52  54.061 -32.150  -0.960
  404    HG2  LYS  52           1HG      LYS  52  53.785 -29.385  -1.161
  405    HG3  LYS  52           2HG      LYS  52  54.065 -29.946  -2.811
  406    HD2  LYS  52           1HD      LYS  52  52.164 -31.267  -2.823
  407    HD3  LYS  52           2HD      LYS  52  52.106 -31.378  -1.062
  408    HE2  LYS  52           1HE      LYS  52  50.821 -29.562  -0.904
  409    HE3  LYS  52           2HE      LYS  52  51.866 -28.641  -1.984
  410    HZ1  LYS  52           3HZ      LYS  52  49.350 -29.789  -2.523
  411    HZ2  LYS  52           1HZ      LYS  52  50.502 -30.484  -3.549
  412    HZ3  LYS  52           2HZ      LYS  52  50.300 -28.805  -3.519
  413    H    ARG  53           H        ARG  53  57.694 -31.201  -1.457
  414    HA   ARG  53           HA       ARG  53  58.163 -28.338  -1.876
  415    HB2  ARG  53           1HB      ARG  53  60.574 -28.660  -1.347
  416    HB3  ARG  53           2HB      ARG  53  59.518 -28.867   0.044
  417    HG2  ARG  53           1HG      ARG  53  59.738 -31.241  -0.050
  418    HG3  ARG  53           2HG      ARG  53  60.592 -31.151  -1.591
  419    HD2  ARG  53           1HD      ARG  53  61.623 -29.873   0.930
  420    HD3  ARG  53           2HD      ARG  53  62.022 -31.525   0.463
  421    HE   ARG  53           HE       ARG  53  63.130 -29.130  -0.610
  422   HH11  ARG  53          1HH1      ARG  53  62.246 -32.402  -1.406
  423   HH12  ARG  53          2HH1      ARG  53  63.400 -32.539  -2.691
  424   HH21  ARG  53          1HH2      ARG  53  64.654 -29.299  -2.299
  425   HH22  ARG  53          2HH2      ARG  53  64.770 -30.774  -3.197
  Start of MODEL    9
    1    H1   MET   1           H        MET   1 -16.670 -16.139  22.909
    2    HA   MET   1           HA       MET   1 -15.068 -14.517  21.394
    3    HB2  MET   1           1HB      MET   1 -14.703 -15.977  23.653
    4    HB3  MET   1           2HB      MET   1 -13.683 -16.865  22.529
    5    HG2  MET   1           1HG      MET   1 -12.109 -15.306  22.586
    6    HG3  MET   1           2HG      MET   1 -13.275 -14.015  22.308
    7    HE1  MET   1           3HE      MET   1 -10.628 -14.578  23.852
    8    HE2  MET   1           1HE      MET   1 -10.823 -13.152  24.872
    9    HE3  MET   1           2HE      MET   1 -10.732 -14.754  25.604
   10    H    ALA   2           H        ALA   2 -14.712 -14.632  19.276
   11    HA   ALA   2           HA       ALA   2 -13.340 -16.864  18.143
   12    HB1  ALA   2           1HB      ALA   2 -16.115 -17.076  18.121
   13    HB2  ALA   2           2HB      ALA   2 -15.687 -16.551  16.492
   14    HB3  ALA   2           3HB      ALA   2 -14.969 -18.016  17.164
   15    H    ALA   3           H        ALA   3 -12.800 -16.507  15.852
   16    HA   ALA   3           HA       ALA   3 -12.091 -13.786  15.393
   17    HB1  ALA   3           1HB      ALA   3 -11.820 -16.282  13.740
   18    HB2  ALA   3           2HB      ALA   3 -11.284 -14.701  13.170
   19    HB3  ALA   3           3HB      ALA   3 -10.566 -15.406  14.618
   20    H    ILE   4           H        ILE   4 -13.470 -12.285  14.723
   21    HA   ILE   4           HA       ILE   4 -15.954 -12.857  13.486
   22    HB   ILE   4           HB       ILE   4 -16.069 -10.387  13.095
   23   HG12  ILE   4          1HG1      ILE   4 -13.446 -10.312  14.592
   24   HG13  ILE   4          2HG1      ILE   4 -13.569 -10.129  12.846
   25   HG21  ILE   4          1HG2      ILE   4 -15.292 -11.203  15.891
   26   HG22  ILE   4          2HG2      ILE   4 -16.278  -9.813  15.439
   27   HG23  ILE   4          3HG2      ILE   4 -16.879 -11.448  15.162
   28   HD11  ILE   4          3HD1      ILE   4 -15.388  -8.320  14.048
   29   HD12  ILE   4          1HD1      ILE   4 -13.829  -8.158  14.854
   30   HD13  ILE   4          2HD1      ILE   4 -13.941  -7.970  13.104
   31    H    GLU   5           H        GLU   5 -12.770 -12.247  12.264
   32    HA   GLU   5           HA       GLU   5 -13.477 -13.044   9.639
   33    HB2  GLU   5           1HB      GLU   5 -12.983 -10.936   8.463
   34    HB3  GLU   5           2HB      GLU   5 -14.408 -10.804   9.485
   35    HG2  GLU   5           1HG      GLU   5 -13.434  -9.327  10.898
   36    HG3  GLU   5           2HG      GLU   5 -11.821 -10.002  10.673
   37    H    LYS   6           H        LYS   6 -11.635 -14.116  11.206
   38    HA   LYS   6           HA       LYS   6  -9.134 -13.416   9.863
   39    HB2  LYS   6           1HB      LYS   6  -9.472 -13.662  12.854
   40    HB3  LYS   6           2HB      LYS   6  -7.910 -13.714  12.047
   41    HG2  LYS   6           1HG      LYS   6  -9.699 -11.403  11.509
   42    HG3  LYS   6           2HG      LYS   6  -8.863 -11.484  13.061
   43    HD2  LYS   6           1HD      LYS   6  -6.981 -12.134  11.050
   44    HD3  LYS   6           2HD      LYS   6  -7.845 -10.690  10.516
   45    HE2  LYS   6           1HE      LYS   6  -6.318  -9.626  11.787
   46    HE3  LYS   6           2HE      LYS   6  -7.407 -10.063  13.102
   47    HZ1  LYS   6           3HZ      LYS   6  -5.100 -11.721  12.246
   48    HZ2  LYS   6           1HZ      LYS   6  -6.070 -11.950  13.614
   49    HZ3  LYS   6           2HZ      LYS   6  -5.043 -10.609  13.520
   50    H    ARG   7           H        ARG   7  -8.469 -15.198   8.880
   51    HA   ARG   7           HA       ARG   7  -8.491 -17.730  10.338
   52    HB2  ARG   7           1HB      ARG   7  -9.744 -17.306   7.623
   53    HB3  ARG   7           2HB      ARG   7  -9.330 -18.892   8.261
   54    HG2  ARG   7           1HG      ARG   7 -10.932 -18.742   9.971
   55    HG3  ARG   7           2HG      ARG   7 -11.139 -17.005   9.734
   56    HD2  ARG   7           1HD      ARG   7 -13.021 -18.284   8.821
   57    HD3  ARG   7           2HD      ARG   7 -12.155 -17.401   7.564
   58    HE   ARG   7           HE       ARG   7 -11.196 -20.070   7.839
   59   HH11  ARG   7          1HH1      ARG   7 -13.762 -18.145   6.486
   60   HH12  ARG   7          2HH1      ARG   7 -14.120 -19.275   5.223
   61   HH21  ARG   7          1HH2      ARG   7 -11.658 -21.566   6.180
   62   HH22  ARG   7          2HH2      ARG   7 -12.924 -21.221   5.050
   63    H    GLN   8           H        GLN   8  -7.903 -16.878   6.936
   64    HA   GLN   8           HA       GLN   8  -5.061 -16.942   7.202
   65    HB2  GLN   8           1HB      GLN   8  -4.799 -18.957   5.671
   66    HB3  GLN   8           2HB      GLN   8  -5.246 -19.292   7.339
   67    HG2  GLN   8           1HG      GLN   8  -7.250 -20.131   6.776
   68    HG3  GLN   8           2HG      GLN   8  -7.495 -18.962   5.479
   69   HE21  GLN   8          2HE2      GLN   8  -8.285 -20.693   4.196
   70   HE22  GLN   8          1HE2      GLN   8  -7.193 -21.786   3.422
   71    H    LYS   9           H        LYS   9  -4.625 -15.293   5.896
   72    HA   LYS   9           HA       LYS   9  -5.495 -15.447   3.111
   73    HB2  LYS   9           1HB      LYS   9  -7.089 -13.984   4.448
   74    HB3  LYS   9           2HB      LYS   9  -5.742 -12.874   4.667
   75    HG2  LYS   9           1HG      LYS   9  -5.571 -12.904   2.104
   76    HG3  LYS   9           2HG      LYS   9  -7.194 -13.596   2.152
   77    HD2  LYS   9           1HD      LYS   9  -8.107 -11.606   2.569
   78    HD3  LYS   9           2HD      LYS   9  -6.986 -11.304   3.898
   79    HE2  LYS   9           1HE      LYS   9  -5.367 -10.376   2.443
   80    HE3  LYS   9           2HE      LYS   9  -6.212 -10.964   1.011
   81    HZ1  LYS   9           3HZ      LYS   9  -7.705  -9.281   1.086
   82    HZ2  LYS   9           1HZ      LYS   9  -6.421  -8.482   1.844
   83    HZ3  LYS   9           2HZ      LYS   9  -7.669  -9.148   2.772
   84    H    GLU  10           H        GLU  10  -3.702 -13.369   5.393
   85    HA   GLU  10           HA       GLU  10  -1.743 -12.747   3.350
   86    HB2  GLU  10           1HB      GLU  10  -2.316 -11.796   6.118
   87    HB3  GLU  10           2HB      GLU  10  -0.688 -11.583   5.489
   88    HG2  GLU  10           1HG      GLU  10  -2.572 -10.737   3.520
   89    HG3  GLU  10           2HG      GLU  10  -2.946  -9.965   5.060
   90    H    ILE  11           H        ILE  11  -1.854 -14.469   6.446
   91    HA   ILE  11           HA       ILE  11   0.810 -15.132   6.732
   92    HB   ILE  11           HB       ILE  11  -0.017 -17.214   7.900
   93   HG12  ILE  11          1HG1      ILE  11  -2.722 -16.026   7.244
   94   HG13  ILE  11          2HG1      ILE  11  -2.064 -17.496   6.532
   95   HG21  ILE  11          1HG2      ILE  11  -0.069 -15.902   9.689
   96   HG22  ILE  11          2HG2      ILE  11  -0.177 -14.506   8.619
   97   HG23  ILE  11          3HG2      ILE  11  -1.647 -15.266   9.226
   98   HD11  ILE  11          3HD1      ILE  11  -1.926 -17.768   9.342
   99   HD12  ILE  11          1HD1      ILE  11  -3.539 -17.188   8.930
  100   HD13  ILE  11          2HD1      ILE  11  -2.918 -18.667   8.195
  101    H    ALA  12           H        ALA  12  -1.609 -16.552   4.629
  102    HA   ALA  12           HA       ALA  12  -0.184 -18.876   3.903
  103    HB1  ALA  12           1HB      ALA  12  -2.633 -18.415   3.517
  104    HB2  ALA  12           2HB      ALA  12  -2.143 -17.418   2.147
  105    HB3  ALA  12           3HB      ALA  12  -1.766 -19.141   2.163
  106    H    ASP  13           H        ASP  13  -0.572 -15.789   2.156
  107    HA   ASP  13           HA       ASP  13   1.165 -16.344   0.054
  108    HB2  ASP  13           1HB      ASP  13   0.223 -13.802   1.337
  109    HB3  ASP  13           2HB      ASP  13   1.454 -13.744   0.078
  110    H    GLY  14           H        GLY  14   1.837 -14.812   3.189
  111    HA2  GLY  14           1HA      GLY  14   4.596 -14.366   2.673
  112    HA3  GLY  14           2HA      GLY  14   3.822 -14.341   4.250
  113    H    LEU  15           H        LEU  15   2.804 -17.088   3.938
  114    HA   LEU  15           HA       LEU  15   5.005 -18.453   5.089
  115    HB2  LEU  15           1HB      LEU  15   2.218 -19.115   4.347
  116    HB3  LEU  15           2HB      LEU  15   3.337 -20.466   4.520
  117    HG   LEU  15           HG       LEU  15   2.964 -18.423   6.693
  118   HD11  LEU  15          1HD1      LEU  15   0.907 -19.172   7.049
  119   HD12  LEU  15          2HD1      LEU  15   1.604 -20.750   7.414
  120   HD13  LEU  15          3HD1      LEU  15   1.065 -20.382   5.775
  121   HD21  LEU  15          3HD2      LEU  15   3.691 -21.298   7.042
  122   HD22  LEU  15          1HD2      LEU  15   4.087 -19.906   8.051
  123   HD23  LEU  15          2HD2      LEU  15   4.916 -20.143   6.513
  124    H    ALA  16           H        ALA  16   3.327 -18.862   1.974
  125    HA   ALA  16           HA       ALA  16   5.142 -20.828   1.006
  126    HB1  ALA  16           1HB      ALA  16   3.766 -19.345  -1.073
  127    HB2  ALA  16           2HB      ALA  16   3.654 -21.051  -0.637
  128    HB3  ALA  16           3HB      ALA  16   2.678 -19.856   0.218
  129    H    SER  17           H        SER  17   4.928 -17.327   0.721
  130    HA   SER  17           HA       SER  17   6.912 -17.035  -1.280
  131    HB2  SER  17           1HB      SER  17   5.248 -15.278  -0.724
  132    HB3  SER  17           2HB      SER  17   6.057 -15.031   0.823
  133    HG   SER  17           HG       SER  17   7.356 -13.751  -0.197
  134    H    ALA  18           H        ALA  18   7.011 -17.058   2.245
  135    HA   ALA  18           HA       ALA  18   9.823 -16.438   2.352
  136    HB1  ALA  18           1HB      ALA  18   9.620 -16.560   4.702
  137    HB2  ALA  18           2HB      ALA  18   8.124 -15.826   4.121
  138    HB3  ALA  18           3HB      ALA  18   8.145 -17.523   4.600
  139    H    GLU  19           H        GLU  19   7.806 -19.318   2.598
  140    HA   GLU  19           HA       GLU  19   9.824 -21.100   3.441
  141    HB2  GLU  19           1HB      GLU  19   7.395 -21.580   3.566
  142    HB3  GLU  19           2HB      GLU  19   7.351 -21.711   1.814
  143    HG2  GLU  19           1HG      GLU  19   9.379 -23.408   3.017
  144    HG3  GLU  19           2HG      GLU  19   7.751 -23.768   3.589
  145    H    ARG  20           H        ARG  20   8.513 -20.422   0.201
  146    HA   ARG  20           HA       ARG  20  10.178 -22.161  -1.221
  147    HB2  ARG  20           1HB      ARG  20   8.147 -21.032  -2.128
  148    HB3  ARG  20           2HB      ARG  20   9.057 -19.529  -2.194
  149    HG2  ARG  20           1HG      ARG  20   9.926 -20.073  -4.155
  150    HG3  ARG  20           2HG      ARG  20  10.501 -21.620  -3.529
  151    HD2  ARG  20           1HD      ARG  20   8.743 -22.760  -4.368
  152    HD3  ARG  20           2HD      ARG  20   7.606 -21.452  -4.038
  153    HE   ARG  20           HE       ARG  20   7.958 -20.648  -6.159
  154   HH11  ARG  20          1HH1      ARG  20  10.391 -23.018  -5.396
  155   HH12  ARG  20          2HH1      ARG  20  11.011 -23.092  -7.012
  156   HH21  ARG  20          1HH2      ARG  20   8.766 -20.736  -8.291
  157   HH22  ARG  20          2HH2      ARG  20  10.087 -21.793  -8.657
  158    H    ALA  21           H        ALA  21  10.628 -18.777  -0.292
  159    HA   ALA  21           HA       ALA  21  13.029 -18.341  -1.699
  160    HB1  ALA  21           1HB      ALA  21  11.686 -17.007   0.609
  161    HB2  ALA  21           2HB      ALA  21  13.331 -16.548   0.168
  162    HB3  ALA  21           3HB      ALA  21  12.026 -16.386  -1.006
  163    H    HIS  22           H        HIS  22  12.498 -19.110   1.744
  164    HA   HIS  22           HA       HIS  22  15.171 -19.317   2.490
  165    HB2  HIS  22           1HB      HIS  22  12.766 -19.600   3.773
  166    HB3  HIS  22           2HB      HIS  22  13.386 -21.249   3.803
  167    HD1  HIS  22           HD1      HIS  22  13.535 -18.155   5.624
  168    HD2  HIS  22           HD2      HIS  22  16.139 -21.321   4.948
  169    HE1  HIS  22           HE1      HIS  22  15.279 -17.988   7.429
  170    H    LYS  23           H        LYS  23  12.960 -21.856   1.349
  171    HA   LYS  23           HA       LYS  23  14.732 -24.007   1.525
  172    HB2  LYS  23           1HB      LYS  23  12.265 -24.149   1.106
  173    HB3  LYS  23           2HB      LYS  23  12.567 -23.643  -0.551
  174    HG2  LYS  23           1HG      LYS  23  13.982 -25.636  -0.872
  175    HG3  LYS  23           2HG      LYS  23  13.580 -26.154   0.767
  176    HD2  LYS  23           1HD      LYS  23  11.144 -26.022   0.041
  177    HD3  LYS  23           2HD      LYS  23  11.755 -25.889  -1.610
  178    HE2  LYS  23           1HE      LYS  23  13.150 -28.021  -0.829
  179    HE3  LYS  23           2HE      LYS  23  11.767 -28.200   0.249
  180    HZ1  LYS  23           3HZ      LYS  23  11.447 -29.394  -1.831
  181    HZ2  LYS  23           1HZ      LYS  23  11.622 -27.958  -2.708
  182    HZ3  LYS  23           2HZ      LYS  23  10.305 -28.158  -1.667
  183    H    ASP  24           H        ASP  24  13.989 -21.940  -1.278
  184    HA   ASP  24           HA       ASP  24  15.695 -23.085  -3.125
  185    HB2  ASP  24           1HB      ASP  24  14.038 -21.295  -3.617
  186    HB3  ASP  24           2HB      ASP  24  15.111 -20.130  -2.845
  187    H    LEU  25           H        LEU  25  16.424 -20.276  -1.048
  188    HA   LEU  25           HA       LEU  25  19.091 -19.975  -1.736
  189    HB2  LEU  25           1HB      LEU  25  17.323 -18.917   0.181
  190    HB3  LEU  25           2HB      LEU  25  18.748 -19.463   1.064
  191    HG   LEU  25           HG       LEU  25  18.704 -17.479  -1.210
  192   HD11  LEU  25          1HD1      LEU  25  19.282 -17.122   1.727
  193   HD12  LEU  25          2HD1      LEU  25  17.821 -16.597   0.892
  194   HD13  LEU  25          3HD1      LEU  25  19.376 -15.871   0.488
  195   HD21  LEU  25          3HD2      LEU  25  21.154 -17.270  -0.094
  196   HD22  LEU  25          1HD2      LEU  25  20.798 -18.247  -1.518
  197   HD23  LEU  25          2HD2      LEU  25  20.871 -19.003   0.074
  198    H    ASP  26           H        ASP  26  17.654 -22.005   0.788
  199    HA   ASP  26           HA       ASP  26  20.007 -22.937   1.959
  200    HB2  ASP  26           1HB      ASP  26  17.190 -23.782   1.875
  201    HB3  ASP  26           2HB      ASP  26  18.331 -25.090   2.174
  202    H    LEU  27           H        LEU  27  18.007 -24.655  -0.449
  203    HA   LEU  27           HA       LEU  27  19.770 -26.733  -0.958
  204    HB2  LEU  27           1HB      LEU  27  17.310 -26.044  -1.848
  205    HB3  LEU  27           2HB      LEU  27  18.277 -25.725  -3.286
  206    HG   LEU  27           HG       LEU  27  19.168 -28.149  -2.871
  207   HD11  LEU  27          1HD1      LEU  27  16.797 -27.955  -1.101
  208   HD12  LEU  27          2HD1      LEU  27  18.267 -28.914  -0.930
  209   HD13  LEU  27          3HD1      LEU  27  17.000 -29.432  -2.043
  210   HD21  LEU  27          3HD2      LEU  27  16.900 -27.053  -4.308
  211   HD22  LEU  27          1HD2      LEU  27  16.686 -28.763  -3.931
  212   HD23  LEU  27          2HD2      LEU  27  18.108 -28.230  -4.828
  213    H    ALA  28           H        ALA  28  19.568 -23.542  -2.472
  214    HA   ALA  28           HA       ALA  28  21.461 -23.925  -4.492
  215    HB1  ALA  28           1HB      ALA  28  20.722 -21.417  -2.992
  216    HB2  ALA  28           2HB      ALA  28  21.699 -21.456  -4.461
  217    HB3  ALA  28           3HB      ALA  28  20.022 -21.999  -4.503
  218    H    LYS  29           H        LYS  29  21.927 -22.426  -1.286
  219    HA   LYS  29           HA       LYS  29  24.696 -22.114  -1.462
  220    HB2  LYS  29           1HB      LYS  29  22.727 -21.601   0.438
  221    HB3  LYS  29           2HB      LYS  29  23.808 -22.735   1.237
  222    HG2  LYS  29           1HG      LYS  29  24.558 -20.549   1.762
  223    HG3  LYS  29           2HG      LYS  29  25.708 -21.233   0.611
  224    HD2  LYS  29           1HD      LYS  29  24.510 -20.031  -1.208
  225    HD3  LYS  29           2HD      LYS  29  23.500 -19.264   0.019
  226    HE2  LYS  29           1HE      LYS  29  26.272 -18.984   0.709
  227    HE3  LYS  29           2HE      LYS  29  26.002 -18.413  -0.937
  228    HZ1  LYS  29           3HZ      LYS  29  25.646 -16.583   0.479
  229    HZ2  LYS  29           1HZ      LYS  29  24.684 -17.478   1.546
  230    HZ3  LYS  29           2HZ      LYS  29  24.104 -17.093   0.004
  231    H    ALA  30           H        ALA  30  22.863 -24.711   0.157
  232    HA   ALA  30           HA       ALA  30  24.978 -26.287   0.968
  233    HB1  ALA  30           1HB      ALA  30  23.450 -27.985   1.322
  234    HB2  ALA  30           2HB      ALA  30  22.427 -26.548   1.348
  235    HB3  ALA  30           3HB      ALA  30  22.491 -27.559  -0.096
  236    H    SER  31           H        SER  31  23.193 -26.505  -2.109
  237    HA   SER  31           HA       SER  31  24.667 -28.590  -3.233
  238    HB2  SER  31           1HB      SER  31  22.530 -27.755  -4.157
  239    HB3  SER  31           2HB      SER  31  23.343 -26.280  -4.678
  240    HG   SER  31           HG       SER  31  24.180 -28.858  -5.496
  241    H    ALA  32           H        ALA  32  25.218 -25.100  -3.298
  242    HA   ALA  32           HA       ALA  32  27.344 -25.055  -5.117
  243    HB1  ALA  32           1HB      ALA  32  26.079 -23.072  -4.263
  244    HB2  ALA  32           2HB      ALA  32  27.011 -23.198  -2.770
  245    HB3  ALA  32           3HB      ALA  32  27.831 -22.871  -4.296
  246    H    THR  33           H        THR  33  27.566 -24.849  -1.559
  247    HA   THR  33           HA       THR  33  30.331 -25.196  -1.401
  248    HB   THR  33           HB       THR  33  28.991 -24.380   0.487
  249    HG1  THR  33           HG1      THR  33  30.323 -25.275   1.945
  250   HG21  THR  33          3HG2      THR  33  27.672 -25.891   1.847
  251   HG22  THR  33          1HG2      THR  33  28.073 -27.242   0.787
  252   HG23  THR  33          2HG2      THR  33  27.073 -25.918   0.189
  253    H    ASP  34           H        ASP  34  27.735 -27.539  -1.616
  254    HA   ASP  34           HA       ASP  34  29.232 -29.825  -0.891
  255    HB2  ASP  34           1HB      ASP  34  26.723 -29.677  -0.993
  256    HB3  ASP  34           2HB      ASP  34  26.850 -29.740  -2.749
  257    H    GLN  35           H        GLN  35  28.227 -28.672  -4.116
  258    HA   GLN  35           HA       GLN  35  29.684 -30.529  -5.601
  259    HB2  GLN  35           1HB      GLN  35  28.183 -28.125  -6.113
  260    HB3  GLN  35           2HB      GLN  35  29.642 -28.142  -7.095
  261    HG2  GLN  35           1HG      GLN  35  29.011 -30.418  -7.875
  262    HG3  GLN  35           2HG      GLN  35  27.486 -30.237  -7.009
  263   HE21  GLN  35          2HE2      GLN  35  27.358 -30.733  -9.629
  264   HE22  GLN  35          1HE2      GLN  35  26.875 -29.326 -10.506
  265    H    LEU  36           H        LEU  36  30.588 -27.266  -4.533
  266    HA   LEU  36           HA       LEU  36  33.105 -27.171  -5.760
  267    HB2  LEU  36           1HB      LEU  36  31.864 -25.257  -4.734
  268    HB3  LEU  36           2HB      LEU  36  32.333 -25.875  -3.152
  269    HG   LEU  36           HG       LEU  36  34.750 -25.622  -4.000
  270   HD11  LEU  36          1HD1      LEU  36  33.193 -24.317  -6.156
  271   HD12  LEU  36          2HD1      LEU  36  34.733 -25.172  -6.225
  272   HD13  LEU  36          3HD1      LEU  36  34.670 -23.517  -5.619
  273   HD21  LEU  36          3HD2      LEU  36  34.265 -24.170  -2.310
  274   HD22  LEU  36          1HD2      LEU  36  32.855 -23.503  -3.134
  275   HD23  LEU  36          2HD2      LEU  36  34.477 -23.017  -3.628
  276    H    LYS  37           H        LYS  37  32.331 -27.904  -2.354
  277    HA   LYS  37           HA       LYS  37  34.871 -28.606  -1.514
  278    HB2  LYS  37           1HB      LYS  37  32.769 -28.339  -0.111
  279    HB3  LYS  37           2HB      LYS  37  32.356 -29.984  -0.575
  280    HG2  LYS  37           1HG      LYS  37  33.464 -30.591   1.257
  281    HG3  LYS  37           2HG      LYS  37  34.925 -30.261   0.322
  282    HD2  LYS  37           1HD      LYS  37  34.338 -27.777   1.208
  283    HD3  LYS  37           2HD      LYS  37  33.705 -28.748   2.540
  284    HE2  LYS  37           1HE      LYS  37  36.266 -29.753   1.732
  285    HE3  LYS  37           2HE      LYS  37  36.378 -28.021   2.041
  286    HZ1  LYS  37           3HZ      LYS  37  35.796 -28.284   4.232
  287    HZ2  LYS  37           1HZ      LYS  37  36.683 -29.700   3.971
  288    HZ3  LYS  37           2HZ      LYS  37  34.993 -29.750   3.975
  289    H    LYS  38           H        LYS  38  32.413 -30.608  -3.080
  290    HA   LYS  38           HA       LYS  38  33.765 -33.067  -2.867
  291    HB2  LYS  38           1HB      LYS  38  31.507 -31.993  -4.442
  292    HB3  LYS  38           2HB      LYS  38  32.327 -33.381  -5.144
  293    HG2  LYS  38           1HG      LYS  38  31.308 -33.343  -2.318
  294    HG3  LYS  38           2HG      LYS  38  30.340 -33.890  -3.689
  295    HD2  LYS  38           1HD      LYS  38  32.105 -35.552  -4.210
  296    HD3  LYS  38           2HD      LYS  38  32.966 -35.047  -2.754
  297    HE2  LYS  38           1HE      LYS  38  31.496 -36.080  -1.365
  298    HE3  LYS  38           2HE      LYS  38  30.121 -35.793  -2.430
  299    HZ1  LYS  38           3HZ      LYS  38  32.178 -37.663  -3.337
  300    HZ2  LYS  38           1HZ      LYS  38  30.506 -37.687  -3.595
  301    HZ3  LYS  38           2HZ      LYS  38  31.139 -38.180  -2.106
  302    H    ALA  39           H        ALA  39  33.613 -30.742  -5.562
  303    HA   ALA  39           HA       ALA  39  35.268 -32.064  -7.348
  304    HB1  ALA  39           1HB      ALA  39  35.300 -29.077  -7.053
  305    HB2  ALA  39           2HB      ALA  39  35.447 -30.046  -8.520
  306    HB3  ALA  39           3HB      ALA  39  33.896 -29.934  -7.689
  307    H    LYS  40           H        LYS  40  36.143 -29.791  -4.768
  308    HA   LYS  40           HA       LYS  40  38.901 -29.702  -5.311
  309    HB2  LYS  40           1HB      LYS  40  37.113 -28.699  -3.312
  310    HB3  LYS  40           2HB      LYS  40  38.511 -29.411  -2.516
  311    HG2  LYS  40           1HG      LYS  40  39.023 -27.137  -2.843
  312    HG3  LYS  40           2HG      LYS  40  39.946 -28.025  -4.057
  313    HD2  LYS  40           1HD      LYS  40  37.303 -27.259  -5.001
  314    HD3  LYS  40           2HD      LYS  40  38.279 -25.869  -4.521
  315    HE2  LYS  40           1HE      LYS  40  39.522 -27.985  -6.210
  316    HE3  LYS  40           2HE      LYS  40  38.401 -26.852  -6.962
  317    HZ1  LYS  40           3HZ      LYS  40  41.016 -26.323  -5.724
  318    HZ2  LYS  40           1HZ      LYS  40  39.855 -25.094  -5.778
  319    HZ3  LYS  40           2HZ      LYS  40  40.411 -25.796  -7.213
  320    H    ALA  41           H        ALA  41  37.140 -31.574  -2.837
  321    HA   ALA  41           HA       ALA  41  39.274 -33.024  -1.834
  322    HB1  ALA  41           1HB      ALA  41  36.741 -34.510  -2.085
  323    HB2  ALA  41           2HB      ALA  41  37.729 -34.176  -0.662
  324    HB3  ALA  41           3HB      ALA  41  36.638 -32.940  -1.287
  325    H    GLU  42           H        GLU  42  37.355 -33.583  -4.728
  326    HA   GLU  42           HA       GLU  42  38.442 -36.170  -5.272
  327    HB2  GLU  42           1HB      GLU  42  36.228 -35.225  -6.116
  328    HB3  GLU  42           2HB      GLU  42  37.177 -34.319  -7.287
  329    HG2  GLU  42           1HG      GLU  42  37.783 -37.182  -7.186
  330    HG3  GLU  42           2HG      GLU  42  36.142 -36.791  -7.699
  331    H    ALA  43           H        ALA  43  39.203 -32.879  -6.264
  332    HA   ALA  43           HA       ALA  43  40.980 -33.385  -8.336
  333    HB1  ALA  43           1HB      ALA  43  41.343 -31.177  -8.291
  334    HB2  ALA  43           2HB      ALA  43  40.097 -31.148  -7.043
  335    HB3  ALA  43           3HB      ALA  43  41.800 -31.189  -6.588
  336    H    GLN  44           H        GLN  44  41.414 -33.681  -4.885
  337    HA   GLN  44           HA       GLN  44  43.648 -35.350  -5.090
  338    HB2  GLN  44           1HB      GLN  44  44.309 -32.621  -5.392
  339    HB3  GLN  44           2HB      GLN  44  44.837 -33.086  -3.780
  340    HG2  GLN  44           1HG      GLN  44  45.887 -35.124  -4.994
  341    HG3  GLN  44           2HG      GLN  44  45.728 -34.119  -6.433
  342   HE21  GLN  44          2HE2      GLN  44  46.593 -31.850  -6.151
  343   HE22  GLN  44          1HE2      GLN  44  48.102 -31.697  -5.323
  344    H    VAL  45           H        VAL  45  42.836 -32.656  -2.894
  345    HA   VAL  45           HA       VAL  45  41.970 -34.561  -0.868
  346    HB   VAL  45           HB       VAL  45  43.399 -33.534   0.875
  347   HG11  VAL  45          1HG1      VAL  45  45.404 -34.746   0.331
  348   HG12  VAL  45          2HG1      VAL  45  44.013 -35.651  -0.268
  349   HG13  VAL  45          3HG1      VAL  45  45.006 -34.715  -1.386
  350   HG21  VAL  45          3HG2      VAL  45  45.345 -32.466  -1.032
  351   HG22  VAL  45          1HG2      VAL  45  43.837 -31.555  -0.954
  352   HG23  VAL  45          2HG2      VAL  45  44.789 -31.812   0.508
  353    H    ILE  46           H        ILE  46  40.949 -33.498   0.989
  354    HA   ILE  46           HA       ILE  46  39.134 -31.508   0.196
  355    HB   ILE  46           HB       ILE  46  38.449 -31.400   2.543
  356   HG12  ILE  46          1HG1      ILE  46  39.888 -33.334   3.868
  357   HG13  ILE  46          2HG1      ILE  46  41.136 -32.512   2.937
  358   HG21  ILE  46          1HG2      ILE  46  37.483 -33.178   1.339
  359   HG22  ILE  46          2HG2      ILE  46  38.970 -34.123   1.387
  360   HG23  ILE  46          3HG2      ILE  46  38.031 -33.884   2.860
  361   HD11  ILE  46          3HD1      ILE  46  40.927 -30.579   4.107
  362   HD12  ILE  46          1HD1      ILE  46  39.216 -30.837   4.449
  363   HD13  ILE  46          2HD1      ILE  46  40.442 -31.725   5.356
  364    H    ILE  47           H        ILE  47  38.814 -29.455   1.566
  365    HA   ILE  47           HA       ILE  47  41.266 -27.906   1.349
  366    HB   ILE  47           HB       ILE  47  38.449 -27.003   1.959
  367   HG12  ILE  47          1HG1      ILE  47  39.380 -26.038  -0.534
  368   HG13  ILE  47          2HG1      ILE  47  39.744 -27.760  -0.491
  369   HG21  ILE  47          1HG2      ILE  47  39.713 -24.814   1.026
  370   HG22  ILE  47          2HG2      ILE  47  39.559 -25.204   2.738
  371   HG23  ILE  47          3HG2      ILE  47  41.041 -25.608   1.872
  372   HD11  ILE  47          3HD1      ILE  47  37.505 -27.045  -1.458
  373   HD12  ILE  47          1HD1      ILE  47  37.496 -28.342  -0.263
  374   HD13  ILE  47          2HD1      ILE  47  37.029 -26.707   0.206
  375    H    GLU  48           H        GLU  48  38.635 -27.762   3.745
  376    HA   GLU  48           HA       GLU  48  40.228 -28.447   5.967
  377    HB2  GLU  48           1HB      GLU  48  41.036 -26.058   5.149
  378    HB3  GLU  48           2HB      GLU  48  39.624 -25.528   6.052
  379    HG2  GLU  48           1HG      GLU  48  40.514 -26.105   8.065
  380    HG3  GLU  48           2HG      GLU  48  41.499 -27.399   7.384
  381    H    GLN  49           H        GLN  49  39.069 -28.381   7.945
  382    HA   GLN  49           HA       GLN  49  36.178 -28.253   7.547
  383    HB2  GLN  49           1HB      GLN  49  37.943 -29.537   9.611
  384    HB3  GLN  49           2HB      GLN  49  36.225 -29.314   9.909
  385    HG2  GLN  49           1HG      GLN  49  36.338 -30.457   7.388
  386    HG3  GLN  49           2HG      GLN  49  37.585 -31.296   8.309
  387   HE21  GLN  49          2HE2      GLN  49  34.610 -31.700   7.339
  388   HE22  GLN  49          1HE2      GLN  49  33.905 -32.511   8.691
  389    H    ALA  50           H        ALA  50  35.341 -26.294   7.888
  390    HA   ALA  50           HA       ALA  50  36.118 -24.878  10.354
  391    HB1  ALA  50           1HB      ALA  50  36.016 -22.785   9.273
  392    HB2  ALA  50           2HB      ALA  50  36.958 -23.828   8.208
  393    HB3  ALA  50           3HB      ALA  50  35.271 -23.478   7.832
  394    H    ASN  51           H        ASN  51  33.907 -26.769   9.761
  395    HA   ASN  51           HA       ASN  51  31.609 -24.975  10.167
  396    HB2  ASN  51           1HB      ASN  51  30.293 -27.134   9.614
  397    HB3  ASN  51           2HB      ASN  51  31.099 -26.287   8.296
  398   HD21  ASN  51          2HD2      ASN  51  31.437 -28.959  10.565
  399   HD22  ASN  51          1HD2      ASN  51  32.443 -29.931   9.551
  400    H    LYS  52           H        LYS  52  33.440 -27.625  11.493
  401    HA   LYS  52           HA       LYS  52  31.888 -27.394  13.975
  402    HB2  LYS  52           1HB      LYS  52  31.886 -29.776  14.305
  403    HB3  LYS  52           2HB      LYS  52  31.192 -29.436  12.726
  404    HG2  LYS  52           1HG      LYS  52  33.301 -30.030  11.659
  405    HG3  LYS  52           2HG      LYS  52  34.016 -30.349  13.240
  406    HD2  LYS  52           1HD      LYS  52  33.401 -32.468  12.513
  407    HD3  LYS  52           2HD      LYS  52  32.042 -31.996  13.537
  408    HE2  LYS  52           1HE      LYS  52  31.029 -31.092  11.321
  409    HE3  LYS  52           2HE      LYS  52  32.203 -32.160  10.553
  410    HZ1  LYS  52           3HZ      LYS  52  30.647 -33.717  10.797
  411    HZ2  LYS  52           1HZ      LYS  52  29.757 -32.808  11.911
  412    HZ3  LYS  52           2HZ      LYS  52  31.067 -33.741  12.435
  413    H    ARG  53           H        ARG  53  33.089 -28.418  15.848
  414    HA   ARG  53           HA       ARG  53  35.901 -27.620  15.667
  415    HB2  ARG  53           1HB      ARG  53  33.852 -27.410  17.690
  416    HB3  ARG  53           2HB      ARG  53  35.268 -28.230  18.335
  417    HG2  ARG  53           1HG      ARG  53  36.149 -26.227  18.679
  418    HG3  ARG  53           2HG      ARG  53  36.299 -26.071  16.928
  419    HD2  ARG  53           1HD      ARG  53  34.024 -25.109  16.856
  420    HD3  ARG  53           2HD      ARG  53  33.959 -25.195  18.616
  421    HE   ARG  53           HE       ARG  53  36.242 -23.750  17.737
  422   HH11  ARG  53          1HH1      ARG  53  32.799 -23.496  18.184
  423   HH12  ARG  53          2HH1      ARG  53  32.823 -21.777  18.402
  424   HH21  ARG  53          1HH2      ARG  53  36.287 -21.488  18.023
  425   HH22  ARG  53          2HH2      ARG  53  34.807 -20.636  18.309
  Start of MODEL   10
    1    H1   MET   1           H        MET   1 -25.226  -7.825  -7.792
    2    HA   MET   1           HA       MET   1 -23.803  -8.476  -5.319
    3    HB2  MET   1           1HB      MET   1 -25.197 -10.537  -7.037
    4    HB3  MET   1           2HB      MET   1 -24.189 -10.876  -5.637
    5    HG2  MET   1           1HG      MET   1 -25.766  -9.812  -4.174
    6    HG3  MET   1           2HG      MET   1 -26.735  -9.280  -5.546
    7    HE1  MET   1           3HE      MET   1 -25.766 -12.166  -3.169
    8    HE2  MET   1           1HE      MET   1 -27.227 -11.272  -2.749
    9    HE3  MET   1           2HE      MET   1 -27.332 -12.978  -3.183
   10    H    ALA   2           H        ALA   2 -21.721  -8.292  -5.795
   11    HA   ALA   2           HA       ALA   2 -20.589  -9.737  -8.015
   12    HB1  ALA   2           1HB      ALA   2 -19.731  -7.963  -9.265
   13    HB2  ALA   2           2HB      ALA   2 -21.390  -7.474  -8.914
   14    HB3  ALA   2           3HB      ALA   2 -20.054  -6.787  -7.991
   15    H    ALA   3           H        ALA   3 -19.813  -7.053  -5.791
   16    HA   ALA   3           HA       ALA   3 -17.570  -8.659  -4.774
   17    HB1  ALA   3           1HB      ALA   3 -16.854  -6.878  -6.437
   18    HB2  ALA   3           2HB      ALA   3 -17.331  -5.697  -5.217
   19    HB3  ALA   3           3HB      ALA   3 -16.055  -6.862  -4.865
   20    H    ILE   4           H        ILE   4 -17.818  -8.968  -2.669
   21    HA   ILE   4           HA       ILE   4 -19.046  -6.822  -1.065
   22    HB   ILE   4           HB       ILE   4 -19.340  -9.791  -0.590
   23   HG12  ILE   4          1HG1      ILE   4 -21.849  -8.961  -0.999
   24   HG13  ILE   4          2HG1      ILE   4 -21.018  -7.777  -2.002
   25   HG21  ILE   4          1HG2      ILE   4 -21.230  -8.183   0.813
   26   HG22  ILE   4          2HG2      ILE   4 -20.009  -9.278   1.461
   27   HG23  ILE   4          3HG2      ILE   4 -19.605  -7.589   1.156
   28   HD11  ILE   4          3HD1      ILE   4 -21.381 -10.673  -2.388
   29   HD12  ILE   4          1HD1      ILE   4 -21.313  -9.365  -3.568
   30   HD13  ILE   4          2HD1      ILE   4 -19.824 -10.003  -2.872
   31    H    GLU   5           H        GLU   5 -17.152  -9.824  -0.670
   32    HA   GLU   5           HA       GLU   5 -15.261  -8.337   1.002
   33    HB2  GLU   5           1HB      GLU   5 -16.963 -10.619   1.833
   34    HB3  GLU   5           2HB      GLU   5 -15.284 -10.663   2.354
   35    HG2  GLU   5           1HG      GLU   5 -16.589  -8.083   2.774
   36    HG3  GLU   5           2HG      GLU   5 -17.315  -9.416   3.671
   37    H    LYS   6           H        LYS   6 -13.308  -8.601   0.176
   38    HA   LYS   6           HA       LYS   6 -12.518 -11.246  -0.813
   39    HB2  LYS   6           1HB      LYS   6 -12.042  -8.651  -2.291
   40    HB3  LYS   6           2HB      LYS   6 -11.399 -10.220  -2.756
   41    HG2  LYS   6           1HG      LYS   6 -13.975 -10.861  -2.693
   42    HG3  LYS   6           2HG      LYS   6 -14.140  -9.135  -3.019
   43    HD2  LYS   6           1HD      LYS   6 -12.155  -9.881  -4.758
   44    HD3  LYS   6           2HD      LYS   6 -13.210 -11.297  -4.754
   45    HE2  LYS   6           1HE      LYS   6 -15.133  -9.694  -5.129
   46    HE3  LYS   6           2HE      LYS   6 -13.920  -8.451  -5.432
   47    HZ1  LYS   6           3HZ      LYS   6 -13.198 -10.618  -6.982
   48    HZ2  LYS   6           1HZ      LYS   6 -13.864  -9.157  -7.516
   49    HZ3  LYS   6           2HZ      LYS   6 -14.873 -10.471  -7.173
   50    H    ARG   7           H        ARG   7 -11.515 -11.178   1.359
   51    HA   ARG   7           HA       ARG   7  -9.058  -9.560   1.414
   52    HB2  ARG   7           1HB      ARG   7 -11.003 -10.280   3.430
   53    HB3  ARG   7           2HB      ARG   7  -9.391 -10.789   3.911
   54    HG2  ARG   7           1HG      ARG   7  -8.797  -8.710   4.403
   55    HG3  ARG   7           2HG      ARG   7  -9.359  -8.111   2.842
   56    HD2  ARG   7           1HD      ARG   7 -11.435  -7.567   3.643
   57    HD3  ARG   7           2HD      ARG   7 -11.387  -8.796   4.906
   58    HE   ARG   7           HE       ARG   7  -9.463  -6.748   5.361
   59   HH11  ARG   7          1HH1      ARG   7 -12.852  -7.499   5.628
   60   HH12  ARG   7          2HH1      ARG   7 -13.129  -6.386   6.927
   61   HH21  ARG   7          1HH2      ARG   7  -9.815  -5.279   7.070
   62   HH22  ARG   7          2HH2      ARG   7 -11.402  -5.123   7.745
   63    H    GLN   8           H        GLN   8  -7.416 -10.674   0.567
   64    HA   GLN   8           HA       GLN   8  -7.274 -13.543   0.713
   65    HB2  GLN   8           1HB      GLN   8  -6.025 -11.455  -0.810
   66    HB3  GLN   8           2HB      GLN   8  -4.785 -12.495  -0.122
   67    HG2  GLN   8           1HG      GLN   8  -5.136 -13.914  -1.777
   68    HG3  GLN   8           2HG      GLN   8  -6.741 -14.222  -1.117
   69   HE21  GLN   8          2HE2      GLN   8  -5.033 -11.839  -3.113
   70   HE22  GLN   8          1HE2      GLN   8  -6.322 -11.606  -4.240
   71    H    LYS   9           H        LYS   9  -6.368 -14.708   2.268
   72    HA   LYS   9           HA       LYS   9  -5.364 -13.657   4.633
   73    HB2  LYS   9           1HB      LYS   9  -5.548 -16.302   3.393
   74    HB3  LYS   9           2HB      LYS   9  -4.173 -16.142   4.479
   75    HG2  LYS   9           1HG      LYS   9  -6.620 -15.056   5.609
   76    HG3  LYS   9           2HG      LYS   9  -6.753 -16.768   5.198
   77    HD2  LYS   9           1HD      LYS   9  -4.239 -16.083   6.515
   78    HD3  LYS   9           2HD      LYS   9  -5.661 -15.750   7.506
   79    HE2  LYS   9           1HE      LYS   9  -6.218 -17.946   7.685
   80    HE3  LYS   9           2HE      LYS   9  -5.596 -18.346   6.085
   81    HZ1  LYS   9           3HZ      LYS   9  -3.422 -18.477   6.888
   82    HZ2  LYS   9           1HZ      LYS   9  -4.343 -19.250   8.078
   83    HZ3  LYS   9           2HZ      LYS   9  -3.792 -17.671   8.329
   84    H    GLU  10           H        GLU  10  -3.673 -12.307   4.700
   85    HA   GLU  10           HA       GLU  10  -1.471 -12.388   2.933
   86    HB2  GLU  10           1HB      GLU  10  -2.162 -10.352   4.132
   87    HB3  GLU  10           2HB      GLU  10  -1.682 -11.089   5.655
   88    HG2  GLU  10           1HG      GLU  10   0.563 -10.897   5.200
   89    HG3  GLU  10           2HG      GLU  10   0.313 -10.836   3.456
   90    H    ILE  11           H        ILE  11  -2.106 -13.886   6.019
   91    HA   ILE  11           HA       ILE  11   0.475 -14.546   6.823
   92    HB   ILE  11           HB       ILE  11  -2.005 -16.233   7.182
   93   HG12  ILE  11          1HG1      ILE  11  -1.305 -14.763   9.518
   94   HG13  ILE  11          2HG1      ILE  11  -1.357 -13.632   8.170
   95   HG21  ILE  11          1HG2      ILE  11  -0.117 -17.541   7.742
   96   HG22  ILE  11          2HG2      ILE  11   0.659 -16.195   8.575
   97   HG23  ILE  11          3HG2      ILE  11  -0.775 -16.951   9.268
   98   HD11  ILE  11          3HD1      ILE  11  -3.571 -15.520   8.935
   99   HD12  ILE  11          1HD1      ILE  11  -3.500 -13.805   9.340
  100   HD13  ILE  11          2HD1      ILE  11  -3.618 -14.310   7.653
  101    H    ALA  12           H        ALA  12  -1.807 -16.630   5.034
  102    HA   ALA  12           HA       ALA  12  -0.053 -18.717   4.502
  103    HB1  ALA  12           1HB      ALA  12  -1.596 -19.444   2.844
  104    HB2  ALA  12           2HB      ALA  12  -2.536 -18.706   4.141
  105    HB3  ALA  12           3HB      ALA  12  -2.246 -17.816   2.646
  106    H    ASP  13           H        ASP  13  -0.689 -15.780   2.622
  107    HA   ASP  13           HA       ASP  13   0.830 -16.360   0.369
  108    HB2  ASP  13           1HB      ASP  13  -0.594 -14.435   0.363
  109    HB3  ASP  13           2HB      ASP  13   0.260 -13.725   1.731
  110    H    GLY  14           H        GLY  14   1.854 -14.549   3.272
  111    HA2  GLY  14           1HA      GLY  14   4.565 -14.342   2.484
  112    HA3  GLY  14           2HA      GLY  14   3.946 -14.108   4.112
  113    H    LEU  15           H        LEU  15   2.785 -16.815   4.200
  114    HA   LEU  15           HA       LEU  15   4.980 -18.163   5.343
  115    HB2  LEU  15           1HB      LEU  15   2.143 -18.630   4.954
  116    HB3  LEU  15           2HB      LEU  15   3.086 -20.112   4.803
  117    HG   LEU  15           HG       LEU  15   3.290 -18.281   7.185
  118   HD11  LEU  15          1HD1      LEU  15   1.844 -20.769   7.583
  119   HD12  LEU  15          2HD1      LEU  15   1.017 -19.669   6.481
  120   HD13  LEU  15          3HD1      LEU  15   1.448 -19.131   8.105
  121   HD21  LEU  15          3HD2      LEU  15   3.912 -21.214   6.999
  122   HD22  LEU  15          1HD2      LEU  15   4.413 -20.055   8.231
  123   HD23  LEU  15          2HD2      LEU  15   5.106 -19.975   6.611
  124    H    ALA  16           H        ALA  16   3.133 -18.894   2.381
  125    HA   ALA  16           HA       ALA  16   4.916 -20.937   1.526
  126    HB1  ALA  16           1HB      ALA  16   3.547 -19.962  -0.722
  127    HB2  ALA  16           2HB      ALA  16   3.146 -21.372   0.260
  128    HB3  ALA  16           3HB      ALA  16   2.437 -19.802   0.640
  129    H    SER  17           H        SER  17   4.577 -17.504   0.770
  130    HA   SER  17           HA       SER  17   6.421 -17.399  -1.347
  131    HB2  SER  17           1HB      SER  17   4.797 -15.592  -0.777
  132    HB3  SER  17           2HB      SER  17   5.785 -15.196   0.629
  133    HG   SER  17           HG       SER  17   6.617 -13.880  -0.841
  134    H    ALA  18           H        ALA  18   6.828 -17.059   2.144
  135    HA   ALA  18           HA       ALA  18   9.633 -16.459   1.955
  136    HB1  ALA  18           1HB      ALA  18   8.024 -17.280   4.370
  137    HB2  ALA  18           2HB      ALA  18   9.627 -16.543   4.373
  138    HB3  ALA  18           3HB      ALA  18   8.234 -15.623   3.803
  139    H    GLU  19           H        GLU  19   7.665 -19.315   2.516
  140    HA   GLU  19           HA       GLU  19   9.697 -21.040   3.410
  141    HB2  GLU  19           1HB      GLU  19   7.267 -21.520   3.570
  142    HB3  GLU  19           2HB      GLU  19   7.222 -21.754   1.828
  143    HG2  GLU  19           1HG      GLU  19   9.107 -23.506   2.336
  144    HG3  GLU  19           2HG      GLU  19   8.389 -23.482   3.946
  145    H    ARG  20           H        ARG  20   8.358 -20.559   0.145
  146    HA   ARG  20           HA       ARG  20  10.009 -22.361  -1.198
  147    HB2  ARG  20           1HB      ARG  20   8.474 -19.929  -2.013
  148    HB3  ARG  20           2HB      ARG  20   9.596 -20.648  -3.160
  149    HG2  ARG  20           1HG      ARG  20   7.374 -22.155  -1.801
  150    HG3  ARG  20           2HG      ARG  20   7.248 -21.419  -3.400
  151    HD2  ARG  20           1HD      ARG  20   9.625 -22.994  -3.287
  152    HD3  ARG  20           2HD      ARG  20   8.270 -23.965  -2.713
  153    HE   ARG  20           HE       ARG  20   8.751 -23.097  -5.394
  154   HH11  ARG  20          1HH1      ARG  20   6.269 -23.942  -3.104
  155   HH12  ARG  20          2HH1      ARG  20   5.124 -24.405  -4.318
  156   HH21  ARG  20          1HH2      ARG  20   7.252 -23.704  -7.003
  157   HH22  ARG  20          2HH2      ARG  20   5.684 -24.270  -6.536
  158    H    ALA  21           H        ALA  21  10.472 -18.903  -0.546
  159    HA   ALA  21           HA       ALA  21  12.872 -18.565  -1.941
  160    HB1  ALA  21           1HB      ALA  21  12.890 -16.928   0.393
  161    HB2  ALA  21           2HB      ALA  21  12.559 -16.472  -1.279
  162    HB3  ALA  21           3HB      ALA  21  11.244 -17.013  -0.235
  163    H    HIS  22           H        HIS  22  12.323 -19.377   1.479
  164    HA   HIS  22           HA       HIS  22  15.010 -19.512   2.249
  165    HB2  HIS  22           1HB      HIS  22  12.761 -19.637   3.633
  166    HB3  HIS  22           2HB      HIS  22  13.016 -21.372   3.471
  167    HD1  HIS  22           HD1      HIS  22  13.547 -21.754   5.935
  168    HD2  HIS  22           HD2      HIS  22  16.035 -18.964   4.122
  169    HE1  HIS  22           HE1      HIS  22  15.409 -21.345   7.576
  170    H    LYS  23           H        LYS  23  12.816 -22.151   1.287
  171    HA   LYS  23           HA       LYS  23  14.623 -24.247   1.424
  172    HB2  LYS  23           1HB      LYS  23  12.095 -24.296   0.964
  173    HB3  LYS  23           2HB      LYS  23  12.521 -24.053  -0.725
  174    HG2  LYS  23           1HG      LYS  23  12.512 -26.292  -0.789
  175    HG3  LYS  23           2HG      LYS  23  14.132 -26.129  -0.109
  176    HD2  LYS  23           1HD      LYS  23  13.208 -27.622   1.368
  177    HD3  LYS  23           2HD      LYS  23  12.817 -26.098   2.170
  178    HE2  LYS  23           1HE      LYS  23  10.837 -27.383   2.211
  179    HE3  LYS  23           2HE      LYS  23  10.605 -26.175   0.948
  180    HZ1  LYS  23           3HZ      LYS  23   9.901 -28.082  -0.085
  181    HZ2  LYS  23           1HZ      LYS  23  11.035 -29.071   0.689
  182    HZ3  LYS  23           2HZ      LYS  23  11.522 -28.050  -0.569
  183    H    ASP  24           H        ASP  24  13.889 -22.138  -1.341
  184    HA   ASP  24           HA       ASP  24  15.623 -23.342  -3.181
  185    HB2  ASP  24           1HB      ASP  24  14.273 -20.707  -2.946
  186    HB3  ASP  24           2HB      ASP  24  15.634 -20.807  -4.060
  187    H    LEU  25           H        LEU  25  16.158 -20.432  -1.188
  188    HA   LEU  25           HA       LEU  25  18.799 -19.965  -1.899
  189    HB2  LEU  25           1HB      LEU  25  16.991 -19.145   0.215
  190    HB3  LEU  25           2HB      LEU  25  18.656 -19.262   0.782
  191    HG   LEU  25           HG       LEU  25  19.103 -17.825  -1.406
  192   HD11  LEU  25          1HD1      LEU  25  16.300 -17.040  -0.622
  193   HD12  LEU  25          2HD1      LEU  25  16.752 -17.863  -2.114
  194   HD13  LEU  25          3HD1      LEU  25  17.327 -16.226  -1.802
  195   HD21  LEU  25          3HD2      LEU  25  18.036 -16.068   0.638
  196   HD22  LEU  25          1HD2      LEU  25  19.700 -16.294   0.096
  197   HD23  LEU  25          2HD2      LEU  25  19.019 -17.364   1.322
  198    H    ASP  26           H        ASP  26  17.503 -22.006   0.692
  199    HA   ASP  26           HA       ASP  26  19.948 -22.746   1.844
  200    HB2  ASP  26           1HB      ASP  26  17.760 -23.145   2.910
  201    HB3  ASP  26           2HB      ASP  26  17.392 -24.358   1.686
  202    H    LEU  27           H        LEU  27  17.945 -24.590  -0.463
  203    HA   LEU  27           HA       LEU  27  19.682 -26.692  -0.908
  204    HB2  LEU  27           1HB      LEU  27  17.351 -25.580  -2.175
  205    HB3  LEU  27           2HB      LEU  27  18.496 -26.147  -3.389
  206    HG   LEU  27           HG       LEU  27  16.760 -27.813  -2.755
  207   HD11  LEU  27          1HD1      LEU  27  18.526 -28.878  -3.723
  208   HD12  LEU  27          2HD1      LEU  27  18.592 -29.607  -2.119
  209   HD13  LEU  27          3HD1      LEU  27  19.684 -28.285  -2.531
  210   HD21  LEU  27          3HD2      LEU  27  18.215 -27.814  -0.112
  211   HD22  LEU  27          1HD2      LEU  27  16.957 -28.949  -0.603
  212   HD23  LEU  27          2HD2      LEU  27  16.569 -27.241  -0.389
  213    H    ALA  28           H        ALA  28  19.620 -23.502  -2.415
  214    HA   ALA  28           HA       ALA  28  21.549 -23.981  -4.405
  215    HB1  ALA  28           1HB      ALA  28  20.019 -21.795  -3.516
  216    HB2  ALA  28           2HB      ALA  28  21.705 -21.278  -3.475
  217    HB3  ALA  28           3HB      ALA  28  21.011 -21.904  -4.971
  218    H    LYS  29           H        LYS  29  21.957 -22.284  -1.289
  219    HA   LYS  29           HA       LYS  29  24.704 -22.003  -1.349
  220    HB2  LYS  29           1HB      LYS  29  22.617 -21.936   0.694
  221    HB3  LYS  29           2HB      LYS  29  24.169 -22.470   1.326
  222    HG2  LYS  29           1HG      LYS  29  23.889 -19.978  -0.322
  223    HG3  LYS  29           2HG      LYS  29  23.667 -19.987   1.429
  224    HD2  LYS  29           1HD      LYS  29  26.104 -21.336   0.524
  225    HD3  LYS  29           2HD      LYS  29  26.050 -19.613   0.144
  226    HE2  LYS  29           1HE      LYS  29  25.120 -20.068   2.823
  227    HE3  LYS  29           2HE      LYS  29  26.699 -20.819   2.596
  228    HZ1  LYS  29           3HZ      LYS  29  27.663 -18.785   2.039
  229    HZ2  LYS  29           1HZ      LYS  29  26.648 -18.408   3.339
  230    HZ3  LYS  29           2HZ      LYS  29  26.174 -18.033   1.759
  231    H    ALA  30           H        ALA  30  22.832 -24.685   0.057
  232    HA   ALA  30           HA       ALA  30  24.990 -26.217   0.946
  233    HB1  ALA  30           1HB      ALA  30  23.466 -28.058   1.075
  234    HB2  ALA  30           2HB      ALA  30  22.595 -26.591   1.525
  235    HB3  ALA  30           3HB      ALA  30  22.368 -27.294  -0.076
  236    H    SER  31           H        SER  31  23.222 -26.390  -2.140
  237    HA   SER  31           HA       SER  31  24.634 -28.489  -3.291
  238    HB2  SER  31           1HB      SER  31  22.808 -27.945  -4.570
  239    HB3  SER  31           2HB      SER  31  23.027 -26.211  -4.339
  240    HG   SER  31           HG       SER  31  24.515 -26.171  -5.927
  241    H    ALA  32           H        ALA  32  25.356 -25.029  -3.256
  242    HA   ALA  32           HA       ALA  32  27.562 -25.101  -5.003
  243    HB1  ALA  32           1HB      ALA  32  27.718 -22.896  -4.602
  244    HB2  ALA  32           2HB      ALA  32  26.173 -23.123  -3.782
  245    HB3  ALA  32           3HB      ALA  32  27.671 -23.105  -2.851
  246    H    THR  33           H        THR  33  27.498 -24.980  -1.437
  247    HA   THR  33           HA       THR  33  30.215 -25.217  -0.975
  248    HB   THR  33           HB       THR  33  29.645 -26.129   1.239
  249    HG1  THR  33           HG1      THR  33  27.913 -27.345   1.275
  250   HG21  THR  33          3HG2      THR  33  27.797 -24.299   1.741
  251   HG22  THR  33          1HG2      THR  33  28.210 -23.778   0.108
  252   HG23  THR  33          2HG2      THR  33  29.457 -23.848   1.353
  253    H    ASP  34           H        ASP  34  27.810 -27.835  -1.188
  254    HA   ASP  34           HA       ASP  34  29.540 -29.978  -0.777
  255    HB2  ASP  34           1HB      ASP  34  26.835 -29.595  -1.772
  256    HB3  ASP  34           2HB      ASP  34  27.653 -30.917  -2.600
  257    H    GLN  35           H        GLN  35  28.506 -28.504  -3.848
  258    HA   GLN  35           HA       GLN  35  29.907 -30.135  -5.593
  259    HB2  GLN  35           1HB      GLN  35  28.300 -28.530  -6.408
  260    HB3  GLN  35           2HB      GLN  35  29.269 -27.190  -5.809
  261    HG2  GLN  35           1HG      GLN  35  30.637 -28.982  -7.691
  262    HG3  GLN  35           2HG      GLN  35  29.285 -28.070  -8.358
  263   HE21  GLN  35          2HE2      GLN  35  29.309 -25.703  -7.818
  264   HE22  GLN  35          1HE2      GLN  35  30.837 -24.900  -7.885
  265    H    LEU  36           H        LEU  36  31.000 -27.151  -4.005
  266    HA   LEU  36           HA       LEU  36  33.544 -27.033  -5.164
  267    HB2  LEU  36           1HB      LEU  36  32.294 -25.302  -3.734
  268    HB3  LEU  36           2HB      LEU  36  32.974 -26.158  -2.352
  269    HG   LEU  36           HG       LEU  36  35.236 -25.658  -3.171
  270   HD11  LEU  36          1HD1      LEU  36  33.787 -24.925  -5.547
  271   HD12  LEU  36          2HD1      LEU  36  35.518 -25.169  -5.316
  272   HD13  LEU  36          3HD1      LEU  36  34.800 -23.591  -4.994
  273   HD21  LEU  36          3HD2      LEU  36  34.486 -24.126  -1.582
  274   HD22  LEU  36          1HD2      LEU  36  33.309 -23.412  -2.685
  275   HD23  LEU  36          2HD2      LEU  36  35.032 -23.110  -2.917
  276    H    LYS  37           H        LYS  37  32.644 -28.272  -1.941
  277    HA   LYS  37           HA       LYS  37  35.104 -29.262  -1.177
  278    HB2  LYS  37           1HB      LYS  37  32.432 -29.451  -0.262
  279    HB3  LYS  37           2HB      LYS  37  33.063 -31.092  -0.327
  280    HG2  LYS  37           1HG      LYS  37  33.943 -30.693   1.671
  281    HG3  LYS  37           2HG      LYS  37  35.111 -29.661   0.843
  282    HD2  LYS  37           1HD      LYS  37  33.914 -27.713   1.337
  283    HD3  LYS  37           2HD      LYS  37  32.436 -28.607   1.705
  284    HE2  LYS  37           1HE      LYS  37  33.171 -28.066   3.816
  285    HE3  LYS  37           2HE      LYS  37  33.892 -29.660   3.600
  286    HZ1  LYS  37           3HZ      LYS  37  35.244 -27.465   4.345
  287    HZ2  LYS  37           1HZ      LYS  37  35.529 -27.467   2.677
  288    HZ3  LYS  37           2HZ      LYS  37  35.950 -28.814   3.608
  289    H    LYS  38           H        LYS  38  32.617 -30.816  -3.153
  290    HA   LYS  38           HA       LYS  38  33.889 -33.331  -3.357
  291    HB2  LYS  38           1HB      LYS  38  31.888 -31.962  -5.160
  292    HB3  LYS  38           2HB      LYS  38  32.403 -33.631  -5.359
  293    HG2  LYS  38           1HG      LYS  38  31.603 -33.300  -2.665
  294    HG3  LYS  38           2HG      LYS  38  30.358 -32.586  -3.693
  295    HD2  LYS  38           1HD      LYS  38  30.311 -34.683  -5.013
  296    HD3  LYS  38           2HD      LYS  38  31.469 -35.386  -3.882
  297    HE2  LYS  38           1HE      LYS  38  29.847 -34.985  -2.051
  298    HE3  LYS  38           2HE      LYS  38  28.685 -34.413  -3.247
  299    HZ1  LYS  38           3HZ      LYS  38  28.076 -36.588  -3.071
  300    HZ2  LYS  38           1HZ      LYS  38  29.642 -37.135  -2.739
  301    HZ3  LYS  38           2HZ      LYS  38  29.208 -36.725  -4.321
  302    H    ALA  39           H        ALA  39  34.015 -30.412  -5.346
  303    HA   ALA  39           HA       ALA  39  35.516 -31.444  -7.475
  304    HB1  ALA  39           1HB      ALA  39  34.367 -29.291  -7.574
  305    HB2  ALA  39           2HB      ALA  39  35.499 -28.628  -6.394
  306    HB3  ALA  39           3HB      ALA  39  36.075 -29.125  -7.985
  307    H    LYS  40           H        LYS  40  36.631 -29.615  -4.622
  308    HA   LYS  40           HA       LYS  40  39.371 -29.819  -5.162
  309    HB2  LYS  40           1HB      LYS  40  39.665 -29.333  -2.731
  310    HB3  LYS  40           2HB      LYS  40  38.580 -28.220  -3.552
  311    HG2  LYS  40           1HG      LYS  40  36.666 -29.568  -2.683
  312    HG3  LYS  40           2HG      LYS  40  37.829 -30.487  -1.724
  313    HD2  LYS  40           1HD      LYS  40  36.943 -28.805  -0.301
  314    HD3  LYS  40           2HD      LYS  40  38.576 -28.294  -0.734
  315    HE2  LYS  40           1HE      LYS  40  37.005 -27.199  -2.722
  316    HE3  LYS  40           2HE      LYS  40  36.013 -27.025  -1.274
  317    HZ1  LYS  40           3HZ      LYS  40  38.689 -26.311  -0.710
  318    HZ2  LYS  40           1HZ      LYS  40  37.290 -25.367  -0.593
  319    HZ3  LYS  40           2HZ      LYS  40  38.142 -25.439  -2.052
  320    H    ALA  41           H        ALA  41  37.253 -31.869  -3.184
  321    HA   ALA  41           HA       ALA  41  39.152 -33.615  -2.163
  322    HB1  ALA  41           1HB      ALA  41  37.052 -35.273  -2.474
  323    HB2  ALA  41           2HB      ALA  41  37.173 -34.074  -1.187
  324    HB3  ALA  41           3HB      ALA  41  36.248 -33.713  -2.644
  325    H    GLU  42           H        GLU  42  37.321 -33.863  -5.204
  326    HA   GLU  42           HA       GLU  42  38.500 -36.295  -6.036
  327    HB2  GLU  42           1HB      GLU  42  36.370 -35.428  -6.940
  328    HB3  GLU  42           2HB      GLU  42  37.248 -34.123  -7.725
  329    HG2  GLU  42           1HG      GLU  42  36.829 -35.737  -9.384
  330    HG3  GLU  42           2HG      GLU  42  38.537 -35.881  -8.973
  331    H    ALA  43           H        ALA  43  39.368 -32.922  -6.490
  332    HA   ALA  43           HA       ALA  43  41.585 -33.626  -8.244
  333    HB1  ALA  43           1HB      ALA  43  41.190 -30.851  -7.257
  334    HB2  ALA  43           2HB      ALA  43  41.686 -31.428  -8.848
  335    HB3  ALA  43           3HB      ALA  43  39.993 -31.523  -8.364
  336    H    GLN  44           H        GLN  44  41.305 -34.175  -5.208
  337    HA   GLN  44           HA       GLN  44  43.202 -32.679  -3.811
  338    HB2  GLN  44           1HB      GLN  44  43.215 -34.448  -2.193
  339    HB3  GLN  44           2HB      GLN  44  41.575 -34.290  -2.807
  340    HG2  GLN  44           1HG      GLN  44  41.920 -36.210  -4.261
  341    HG3  GLN  44           2HG      GLN  44  43.577 -36.361  -3.680
  342   HE21  GLN  44          2HE2      GLN  44  41.015 -38.031  -3.533
  343   HE22  GLN  44          1HE2      GLN  44  40.938 -38.502  -1.873
  344    H    VAL  45           H        VAL  45  43.585 -35.203  -6.154
  345    HA   VAL  45           HA       VAL  45  46.116 -36.172  -5.567
  346    HB   VAL  45           HB       VAL  45  44.658 -37.081  -7.347
  347   HG11  VAL  45          1HG1      VAL  45  45.650 -34.956  -9.200
  348   HG12  VAL  45          2HG1      VAL  45  44.256 -36.026  -9.363
  349   HG13  VAL  45          3HG1      VAL  45  44.205 -34.675  -8.229
  350   HG21  VAL  45          3HG2      VAL  45  46.407 -37.787  -8.772
  351   HG22  VAL  45          1HG2      VAL  45  47.326 -36.306  -8.500
  352   HG23  VAL  45          2HG2      VAL  45  47.154 -37.488  -7.203
  353    H    ILE  46           H        ILE  46  45.161 -33.148  -7.045
  354    HA   ILE  46           HA       ILE  46  48.004 -32.411  -7.295
  355    HB   ILE  46           HB       ILE  46  46.733 -32.411  -9.435
  356   HG12  ILE  46          1HG1      ILE  46  47.399 -30.065 -10.088
  357   HG13  ILE  46          2HG1      ILE  46  47.767 -29.768  -8.393
  358   HG21  ILE  46          1HG2      ILE  46  45.038 -30.742  -9.848
  359   HG22  ILE  46          2HG2      ILE  46  44.562 -31.736  -8.472
  360   HG23  ILE  46          3HG2      ILE  46  45.209 -30.117  -8.207
  361   HD11  ILE  46          3HD1      ILE  46  49.025 -32.126  -9.659
  362   HD12  ILE  46          1HD1      ILE  46  49.602 -30.532 -10.143
  363   HD13  ILE  46          2HD1      ILE  46  49.657 -31.012  -8.447
  364    H    ILE  47           H        ILE  47  48.745 -30.648  -6.245
  365    HA   ILE  47           HA       ILE  47  47.178 -29.537  -4.145
  366    HB   ILE  47           HB       ILE  47  49.599 -29.808  -3.919
  367   HG12  ILE  47          1HG1      ILE  47  50.107 -27.558  -3.002
  368   HG13  ILE  47          2HG1      ILE  47  48.682 -26.925  -3.819
  369   HG21  ILE  47          1HG2      ILE  47  49.851 -27.590  -5.944
  370   HG22  ILE  47          2HG2      ILE  47  51.165 -28.425  -5.117
  371   HG23  ILE  47          3HG2      ILE  47  50.159 -29.295  -6.275
  372   HD11  ILE  47          3HD1      ILE  47  47.274 -28.419  -2.482
  373   HD12  ILE  47          1HD1      ILE  47  48.711 -29.003  -1.643
  374   HD13  ILE  47          2HD1      ILE  47  48.220 -27.316  -1.483
  375    H    GLU  48           H        GLU  48  46.313 -27.497  -3.912
  376    HA   GLU  48           HA       GLU  48  46.564 -25.538  -6.022
  377    HB2  GLU  48           1HB      GLU  48  44.120 -25.390  -6.412
  378    HB3  GLU  48           2HB      GLU  48  44.811 -26.910  -6.962
  379    HG2  GLU  48           1HG      GLU  48  44.081 -27.786  -4.631
  380    HG3  GLU  48           2HG      GLU  48  43.018 -26.380  -4.638
  381    H    GLN  49           H        GLN  49  46.770 -23.655  -5.029
  382    HA   GLN  49           HA       GLN  49  45.285 -23.214  -2.522
  383    HB2  GLN  49           1HB      GLN  49  48.123 -22.972  -3.103
  384    HB3  GLN  49           2HB      GLN  49  47.456 -21.476  -2.466
  385    HG2  GLN  49           1HG      GLN  49  46.393 -23.101  -0.690
  386    HG3  GLN  49           2HG      GLN  49  47.739 -24.133  -1.172
  387   HE21  GLN  49          2HE2      GLN  49  48.279 -23.787   1.134
  388   HE22  GLN  49          1HE2      GLN  49  49.243 -22.411   1.540
  389    H    ALA  50           H        ALA  50  44.574 -21.070  -2.102
  390    HA   ALA  50           HA       ALA  50  43.620 -19.712  -4.414
  391    HB1  ALA  50           1HB      ALA  50  42.381 -18.402  -2.974
  392    HB2  ALA  50           2HB      ALA  50  42.597 -19.875  -2.028
  393    HB3  ALA  50           3HB      ALA  50  43.600 -18.462  -1.701
  394    H    ASN  51           H        ASN  51  43.832 -17.168  -4.356
  395    HA   ASN  51           HA       ASN  51  46.643 -16.430  -3.935
  396    HB2  ASN  51           1HB      ASN  51  46.581 -15.201  -6.122
  397    HB3  ASN  51           2HB      ASN  51  46.517 -16.954  -6.279
  398   HD21  ASN  51          2HD2      ASN  51  44.443 -17.931  -6.675
  399   HD22  ASN  51          1HD2      ASN  51  43.231 -17.045  -7.530
  400    H    LYS  52           H        LYS  52  46.859 -14.571  -2.879
  401    HA   LYS  52           HA       LYS  52  44.831 -12.489  -3.151
  402    HB2  LYS  52           1HB      LYS  52  44.689 -12.193  -0.702
  403    HB3  LYS  52           2HB      LYS  52  44.065 -13.752  -1.227
  404    HG2  LYS  52           1HG      LYS  52  45.755 -14.921  -0.239
  405    HG3  LYS  52           2HG      LYS  52  46.910 -13.594  -0.387
  406    HD2  LYS  52           1HD      LYS  52  46.361 -13.868   1.933
  407    HD3  LYS  52           2HD      LYS  52  45.626 -12.368   1.361
  408    HE2  LYS  52           1HE      LYS  52  43.575 -13.097   1.838
  409    HE3  LYS  52           2HE      LYS  52  43.853 -14.628   1.009
  410    HZ1  LYS  52           3HZ      LYS  52  44.832 -15.537   2.961
  411    HZ2  LYS  52           1HZ      LYS  52  43.359 -14.840   3.417
  412    HZ3  LYS  52           2HZ      LYS  52  44.812 -14.043   3.755
  413    H    ARG  53           H        ARG  53  45.558 -10.479  -1.870
  414    HA   ARG  53           HA       ARG  53  47.065  -8.783  -1.694
  415    HB2  ARG  53           1HB      ARG  53  48.631 -11.159  -0.751
  416    HB3  ARG  53           2HB      ARG  53  49.416  -9.593  -0.896
  417    HG2  ARG  53           1HG      ARG  53  48.322  -8.723   0.879
  418    HG3  ARG  53           2HG      ARG  53  46.852  -9.648   0.565
  419    HD2  ARG  53           1HD      ARG  53  47.596 -11.482   1.721
  420    HD3  ARG  53           2HD      ARG  53  49.294 -11.113   1.426
  421    HE   ARG  53           HE       ARG  53  49.322  -9.927   3.375
  422   HH11  ARG  53          1HH1      ARG  53  46.018 -10.316   2.350
  423   HH12  ARG  53          2HH1      ARG  53  45.352  -9.618   3.790
  424   HH21  ARG  53          1HH2      ARG  53  48.458  -9.007   5.275
  425   HH22  ARG  53          2HH2      ARG  53  46.741  -8.873   5.452