*HEADER    METAL BINDING PROTEIN                   08-JAN-02   1KQV              
*TITLE     FAMILY OF NMR SOLUTION STRUCTURES OF CA LN CALBINDIN D9K              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VITAMIN D-DEPENDENT CALCIUM-BINDING PROTEIN;               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: CABP, CALBINDIN D9K;                                        
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: BOS TAURUS;                                     
*SOURCE   3 ORGANISM_COMMON: BOVINE;                                             
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    CALCIUM BINDING PROTEINS, NMR SOLUTION STRUCTURE,                     
*KEYWDS   2 PARAMAGNETISM-BASED CONSTRAINTS                                      
*EXPDTA    NMR, 30 STRUCTURES                                                    
*AUTHOR    I.BERTINI, A.DONAIRE, B.JIMENEZ, C.LUCHINAT, G.PARIGI,                
*AUTHOR   2 M.PICCIOLI, L.POGGI                                                  
*REVDAT   1   16-JAN-02 1KQV    0                                                
#
1D-NOE as upper limit constraints

 54 ASP-
         HA     54 ASP- HB2     4.00
         HA     54 ASP- HB3     4.00
         HA     54 ASP- HN      4.00
         HA     55 LYS+ HN      3.50
         HA     61 VAL  QG2     6.00
 56 ASN
         HD22   56 ASN  HD21    3.50
         HD22   56 ASN  HA      5.00
 58 ASP-                            
         HN     59 GLY  HN      5.00
         HN     58 ASP- HA      3.50 
         HN     57 GLY  HN      4.00
         HN     58 ASP- HB2     4.00
 59 GLY
         HN     59 GLY  HA1     6.00
         HN     59 GLY  HA2     4.00
         HN     57 GLY  HN      5.10
 60 GLU-
         HN     59 GLY  HN      4.00
         HN     59 GLY  HA1     6.00
         HN     59 GLY  HA2     4.00
         HN     60 GLU- HA      4.00
         HN     60 GLU- HB2     4.00
         HN     60 GLU- HB3     4.00
         HN     61 VAL  HN      6.00
 61 VAL
         HA     61 VAL  HN      4.00
         HA     61 VAL  HB      5.00
         HA     61 VAL  QG1     4.50
         HA     61 VAL  QG1     4.50
         HA     62 SER  HN      6.00
         HA     65 GLU- HB2     5.00
         HA     65 GLU- HB3     5.00
 62 SER
         HG     65 GLU- HG2     5.00
         HG     65 GLU- HG3     5.00
#
Hydrogen bonds as upper limit constraints

  6 LEU
         HN      3 PRO  O       2.20
         N       3 PRO  O       3.30
  9 ILE
         HN      5 GLU  O       2.20
         N       5 GLU  O       3.30
 10 PHE
         HN      6 LEU  O       2.20
         N       6 LEU  O       3.30
 13 TYR 
         HN     10 PHE  O       2.20
         N      10 PHE  O       3.30
 14 ALA
         HN     10 PHE  O       2.20
         N      10 PHE  O       3.30
 15 ALA
         HN     11 GLU  O       2.20
         N      11 GLU  O       3.30
 17 GLU 
         HN     27 GLU  OE2     2.20
         N      27 GLU  OE2     3.30
 21 ASN
         HN     19 ASP  OD1     2.20
         N      19 ASP  OD1     3.30
 28 LEU 
         HN     24 SER  O       2.20
         N      24 SER  O       3.30
 32 LEU 
         HN     28 LEU  O       2.20
         N      28 LEU  O       3.30
 35 GLU
         HN     31 LEU  O       2.20
         N      31 LEU  O       3.30
 41 LYS
         HN     38 SER  O       2.20
         N      38 SER  O       3.30
 49 LEU  
         HN     45 THR  O       2.20
         N      45 THR  O       3.30
 53 LEU
         HN     49 LEU  O       2.20
         N      49 LEU  O       3.30
 75 GLN
         HN     71 LYS  O       2.20
         N      71 LYS  O       3.30
#
Metal-to-ligand distances as lower limit constraints

105 LTNS
         ME     54 ASP- OD1     2.15  5.00E+00
         ME     56 ASN  OD1     2.15  5.00E+00
         ME     58 ASP- OD1     2.15  5.00E+00
         ME     60 GLU- O       2.15  5.00E+00
         ME     65 GLU- OE1     2.15  5.00E+00
         ME     65 GLU- OE2     2.15  5.00E+00
115 LTNS
         ME     54 ASP- OD1     2.15  5.00E+00
         ME     56 ASN  OD1     2.15  5.00E+00
         ME     58 ASP- OD1     2.15  5.00E+00
         ME     60 GLU- O       2.15  5.00E+00
         ME     65 GLU- OE1     2.15  5.00E+00
         ME     65 GLU- OE2     2.15  5.00E+00
125 LTNS
         ME     54 ASP- OD1     2.15  5.00E+00
         ME     56 ASN  OD1     2.15  5.00E+00
         ME     58 ASP- OD1     2.15  5.00E+00
         ME     60 GLU- O       2.15  5.00E+00
         ME     65 GLU- OE1     2.15  5.00E+00
         ME     65 GLU- OE2     2.15  5.00E+00
135 LTNS
         ME     54 ASP- OD1     2.15  5.00E+00
         ME     56 ASN  OD1     2.15  5.00E+00
         ME     58 ASP- OD1     2.15  5.00E+00
         ME     60 GLU- O       2.15  5.00E+00
         ME     65 GLU- OE1     2.15  5.00E+00
         ME     65 GLU- OE2     2.15  5.00E+00
145 LTNS
         ME     54 ASP- OD1     2.15  5.00E+00
         ME     56 ASN  OD1     2.15  5.00E+00
         ME     58 ASP- OD1     2.15  5.00E+00
         ME     60 GLU- O       2.15  5.00E+00
         ME     65 GLU- OE1     2.15  5.00E+00
         ME     65 GLU- OE2     2.15  5.00E+00
155 LTNS
         ME     54 ASP- OD1     2.15  5.00E+00
         ME     56 ASN  OD1     2.15  5.00E+00
         ME     58 ASP- OD1     2.15  5.00E+00
         ME     60 GLU- O       2.15  5.00E+00
         ME     65 GLU- OE1     2.15  5.00E+00
         ME     65 GLU- OE2     2.15  5.00E+00
165 LTNS
         ME     54 ASP- OD1     2.15  5.00E+00
         ME     56 ASN  OD1     2.15  5.00E+00
         ME     58 ASP- OD1     2.15  5.00E+00
         ME     60 GLU- O       2.15  5.00E+00
         ME     65 GLU- OE1     2.15  5.00E+00
         ME     65 GLU- OE2     2.15  5.00E+00
175 LTNS
         ME     54 ASP- OD1     2.15  5.00E+00
         ME     56 ASN  OD1     2.15  5.00E+00
         ME     58 ASP- OD1     2.15  5.00E+00
         ME     60 GLU- O       2.15  5.00E+00
         ME     65 GLU- OE1     2.15  5.00E+00
         ME     65 GLU- OE2     2.15  5.00E+00
185 LTNS
         ME     54 ASP- OD1     2.15  5.00E+00
         ME     56 ASN  OD1     2.15  5.00E+00
         ME     58 ASP- OD1     2.15  5.00E+00
         ME     60 GLU- O       2.15  5.00E+00
         ME     65 GLU- OE1     2.15  5.00E+00
         ME     65 GLU- OE2     2.15  5.00E+00
195 LTNS
         ME     54 ASP- OD1     2.15  5.00E+00
         ME     56 ASN  OD1     2.15  5.00E+00
         ME     58 ASP- OD1     2.15  5.00E+00
         ME     60 GLU- O       2.15  5.00E+00
         ME     65 GLU- OE1     2.15  5.00E+00
         ME     65 GLU- OE2     2.15  5.00E+00
205 LTNS
         ME     54 ASP- OD1     2.15  5.00E+00
         ME     56 ASN  OD1     2.15  5.00E+00
         ME     58 ASP- OD1     2.15  5.00E+00
         ME     60 GLU- O       2.15  5.00E+00
         ME     65 GLU- OE1     2.15  5.00E+00
         ME     65 GLU- OE2     2.15  5.00E+00
#
Metal-to-ligand distances as upper limit constraints

105 LTNS
         ME     54 ASP- OD1     3.50  #5.00E+00
         ME     56 ASN  OD1     3.50  #5.00E+00
         ME     58 ASP- OD1     3.50  #5.00E+00
         ME     60 GLU- O       3.50  #5.00E+00
         ME     65 GLU- OE1     3.50  #5.00E+00
115 LTNS
         ME     54 ASP- OD1     3.50  #5.00E+00
         ME     56 ASN  OD1     3.50  #5.00E+00
         ME     58 ASP- OD1     3.50  #5.00E+00
         ME     60 GLU- O       3.50  #5.00E+00
         ME     65 GLU- OE1     3.50  #5.00E+00
125 LTNS
         ME     54 ASP- OD1     3.50  #5.00E+00
         ME     56 ASN  OD1     3.50  #5.00E+00
         ME     58 ASP- OD1     3.50  #5.00E+00
         ME     60 GLU- O       3.50  #5.00E+00
         ME     65 GLU- OE1     3.50  #5.00E+00
135 LTNS
         ME     54 ASP- OD1     3.50  #5.00E+00
         ME     56 ASN  OD1     3.50  #5.00E+00
         ME     58 ASP- OD1     3.50  #5.00E+00
         ME     60 GLU- O       3.50  #5.00E+00
         ME     65 GLU- OE1     3.50  #5.00E+00
145 LTNS
         ME     54 ASP- OD1     3.50  #5.00E+00
         ME     56 ASN  OD1     3.50  #5.00E+00
         ME     58 ASP- OD1     3.50  #5.00E+00
         ME     60 GLU- O       3.50  #5.00E+00
         ME     65 GLU- OE1     3.50  #5.00E+00
155 LTNS
         ME     54 ASP- OD1     3.50  #5.00E+00
         ME     56 ASN  OD1     3.50  #5.00E+00
         ME     58 ASP- OD1     3.50  #5.00E+00
         ME     60 GLU- O       3.50  #5.00E+00
         ME     65 GLU- OE1     3.50  #5.00E+00
165 LTNS
         ME     54 ASP- OD1     3.50  #5.00E+00
         ME     56 ASN  OD1     3.50  #5.00E+00
         ME     58 ASP- OD1     3.50  #5.00E+00
         ME     60 GLU- O       3.50  #5.00E+00
         ME     65 GLU- OE1     3.50  #5.00E+00
175 LTNS
         ME     54 ASP- OD1     3.50  #5.00E+00
         ME     56 ASN  OD1     3.50  #5.00E+00
         ME     58 ASP- OD1     3.50  #5.00E+00
         ME     60 GLU- O       3.50  #5.00E+00
         ME     65 GLU- OE1     3.50  #5.00E+00
185 LTNS
         ME     54 ASP- OD1     3.50  #5.00E+00
         ME     56 ASN  OD1     3.50  #5.00E+00
         ME     58 ASP- OD1     3.50  #5.00E+00
         ME     60 GLU- O       3.50  #5.00E+00
         ME     65 GLU- OE1     3.50  #5.00E+00
195 LTNS
         ME     54 ASP- OD1     3.50  #5.00E+00
         ME     56 ASN  OD1     3.50  #5.00E+00
         ME     58 ASP- OD1     3.50  #5.00E+00
         ME     60 GLU- O       3.50  #5.00E+00
         ME     65 GLU- OE1     3.50  #5.00E+00
205 LTNS
         ME     54 ASP- OD1     3.50  #5.00E+00
         ME     56 ASN  OD1     3.50  #5.00E+00
         ME     58 ASP- OD1     3.50  #5.00E+00
         ME     60 GLU- O       3.50  #5.00E+00
         ME     65 GLU- OE1     3.50  #5.00E+00
#
NOESY as upper limit constraints

  1 LYS+ 
         HN      1 LYS+ HA      5.60  #     2     1115.0  e   1ceaug     2
         HN      1 LYS+ HB2     7.00  #   w 2      267.0  e   1ceaug  1384
         HN      1 LYS+ HB3     7.00  #   w 2         .0  e   1ceaug  1001
         HN      1 LYS+ QG      6.70  # m   1     1221.5*2e   1ceaug  2689
         HN      1 LYS+ QD      7.60  # m   1      477.5*2e   1ceaug  1385
         HN      2 SER  HN      7.00  #   w 2      229.0  e   1ceaug  1197
         HA      1 LYS+ HB2     3.20 <#     2    31560.0  e   1ceaug  1380
         HA      1 LYS+ HB3     4.10 >#     2     7270.0  e   1ceaug  1002
         HA      1 LYS+ QG      5.60  # i   1     2620.0*2e   1ceaug  1382
         HA      1 LYS+ QD      5.80  # m   1     3510.5*2e   1ceaug  1381
         HB2     1 LYS+ QG      4.90  # m   1    11945.0*2e   1ceaug  4946
         HB2     1 LYS+ QD      4.70  # m   1    17465.0*2e   1ceaug  4947
         HB3     1 LYS+ QG      4.50  # m   1    21280.0*2e   1ceaug  2683
         HB3     1 LYS+ QD      4.40  # m   1    26370.0*2e   1ceaug  2684
         QG      1 LYS+ QD      5.00  # mm  1    56175.0*4e   1ceaug  2685
         QD      1 LYS+ QE      7.30  # mm  1     1824.8*4e   1ceaug  1383
         QD      2 SER  HN      8.00  # m w 5     1073.5*2e   1ceaug  1484
  2 SER  
         HN      2 SER  HA      3.50  #     2    20620.0  e   1ceaug     6
         HN      2 SER  HB2     3.20  #     2    31050.0  e   1ceaug  1004
         HN      2 SER  HB3     3.70  #     2    12900.0  e   1ceaug  1003
         HN      3 PRO  QD      8.00  # m w 5      860.5*2e   1ceaug  1198
         HN      4 GLU- HN      7.00  #     3     1319.0  e   1ceaug  3873
         HN      5 GLU- HN      5.20  #     3     4506.0  e   1ceaug  1388
         HN      5 GLU- HA      7.00  #   w 3      827.0  e   1ceaug  4952
         HN      5 GLU- HB2     4.80  #     3     6267.0  e   1ceaug  1390
         HN      5 GLU- HB3     4.20  #     3    10290.0  e   1ceaug  1389
         HN      5 GLU- HG2     7.00 >#   w 5     1503.0  e   1ceaug  3880
         HN      5 GLU- HG3     4.60 <#     5    15300.0  e   1ceaug  3877
         HN      6 LEU  HN      7.00  #   w 3      976.0  e   1ceaug  3882
         HA      2 SER  HB2     3.30 <#     2    25290.0  e   1ceaug  1771
         HA      2 SER  HB3     4.10 >#     2     7709.0  e   1ceaug  1773
         HA      3 PRO  QD      5.00  # m   5    27055.0*2e   1ceaug  2249
         HA      4 GLU- HN      5.30  #     3     4039.0  e   1ceaug  3872
         HB2     4 GLU- HN      6.60 >#     3     1670.0  e   1ceaug  3874
         HB2     5 GLU- HN      6.80  #     3     1496.0  e   1ceaug  4953
         HB3     3 PRO  QD      5.40  # m   5    18110.0*2e   1ceaug  2255
         HB3     4 GLU- HN      5.10 <#     3     4909.0  e   1ceaug  1395
         HB3     5 GLU- HN      6.80  #     3     1561.0  e   1ceaug  1397
  3 PRO  
         HA      3 PRO  HB2     3.40 >#     2    22610.0  e   1ceaug     9
         HA      3 PRO  HB3     2.80 <#     2    80740.0  e   1ceaug    11
         HA      3 PRO  HG2     4.20  #     1     8082.0  e   1ceaug  1775
         HA      3 PRO  HG3     4.40  #     1     5881.0  e   1ceaug  2693
         HA      3 PRO  QD      5.90  # m   1     2946.5*2e   1ceaug  3868
         HA      4 GLU- HN      4.00  #     2     8176.0  e   1ceaug    13
         HA      5 GLU- HN      6.10  #     3     2365.0  e   1ceaug  3883
         HA      6 LEU  HN      4.90  #     3     5681.0  e   1ceaug  3884
         HA      6 LEU  HB2     4.30  #     3     9628.0  e   1ceaug  3885
         HA      6 LEU  QD1     7.00 <#     5M   11360.0  e   1ceaug  3888
         HA      6 LEU  QD2     8.00 >#     5M    1195.0  e   1ceaug  3887
         HA      7 LYS+ HN      5.10  #     3     4667.0  e   1ceaug  4858
         HB2     3 PRO  HG3     3.10  #     1    49980.0  e   1ceaug  2704
         HB2     3 PRO  QD      4.80 <# m   1    15015.0*2e   1ceaug  2697
         HB2     4 GLU- HN      3.50 <#     2    19020.0  e   1ceaug    17
         HB2     6 LEU  HB2     7.00  #   w 5         .0  e   1ceaug  5198
         HB2     6 LEU  HB3     6.80  #     5     3325.0  e   1ceaug  3892
         HB2     6 LEU  QD1     7.70  #     5M    7923.0  e   1ceaug  3895
         HB2     6 LEU  QD2     8.00  #     5M    2475.0  e   1ceaug  3894
         HB3     3 PRO  HG2     3.50  #     1    24760.0  e   1ceaug  2701
         HB3     3 PRO  HG3     3.70  #     1    15820.0  e   1ceaug  2700
         HB3     3 PRO  QD      5.50 ># m   1     5090.0*2e   1ceaug  2699
         HB3     4 GLU- HN      4.40 >#     2     4825.0  e   1ceaug    19
         HB3     6 LEU  HB3     7.00  #   w 5      718.0  e   1ceaug  3891
         HB3     6 LEU  HG      7.00  #   w 5     1900.0  e   1ceaug  3890
         HG2     3 PRO  QD      4.50  # m   1    22100.0*2e   1ceaug  2698
         HG2     4 GLU- HN      5.40  #     5     8435.0  e   1ceaug  1396
         HG3     3 PRO  QD      4.20  # m   1    40395.0*2e   1ceaug  1776
         HG3     4 GLU- HN      6.00  #     5     5480.0  e   1ceaug  1200
         QD      4 GLU- HN      6.40  # m   5     8055.0*2e   1ceaug  1199
  4 GLU- 
         HN      4 GLU- HA      3.10  #     2    40580.0  e   1ceaug    22
         HN      4 GLU- HB2     3.00  #     2    48620.0  e   1ceaug    25
         HN      4 GLU- HB3     3.30  #     2    26600.0  e   1ceaug    24
         HN      4 GLU- HG2     3.90  #     1    11560.0  e   1ceaug  2715
         HN      4 GLU- HG3     4.20  #     1     7131.0  e   1ceaug  1009
         HN      5 GLU- HN      3.20  #     2    31430.0  e   1ceaug  1201
         HN      6 LEU  HN      5.40  #     3     3716.0  e   1ceaug  3898
         HN      7 LYS+ HN      7.00  #   w 3     1041.0  e   1ceaug  3909
         HA      4 GLU- HB2     3.10  #     2    41850.0  e   1ceaug    29
         HA      4 GLU- HB3     3.20  #     2    35660.0  e   1ceaug    27
         HA      4 GLU- HG2     3.10  #     1    45930.0  e   1ceaug  2714
         HA      4 GLU- HG3     3.60  #     1    20510.0  e   1ceaug  2710
         HA      5 GLU- HN      3.70  #     2    14750.0  e   1ceaug    31
         HA      6 LEU  HN      6.70  #     3     1567.0  e   1ceaug  3900
         HA      7 LYS+ HN      3.90  #     3    14360.0  e   1ceaug  1722
         HA      7 LYS+ HB2     3.50  #     3    23000.0  e   1ceaug  1724
         HA      7 LYS+ HB3     3.90  #     3    14390.0  e   1ceaug  1723
         HA      7 LYS+ HG3     5.30  #     5     8708.0  e   1ceaug  3913
         HA      7 LYS+ QD      7.70  # m   5     3409.0*2e   1ceaug  3915
         HA      8 GLY  HN      4.60  #     3     7200.0  e   1ceaug  1725
         HB2     4 GLU- HG2     3.50  #     1    22910.0  e   1ceaug  1780
         HB2     4 GLU- HG3     3.40  #     1    26160.0  e   1ceaug  2708
         HB2     5 GLU- HN      3.80  #     2    11550.0  e   1ceaug  3870
         HB3     4 GLU- HG2     3.20  #     1    43390.0  e   1ceaug  2712
         HB3     4 GLU- HG3     3.40  #     1    28520.0  e   1ceaug  2709
         HB3     5 GLU- HN      3.50  #     2    19710.0  e   1ceaug  1538
  5 GLU- 
         HN      5 GLU- HA      3.40  #     2    24600.0  e   1ceaug    38
         HN      5 GLU- HB2     3.40  #     2    24700.0  e   1ceaug  1013
         HN      5 GLU- HB3     3.00  #     2    44620.0  e   1ceaug  1010
         HN      5 GLU- HG2     3.90  #     1    12090.0  e   1ceaug  1011
         HN      5 GLU- HG3     3.70  #     1    17550.0  e   1ceaug  1012
         HN      6 LEU  HN      3.10  #     2    36540.0  e   1ceaug  1202
         HN      7 LYS+ HN      4.30  #     3     9379.0  e   1ceaug  5131
         HN      8 GLY  HN      5.40  #     3     3717.0  e   1ceaug  3922
         HA      5 GLU- HB2     3.30  #     2    27690.0  e   1ceaug  2734
         HA      5 GLU- HB3     3.80  #     2    11140.0  e   1ceaug  2723
         HA      5 GLU- HG2     4.30 >#     1     6648.0  e   1ceaug  2721
         HA      5 GLU- HG3     3.30 <#     1    34170.0  e   1ceaug  3866
         HA      6 LEU  HN      4.10  #     2     7535.0  e   1ceaug    41
         HA      8 GLY  HN      4.70  #     3     6937.0  e   1ceaug  1726
         HA      8 GLY  HA2     5.90  #     3     2754.0  e   1ceaug  5124
         HA      9 ILE  HN      7.00  #   w 3     1182.0  e   1ceaug  3940
         HB2     5 GLU- HG2     3.20  #     1    37100.0  e   1ceaug  2733
         HB2     5 GLU- HG3     3.30  #     1    32970.0  e   1ceaug  2732
         HB2     6 LEU  HN      4.00  #     2     9154.0  e   1ceaug  4044
         HB2     7 LYS+ HN      7.00  #   w 3      843.0  e   1ceaug  5134
         HB3     5 GLU- HG2     3.30  #     1    35040.0  e   1ceaug  2728
         HB3     5 GLU- HG3     3.50  #     1    21630.0  e   1ceaug  2731
         HB3     6 LEU  HN      3.60  #     2    15030.0  e   1ceaug  1899
         HB3     6 LEU  HB2     6.60  #     5     3698.0  e   1ceaug  5199
         HG2     6 LEU  HN      6.90 >#     5     3043.0  e   1ceaug  4101
         HG3     6 LEU  HN      5.20 <#     5     9353.0  e   1ceaug  5313
  6 LEU  
         HN      6 LEU  HA      3.30  #     2    26380.0  e   1ceaug    44
         HN      6 LEU  HB2     3.00 <#     2    52500.0  e   1ceaug    48
         HN      6 LEU  HB3     3.60 >#     2    15110.0  e   1ceaug    46
         HN      6 LEU  HG      3.10  #     1    48360.0  e   1ceaug  1016
         HN      6 LEU  QD1     5.10  #     1M    5354.0  e   1ceaug  1857
         HN      6 LEU  QD2     4.90  #     1M    6897.0  e   1ceaug  1788
         HN      7 LYS+ HN      3.00  #     2    44980.0  e   1ceaug  1203
         HN      8 GLY  HN      5.00  #     3     5402.0  e   1ceaug  5118
         HN      9 ILE  HN      6.00  #     3     2438.0  e   1ceaug  3942
         HN      9 ILE  HB      6.20  #     3     2209.0  e   1ceaug  3941
         HA      6 LEU  HB2     3.60  #     2    16190.0  e   1ceaug    51
         HA      6 LEU  HB3     3.30  #     2    28560.0  e   1ceaug    49
         HA      6 LEU  HG      4.00  #     1     9719.0  e   1ceaug  1017
         HA      6 LEU  QD1     4.60 >#     1M    9647.0  e   1ceaug  1015
         HA      6 LEU  QD2     3.40 <#     1M   67200.0  e   1ceaug  1014
         HA      7 LYS+ HN      4.00  #     2     8330.0  e   1ceaug    53
         HA      7 LYS+ HA      5.70  #     2      964.0  e   1ceaug  5126
         HA      8 GLY  HN      5.40  #     3     3952.0  e   1ceaug  5120
         HA      9 ILE  HN      4.00  #     3    13200.0  e   1ceaug  1727
         HA      9 ILE  HB      3.90  #     3    13760.0  e   1ceaug  3947
         HA      9 ILE  QG2     8.00  #     5M    2310.0  e   1ceaug  3948
         HA      9 ILE  HG13    7.00  #   w 5     2152.0  e   1ceaug  3949
         HA     66 PHE  QE      9.00  # r w 5      663.0*2e   1ceaug  4022
         HB2     6 LEU  HG      3.10  #     1    49620.0  e   1ceaug  2743
         HB2     6 LEU  QD1     4.30  #     1M   14100.0  e   1ceaug  2750
         HB2     6 LEU  QD2     4.20  #     1M   16990.0  e   1ceaug  1787
         HB2     7 LYS+ HN      3.50  #     2    18820.0  e   1ceaug  5018
         HB2     7 LYS+ HB3     6.20  #     5     4777.0  e   1ceaug  5127
         HB2    66 PHE  QE      9.00 ># r w 5     1154.0*2e   1ceaug  4023
         HB3     6 LEU  HG      3.30  #     1    32860.0  e   1ceaug  2747
         HB3     6 LEU  QD1     3.40  #     1M   59970.0  e   1ceaug  1791
         HB3     6 LEU  QD2     3.60  #     1M   40680.0  e   1ceaug  1790
         HB3     7 LYS+ HN      3.90  #     2    10010.0  e   1ceaug  1512
         HB3     8 GLY  HN      7.00  #   w 3      714.0  e   1ceaug  5122
         HB3    66 PHE  QE      7.60 <# r   5     7000.0*2e   1ceaug  5102
         HB3    70 VAL  QG1     7.80  #     5M    7253.0  e   1ceaug  3951
         HG      6 LEU  QD1     3.40  #     1M   62450.0  e   1ceaug  1785
         HG      6 LEU  QD2     3.40  #     1M   56560.0  e   1ceaug  1789
         HG     66 PHE  QE      9.00  # r w 5     1960.0*2e   1ceaug  5101
         QD1     7 LYS+ HN      8.00  #     5M    2032.0  e   1ceaug  5012
         QD1    36 PHE  QD      9.80 <# r   5M    7475.0*2e   1ceaug  5269
         QD1    36 PHE  QE      8.60  # r   5M   14295.0*2e   1ceaug  5270
         QD1    66 PHE  QD     10.00  # r   5M    3616.5*2e   1ceaug  5097
         QD1    66 PHE  QE     10.00  # r   5M    5700.0*2e   1ceaug  4025
         QD1    73 ILE  QD1     9.00 <# m   5M    6593.0  e   1ceaug  1673
         QD2     7 LYS+ HN      8.00  #     5M        .0  e   1ceaug  5013
         QD2    36 PHE  QD     10.00 ># r   5M    2002.0*2e   1ceaug  5301
         QD2    36 PHE  QE      9.40  # r   5M    9065.0*2e   1ceaug  1566
         QD2    66 PHE  QE     10.00  # r   5M    5480.0*2e   1ceaug  5104
         QD2    73 ILE  QD1     9.00 ># m   5M    1598.0  e   1ceaug  1674
  7 LYS+ 
         HN      7 LYS+ HA      3.20  #     2    34220.0  e   1ceaug    60
         HN      7 LYS+ HB2     2.80  #     2    73110.0  e   1ceaug    61
         HN      7 LYS+ HB3     3.00  #     2    51180.0  e   1ceaug    64
         HN      7 LYS+ HG2     4.50  #     1     4955.0  e   1ceaug  3908
         HN      7 LYS+ HG3     5.20  #     1     2041.0  e   1ceaug  1018
         HN      7 LYS+ QD      6.00  # m   1     2571.5*2e   1ceaug  1020
         HN      8 GLY  HN      3.10  #     2    39380.0  e   1ceaug  3686
         HN      9 ILE  HN      4.60  #     3     7252.0  e   1ceaug  5020
         HN     63 PHE  QE      8.90  # r   5     3137.5*2e   1ceaug  4959
         HA      7 LYS+ HB2     2.90  #     2    61200.0  e   1ceaug    69
         HA      7 LYS+ HB3     3.20  #     2    35260.0  e   1ceaug    71
         HA      7 LYS+ HG2     3.70 <#     1    17190.0  e   1ceaug  2766
         HA      7 LYS+ HG3     4.50 >#     1     4941.0  e   1ceaug  3905
         HA      7 LYS+ QD      7.90  # m   1      372.5*2e   1ceaug  2753
         HA      8 GLY  HN      3.70  #     2    13310.0  e   1ceaug    73
         HA     10 PHE  HN      4.40  #     3     8547.0  e   1ceaug  1729
         HA     10 PHE  HB3     4.90  #     3     5899.0  e   1ceaug  3952
         HA     11 GLU- HN      4.90  #     3     5482.0  e   1ceaug  3954
         HA     63 PHE  QD      9.00  # r w 5     1758.5*2e   1ceaug  1969
         HA     63 PHE  QE      7.50  # r   5     7600.0*2e   1ceaug  4955
         HA     63 PHE  HZ      5.50  #     5     7548.0  e   1ceaug  1966
         HB2     7 LYS+ HG2     3.10  #     1    44570.0  e   1ceaug  2759
         HB2     7 LYS+ HG3     3.10  #     1    52160.0  e   1ceaug  2758
         HB2     7 LYS+ QD      4.50  # m   1    24305.0*2e   1ceaug  2771
         HB2     8 GLY  HN      3.50  #     2    20510.0  e   1ceaug  3920
         HB2    63 PHE  QE      8.10 <# r   5     4923.5*2e   1ceaug  4960
         HB2    63 PHE  HZ      5.20  #     5     9641.0  e   1ceaug  1930
         HB3     7 LYS+ HG2     3.50  #     1    21320.0  e   1ceaug  2756
         HB3     7 LYS+ HG3     3.30  #     1    30420.0  e   1ceaug  2755
         HB3     7 LYS+ QD      4.70  # m   1    15605.0*2e   1ceaug  2754
         HB3     8 GLY  HN      3.20  #     2    36230.0  e   1ceaug  3919
         HB3    63 PHE  QE      9.00 ># r w 5      104.0*2e   1ceaug  4961
         HG2     7 LYS+ QD      4.50  # m   1    21115.0*2e   1ceaug  2760
         HG2     7 LYS+ HE3     6.00  #     1      881.0  e   1ceaug  1793
         HG2     8 GLY  HN      7.00 >#   w 5      200.0  e   1ceaug  3917
         HG2     8 GLY  HA1     5.80  #     5     5992.0  e   1ceaug  5117
         HG2    63 PHE  QE      9.00  # r w 5     1228.5*2e   1ceaug  2283
         HG2    63 PHE  HZ      6.30  #     5     4539.0  e   1ceaug  1918
         HG3     7 LYS+ QD      4.40  # m   1    26475.0*2e   1ceaug  2770
         HG3     7 LYS+ HE2     6.00  #     1      887.0  e   1ceaug  3901
         HG3     7 LYS+ HE3     5.10  #     1     2257.0  e   1ceaug  3904
         HG3     8 GLY  HN      6.70 <#     5     3455.0  e   1ceaug  3918
         HG3    63 PHE  QE      9.00  # r w 5     2688.5*2e   1ceaug  2218
         QD      7 LYS+ HE2     4.40  # m   1    26460.0*2e   1ceaug  1022
         QD      7 LYS+ HE3     4.90  # m   1    11180.0*2e   1ceaug  3903
         QD     63 PHE  QE     10.00  # mrw 5      663.2*4e   1ceaug  4954
         QD     63 PHE  HZ      8.00  # m w 5      642.0*2e   1ceaug  1920
         HE2    63 PHE  QD      9.00  # r w 5     1079.5*2e   1ceaug  4962
         HE2    63 PHE  QE      9.00  # r w 5     2544.0*2e   1ceaug  4958
  8 GLY  
         HN      8 GLY  HA1     2.80  #     2    72240.0  e   1ceaug  3598
         HN      8 GLY  HA2     3.00  #     2    47160.0  e   1ceaug  1023
         HN      9 ILE  HN      3.00  #     2    48770.0  e   1ceaug  1206
         HA1     9 ILE  HN      3.70  #     2    14200.0  e   1ceaug  3936
         HA1    11 GLU- HN      4.70  #     3     6860.0  e   1ceaug  4046
         HA1    11 GLU- HB2     4.40  #     3     8715.0  e   1ceaug  4053
         HA1    11 GLU- HB3     5.30  #     3     4256.0  e   1ceaug  4050
         HA2     9 ILE  HN      3.90  #     2    10280.0  e   1ceaug  1205
         HA2    11 GLU- HN      4.40  #     3     8937.0  e   1ceaug  1731
         HA2    11 GLU- HB2     5.60  #     3     3418.0  e   1ceaug  4051
         HA2    11 GLU- HB3     7.00  #   w 3      597.0  e   1ceaug  4052
         HA2    12 LYS+ HN      5.60  #     3     3263.0  e   1ceaug  4055
  9 ILE  
         HN      9 ILE  HA      3.60  #     2    16510.0  e   1ceaug    77
         HN      9 ILE  HB      2.80  #     2    74170.0  e   1ceaug  2774
         HN      9 ILE  QG2     4.70  #     1M    8452.0  e   1ceaug  1025
         HN      9 ILE  HG12    4.20 >#     1     7183.0  e   1ceaug  3924
         HN      9 ILE  HG13    3.50 <#     1    24450.0  e   1ceaug  2778
         HN      9 ILE  QD1     4.70  #     1M    8880.0  e   1ceaug  2782
         HN     10 PHE  HN      3.50  #     2    18560.0  e   1ceaug  3616
         HN     11 GLU- HN      4.80  #     3     6429.0  e   1ceaug  4059
         HN     12 LYS+ HN      6.10  #     3     2331.0  e   1ceaug    80
         HN     12 LYS+ HB2     7.00  #   w 3      906.0  e   1ceaug  4062
         HN     12 LYS+ HB3     7.00  #   w 3     1042.0  e   1ceaug  4065
         HA      9 ILE  HB      3.10  #     2    40320.0  e   1ceaug    85
         HA      9 ILE  QG2     3.80  #     1M   33760.0  e   1ceaug  2789
         HA      9 ILE  HG12    3.60  #     1    18250.0  e   1ceaug  3925
         HA      9 ILE  HG13    3.70  #     1    15300.0  e   1ceaug  2785
         HA      9 ILE  QD1     4.40  #     1M   13210.0  e ! 1ceaug  2781
         HA     10 PHE  HN      4.50  #     2     4399.0  e   1ceaug  1207
         HA     12 LYS+ HN      5.10  #     3     5021.0  e   1ceaug  4061
         HA     12 LYS+ HB2     4.30 >#     3    10060.0  e   1ceaug  4066
         HA     12 LYS+ HB3     3.40 <#     3    26490.0  e   1ceaug  4072
         HA     12 LYS+ HG2     7.00  #   w 5      940.0  e   1ceaug  4070
         HA     12 LYS+ HG3     7.00  #   w 5      641.0  e   1ceaug  4069
         HA     12 LYS+ HD3     7.00  #   w 5     1417.0  e   1ceaug  4068
         HA     13 TYR  HN      5.20  #     3     4644.0  e   1ceaug  4074
         HA     13 TYR  QD      8.20  # r   5     4770.5*2e   1ceaug  4073
         HA     13 TYR  QE      9.00  # r w 5      914.0*2e   1ceaug  4076
         HB      9 ILE  QG2     3.80  #     1M   30740.0  e   1ceaug  2790
         HB      9 ILE  HG12    3.80 >#     1    12890.0  e   1ceaug  3926
         HB      9 ILE  HG13    2.80 <#     1    83430.0  e   1ceaug  2786
         HB      9 ILE  QD1     3.50  #     1M   55030.0  e   1ceaug  1718
         HB     10 PHE  HN      3.40  #     2    24610.0  e   1ceaug  3615
         QG2     9 ILE  HG12    3.30 <#   s 1M   76640.0  e   1ceaug  3934
         QG2     9 ILE  HG13    4.50 >#     1M   11200.0  e   1ceaug  2787
         QG2     9 ILE  QD1     4.50  # m   1M   48120.0  e   1ceaug  2780
         QG2    10 PHE  HN      6.70  #     5M   13780.0  e   1ceaug  1496
         QG2    13 TYR  HN      7.30  #     5M    9552.0  e   1ceaug  1529
         QG2    13 TYR  QD      7.90  # r   5M   22270.0*2e   1ceaug  1921
         QG2    13 TYR  QE      8.30  # r   5M   17290.0*2e   1ceaug  1592
         QG2    36 PHE  QD     10.00  # r   5M    3879.0*2e   1ceaug  4082
         QG2    36 PHE  QE     10.00  # r   5M    2876.5*2e   1ceaug  4084
         HG12    9 ILE  QD1     3.40  #     1M   60780.0  e   1ceaug  3935
         HG13    9 ILE  QD1     3.30  #   s 1M   90630.0  e   1ceaug  2779
         QD1    10 PHE  HN      8.00  #     5M    2038.0  e   1ceaug  5215
         QD1    13 TYR  QE     10.00  # r   5M    2983.5*2e   1ceaug  1591
         QD1    35 GLU- HB3     5.80  #     5M   24830.0  e   1ceaug  4079
         QD1    36 PHE  QD     10.00  # r   5M    2497.0*2e   1ceaug  4083
         QD1    36 PHE  QE     10.00  # r   5M    3636.5*2e   1ceaug  4085
 10 PHE  
         HN     10 PHE  HA      3.10  #     2    43770.0  e   1ceaug  1028
         HN     10 PHE  HB2     3.00  #     2    48440.0  e   1ceaug  1728
         HN     10 PHE  HB3     3.20  #     2    33110.0  e   1ceaug  1029
         HN     10 PHE  QD      9.00  # r w 1      105.5*2e   1ceaug  1460
         HN     11 GLU- HN      3.20  #     2    31570.0  e   1ceaug  5138
         HN     12 LYS+ HN      4.50  #     3     7898.0  e   1ceaug  4088
         HN     31 LEU  QD1     8.00  #     5M     796.0  e   1ceaug  5223
         HN     66 PHE  QE      9.00  # r w 5     1770.0*2e   1ceaug  5145
         HA     10 PHE  HB2     2.80  #     2    71070.0  e   1ceaug    87
         HA     10 PHE  HB3     3.00  #     2    46070.0  e   1ceaug    90
         HA     10 PHE  QD      4.80  # m   1    14170.0*2e   1ceaug  2799
         HA     11 GLU- HN      3.90  #     2     9391.0  e   1ceaug  3621
         HA     12 LYS+ HN      7.00  #   w 3         .0  e   1ceaug  4090
         HA     13 TYR  HN      6.80  #     3     1554.0  e   1ceaug  1533
         HA     13 TYR  HB2     7.00 >#   w 3      473.0  e   1ceaug  4092
         HA     13 TYR  HB3     4.50 <#     3     7680.0  e   1ceaug  4093
         HA     14 ALA  HN      7.00  #   w 3      637.0  e   1ceaug  1734
         HA     14 ALA  QB      6.10  #     3M     454.0  e   1ceaug  4095
         HA     23 LEU  QD1     8.00  #     5M    3954.0  e   1ceaug  4927
         HA     23 LEU  QD2     8.00  #     5M    3844.0  e   1ceaug  1735
         HA     31 LEU  QD1     5.70 <#     5M   27020.0  e   1ceaug  4097
         HA     31 LEU  QD2     7.40 >#     5M    9013.0  e   1ceaug  4096
         HA     66 PHE  QE      9.00  # r   5     2899.0*2e   1ceaug  4020
         HB2    10 PHE  QD      5.50  # r   1    22040.0*2e   1ceaug  2801
         HB2    10 PHE  QE      6.40 <# r   1     6010.0*2e   1ceaug  2802
         HB2    11 GLU- HN      4.10  #     2     6986.0  e   1ceaug  3617
         HB2    63 PHE  QD      8.50  # r   5     3836.5*2e   1ceaug  2305
         HB2    63 PHE  QE      8.40  # r   5     4074.0*2e   1ceaug  1953
         HB2    66 PHE  QD      7.60 <# r   5     7110.0*2e   1ceaug  1571
         HB2    66 PHE  QE      8.00 <# r   5     5360.0*2e   1ceaug  4021
         HB3    10 PHE  QD      5.90  # r   1    11195.0*2e   1ceaug  2800
         HB3    10 PHE  QE      7.40 ># r   1     1632.5*2e   1ceaug  2803
         HB3    11 GLU- HN      3.60  #     2    16550.0  e   1ceaug  3620
         HB3    63 PHE  QD      7.80  # r   5     6220.0*2e   1ceaug  2307
         HB3    63 PHE  QE      8.00  # r   5     5495.0*2e   1ceaug  5111
         HB3    66 PHE  QD      9.00 ># r w 5     1603.0*2e   1ceaug  4015
         HB3    66 PHE  QE      9.00 ># r w 5     1832.0*2e   1ceaug  4019
         QD     10 PHE  QE      7.70  # rr  1    15500.0*4e   1ceaug  2797
         QD     10 PHE  HZ      6.80  # r   1     3492.0*2e   1ceaug  1031
         QD     11 GLU- HN      8.80  # r   5     3297.0*2e   1ceaug  1459
         QD     11 GLU- HA      9.00  # r w 5     2451.0*2e   1ceaug  5143
         QD     14 ALA  QB     10.00  # r   5M    1976.0*2e   1ceaug  4990
         QD     15 ALA  HN      8.80  # r   5     3159.0*2e   1ceaug  4993
         QD     23 LEU  QD1    10.00  # r   5M    4358.0*2e   1ceaug  4929
         QD     23 LEU  QD2    10.00  # r   5M    4847.5*2e   1ceaug  4928
         QD     63 PHE  QD     10.10  # rr  5     4885.0*4e   1ceaug  4032
         QD     66 PHE  HN      9.00  # r w 5      454.5*2e   1ceaug  4861
         QD     66 PHE  HB2     8.90  # r   5     3067.5*2e   1ceaug  4013
         QD     66 PHE  HB3     9.00  # r w 5     2128.0*2e   1ceaug  4012
         QD     66 PHE  QE     11.00  # rrw 5     1337.8*4e   1ceaug  4018
         QE     10 PHE  HZ      4.90  # r   1    65950.0*2e   1ceaug  1032
         QE     14 ALA  HN      9.00  # r w 5      354.5*2e   1ceaug  4992
         QE     14 ALA  QB      9.30  # r   5M    9750.0*2e   1ceaug  4991
         QE     23 LEU  HB2     8.90  # r   5     3116.0*2e   1ceaug  5294
         QE     23 LEU  HB3     9.00  # r w 5     1620.5*2e   1ceaug  5234
         QE     61 VAL  HB      9.00  # r w 5      223.0*2e   1ceaug  4885
         QE     61 VAL  QG1     9.20  # r   5M    9980.0*2e   1ceaug  4887
         QE     63 PHE  HN      7.50  # r   5     7365.0*2e   1ceaug  1434
         QE     63 PHE  HA      7.40  # r   5     7980.0*2e   1ceaug  1955
         QE     63 PHE  HB2     9.00  # r w 5      423.0*2e   1ceaug  2332
         QE     63 PHE  QD      8.90  # rr  5    12315.0*4e   1ceaug  4033
         HZ     14 ALA  QB      7.70  #     5M    7940.0  e   1ceaug  5229
         HZ     22 GLN  HN      6.80  #     5     3313.0  e   1ceaug  2118
         HZ     22 GLN  HA      4.40  #     5    18810.0  e   1ceaug  5010
         HZ     23 LEU  HN      6.00  #     5     5538.0  e   1ceaug  2123
         HZ     23 LEU  HB2     6.40 <#     5     4117.0  e   1ceaug  5295
         HZ     23 LEU  HB3     7.00 >#   w 5     1611.0  e   1ceaug  5235
         HZ     23 LEU  HG      4.70  #     5    13800.0  e   1ceaug  2121
         HZ     23 LEU  QD1     8.00 >#     5M     829.0  e   1ceaug  2120
         HZ     23 LEU  QD2     8.00 <#     5M    2451.0  e   1ceaug  2119
         HZ     62 SER  HA      7.00  #   w 5     1687.0  e   1ceaug  1891
         HZ     62 SER  HB2     6.20  #     5     4654.0  e   1ceaug  2125
         HZ     63 PHE  QD      6.90  # r   5    11665.0*2e   1ceaug  4034
 11 GLU- 
         HN     11 GLU- HA      3.40  #     2    22500.0  e   1ceaug    94
         HN     11 GLU- HB2     2.80 <#     2    73450.0  e   1ceaug    98
         HN     11 GLU- HB3     3.30 >#     2    26160.0  e   1ceaug    96
         HN     11 GLU- HG2     4.10  #     1     9436.0  e   1ceaug  1033
         HN     11 GLU- HG3     3.90  #     1    11490.0  e   1ceaug  1034
         HN     12 LYS+ HN      3.20  #     2    35920.0  e   1ceaug   100
         HN     13 TYR  HN      7.00  #   w 3      846.0  e   1ceaug   102
         HN     14 ALA  HN      6.00  #     3     2513.0  e   1ceaug  4102
         HN     14 ALA  QB      8.00  #     3M        .0  e   1ceaug  4104
         HA     11 GLU- HB2     3.40  #     2    22110.0  e   1ceaug   105
         HA     11 GLU- HB3     3.00  #     2    47990.0  e   1ceaug   103
         HA     11 GLU- HG2     3.10 <#     1    44850.0  e   1ceaug  2812
         HA     11 GLU- HG3     3.80 >#     1    14760.0  e   1ceaug  1796
         HA     12 LYS+ HN      4.10  #     2     7796.0  e   1ceaug  1216
         HA     14 ALA  HN      4.40  #     3     8642.0  e   1ceaug  1736
         HA     14 ALA  QB      3.30  #   s 3M   42190.0  e   1ceaug  1738
         HA     15 ALA  HN      7.00  #   w 3      422.0  e   1ceaug  2150
         HB2    11 GLU- HG2     3.30  #     1    33940.0  e   1ceaug  2807
         HB2    11 GLU- HG3     3.40  #     1    26800.0  e   1ceaug  2808
         HB2    12 LYS+ HN      4.10  #     2     7657.0  e   1ceaug   111
         HB3    11 GLU- HG2     3.00  #     1    58180.0  e   1ceaug  2809
         HB3    11 GLU- HG3     4.30  #     1     6673.0  e   1ceaug  2811
         HB3    12 LYS+ HN      4.00  #     2     8055.0  e   1ceaug   110
         HG2    12 LYS+ HN      7.00  #   w 5     2418.0  e   1ceaug  3973
         HG3    12 LYS+ HN      7.00  #   w 5     1542.0  e   1ceaug  3974
 12 LYS+ 
         HN     12 LYS+ HA      3.10  #     2    38340.0  e   1ceaug  1035
         HN     12 LYS+ HB2     3.20  #     2    32330.0  e   1ceaug  1037
         HN     12 LYS+ HB3     3.20  #     2    32750.0  e   1ceaug  1036
         HN     12 LYS+ HG2     5.10  #     1     2286.0  e   1ceaug  1039
         HN     12 LYS+ HG3     5.40  #     1     1678.0  e   1ceaug  1038
         HN     12 LYS+ HD2     6.50  #     1      560.0  e   1ceaug  2816
         HN     12 LYS+ HD3     5.60  #     1     1343.0  e   1ceaug  2817
         HN     13 TYR  HN      2.90  #     2    54380.0  e   1ceaug   114
         HN     13 TYR  HA      5.50  #     2     1190.0  e   1ceaug  5249
         HN     13 TYR  QD      9.00  # r w 5     1268.0*2e   1ceaug  4907
         HN     14 ALA  HN      5.10  #     3     4896.0  e   1ceaug  4107
         HA     12 LYS+ HB2     3.50  #     2    19110.0  e   1ceaug  3625
         HA     12 LYS+ HB3     3.40  #     2    20990.0  e   1ceaug  2827
         HA     12 LYS+ HG2     4.10 >#     1     8824.0  e   1ceaug  3955
         HA     12 LYS+ HG3     2.90 <#     1    69490.0  e   1ceaug  2842
         HA     12 LYS+ HD2     5.20  #     1     2039.0  e   1ceaug  2825
         HA     12 LYS+ HD3     5.40  #     1     1648.0  e   1ceaug  2824
         HA     12 LYS+ QE      7.50  # m   1      560.5*2e   1ceaug  1040
         HA     13 TYR  HN      4.00  #     2     8660.0  e   1ceaug  1217
         HA     13 TYR  QD      9.00  # r w 5      598.5*2e   1ceaug  1586
         HA     14 ALA  HN      7.00  #   w 3      788.0  e   1ceaug  4108
         HA     15 ALA  QB      4.20  #     3M    4346.0  e   1ceaug  1042
         HB2    12 LYS+ HG2     4.40  #     1     5940.0  e   1ceaug  2833
         HB2    12 LYS+ HG3     4.10  #     1     8603.0  e   1ceaug  2819
         HB2    12 LYS+ HD2     3.50  #     1    23240.0  e   1ceaug  2836
         HB2    12 LYS+ HD3     4.10  #     1     9173.0  e   1ceaug  3959
         HB2    12 LYS+ QE      6.50  # m   1     1515.0*2e   1ceaug  3957
         HB2    13 TYR  HN      4.20 >#     2     6310.0  e   1ceaug  1532
         HB2    13 TYR  QD      7.10  # r   5    10345.0*2e   1ceaug  2335
         HB2    13 TYR  QE      9.00 ># r w 5      422.0*2e   1ceaug  1594
         HB3    12 LYS+ HG2     4.10  #     1     9160.0  e   1ceaug  3970
         HB3    12 LYS+ HG3     7.00  #   w 1         .0  e   1ceaug  2821
         HB3    12 LYS+ HD2     3.00  #     1    56190.0  e   1ceaug  3960
         HB3    12 LYS+ HD3     3.40  #     1    26700.0  e   1ceaug  3961
         HB3    12 LYS+ QE      6.20  # m   1     2164.0*2e   1ceaug  3956
         HB3    13 TYR  HN      3.50 <#     2    20460.0  e   1ceaug  3975
         HB3    13 TYR  HA      4.60  #     2     3838.0  e   1ceaug  5291
         HB3    13 TYR  QE      9.00 <# r w 5     1279.0*2e   1ceaug  5200
         HG2    12 LYS+ HD2     3.60  #     1    18910.0  e   1ceaug  3968
         HG2    12 LYS+ HD3     3.30  #     1    32550.0  e   1ceaug  2847
         HG2    12 LYS+ QE      5.60  # m   1     4595.0*2e   1ceaug  2850
         HG2    13 TYR  QD      9.00  # r w 5      674.5*2e   1ceaug  4905
         HG2    13 TYR  QE      9.00  # r w 5      525.0*2e   1ceaug  1578
         HG3    12 LYS+ HD2     3.70  #     1    15430.0  e   1ceaug  2845
         HG3    12 LYS+ HD3     3.60  #     1    20830.0  e   1ceaug  2846
         HG3    12 LYS+ QE      5.60  # m   1     4457.5*2e   1ceaug  2841
         HG3    13 TYR  HN      7.00  #     5     2853.0  e   1ceaug  1528
         HG3    13 TYR  QD      9.00  # r w 5     1166.0*2e   1ceaug  4904
         HG3    13 TYR  QE      9.00  # r w 5      706.5*2e   1ceaug  5328
         HD2    13 TYR  QD      9.00  # r w 5      568.5*2e   1ceaug  4903
         HD3    12 LYS+ QE      4.70  # m   1    16710.0*2e   1ceaug  2830
         HD3    13 TYR  HN      7.00  #   w 5     1964.0  e   1ceaug  1530
         HD3    13 TYR  QE      7.70  # r   5     6775.0*2e   1ceaug  1593
         QE     13 TYR  QE     10.00  # mrw 5     2432.8*4e   1ceaug  1766
 13 TYR  
         HN     13 TYR  HA      3.70  #     2    12980.0  e   1ceaug   118
         HN     13 TYR  HB2     3.10  #     2    41520.0  e   1ceaug  1044
         HN     13 TYR  HB3     3.40  #     2    21480.0  e   1ceaug  2857
         HN     13 TYR  QD      5.60  # r   1    20775.0*2e   1ceaug  2855
         HN     14 ALA  HN      2.90  #     2    58240.0  e   1ceaug  1536
         HN     14 ALA  QB      4.70  #     2M    3483.0  e   1ceaug  1525
         HN     15 ALA  HN      5.80  #     3     2838.0  e   1ceaug  4110
         HN     23 LEU  QD2     8.00  #     5M    1336.0  e   1ceaug  1939
         HN     31 LEU  QD1     8.00  #     5M    3238.0  e   1ceaug  4117
         HA     13 TYR  HB2     3.70 >#     2    13660.0  e   1ceaug   120
         HA     13 TYR  HB3     3.00 <#     2    51440.0  e   1ceaug   121
         HA     13 TYR  QD      4.60  # m   1    20620.0*2e   1ceaug  2854
         HA     13 TYR  QE      6.20  # i   1     1326.5*2e   1ceaug  1584
         HA     14 ALA  HN      3.90  #     2    10350.0  e   1ceaug   123
         HA     16 LYS+ HN      5.90  #     3     2667.0  e   1ceaug  2337
         HA     16 LYS+ HB2     5.00  #     3     5305.0  e   1ceaug  4111
         HA     16 LYS+ HB3     6.00  #     3     2562.0  e   1ceaug  4112
         HB2    13 TYR  QD      5.20  # r   1    40880.0*2e   1ceaug  1585
         HB2    14 ALA  HN      3.50 <#     2    20390.0  e   1ceaug   127
         HB2    23 LEU  QD1     6.60  #     5M   14280.0  e   1ceaug  2133
         HB2    23 LEU  QD2     6.30  #     5M   17740.0  e   1ceaug  4248
         HB2    31 LEU  QD1     5.20  #     5M   37400.0  e   1ceaug  5037
         HB3    13 TYR  QD      5.20  # r   1    37765.0*2e   1ceaug  1580
         HB3    13 TYR  QE      6.40  # r   1     5480.0*2e   1ceaug  1581
         HB3    14 ALA  HN      4.20 >#     2     6360.0  e   1ceaug   129
         HB3    23 LEU  QD1     8.00  #     5M    6678.0  e   1ceaug  2131
         HB3    23 LEU  QD2     7.70  #     5M    7679.0  e   1ceaug  1698
         HB3    31 LEU  HN      7.00  #   w 5     1201.0  e   1ceaug  1894
         HB3    31 LEU  QD1     6.10  #     5M   19830.0  e   1ceaug  5036
         QD     13 TYR  QE      7.10  # rr  1    46825.0*4e   1ceaug  2881
         QD     14 ALA  HN      8.50  # r   5     3765.5*2e   1ceaug  2359
         QD     23 LEU  QD1    10.00 <# r   5M    2335.0*2e   1ceaug  4909
         QD     23 LEU  QD2    10.00 ># r   5M     421.0*2e   1ceaug  1604
         QD     30 LEU  HB2     7.40  # r   5     8130.0*2e   1ceaug  5053
         QD     30 LEU  HB3     7.60  # r   5     7170.0*2e   1ceaug  5054
         QD     30 LEU  HG      8.10  # r   5     4947.0*2e   1ceaug  2142
         QD     30 LEU  QD1     9.70  # r   5M    8000.0*2e   1ceaug  5052
         QD     30 LEU  QD2    10.00  # r   5M    4375.5*2e   1ceaug  5051
         QD     31 LEU  HN      7.30  # r   5     8570.0*2e   1ceaug  2006
         QD     31 LEU  HA      7.20  # r   5     9275.0*2e   1ceaug  4123
         QD     31 LEU  HB2     7.60 <# r   5     7070.0*2e   1ceaug  4120
         QD     31 LEU  HB3     9.00 ># r w 5     1556.0*2e   1ceaug  4121
         QD     31 LEU  HG      6.50  # r   5    16735.0*2e   1ceaug  1922
         QD     31 LEU  QD1     7.90 <# r   5M   22440.0*2e   1ceaug  4119
         QD     31 LEU  QD2    10.00 ># r   5M    1925.5*2e   1ceaug  2362
         QE     30 LEU  HB3     6.70  # r   5    13970.0*2e   1ceaug  1595
         QE     30 LEU  HG      7.60  # r   5     7185.0*2e   1ceaug  5162
         QE     30 LEU  QD1    10.00  # r   5M    6840.0*2e   1ceaug  5272
         QE     30 LEU  QD2    10.00  # r   5M    2791.5*2e   1ceaug  5273
         QE     31 LEU  HN      9.00  # r w 5      799.5*2e   1ceaug  4132
         QE     31 LEU  HA      5.90  # r   5    30005.0*2e   1ceaug  1765
         QE     31 LEU  HB2     9.00  # r w 5     2690.5*2e   1ceaug  4131
         QE     31 LEU  HG      7.10  # r   5    10085.0*2e   1ceaug  4126
         QE     31 LEU  QD1    10.00  # r   5M    1025.5*2e   1ceaug  1579
         QE     31 LEU  QD2    10.00  # r   5M    1117.5*2e   1ceaug  2366
         QE     34 THR  HB      9.00  # r   5     2827.0*2e   1ceaug  1583
         QE     34 THR  QG2    10.00  # r   5M    4810.0*2e   1ceaug  2368
         QE     35 GLU- HG2     9.00  # r w 5     1915.0*2e   1ceaug  5163
 14 ALA  
         HN     14 ALA  HA      3.20  #     2    35570.0  e   1ceaug   132
         HN     14 ALA  QB      3.30  #   s 2M   87320.0  e   1ceaug  2862
         HN     15 ALA  HN      3.10  #     2    41370.0  e   1ceaug  1219
         HN     15 ALA  QB      5.50  #     2M    1341.0  e   1ceaug  1863
         HN     16 LYS+ HN      5.30  #     3     4192.0  e   1ceaug  2090
         HN     23 LEU  HG      7.00  #   w 5         .0  e   1ceaug  1853
         HN     23 LEU  QD1     6.70  #     5M   13760.0  e   1ceaug  5225
         HN     23 LEU  QD2     5.70  #     5M   25990.0  e   1ceaug  1851
         HA     14 ALA  QB      3.30  #   s 2M  111300.0  e   1ceaug  1685
         HA     15 ALA  HN      4.60  #     2     3499.0  e   1ceaug   133
         HA     15 ALA  HA      6.50  #     2      457.0  e   1ceaug  3978
         HA     16 LYS+ HN      4.30  #     3     9250.0  e   1ceaug  4135
         HA     17 GLU- HN      7.00  #   w 3         .0  e   1ceaug  4136
         HA     23 LEU  HA      3.60  #     4    13570.0  e   1ceaug  4137
         HA     23 LEU  QD1     5.10  #     5M   42030.0  e   1ceaug  5049
         HA     23 LEU  QD2     4.50  #     5M   67040.0  e   1ceaug  1684
         HA     24 SER  HN      4.70  #     4     2491.0  e   1ceaug  1407
         QB     15 ALA  HN      3.80  #     2M   12560.0  e   1ceaug  4988
         QB     15 ALA  QB      9.00  # m   5M    4554.0  e   1ceaug  3977
         QB     21 ASN  HN      8.00  #     5M    2230.0  e   1ceaug  5228
         QB     21 ASN  HA      5.20  #     5M   37580.0  e   1ceaug  1681
         QB     22 GLN  HN      6.30  #     5M   17730.0  e   1ceaug  1518
         QB     23 LEU  HN      8.00  #     5M    4823.0  e   1ceaug  4171
 15 ALA  
         HN     15 ALA  HA      3.40  #     2    23820.0  e   1ceaug   136
         HN     15 ALA  QB      3.30  #   s 2M  107600.0  e   1ceaug  1046
         HN     16 LYS+ HN      3.10  #     2    37420.0  e   1ceaug  2373
         HN     20 PRO  HA      4.10  #     4     6024.0  e   1ceaug  4140
         HN     20 PRO  HB2     7.00  #   w 5      748.0  e   1ceaug  4141
         HN     23 LEU  QD1     8.00  #     5M    1158.0  e   1ceaug  4976
         HN     23 LEU  QD2     8.00  #     5M     932.0  e   1ceaug  4975
         HA     15 ALA  QB      3.30  #   s 2M  107700.0  e   1ceaug  1695
         HA     16 LYS+ HN      4.00  #     2     8484.0  e   1ceaug   137
         HA     17 GLU- HN      7.00  #   w 3      615.0  e   1ceaug  1427
         HA     20 PRO  HB3     7.00  #   w 5      268.0  e   1ceaug  4143
         QB     16 LYS+ HN      3.90  #     2M   11110.0  e   1ceaug  3628
 16 LYS+ 
         HN     16 LYS+ HA      3.10  #     2    39160.0  e   1ceaug   142
         HN     16 LYS+ HB2     3.20  #     2    33260.0  e   1ceaug  1047
         HN     16 LYS+ HB3     3.40  #     2    21310.0  e   1ceaug  3629
         HN     16 LYS+ HG2     4.20  #     1     7766.0  e   1ceaug  1049
         HN     16 LYS+ HG3     4.00  #     1     9749.0  e   1ceaug  1050
         HN     16 LYS+ HD2     4.70  #     1     3995.0  e   1ceaug  3979
         HN     16 LYS+ HD3     4.90  #     1     2933.0  e   1ceaug   144
         HN     17 GLU- HN      3.50  #     2    19690.0  e   1ceaug  3632
         HN     27 GLU- HG2     6.90  #     5     3072.0  e   1ceaug  5330
         HN     27 GLU- HG3     7.00  #     5     2878.0  e   1ceaug  4146
         HA     16 LYS+ HB2     3.20  #     2    35780.0  e   1ceaug   148
         HA     16 LYS+ HB3     3.00  #     2    46840.0  e   1ceaug   145
         HA     16 LYS+ HG2     3.90  #     1    11680.0  e   1ceaug  2074
         HA     16 LYS+ HG3     4.10  #     1     8542.0  e   1ceaug  3992
         HA     16 LYS+ HD2     4.40  #     1     6106.0  e   1ceaug  1051
         HA     16 LYS+ HD3     4.50  #     1     4772.0  e   1ceaug  3980
         HA     17 GLU- HN      3.80  #     2    11040.0  e   1ceaug   149
         HB2    16 LYS+ HG2     3.80  #     1    14450.0  e   1ceaug  2087
         HB2    16 LYS+ HG3     3.70  #     1    16080.0  e   1ceaug  2086
         HB2    16 LYS+ HD2     3.40  #     1    27450.0  e   1ceaug  3989
         HB2    16 LYS+ HD3     3.50  #     1    22800.0  e   1ceaug   156
         HB2    16 LYS+ HE2     4.80  #     1     3550.0  e   1ceaug  3983
         HB2    17 GLU- HN      3.30  #     2    27150.0  e   1ceaug  1423
         HB3    16 LYS+ HG2     3.50  #     1    21580.0  e   1ceaug  4152
         HB3    16 LYS+ HG3     3.70  #     1    17770.0  e   1ceaug  3999
         HB3    16 LYS+ HD2     3.60  #     1    19760.0  e   1ceaug  4147
         HB3    16 LYS+ HD3     3.70  #     1    16560.0  e   1ceaug  4148
         HB3    16 LYS+ HE2     5.10  #     1     2354.0  e   1ceaug  3982
         HB3    17 GLU- HN      3.50  #     2    18000.0  e   1ceaug   154
         HB3    27 GLU- HG2     4.70  #     5    14760.0  e   1ceaug  4150
         HB3    27 GLU- HG3     4.10  #     5    26030.0  e   1ceaug  4149
         HG2    16 LYS+ HD2     2.90  #     1    65150.0  e   1ceaug  2088
         HG2    16 LYS+ HD3     3.00  #     1    55040.0  e   1ceaug  4002
         HG2    16 LYS+ HE2     3.50  #     1    23790.0  e   1ceaug  2083
         HG2    16 LYS+ HE3     4.90  #     1     2958.0  e   1ceaug  2078
         HG2    17 GLU- HN      7.00  #   w 5     1192.0  e   1ceaug  1827
         HG3    16 LYS+ HD2     2.80  #     1    81880.0  e   1ceaug  2870
         HG3    16 LYS+ HD3     3.30  #     1    33770.0  e   1ceaug  4003
         HG3    16 LYS+ HE2     4.00  #     1    10390.0  e   1ceaug  2082
         HG3    16 LYS+ HE3     4.60  #     1     4468.0  e   1ceaug  3994
         HG3    17 GLU- HN      7.00  #   w 5     1028.0  e   1ceaug  4010
         HD2    16 LYS+ HE3     4.60  #     1     4227.0  e   1ceaug  2081
         HD2    17 GLU- HN      7.00  #   w 5      699.0  e   1ceaug  4008
         HD3    16 LYS+ HE2     5.00  #     1     2630.0  e   1ceaug   158
         HD3    16 LYS+ HE3     3.90  #     1    11720.0  e   1ceaug  4006
         HD3    17 GLU- HN      7.00  #   w 5      680.0  e   1ceaug  4009
 17 GLU- 
         HN     17 GLU- HA      3.40  #     2    24220.0  e   1ceaug   160
         HN     17 GLU- HB2     3.40  #     2    23800.0  e   1ceaug   164
         HN     17 GLU- HB3     3.70  #     2    13410.0  e   1ceaug   162
         HN     17 GLU- HG2     3.60  #     1    20560.0  e   1ceaug  1054
         HN     17 GLU- HG3     3.50  #     1    23730.0  e   1ceaug  1053
         HN     18 GLY  HN      5.20  #     2     1724.0  e   1ceaug  1446
         HN     27 GLU- HB2     5.20  #     5     9501.0  e   1ceaug  1424
         HN     27 GLU- HG2     5.30  #     5     9078.0  e   1ceaug  2384
         HN     27 GLU- HG3     5.90  #     5     5851.0  e   1ceaug  2386
         HA     17 GLU- HB2     3.30  #     2    26720.0  e   1ceaug   167
         HA     17 GLU- HB3     3.50  #     2    20550.0  e   1ceaug   165
         HA     17 GLU- HG2     3.70 <#     1    15880.0  e   1ceaug   169
         HA     17 GLU- HG3     5.40 >#     1     1635.0  e   1ceaug   171
         HA     18 GLY  HN      2.60  #     2   110000.0  e   1ceaug   173
         HB2    17 GLU- HG3     3.00  #     1    53930.0  e   1ceaug   184
         HB2    27 GLU- HB3     4.70  #     5    14280.0  e   1ceaug  5293
         HB3    17 GLU- HG2     3.30  #     1    32770.0  e   1ceaug   178
         HB3    17 GLU- HG3     3.10  #     1    46860.0  e   1ceaug   180
         HB3    18 GLY  HN      3.30  #     2    25830.0  e   1ceaug  3684
         HB3    27 GLU- HB2     5.10  #     5    10460.0  e   1ceaug  5308
         HB3    27 GLU- HB3     6.70  #     5     3446.0  e   1ceaug  4153
         HG2    18 GLY  HN      4.60  #     5    15900.0  e   1ceaug  3685
 18 GLY  
         HN     18 GLY  HA1     2.80  #     2    71910.0  e   1ceaug  1056
         HN     18 GLY  HA2     3.20  #     2    35720.0  e   1ceaug  1055
         HN     19 ASP- HN      5.10  #     2     2027.0  e   1ceaug  1222
         HA1    19 ASP- HN      3.40  #     2    24790.0  e   1ceaug  1224
         HA2    19 ASP- HN      2.90  #     2    58960.0  e   1ceaug  1223
 19 ASP- 
         HN     19 ASP- HA      3.60  #     2    15130.0  e   1ceaug   188
         HN     19 ASP- HB2     3.10  #     2    36580.0  e   1ceaug   190
         HN     19 ASP- HB3     3.20  #     2    30220.0  e   1ceaug  2886
         HA     19 ASP- HB2     3.60  #     2    16610.0  e   1ceaug   195
         HA     19 ASP- HB3     3.20  #     2    34190.0  e   1ceaug   197
         HA     20 PRO  HD2     3.10  #     5    76720.0  e   1ceaug  2387
         HA     20 PRO  HD3     3.40  #     5    55870.0  e   1ceaug  2389
         HA     21 ASN  HN      7.00  #   w 3     1302.0  e   1ceaug  4857
         HB2    20 PRO  HD2     6.20  #     5     4570.0  e   1ceaug  3861
         HB2    21 ASN  HN      5.30  #     3     4230.0  e   1ceaug   201
         HB2    22 GLN  HN      5.50  #     3     3616.0  e   1ceaug   203
         HB3    20 PRO  HD2     6.10  #     5     4985.0  e   1ceaug  3860
         HB3    21 ASN  HN      5.00  #     3     5228.0  e   1ceaug   206
         HB3    22 GLN  HN      4.40  #     3     8487.0  e   1ceaug   208
 20 PRO  
         HA     20 PRO  HB2     5.10 >#     2     2010.0  e   1ceaug   211
         HA     20 PRO  HB3     4.10 <#     2     7076.0  e   1ceaug   209
         HA     21 ASN  HN      4.60  #     2     3690.0  e   1ceaug  1225
         HB2    20 PRO  HG2     4.60  #     1     4623.0  e   1ceaug  2889
         HB2    20 PRO  HG3     3.20  #     1    40120.0  e   1ceaug  2901
         HB2    20 PRO  HD2     5.70  #     1     1190.0  e   1ceaug  2888
         HB2    20 PRO  HD3     5.50  #     1     1545.0  e   1ceaug  2892
         HB2    21 ASN  HN      5.50  #     2     1268.0  e   1ceaug  1228
         HB3    20 PRO  HG2     2.90  #     1    68540.0  e   1ceaug  2910
         HB3    20 PRO  HG3     3.10  #     1    49940.0  e   1ceaug  2902
         HB3    20 PRO  HD2     5.00  #     1     2527.0  e   1ceaug  2906
         HB3    20 PRO  HD3     4.80  #     1     3592.0  e   1ceaug  2907
         HG2    20 PRO  HD2     3.60  #     1    20940.0  e   1ceaug  2900
         HG2    20 PRO  HD3     3.90  #     1    11060.0  e   1ceaug  1060
         HG2    21 ASN  HN      5.70 <#     5     6590.0  e   1ceaug  1485
         HG3    20 PRO  HD2     2.90  #     1    69070.0  e   1ceaug  1061
         HG3    20 PRO  HD3     3.20  #     1    38510.0  e   1ceaug  1062
         HG3    21 ASN  HN      7.00 >#   w 5      573.0  e   1ceaug  5329
         HD2    21 ASN  HN      5.80  #     5     6019.0  e   1ceaug  1227
         HD3    21 ASN  HN      6.20  #     5     4666.0  e   1ceaug  1226
 21 ASN  
         HN     21 ASN  HA      3.60  #     2    16860.0  e   1ceaug   216
         HN     21 ASN  HB2     3.00 <#     2    45060.0  e   1ceaug   218
         HN     21 ASN  HB3     4.10 >#     2     7501.0  e   1ceaug   220
         HN     21 ASN  HD21    4.60  #     1     4113.0  e   1ceaug  2915
         HN     21 ASN  HD22    4.80  #     1     3504.0  e   1ceaug  1812
         HN     22 GLN  HN      2.70  #     2    87310.0  e   1ceaug   222
         HA     21 ASN  HB2     3.40  #     2    24840.0  e   1ceaug   223
         HA     21 ASN  HB3     3.00  #     2    45690.0  e   1ceaug   225
         HA     21 ASN  HD22    7.00  #   w 1      219.0  e   1ceaug  2911
         HA     22 GLN  HN      3.70  #     2    13020.0  e   1ceaug  1230
         HA     63 PHE  HN      7.00  #   w 4      150.0  e   1ceaug  4849
         HB2    21 ASN  HD21    3.50  #     1    24520.0  e   1ceaug  1650
         HB2    21 ASN  HD22    4.10  #     1     8169.0  e   1ceaug  1652
         HB2    22 GLN  HN      4.50  #     2     4017.0  e   1ceaug  1950
         HB3    21 ASN  HD21    4.40  #     1     5974.0  e   1ceaug  1651
         HB3    21 ASN  HD22    4.40  #     1     5688.0  e   1ceaug  2919
         HB3    22 GLN  HN      4.70  #     2     3014.0  e   1ceaug  5191
 22 GLN  
         HN     22 GLN  HA      4.30  #     2     5392.0  e   1ceaug   230
         HN     22 GLN  HB2     4.70 >#     2     3039.0  e   1ceaug  1066
         HN     22 GLN  HB3     4.00 <#     2     8798.0  e   1ceaug  1064
         HN     22 GLN  HG2     5.10  #     1     2444.0  e   1ceaug  1063
         HN     22 GLN  HG3     4.60  #     1     4177.0  e   1ceaug  1065
         HA     22 GLN  HB3     5.30  #     2     1464.0  e   1ceaug  1994
         HA     22 GLN  HG2     3.90 <#     1    12180.0  e   1ceaug  2927
         HA     22 GLN  HG3     7.00 >#   w 1      282.0  e   1ceaug  1993
         HA     23 LEU  HN      3.60  #     2    16140.0  e   1ceaug   231
         HA     63 PHE  HN      5.90  #     4      691.0  e   1ceaug  4848
         HB2    22 GLN  HG2     4.00  #     1    10480.0  e   1ceaug  2944
         HB2    22 GLN  HG3     4.00  #     1    10600.0  e   1ceaug  2925
         HB2    23 LEU  HN      5.00 >#     2     2308.0  e   1ceaug  1417
         HB3    22 GLN  HG2     5.30  #     1     1776.0  e   1ceaug  2932
         HB3    22 GLN  HG3     6.10  #     1      807.0  e   1ceaug  2931
         HB3    22 GLN  HE21    6.00  #     1      883.0  e   1ceaug  2934
         HB3    23 LEU  HN      4.00 <#     2     8434.0  e   1ceaug  5209
         HG2    22 GLN  HE21    3.50  #     1    24560.0  e   1ceaug  2928
         HG3    22 GLN  HE21    4.80  #     1     3458.0  e   1ceaug  1623
 23 LEU  
         HN     23 LEU  HA      4.00  #     2     8862.0  e   1ceaug   234
         HN     23 LEU  HB2     3.80  #     2    11730.0  e   1ceaug   235
         HN     23 LEU  HB3     4.00  #     2     9033.0  e   1ceaug   237
         HN     23 LEU  HG      4.00  #     1     9657.0  e   1ceaug  1067
         HN     23 LEU  QD1     5.80  #     1M    2416.0  e   1ceaug  2956
         HN     23 LEU  QD2     6.50  #     1M    1169.0  e   1ceaug  1413
         HN     24 SER  HN      6.60  #     2      406.0  e   1ceaug  1231
         HN     61 VAL  HN      4.00  #     4     7286.0  e   1ceaug  1801
         HN     61 VAL  HB      5.40  #     5     8359.0  e   1ceaug  4865
         HN     61 VAL  QG1     8.00  #     5M        .0  e   1ceaug  2412
         HA     23 LEU  HB2     3.60  #     2    17470.0  e   1ceaug   239
         HA     23 LEU  HB3     3.20  #     2    31100.0  e   1ceaug   241
         HA     23 LEU  HG      3.70  #     1    15620.0  e   1ceaug  2958
         HA     23 LEU  QD1     3.90 <#     1M   24990.0  e   1ceaug  2962
         HA     23 LEU  QD2     5.30 >#     1M    3992.0  e   1ceaug  2967
         HA     24 SER  HN      2.60  #     2   105600.0  e   1ceaug   243
         HA     27 GLU- HN      7.00  #   w 3     1103.0  e   1ceaug  4154
         HA     27 GLU- HB2     3.90  #     3    14230.0  e   1ceaug  4156
         HA     27 GLU- HB3     4.20  #     3    10330.0  e   1ceaug  4157
         HA     27 GLU- HG2     7.00  #     5     2859.0  e   1ceaug  4155
         HA     27 GLU- HG3     7.00  #   w 5     2429.0  e   1ceaug  4158
         HA     28 LEU  HN      5.10  #     4     1547.0  e   1ceaug  4160
         HA     61 VAL  HN      5.70  #     4      807.0  e   1ceaug  4260
         HB2    23 LEU  HG      3.10  #     1    51220.0  e   1ceaug  2959
         HB2    23 LEU  QD1     3.80  #     1M   31860.0  e   1ceaug  2953
         HB2    23 LEU  QD2     3.80  #     1M   33440.0  e   1ceaug  2954
         HB2    24 SER  HN      4.50  #     2     4042.0  e   1ceaug  1410
         HB2    28 LEU  HN      7.00 >#   w 5     1839.0  e   1ceaug  4252
         HB2    61 VAL  HB      3.10  #     5    75150.0  e   1ceaug  4867
         HB2    61 VAL  QG1     6.80  #     5M   12630.0  e   1ceaug  4870
         HB3    23 LEU  HG      3.20  #     1    41790.0  e   1ceaug  2949
         HB3    23 LEU  QD1     3.70  #     1M   37770.0  e   1ceaug  2950
         HB3    23 LEU  QD2     4.10  #     1M   18750.0  e   1ceaug  2951
         HB3    24 SER  HN      3.90  #     2     9525.0  e   1ceaug   247
         HB3    27 GLU- HB3     4.30  #     5    20590.0  e   1ceaug  4241
         HB3    28 LEU  HN      6.20 <#     5     4781.0  e   1ceaug  4163
         HB3    28 LEU  HA      7.00  #   w 5     2466.0  e   1ceaug  4255
         HB3    28 LEU  HB2     5.20  #     5     9225.0  e   1ceaug  4167
         HB3    28 LEU  HG      7.00  #   w 5     1794.0  e   1ceaug  4168
         HB3    28 LEU  QD1     5.20  #     5M   37800.0  e   1ceaug  4166
         HB3    28 LEU  QD2     4.70  #     5M   54900.0  e   1ceaug  4165
         HB3    61 VAL  HN      7.00  #   w 5      505.0  e   1ceaug  5197
         HB3    61 VAL  HB      3.90  #     5    30210.0  e   1ceaug  4866
         HB3    61 VAL  QG1     8.00  #     5M    4655.0  e   1ceaug  4869
         HG     23 LEU  QD1     3.60  #     1M   40090.0  e   1ceaug  2965
         HG     23 LEU  QD2     3.80  #     1M   30800.0  e   1ceaug  2961
         HG     24 SER  HN      6.60  #     5     3618.0  e   1ceaug  1411
         HG     61 VAL  HB      4.80  #     5    13670.0  e   1ceaug  4868
         QD1    24 SER  HN      7.10 <#     5M   10800.0  e   1ceaug  1412
         QD1    27 GLU- HN      8.00  #     5M    1374.0  e   1ceaug  4250
         QD1    27 GLU- HB2     7.20  #     5M   10370.0  e   1ceaug  4244
         QD1    27 GLU- HB3     5.00  #     5M   44140.0  e   1ceaug  5152
         QD1    28 LEU  HN      8.00  #     5M    6690.0  e   1ceaug  1855
         QD1    28 LEU  HA      6.70  #     5M   13850.0  e   1ceaug  5046
         QD1    28 LEU  QD1     9.00  # m   5M    2167.0  e   1ceaug  5344
         QD1    28 LEU  QD2     9.00  # m   5M    3768.0  e   1ceaug  5342
         QD1    31 LEU  HN      8.00  #     5M     996.0  e   1ceaug  5265
         QD1    61 VAL  HB      5.20  #     5M   37970.0  e   1ceaug  4873
         QD1    61 VAL  QG1     6.70  # m   5M   26880.0  e   1ceaug  4874
         QD1    66 PHE  HN      8.00  #     5M     759.0  e   1ceaug  4910
         QD1    66 PHE  HB3     8.00  #     5M    1743.0  e   1ceaug  4912
         QD1    66 PHE  QD      8.60  # r   5M   14470.0*2e   1ceaug  4915
         QD1    66 PHE  QE     10.00  # r   5M    5515.0*2e   1ceaug  4916
         QD2    24 SER  HN      8.00 >#     5M    2990.0  e   1ceaug  1379
         QD2    27 GLU- HB2     8.00  #     5M    2144.0  e   1ceaug  4243
         QD2    28 LEU  HN      8.00  #     5M    2895.0  e   1ceaug  5226
         QD2    28 LEU  HA      7.80  #     5M    7250.0  e   1ceaug  1683
         QD2    28 LEU  QD1     9.00  # m   5M    3390.0  e   1ceaug  5345
         QD2    28 LEU  QD2     9.00  # m   5M    6309.0  e   1ceaug  5343
         QD2    61 VAL  HB      5.30  #     5M   36280.0  e   1ceaug  4876
         QD2    61 VAL  QG1     6.30  # m   5M   34970.0  e   1ceaug  4872
         QD2    66 PHE  HN      8.00  #     5M     967.0  e   1ceaug  4923
         QD2    66 PHE  HB3     8.00  #     5M    1578.0  e   1ceaug  4911
         QD2    66 PHE  QD      7.60  # r   5M   29110.0*2e   1ceaug  4921
         QD2    66 PHE  QE      9.40  # r   5M    9050.0*2e   1ceaug  4918
 24 SER  
         HN     24 SER  HA      3.70  #     2    14210.0  e   1ceaug   250
         HN     24 SER  HB2     3.40 <#     2    22830.0  e   1ceaug  1072
         HN     24 SER  HB3     4.10 >#     2     7649.0  e   1ceaug  1071
         HN     25 LYS+ HN      6.00  #     2      758.0  e   1ceaug  1803
         HN     27 GLU- HN      4.20  #     3    10850.0  e   1ceaug  3705
         HN     27 GLU- HA      5.80  #     3     2974.0  e   1ceaug  1406
         HN     27 GLU- HB2     2.60  #     3    71730.0  e   1ceaug  1408
         HN     27 GLU- HB3     3.20  #     3    30120.0  e   1ceaug  3708
         HN     27 GLU- HG2     5.40  #     5     8027.0  e   1ceaug  3706
         HN     27 GLU- HG3     5.40  #     5     8450.0  e   1ceaug  4172
         HN     28 LEU  HN      6.80  #     3     1527.0  e   1ceaug  1802
         HN     60 GLU- HA      7.00  #   w 4         .0  e   1ceaug  1800
         HN     61 VAL  HN      4.70  #     4     2653.0  e   1ceaug  4258
         HA     24 SER  HB2     3.50 <#     2    19100.0  e   1ceaug  2975
         HA     24 SER  HB3     5.60 >#     2     1117.0  e   1ceaug  2972
         HA     25 LYS+ HN      2.80  #     2    67110.0  e   1ceaug   251
         HA     25 LYS+ HA      6.00  #     2      753.0  e   1ceaug  3855
         HA     26 GLU- HN      5.40  #     3     3700.0  e   1ceaug  4043
         HA     27 GLU- HN      5.50  #     3     3576.0  e   1ceaug  3704
         HB2    25 LYS+ HN      3.80 >#     2    10730.0  e   1ceaug  1468
         HB2    26 GLU- HN      5.80  #     3     2827.0  e   1ceaug  2437
         HB2    27 GLU- HN      6.90 <#     3     1458.0  e   1ceaug  5298
         HB2    27 GLU- HB3     7.00  #   w 5     1530.0  e   1ceaug  4179
         HB3    25 LYS+ HN      3.10 <#     2    42020.0  e   1ceaug  1469
         HB3    26 GLU- HN      5.80  #     3     2833.0  e   1ceaug  2441
         HB3    27 GLU- HN      7.00 >#   w 3      500.0  e   1ceaug  2017
 25 LYS+ 
         HN     25 LYS+ HA      3.30  #     2    27510.0  e   1ceaug   254
         HN     25 LYS+ HB2     2.90  #     2    62750.0  e   1ceaug  1475
         HN     25 LYS+ HB3     3.10  #     2    36510.0  e   1ceaug   255
         HN     25 LYS+ HG2     7.00  #   w 1         .0  e   1ceaug  1486
         HN     25 LYS+ HG3     5.90  #     1      955.0  e   1ceaug  1502
         HN     25 LYS+ QE      8.00  # m w 1      103.0*2e   1ceaug  4261
         HN     26 GLU- HN      3.30  #     2    28990.0  e   1ceaug   258
         HN     27 GLU- HN      7.00  #   w 3      701.0  e   1ceaug   261
         HN     28 LEU  HN      7.00  #   w 3      440.0  e   1ceaug  4198
         HN     50 PHE  HA      5.90  #     4      636.0  e   1ceaug  4275
         HA     25 LYS+ HB2     2.80 <#     2    68150.0  e   1ceaug   264
         HA     25 LYS+ HB3     3.40 >#     2    21190.0  e   1ceaug   266
         HA     25 LYS+ HG2     4.10  #     1     8918.0  e   1ceaug  1075
         HA     25 LYS+ HG3     3.90  #     1    11150.0  e   1ceaug  2981
         HA     25 LYS+ QE      5.60  # m   1     4548.0*2e   1ceaug  4183
         HA     26 GLU- HN      4.20  #     2     6285.0  e   1ceaug   267
         HA     27 GLU- HN      7.00  #   w 3      701.0  e   1ceaug  4196
         HA     28 LEU  HN      4.40  #     3     9149.0  e   1ceaug  1472
         HA     28 LEU  HB3     4.00  #     3    13340.0  e   1ceaug  5038
         HA     28 LEU  QD1     8.00 >#     5M    3344.0  e   1ceaug  4264
         HA     28 LEU  QD2     7.20 <#     5M   10150.0  e   1ceaug  4265
         HA     29 LYS+ HN      6.20  #     3     2191.0  e   1ceaug  4237
         HA     46 LEU  QD1     8.00 <#     5M    3370.0  e   1ceaug  4209
         HA     46 LEU  QD2     8.00 >#     5M    1278.0  e   1ceaug  4268
         HA     50 PHE  HA      5.00  #     4     1806.0  e   1ceaug  4276
         HA     50 PHE  HB2     5.70  #     5     6527.0  e   1ceaug  4279
         HA     50 PHE  HB3     5.20  #     5     9425.0  e   1ceaug  4281
         HA     50 PHE  QD      6.50  # r   5    17535.0*2e   1ceaug  4219
         HB2    25 LYS+ HG2     3.40  #     1    29000.0  e   1ceaug  2998
         HB2    25 LYS+ HG3     3.20  #     1    40130.0  e   1ceaug  4188
         HB2    25 LYS+ QD      5.00  # m   1    10895.0*2e   1ceaug  2988
         HB2    25 LYS+ QE      5.40 ># m   1     5735.0*2e   1ceaug  2985
         HB2    26 GLU- HN      3.70  #     2    18730.0  e   1ceaug  1520
         HB2    50 PHE  QD      7.60  # r   5     7205.0*2e   1ceaug  4283
         HB3    25 LYS+ HG2     3.40  #     1    29970.0  e   1ceaug  4187
         HB3    25 LYS+ HG3     3.50  #     1    24580.0  e   1ceaug  2993
         HB3    25 LYS+ QE      4.60 <# m   1    18015.0*2e   1ceaug  4184
         HB3    26 GLU- HN      3.30  #     2    28120.0  e   1ceaug  1541
         HG2    25 LYS+ QD      4.00 <# m   1    60350.0*2e   1ceaug  2996
         HG2    25 LYS+ QE      5.30  # m   1     6555.0*2e   1ceaug  2984
         HG2    26 GLU- HA      5.50  #     5     7580.0  e   1ceaug  4191
         HG2    29 LYS+ HN      6.00  #     5     5228.0  e   1ceaug  4204
         HG2    29 LYS+ HB2     5.00  #     5    11100.0  e   1ceaug  4202
         HG2    29 LYS+ HB3     4.90  #     5    12060.0  e   1ceaug  4203
         HG2    46 LEU  QD1     3.90  #     5M  115900.0  e   1ceaug  2199
         HG2    46 LEU  QD2     4.60  #     5M   62040.0  e   1ceaug  4272
         HG2    50 PHE  HB3     7.00  #   w 5     2616.0  e   1ceaug  4218
         HG2    50 PHE  QD      5.50  # r   5    47185.0*2e   1ceaug  4282
         HG3    25 LYS+ QD      4.70 ># m   1    17550.0*2e   1ceaug  2986
         HG3    25 LYS+ QE      5.80  # m   1     3564.0*2e   1ceaug  4182
         HG3    26 GLU- HN      7.00  #   w 5         .0  e   1ceaug  3853
         HG3    46 LEU  QD1     5.20  #     5M   38710.0  e   1ceaug  4271
         HG3    46 LEU  QD2     6.80  #     5M   12940.0  e   1ceaug  5340
         HG3    47 ASP- HA      7.00  #   w 5     2045.0  e   1ceaug  4213
         QD     25 LYS+ QE      7.70  # mm  1     1130.5*4e   1ceaug  1720
         QE     46 LEU  QD1     9.00 <# m   5M    4567.5*2e   1ceaug  4211
         QE     46 LEU  QD2     9.00 ># m   5M    1437.0*2e   1ceaug  5338
 26 GLU- 
         HN     26 GLU- HA      3.30  #     2    25940.0  e   1ceaug   271
         HN     26 GLU- HB2     3.00  #     2    47120.0  e   1ceaug   276
         HN     26 GLU- HB3     3.20  #     2    34300.0  e   1ceaug   273
         HN     26 GLU- HG2     3.90  #     1    12760.0  e   1ceaug  3693
         HN     26 GLU- HG3     4.10  #     1     8863.0  e   1ceaug  3003
         HN     27 GLU- HN      3.10  #     2    39190.0  e   1ceaug   277
         HN     28 LEU  HN      5.60  #     3     3296.0  e   1ceaug   279
         HN     29 LYS+ HN      5.10  #     3     4997.0  e   1ceaug  4229
         HA     26 GLU- HB2     3.10  #     2    38780.0  e   1ceaug   283
         HA     26 GLU- HB3     3.40  #     2    23090.0  e   1ceaug   281
         HA     26 GLU- HG2     5.30  #     1     1762.0  e   1ceaug  3697
         HA     26 GLU- HG3     4.80  #     1     3489.0  e   1ceaug  3005
         HA     27 GLU- HN      4.40  #     2     4554.0  e   1ceaug  3701
         HA     28 LEU  HN      6.00  #     3     2594.0  e   1ceaug  4225
         HA     29 LYS+ HN      4.50  #     3     8020.0  e   1ceaug  4285
         HA     29 LYS+ HB2     3.70  #     3    16910.0  e   1ceaug  4231
         HA     29 LYS+ HB3     4.00  #     3    13420.0  e   1ceaug  1743
         HB2    26 GLU- HG2     3.40  #     1    28290.0  e   1ceaug   292
         HB2    26 GLU- HG3     3.10  #     1    46090.0  e   1ceaug  3009
         HB2    27 GLU- HN      3.70  #     2    12620.0  e   1ceaug   290
         HB3    26 GLU- HG2     3.10  #     1    50600.0  e   1ceaug  3695
         HB3    26 GLU- HG3     3.20  #     1    38880.0  e   1ceaug  3008
         HB3    27 GLU- HN      3.40  #     2    22760.0  e   1ceaug   288
         HG2    27 GLU- HN      7.00 >#   w 5      416.0  e   1ceaug  3703
         HG3    27 GLU- HN      5.20 <#     5     9927.0  e   1ceaug  3702
 27 GLU- 
         HN     27 GLU- HA      3.20  #     2    36220.0  e   1ceaug   294
         HN     27 GLU- HB2     3.10  #     2    37150.0  e   1ceaug   298
         HN     27 GLU- HB3     3.60  #     2    17340.0  e   1ceaug   295
         HN     27 GLU- HG2     3.60  #     1    18310.0  e   1ceaug   299
         HN     27 GLU- HG3     3.60  #     1    20020.0  e   1ceaug   301
         HN     28 LEU  HN      3.00  #     2    45440.0  e   1ceaug   303
         HN     29 LYS+ HN      5.00  #     3     5415.0  e   1ceaug  3852
         HA     27 GLU- HB2     3.60  #     2    16950.0  e   1ceaug   307
         HA     27 GLU- HB3     3.20  #     2    33700.0  e   1ceaug   305
         HA     27 GLU- HG2     3.40  #     1    29520.0  e   1ceaug   310
         HA     27 GLU- HG3     3.50  #     1    24410.0  e   1ceaug  4159
         HA     28 LEU  HN      3.90  #     2    10000.0  e   1ceaug  1233
         HA     29 LYS+ HN      5.60  #     3     3259.0  e   1ceaug  4238
         HA     30 LEU  HN      4.40  #     3     8646.0  e   1ceaug   311
         HA     30 LEU  HB2     4.00  #     3    13550.0  e   1ceaug   313
         HA     30 LEU  HG      4.40  #     5    18360.0  e   1ceaug  5306
         HA     30 LEU  QD1     7.00  #     5M   11460.0  e   1ceaug  4288
         HA     31 LEU  HN      5.30  #     3     4213.0  e   1ceaug  1886
         HB2    27 GLU- HG2     3.70  #     1    17000.0  e   1ceaug   325
         HB2    27 GLU- HG3     2.80  #     1    96020.0  e   1ceaug   327
         HB2    28 LEU  HN      3.30 <#     2    26640.0  e   1ceaug  4236
         HB3    27 GLU- HG2     3.50  #     1    24140.0  e   1ceaug   319
         HB3    27 GLU- HG3     3.20  #     1    36680.0  e   1ceaug   321
         HB3    28 LEU  HN      4.40 >#     2     5063.0  e   1ceaug   324
         HB3    30 LEU  QD1     8.00  #     5M    4397.0  e   1ceaug  5201
         HB3    30 LEU  QD2     8.00  #     5M    4664.0  e   1ceaug  5333
         HG2    30 LEU  QD1     8.00  #     5M    5500.0  e   1ceaug  4289
         HG2    31 LEU  QD1     8.00  #     5M    2583.0  e   1ceaug  4292
 28 LEU  
         HN     28 LEU  HA      3.60  #     2    16530.0  e   1ceaug   332
         HN     28 LEU  HB3     2.90  #     2    65490.0  e   1ceaug  1078
         HN     28 LEU  QD1     4.60  #     1M   10080.0  e   1ceaug  1842
         HN     28 LEU  QD2     4.80  #     1M    7303.0  e   1ceaug  1843
         HN     29 LYS+ HN      3.00  #     2    45710.0  e   1ceaug   334
         HN     30 LEU  HN      5.30  #     3     4166.0  e   1ceaug  4293
         HN     31 LEU  HN      7.00  #   w 3      958.0  e   1ceaug  4296
         HN     50 PHE  QD      9.00  # r w 5      400.5*2e   1ceaug  1455
         HA     28 LEU  HB2     4.80 >#     2     2747.0  e   1ceaug  3013
         HA     28 LEU  HB3     3.90 <#     2     9733.0  e   1ceaug  1844
         HA     28 LEU  HG      5.10  #     1     2442.0  e   1ceaug  1745
         HA     28 LEU  QD1     4.50  #     1M   11040.0  e   1ceaug  1834
         HA     28 LEU  QD2     4.40  #     1M   13480.0  e   1ceaug  1833
         HA     29 LYS+ HN      4.20  #     2     6088.0  e   1ceaug  3713
         HA     29 LYS+ HA      5.50  #     2     1289.0  e   1ceaug  4301
         HA     30 LEU  HN      6.40  #     3     1966.0  e   1ceaug  4294
         HA     31 LEU  HN      3.60  #     3    20540.0  e   1ceaug  1744
         HA     31 LEU  HB2     3.80  #     3    16650.0  e   1ceaug  4307
         HA     31 LEU  HB3     3.60  #     3    20910.0  e   1ceaug  4303
         HA     31 LEU  QD1     6.30  #     5M   17090.0  e   1ceaug  4310
         HA     31 LEU  QD2     6.40  #     5M   16560.0  e   1ceaug  4311
         HA     32 LEU  HN      4.30  #     3     9883.0  e   1ceaug  4357
         HB2    28 LEU  HG      3.60 >#     1    18680.0  e   1ceaug  3020
         HB2    28 LEU  QD1     4.00  #     1M   22380.0  e   1ceaug  1840
         HB2    28 LEU  QD2     4.40  #     1M   13360.0  e   1ceaug  1837
         HB2    29 LYS+ HN      4.30 >#     2     5726.0  e   1ceaug  1501
         HB3    28 LEU  HG      2.60 <#     1   126600.0  e   1ceaug  3015
         HB3    28 LEU  QD1     3.50  #     1M   50950.0  e   1ceaug  4314
         HB3    28 LEU  QD2     3.60  #     1M   43310.0  e   1ceaug  1835
         HB3    29 LYS+ HN      3.60 <#     2    15210.0  e   1ceaug  1897
         HB3    31 LEU  HN      6.50  #     3     1859.0  e   1ceaug  4316
         HB3    32 LEU  HG      4.90  #     5    12310.0  e   1ceaug  4322
         HG     28 LEU  QD1     4.10 <#     1M   21010.0  e   1ceaug  3022
         HG     28 LEU  QD2     6.40 >#     1M    1344.0  e   1ceaug  3021
         HG     29 LYS+ HN      7.00  #   w 5     1099.0  e   1ceaug  1902
         HG     31 LEU  HB3     5.50  #     5     7362.0  e   1ceaug  4312
         HG     32 LEU  HN      6.50  #     5     3888.0  e   1ceaug  4323
         HG     32 LEU  HB2     4.60  #     5    15680.0  e   1ceaug  4318
         HG     32 LEU  HB3     4.90  #     5    12320.0  e   1ceaug  4331
         HG     32 LEU  HG      2.90  #     5   101300.0  e   1ceaug  4325
         HG     32 LEU  QD1     8.00  #     5M    1747.0  e   1ceaug  4327
         QD1    29 LYS+ HN      8.00  #     5M    5779.0  e   1ceaug  1848
         QD2    29 LYS+ HN      8.00  #     5M    4822.0  e   1ceaug  2479
 29 LYS+ 
         HN     29 LYS+ HA      3.10  #     2    36540.0  e   1ceaug   336
         HN     29 LYS+ HB2     2.90  #     2    55890.0  e   1ceaug   338
         HN     29 LYS+ HB3     3.00  #     2    52410.0  e   1ceaug   339
         HN     29 LYS+ HG2     5.00 >#     1     2574.0  e   1ceaug   342
         HN     29 LYS+ HG3     4.30 <#     1     6881.0  e ! 1ceaug   344
         HN     29 LYS+ QD      5.60  # m   1     4101.5*2e   1ceaug  4337
         HN     29 LYS+ QE      7.50  # m   1      547.5*2e   1ceaug  3709
         HN     30 LEU  HN      3.10  #     2    38430.0  e ! 1ceaug  3850
         HN     30 LEU  HG      6.60  #     5     3566.0  e   1ceaug  4340
         HN     31 LEU  HN      5.10  #     3     4876.0  e   1ceaug  2154
         HN     31 LEU  QD2     8.00  #     5M    1315.0  e   1ceaug  5335
         HN     32 LEU  HN      5.30  #     3     4281.0  e   1ceaug  4353
         HN     32 LEU  QD2     8.00  #     5M    1316.0  e   1ceaug  5212
         HN     46 LEU  HG      7.00  #   w 5     2030.0  e   1ceaug  4371
         HN     46 LEU  QD1     7.90  #     5M    7154.0  e   1ceaug  4373
         HN     46 LEU  QD2     7.60  #     5M    8155.0  e   1ceaug  4372
         HA     29 LYS+ HB2     2.80  #     2    69460.0  e   1ceaug   348
         HA     29 LYS+ HB3     3.20  #     2    31130.0  e   1ceaug   350
         HA     29 LYS+ HG2     3.90  #     1    11460.0  e   1ceaug   352
         HA     29 LYS+ HG3     3.50  #     1    24380.0  e   1ceaug   353
         HA     29 LYS+ QD      8.00  # m w 1      129.5*2e   1ceaug  1082
         HA     30 LEU  HN      3.90  #     2    10380.0  e   1ceaug  1234
         HA     30 LEU  HA      5.50  #     2     1296.0  e   1ceaug  4343
         HA     31 LEU  HN      7.00  #   w 3      606.0  e   1ceaug  1556
         HA     32 LEU  HN      4.30  #     3     9834.0  e   1ceaug   355
         HA     32 LEU  QD1     6.40  #     5M   16340.0  e   1ceaug  4355
         HA     33 GLN  HN      5.20  #     3     4400.0  e   1ceaug   357
         HA     40 LEU  QD1     7.80  #     5M    7267.0  e   1ceaug  4361
         HA     46 LEU  QD1     6.50  #     5M   15790.0  e   1ceaug  2196
         HA     46 LEU  QD2     6.70  #     5M   13730.0  e   1ceaug  4374
         HB2    29 LYS+ HG2     3.50  #     1    24580.0  e   1ceaug   364
         HB2    29 LYS+ HG3     3.10  #     1    49760.0  e   1ceaug   366
         HB2    29 LYS+ QD      4.10  # m   1    47070.0*2e   1ceaug  3034
         HB2    30 LEU  HN      3.70  #     2    13020.0  e   1ceaug   367
         HB2    46 LEU  QD1     6.90  #     5M   11800.0  e   1ceaug  5309
         HB2    46 LEU  QD2     6.00  #     5M   21250.0  e   1ceaug  5310
         HB3    29 LYS+ HG2     4.00  #     1    10810.0  e   1ceaug   370
         HB3    29 LYS+ HG3     4.00  #     1    10660.0  e   1ceaug   372
         HB3    29 LYS+ QD      4.30  # m   1    31450.0*2e   1ceaug  3030
         HB3    29 LYS+ QE      6.00  # m   1     2650.5*2e   1ceaug  3028
         HB3    30 LEU  HN      3.30  #     2    27200.0  e   1ceaug  1904
         HB3    46 LEU  QD1     7.50  #     5M    8868.0  e   1ceaug  4378
         HB3    46 LEU  QD2     8.00  #     5M    5086.0  e   1ceaug  4377
         HG2    29 LYS+ QD      4.80  # m   1    13195.0*2e   1ceaug  3036
         HG2    30 LEU  HN      7.00  #   w 5     2477.0  e   1ceaug  1909
         HG2    30 LEU  HA      7.00  #   w 5     1103.0  e   1ceaug  4345
         HG2    30 LEU  HG      4.60  #     5    15080.0  e   1ceaug  4346
         HG2    30 LEU  QD1     8.00  #     5M    6315.0  e   1ceaug  4348
         HG2    30 LEU  QD2     7.90  #     5M    6958.0  e   1ceaug  5334
         HG2    46 LEU  QD1     6.10  #     5M   19760.0  e   1ceaug  4382
         HG2    46 LEU  QD2     5.90  #     5M   23280.0  e   1ceaug  4381
         HG3    29 LYS+ QD      4.30  # m   1    31810.0*2e   1ceaug  3035
         HG3    40 LEU  QD1     8.00  #     5M    2556.0  e   1ceaug  4369
         HG3    40 LEU  QD2     8.00  #     5M    4388.0  e   1ceaug  4365
         HG3    46 LEU  QD1     8.00  #     5M    6634.0  e   1ceaug  4383
         HG3    46 LEU  QD2     6.10  #     5M   19790.0  e   1ceaug  4379
         QD     29 LYS+ QE      5.70  # mm  1    16937.5*4e   1ceaug  3032
         QD     30 LEU  HN      7.50  # m   5     3844.0*2e   1ceaug  4344
         QE     46 LEU  QD1     9.00 ># m   5M     740.5*2e   1ceaug  5336
         QE     46 LEU  QD2     9.00 <# m   5M    3373.0*2e   1ceaug  4376
 30 LEU  
         HN     30 LEU  HA      3.10  #     2    43390.0  e   1ceaug   380
         HN     30 LEU  HB2     3.30  #     2    26040.0  e   1ceaug   382
         HN     30 LEU  HB3     3.80  #     2    12480.0  e   1ceaug   384
         HN     30 LEU  HG      3.20  #     1    39050.0  e   1ceaug  1087
         HN     30 LEU  QD1     5.00  #     1M    5957.0  e   1ceaug  5271
         HN     30 LEU  QD2     4.90  #     1M    6717.0  e   1ceaug  3043
         HN     31 LEU  HN      3.10  #     2    40340.0  e   1ceaug   385
         HN     32 LEU  HN      6.60  #     3     1682.0  e   1ceaug  4393
         HA     30 LEU  HB2     3.20  #     2    32520.0  e   1ceaug   387
         HA     30 LEU  HB3     3.20  #     2    33250.0  e   1ceaug   389
         HA     30 LEU  HG      3.50  #     1    23550.0  e   1ceaug  3044
         HA     30 LEU  QD1     4.40  #     1M   12160.0  e   1ceaug  3042
         HA     30 LEU  QD2     4.70  #     1M    9148.0  e   1ceaug  1085
         HA     31 LEU  HN      4.00  #     2     8866.0  e   1ceaug  1235
         HA     32 LEU  HN      7.00  #   w 3         .0  e   1ceaug  4395
         HA     33 GLN  HN      4.10  #     3    11340.0  e   1ceaug  1471
         HA     33 GLN  HB2     4.10  #     3    11630.0  e   1ceaug  4397
         HA     33 GLN  HB3     3.80  #     3    15520.0  e   1ceaug  5311
         HB2    30 LEU  HG      3.20  #     1    36180.0  e   1ceaug  3057
         HB2    30 LEU  QD1     3.80  #     1M   29950.0  e   1ceaug  3059
         HB2    30 LEU  QD2     3.80  #     1M   29640.0  e   1ceaug  3058
         HB2    31 LEU  HN      3.30  #     2    26480.0  e   1ceaug  4304
         HB2    31 LEU  HA      4.40  #     2     4556.0  e   1ceaug  4389
         HB3    30 LEU  QD1     3.70  #     1M   37250.0  e   1ceaug  3054
         HB3    30 LEU  QD2     3.80  #     1M   31730.0  e   1ceaug  3049
         HB3    31 LEU  HN      3.40  #     2    22090.0  e   1ceaug  1511
         HB3    31 LEU  HA      5.00  #     2     2212.0  e   1ceaug  4391
         HG     30 LEU  QD1     3.80  #     1M   30210.0  e   1ceaug  3048
         HG     30 LEU  QD2     3.80  #     1M   33680.0  e   1ceaug  3047
         HG     31 LEU  HN      4.20  #     5    22600.0  e ! 1ceaug  3712
         QD1    31 LEU  HN      8.00  #     5M    5507.0  e   1ceaug  3711
         QD1    33 GLN  HE21    8.00  #     5M    2389.0  e   1ceaug  1924
         QD1    33 GLN  HE22    8.00  #     5M    2167.0  e   1ceaug  5009
         QD2    31 LEU  HN      8.00  #     5M    6499.0  e   1ceaug  3710
         QD2    33 GLN  HE21    8.00  #     5M    1140.0  e   1ceaug  5332
         QD2    33 GLN  HE22    8.00  #     5M    1263.0  e   1ceaug  5275
 31 LEU  
         HN     31 LEU  HA      3.20  #     2    35030.0  e   1ceaug   394
         HN     31 LEU  HB2     2.90  #     2    60790.0  e   1ceaug   395
         HN     31 LEU  HB3     2.80  #     2    70800.0  e   1ceaug  1509
         HN     31 LEU  HG      4.30  #     1     6432.0  e   1ceaug  3079
         HN     31 LEU  QD1     5.10  #     1M    5008.0  e   1ceaug  3074
         HN     31 LEU  QD2     5.40  #     1M    3698.0  e   1ceaug  3069
         HN     32 LEU  HN      3.50  #     2    18420.0  e   1ceaug   398
         HN     33 GLN  HN      5.70  #     3     3170.0  e   1ceaug   399
         HA     31 LEU  HB2     3.00 <#     2    45840.0  e   1ceaug   402
         HA     31 LEU  HB3     3.60 >#     2    16860.0  e   1ceaug   403
         HA     31 LEU  HG      2.90  #     1    66230.0  e   1ceaug  3066
         HA     31 LEU  QD1     5.40  #     1M    3532.0  e   1ceaug  3068
         HA     31 LEU  QD2     4.70  #     1M    8362.0  e   1ceaug  3067
         HA     32 LEU  HN      4.40  #     2     4579.0  e   1ceaug  1236
         HA     34 THR  HB      3.70  #     3    17160.0  e   1ceaug  2494
         HA     35 GLU- HN      4.20  #     3    11040.0  e   1ceaug  2153
         HA     35 GLU- HB2     3.40  #     3    25880.0  e   1ceaug  5042
         HA     35 GLU- HB3     3.60  #     3    24880.0  e   1ceaug  5041
         HB2    31 LEU  QD1     3.90  #     1M   26330.0  e   1ceaug  3076
         HB2    31 LEU  QD2     4.00  #     1M   23340.0  e   1ceaug  3071
         HB2    32 LEU  HN      3.40  #     2    21830.0  e   1ceaug  4469
         HB2    33 GLN  HN      6.40  #     3     1925.0  e   1ceaug   408
         HB3    31 LEU  HG      4.40  #     1     5844.0  e   1ceaug  3061
         HB3    31 LEU  QD1     3.90  #     1M   26170.0  e   1ceaug  3075
         HB3    31 LEU  QD2     4.10  #     1M   18910.0  e   1ceaug  3070
         HB3    32 LEU  HN      2.90  #     2    54490.0  e   1ceaug  1500
         HG     31 LEU  QD1     3.30  #   s 1M  101100.0  e   1ceaug  4474
         HG     31 LEU  QD2     3.30  #   s 1M  177300.0  e   1ceaug  3072
         QD1    32 LEU  HN      8.00  #     5M    4546.0  e   1ceaug  4470
         QD1    66 PHE  QD     10.00  # r   5M    5970.0*2e   1ceaug  1575
         QD1    66 PHE  QE      8.10 <# r   5M   20590.0*2e   1ceaug  4937
         QD2    35 GLU- HN      8.00  #     5M    2194.0  e   1ceaug  5222
         QD2    35 GLU- HB2     6.80  #     5M   12910.0  e   1ceaug  2163
         QD2    35 GLU- HB3     6.70  #     5M   13850.0  e   1ceaug  2162
         QD2    36 PHE  QE     10.00  # r   5M    6090.0*2e   1ceaug  1926
         QD2    66 PHE  QD      9.40  # r   5M    8970.0*2e   1ceaug  4938
         QD2    66 PHE  QE     10.00 ># r   5M    6760.0*2e   1ceaug  4940
 32 LEU  
         HN     32 LEU  HA      3.10  #     2    38760.0  e   1ceaug  1091
         HN     32 LEU  HB2     2.80 <#     2    77210.0  e   1ceaug  1092
         HN     32 LEU  HB3     3.80 >#     2    12210.0  e   1ceaug  1093
         HN     32 LEU  HG      3.10  #     1    47380.0  e   1ceaug  3841
         HN     32 LEU  QD1     4.30  #     1M   15010.0  e   1ceaug  3098
         HN     32 LEU  QD2     3.80  #     1M   29510.0  e   1ceaug  3094
         HN     33 GLN  HN      3.00  #     2    46790.0  e   1ceaug   409
         HN     34 THR  HN      6.60  #     3     1715.0  e   1ceaug  5157
         HN     34 THR  QG2     8.00  #     5M    2200.0  e   1ceaug  1490
         HN     35 GLU- HB2     5.60  #     3     3291.0  e   1ceaug  5171
         HN     40 LEU  QD1     8.00  #     5M    3458.0  e   1ceaug  4100
         HA     32 LEU  HB2     3.60  #     2    15120.0  e   1ceaug  3081
         HA     32 LEU  HB3     3.30  #     2    26920.0  e   1ceaug  3082
         HA     32 LEU  HG      3.70  #     1    16440.0  e   1ceaug  5299
         HA     32 LEU  QD1     4.90 >#     1M    6932.0  e   1ceaug  1095
         HA     32 LEU  QD2     3.30 <#   s 1M  121000.0  e   1ceaug  1094
         HA     33 GLN  HN      3.90  #     2     9978.0  e   1ceaug  1237
         HA     35 GLU- HN      5.40  #     3     3727.0  e   1ceaug  5174
         HA     36 PHE  HN      3.30  #     3    29090.0  e   1ceaug  2165
         HA     36 PHE  HB2     3.90 <#     3    14200.0  e   1ceaug  2497
         HA     36 PHE  HB3     5.40 >#     3     3847.0  e   1ceaug  2499
         HA     36 PHE  QD      7.70  # r   5     6830.0*2e   1ceaug  5044
         HA     37 PRO  HA      5.20  #     4     1391.0  e   1ceaug  4963
         HB2    32 LEU  HG      2.70 <#     1   115800.0  e   1ceaug  5300
         HB2    32 LEU  QD1     3.50  #     1M   51720.0  e   1ceaug  3099
         HB2    32 LEU  QD2     3.90  #     1M   27710.0  e   1ceaug  3095
         HB2    33 GLN  HN      3.30 <#     2    25040.0  e   1ceaug  4401
         HB2    37 PRO  HA      7.00  #   w 5      809.0  e   1ceaug  4964
         HB3    32 LEU  HG      3.40 >#     1    26460.0  e   1ceaug  3843
         HB3    32 LEU  QD1     3.50  #     1M   52030.0  e   1ceaug  3100
         HB3    32 LEU  QD2     3.80  #     1M   32250.0  e   1ceaug  3096
         HB3    33 GLN  HN      4.10 >#     2     7351.0  e   1ceaug  3847
         HB3    37 PRO  HA      7.00  #   w 5     1847.0  e   1ceaug  4965
         HB3    40 LEU  HN      7.00  #   w 5         .0  e   1ceaug  5374
         HB3    40 LEU  HB3     7.00  #   w 5     2019.0  e   1ceaug  5378
         HG     32 LEU  QD1     3.50  #     1M   48620.0  e   1ceaug  3845
         HG     32 LEU  QD2     3.30  #   s 1M   87060.0  e   1ceaug  3844
         HG     69 LEU  QD2     8.00  #     5M    1007.0  e   1ceaug  4983
         QD1    33 GLN  HN      8.00 <#     5M    4840.0  e   1ceaug  4844
         QD1    36 PHE  QD     10.00 ># r   5M    5075.0*2e ! 1ceaug  1598
         QD1    40 LEU  HB2     8.00  #     5M     858.0  e   1ceaug  5379
         QD1    40 LEU  HB3     8.00  #     5M    1806.0  e   1ceaug  5377
         QD2    33 GLN  HN      8.00 >#     5M    1745.0  e   1ceaug  3848
         QD2    36 PHE  HN      7.50  #     5M    8505.0  e   1ceaug  5220
         QD2    36 PHE  HB2     5.40  #     5M   31920.0  e   1ceaug  1712
         QD2    36 PHE  HB3     6.90  #     5M   11940.0  e   1ceaug  1707
         QD2    36 PHE  QD      8.00 <# r   5M   21505.0*2e   1ceaug  1524
         QD2    69 LEU  QD1     5.60  # m   5M   64410.0  e   1ceaug  5031
         QD2    69 LEU  QD2     5.50  # m   5M   65820.0  e   1ceaug  5030
 33 GLN  
         HN     33 GLN  HA      3.20  #     2    32530.0  e   1ceaug   411
         HN     33 GLN  HB2     3.20 <#     2    35420.0  e   1ceaug  1211
         HN     33 GLN  HB3     4.00 >#     2     8598.0  e   1ceaug  1212
         HN     33 GLN  HG2     5.10 >#     1     2339.0  e   1ceaug  3113
         HN     33 GLN  HG3     3.90 <#     1    12210.0  e   1ceaug  3117
         HN     33 GLN  HE21    6.20  #     1      719.0  e   1ceaug  4475
         HN     34 THR  HN      3.20  #     2    32280.0  e   1ceaug  3634
         HN     35 GLU- HN      4.50  #     3     7902.0  e   1ceaug  4403
         HN     40 LEU  QD1     6.80  #     5M   12550.0  e   1ceaug  1494
         HA     33 GLN  HB2     3.80  #     2    12450.0  e   1ceaug  1098
         HA     33 GLN  HB3     3.20  #     2    30380.0  e   1ceaug  3104
         HA     33 GLN  HG2     3.80 <#     1    13260.0  e   1ceaug  3111
         HA     33 GLN  HG3     5.70 >#     1     1156.0  e   1ceaug  1096
         HA     34 THR  HN      3.90  #     2    10550.0  e   1ceaug   413
         HA     37 PRO  HA      3.10  #     3    38360.0  e   1ceaug  4404
         HA     37 PRO  HB2     6.20  #     3     2142.0  e   1ceaug  4406
         HA     37 PRO  HB3     6.80  #     3     1509.0  e   1ceaug  4407
         HA     40 LEU  QD1     6.50  #     5M   15130.0  e   1ceaug  4414
         HB2    33 GLN  HG2     3.10  #     1    50200.0  e   1ceaug  3106
         HB2    33 GLN  HG3     3.40  #     1    29300.0  e   1ceaug  2098
         HB2    34 THR  HN      3.50  #     2    18000.0  e   1ceaug  3635
         HB3    33 GLN  HG2     3.20  #     1    41380.0  e   1ceaug  2100
         HB3    33 GLN  HG3     3.50  #     1    23320.0  e   1ceaug  2099
         HB3    34 THR  HN      3.70  #     2    12930.0  e   1ceaug  3840
         HG2    33 GLN  HE21    4.10  #     1     8540.0  e   1ceaug  1940
         HG2    33 GLN  HE22    4.60  #     1     4399.0  e   1ceaug  2092
         HG2    34 THR  HN      7.00  #   w 5      269.0  e   1ceaug  3839
         HG2    37 PRO  HA      5.90  #     5     5847.0  e   1ceaug  4970
         HG2    40 LEU  QD1     8.00  #     5M    6851.0  e   1ceaug  4417
         HG3    33 GLN  HE21    4.40  #     1     5565.0  e   1ceaug  1941
         HG3    33 GLN  HE22    4.30  #     1     6629.0  e   1ceaug  2093
         HG3    34 THR  HN      7.00  #   w 5      410.0  e   1ceaug  3838
         HG3    37 PRO  HA      7.00  #   w 5     2504.0  e   1ceaug  4969
         HG3    40 LEU  QD1     7.50  #     5M    8682.0  e   1ceaug  4418
         HE21   40 LEU  QD1     8.00  #     5M     985.0  e   1ceaug  5276
         HE21   40 LEU  QD2     8.00  #     5M    1709.0  e   1ceaug  4420
         HE22   40 LEU  QD1     8.00  #     5M    1670.0  e   1ceaug  5208
 34 THR  
         HN     34 THR  HA      3.30  #     2    27660.0  e   1ceaug   416
         HN     34 THR  HB      3.30  #     2    28200.0  e   1ceaug  1101
         HN     34 THR  QG2     4.70  #     1M    8948.0  e   1ceaug  3123
         HN     35 GLU- HN      3.10  #     2    36470.0  e   1ceaug  3605
         HN     35 GLU- HB2     6.40  #     2      495.0  e   1ceaug  4421
         HN     35 GLU- HG2     7.00  #   w 5     1729.0  e   1ceaug  4422
         HN     36 PHE  HN      4.40  #     3     8550.0  e   1ceaug  2520
         HA     34 THR  HB      3.10  #     2    38830.0  e   1ceaug  3121
         HA     34 THR  QG2     3.60  #     1M   42340.0  e   1ceaug  3119
         HA     35 GLU- HN      4.00  #     2     8946.0  e   1ceaug   417
         HB     34 THR  QG2     3.50  #     1M   55730.0  e   1ceaug  3122
         HB     35 GLU- HN      3.70  #     2    13020.0  e   1ceaug  2521
         QG2    35 GLU- HN      6.50  #     5M   15120.0  e   1ceaug  3836
 35 GLU- 
         HN     35 GLU- HA      3.60  #     2    15790.0  e   1ceaug   420
         HN     35 GLU- HB2     3.90 >#     2    10140.0  e   1ceaug  1102
         HN     35 GLU- HB3     3.30 <#     2    27880.0  e   1ceaug  1103
         HN     35 GLU- HG2     4.10 <#     1     9299.0  e ! 1ceaug  2144
         HN     35 GLU- HG3     5.30 >#     1     1818.0  e   1ceaug  5350
         HN     36 PHE  HN      3.10  #     2    38440.0  e ! 1ceaug  3606
         HN     36 PHE  HB2     5.50  #     2     1253.0  e ! 1ceaug  4431
         HN     36 PHE  QD      9.00  # r w 5     2113.0*2e   1ceaug  4430
         HA     35 GLU- HB2     3.00  #     2    49650.0  e   1ceaug  3131
         HA     35 GLU- HB3     2.80  #     2    70760.0  e   1ceaug  3128
         HA     35 GLU- HG2     4.60  #     1     4191.0  e   1ceaug  2147
         HA     36 PHE  HN      4.20  #     2     6528.0  e   1ceaug  4435
         HA     37 PRO  HD2     7.00  #   w 5     1814.0  e   1ceaug  2159
         HB2    35 GLU- HG2     3.40  #     1    25370.0  e   1ceaug  2149
         HB2    36 PHE  HN      5.00 >#     2     2265.0  e   1ceaug  1545
         HB2    36 PHE  QD      7.80  # r   5     6140.0*2e   1ceaug  2527
         HB3    35 GLU- HG2     3.80  #     1    12980.0  e   1ceaug  2148
         HB3    36 PHE  HN      4.20 <#     2     6460.0  e   1ceaug  4438
         HB3    36 PHE  QD      7.30  # r   5     8675.0*2e   1ceaug  5144
 36 PHE  
         HN     36 PHE  HA      3.60  #     2    15280.0  e   1ceaug  1106
         HN     36 PHE  HB2     3.60  #     2    15720.0  e   1ceaug  1104
         HN     36 PHE  HB3     4.10  #     2     7804.0  e   1ceaug  1105
         HN     36 PHE  QD      6.00  # r   1    10150.0*2e   1ceaug  3135
         HN     36 PHE  QE      7.30  # m   1      621.0*2e   1ceaug  3831
         HN     37 PRO  HA      4.50  #     2     4161.0  e   1ceaug  4439
         HN     37 PRO  HD2     4.60 <#     5    15090.0  e   1ceaug  3639
         HN     37 PRO  HD3     5.90 >#     5     5811.0  e   1ceaug  1241
         HA     36 PHE  HB2     3.80  #     2    11360.0  e   1ceaug   421
         HA     36 PHE  HB3     3.30  #     2    26960.0  e   1ceaug   423
         HA     36 PHE  QD      4.40  # m   1    26835.0*2e   1ceaug  1975
         HA     37 PRO  HD2     4.00 >#     5    26800.0  e   1ceaug  3638
         HA     37 PRO  HD3     3.20 <#     5    70840.0  e   1ceaug  3637
         HA     38 SER  HN      5.40  #     3     3801.0  e   1ceaug  1465
         HA     39 LEU  HN      7.00  #   w 3     1050.0  e   1ceaug  2169
         HB2    36 PHE  QD      5.30  # r   1    35755.0*2e   1ceaug  1565
         HB2    37 PRO  HD2     4.60  #     5    15500.0  e   1ceaug  4445
         HB2    37 PRO  HD3     7.00  #   w 5     2500.0  e   1ceaug  4443
         HB2    39 LEU  HN      6.80 >#     3     1522.0  e   1ceaug  4455
         HB2    39 LEU  QQD     9.40  #     5M    3910.5*2e   1ceaug  5259
         HB3    36 PHE  QD      5.20  # r   1    36110.0*2e   1ceaug  1564
         HB3    37 PRO  HD2     4.60  #     5    15220.0  e   1ceaug  4441
         HB3    37 PRO  HD3     5.30  #     5     8534.0  e   1ceaug  3835
         HB3    39 LEU  HN      5.10 <#     3     4976.0  e   1ceaug  1893
         HB3    39 LEU  HB2     6.90  #     5     2965.0  e   1ceaug  2172
         HB3    39 LEU  HB3     7.00  #   w 5     2097.0  e   1ceaug  2174
         HB3    39 LEU  HG      6.10  #     5     5104.0  e   1ceaug  4452
         HB3    39 LEU  QQD     9.40  #     5M    5715.0*2e   1ceaug  1706
         HB3    73 ILE  HG12    5.60  #     5     6912.0  e   1ceaug  4458
         QD     36 PHE  QE      7.00  # rr  1    59150.0*4e   1ceaug  3137
         QD     36 PHE  HZ      5.40  # r   1    26045.0*2e   1ceaug  4466
         QD     37 PRO  HD3     9.00  # r w 5     2233.0*2e   1ceaug  4446
         QD     39 LEU  HG      9.00  # r w 5     1587.5*2e   1ceaug  1929
         QD     39 LEU  QQD    11.40  # r   5M    1308.5*4e   1ceaug  2178
         QD     66 PHE  HZ      7.90  # r   5     5615.0*2e   1ceaug  4467
         QD     69 LEU  QD2    10.00  # r   5M    2994.0*2e   1ceaug  1597
         QD     73 ILE  QG2     9.10  # r   5M   10730.0*2e   1ceaug  1596
         QD     73 ILE  HG12    8.10  # r   5     4939.5*2e   1ceaug  4459
         QE     36 PHE  HZ      5.70  # r   1    15610.0*2e   1ceaug  1109
         QE     73 ILE  QG2     9.80  # r   5M    7580.0*2e   1ceaug  4465
         QE     73 ILE  HG12    8.20  # r   5     4773.5*2e   1ceaug  4463
         HZ     73 ILE  QD1     8.00  #     5M    1328.0  e   1ceaug  1516
 37 PRO  
         HA     37 PRO  HB2     3.50  #     2    20020.0  e   1ceaug   427
         HA     37 PRO  HB3     3.50  #     2    18120.0  e   1ceaug   429
         HA     37 PRO  QG      4.50  # i   1    11395.0*2e   1ceaug  1112
         HA     37 PRO  HD2     4.20 <#     1     7501.0  e   1ceaug  3149
         HA     37 PRO  HD3     5.30 >#     1     1929.0  e   1ceaug  4411
         HA     38 SER  HN      4.00  #     2     9091.0  e   1ceaug   431
         HA     38 SER  HA      4.70  #     2     3341.0  e   1ceaug  4486
         HA     39 LEU  HN      5.00  #     3     5345.0  e   1ceaug  4974
         HA     40 LEU  HN      4.60  #     3     7425.0  e   1ceaug  2057
         HA     40 LEU  HB2     7.00 >#   w 3      275.0  e   1ceaug  5318
         HA     40 LEU  HB3     7.00 <#   w 3     1208.0  e   1ceaug  4495
         HA     40 LEU  HG      4.10  #     5    24940.0  e   1ceaug  2182
         HA     40 LEU  QD1     8.00  #     5M    4355.0  e   1ceaug  2183
         HB2    37 PRO  QG      3.90  # m   1    65400.0*2e   1ceaug  3156
         HB2    37 PRO  HD2     4.80  #     1     3476.0  e   1ceaug   436
         HB2    37 PRO  HD3     5.70  #     1     1243.0  e   1ceaug  5312
         HB2    38 SER  HN      5.90  #     2      811.0  e   1ceaug  3715
         HB3    37 PRO  QG      4.30  # m   1    30460.0*2e   1ceaug  3151
         HB3    37 PRO  HD2     4.40  #     1     5677.0  e   1ceaug   440
         HB3    37 PRO  HD3     4.30  #     1     6473.0  e   1ceaug  3150
         HB3    38 SER  HN      5.10  #     2     1945.0  e   1ceaug  3716
         QG     37 PRO  HD2     4.20  # m   1    37015.0*2e   1ceaug  3152
         QG     37 PRO  HD3     4.30  # m   1    30085.0*2e   1ceaug  3153
         QG     38 SER  HN      6.40  # m   5     8315.0*2e   1ceaug  1903
         QG     38 SER  HB2     8.00  # m w 5      652.5*2e   1ceaug  4489
         HD2    38 SER  HN      6.70  #     5     3381.0  e   1ceaug  1246
         HD3    38 SER  HN      5.80  #     5     5970.0  e   1ceaug  1245
 38 SER  
         HN     38 SER  HA      3.20  #     2    30480.0  e   1ceaug   450
         HN     38 SER  HB2     3.70  #     2    13560.0  e   1ceaug  1113
         HN     38 SER  HB3     3.40  #     2    23700.0  e   1ceaug   452
         HN     39 LEU  HN      3.40  #     2    22680.0  e   1ceaug  1247
         HN     39 LEU  HB2     7.00  #   w 2      254.0  e   1ceaug  4497
         HN     40 LEU  HN      5.30  #     3     4017.0  e   1ceaug  4498
         HA     38 SER  HB2     3.70  #     2    13200.0  e   1ceaug   453
         HA     38 SER  HB3     3.30  #     2    29040.0  e   1ceaug   455
         HA     39 LEU  HN      3.90  #     2    10240.0  e   1ceaug   457
         HA     40 LEU  HN      4.70  #     3     6451.0  e   1ceaug  2058
         HA     40 LEU  HB2     7.00 >#   w 3      219.0  e   1ceaug  5317
         HA     40 LEU  HB3     7.00 <#   w 3      711.0  e   1ceaug  4500
         HA     41 LYS+ HN      6.00  #     3     2431.0  e   1ceaug  2185
         HA     41 LYS+ HB3     5.90  #     3     2696.0  e   1ceaug  4503
         HA     41 LYS+ HG2     7.00  #   w 5     1014.0  e   1ceaug  4504
         HA     41 LYS+ HG3     7.00  #   w 5         .0  e   1ceaug  5356
         HA     41 LYS+ QD      8.00  # m w 5      883.5*2e   1ceaug  5353
         HA     41 LYS+ QE      8.00  # m w 5      157.5*2e   1ceaug  5355
         HB2    39 LEU  HN      3.90 <#     2    10270.0  e   1ceaug   463
         HB2    41 LYS+ HN      7.00 >#   w 3      269.0  e   1ceaug  4507
         HB2    41 LYS+ QD      8.00 ># m w 5      862.0*2e   1ceaug  5358
         HB3    39 LEU  HN      4.70 >#     2     3362.0  e   1ceaug   467
         HB3    41 LYS+ HN      5.50 <#     3     3565.0  e   1ceaug  4506
         HB3    41 LYS+ QD      8.00 <# m w 5     2202.5*2e   1ceaug  5359
 39 LEU  
         HN     39 LEU  HA      3.10  #     2    39910.0  e   1ceaug   470
         HN     39 LEU  HB2     3.00  #     2    49220.0  e   1ceaug   473
         HN     39 LEU  HB3     3.20  #     2    31180.0  e   1ceaug   471
         HN     39 LEU  HG      4.10  #     1     9092.0  e   1ceaug  1115
         HN     39 LEU  QQD     7.60  # q   1M    4882.5*2e   1ceaug  3164
         HN     40 LEU  HN      3.10  #     2    41140.0  e   1ceaug  1248
         HN     40 LEU  HB2     6.40  #     2      506.0  e   1ceaug  4511
         HN     40 LEU  HG      5.60  #     5     6843.0  e   1ceaug  2530
         HN     41 LYS+ HN      4.30  #     3     3759.0  e   MPeaug  4515
         HA     39 LEU  HB2     3.20  #     2    35510.0  e   1ceaug   477
         HA     39 LEU  HB3     3.20  #     2    32270.0  e   1ceaug   475
         HA     39 LEU  HG      4.10  #     1     9406.0  e   1ceaug  3160
         HA     39 LEU  QQD     5.60  # s   1M   26160.0*2e   1ceaug  3163
         HA     40 LEU  HN      3.90  #     2     9306.0  e   1ceaug   479
         HA     40 LEU  HA      5.10  #     2     1914.0  e   1ceaug  4513
         HA     41 LYS+ HN      4.60  #     3     7311.0  e   1ceaug  2186
         HA     41 LYS+ HG2     7.00  #   w 5     1031.0  e   1ceaug  5361
         HA     41 LYS+ QD      8.00  # m w 5      645.0*2e   1ceaug  2187
         HA     42 GLY  HN      5.40  #     3     3844.0  e   1ceaug  5341
         HB2    39 LEU  HG      2.70  #     1   121700.0  e   1ceaug  3166
         HB2    39 LEU  QQD     5.40  #     1M   22895.0*2e   1ceaug  2167
         HB2    40 LEU  HN      3.60  #     2    16640.0  e   1ceaug  2064
         HB2    69 LEU  HG      6.80  #     5     3147.0  e   1ceaug  5363
         HB2    69 LEU  QD1     8.00  #     5M    5503.0  e   1ceaug  5364
         HB2    69 LEU  QD2     8.00  #     5M    4951.0  e   1ceaug  5365
         HB2    73 ILE  HG13    5.20  #     5     9398.0  e   1ceaug  4785
         HB2    73 ILE  QD1     8.00  #     5M    1088.0  e   1ceaug  5362
         HB3    39 LEU  QQD     5.20  #     1M   29455.0*2e   1ceaug  3162
         HB3    40 LEU  HN      3.50  #     2    19390.0  e   1ceaug  2063
         HB3    69 LEU  QD1     8.00  #     5M     841.0  e   1ceaug  5367
         HB3    69 LEU  QD2     8.00  #     5M    1155.0  e   1ceaug  5366
         HG     39 LEU  QQD     5.50  #     1M   20360.0*2e   1ceaug  2168
         HG     40 LEU  HN      7.00  #   w 5     2454.0  e   1ceaug  5368
         HG     73 ILE  QG2     8.00  #     5M     466.0  e   1ceaug  5369
         QQD    40 LEU  HN      9.40  #     5M     892.0*2e   1ceaug  2062
         QQD    72 LYS+ QB     10.40  # m   5M    1114.8*4e   1ceaug  4808
         QQD    73 ILE  HA      9.40  #     5M     374.5*2e   1ceaug  5370
         QQD    73 ILE  QG2    10.10  # m   5M    7715.0*2e   1ceaug  5371
 40 LEU  
         HN     40 LEU  HA      3.20  #     2    30040.0  e   1ceaug   486
         HN     40 LEU  HB2     3.10  #     2    39820.0  e   1ceaug  1117
         HN     40 LEU  HB3     3.60  #     2    16890.0  e   1ceaug  1116
         HN     40 LEU  HG      3.30  #     1    30810.0  e   1ceaug  1118
         HN     40 LEU  QD1     5.40  #     1M    3850.0  e   1ceaug  3175
         HN     40 LEU  QD2     5.40  #     1M    3726.0  e   1ceaug  1120
         HN     41 LYS+ HN      3.10  #     2    39060.0  e   1ceaug   488
         HN     41 LYS+ HB2     5.40  #     2     1301.0  e   1ceaug  4517
         HN     41 LYS+ HG2     7.00 >#   w 5      737.0  e   1ceaug  4518
         HN     41 LYS+ HG3     6.80 <#     5     3312.0  e   1ceaug  4522
         HN     42 GLY  HN      5.60  #     3     1866.0  e   MPeaug  4532
         HA     40 LEU  HB2     3.40  #     2    24650.0  e   1ceaug   489
         HA     40 LEU  HB3     3.20  #     2    30200.0  e   1ceaug   491
         HA     40 LEU  HG      3.70  #     1    17520.0  e   1ceaug  3181
         HA     40 LEU  QD1     5.30 >#     1M    4060.0  e   1ceaug  3174
         HA     40 LEU  QD2     3.40 <#     1M   65000.0  e   1ceaug  1686
         HA     41 LYS+ HN      3.90  #     2     9474.0  e   1ceaug   493
         HA     41 LYS+ HG2     7.00  #   w 5     1006.0  e   1ceaug  4527
         HA     41 LYS+ HG3     7.00  #   w 5     1451.0  e   1ceaug  4526
         HA     42 GLY  HN      4.80  #     3     6303.0  e   1ceaug  4533
         HA     42 GLY  HA1     7.00  #   w 3      670.0  e   1ceaug  4535
         HA     49 LEU  QD1     8.00  #     5M     158.0  e   1ceaug  5376
         HB2    40 LEU  HG      3.10  #     1    44000.0  e   1ceaug  3179
         HB2    40 LEU  QD1     3.80  #     1M   30830.0  e   1ceaug  2024
         HB2    40 LEU  QD2     3.90  #     1M   28010.0  e   1ceaug  2025
         HB2    41 LYS+ HN      3.80  #     2    11720.0  e   1ceaug  4529
         HB3    40 LEU  HG      3.20  #     1    41330.0  e   1ceaug  3180
         HB3    40 LEU  QD1     3.40  #     1M   66860.0  e   1ceaug  2023
         HB3    40 LEU  QD2     3.60  #     1M   40130.0  e   1ceaug  2022
         HB3    41 LYS+ HN      7.00  #   w 2         .0  e   1ceaug  4528
         HB3    49 LEU  QD1     8.00  #     5M     932.0  e ! 1ceaug  5380
         HG     40 LEU  QD1     3.80  #     1M   29870.0  e   1ceaug  2027
         HG     40 LEU  QD2     3.40  #     1M   64660.0  e   1ceaug  2026
         HG     41 LYS+ HN      4.60  #     5    16290.0  e   1ceaug  4530
         QD1    41 LYS+ HN      8.00 >#     5M     493.0  e   1ceaug  4521
         QD2    41 LYS+ HN      6.20 <#     5M   19030.0  e   1ceaug  2050
         QD2    45 THR  HA      8.00  #     5M     107.0  e   1ceaug  5383
         QD2    45 THR  HB      8.00  #     5M     140.0  e   1ceaug  5382
         QD2    46 LEU  HN      8.00  #     5M    2687.0  e   1ceaug  5351
         QD2    46 LEU  HA      8.00  #     5M     441.0  e   1ceaug  5352
         QD2    46 LEU  QD2     7.10  # m   5M   20130.0  e   1ceaug  5381
 41 LYS+ 
         HN     41 LYS+ HA      3.10  #     2    42860.0  e   1ceaug   498
         HN     41 LYS+ HB2     3.00 <#     2    46960.0  e   1ceaug  1123
         HN     41 LYS+ HB3     3.70 >#     2    13110.0  e   1ceaug  1122
         HN     41 LYS+ HG2     3.80  #     1    14010.0  e   1ceaug  1124
         HN     41 LYS+ HG3     4.10  #     1     9438.0  e   1ceaug  1125
         HN     41 LYS+ QD      5.70  # m   1     4068.0*2e   1ceaug  1126
         HN     41 LYS+ QE      8.00  # m w 1      276.5*2e   1ceaug  3222
         HN     42 GLY  HN      3.40  #     2    24880.0  e   1ceaug  3688
         HA     41 LYS+ HB2     3.70  #     2    12900.0  e   1ceaug  2032
         HA     41 LYS+ HB3     3.30  #     2    26890.0  e   1ceaug  2033
         HA     41 LYS+ HG2     4.20  #     1     7796.0  e   1ceaug  2029
         HA     41 LYS+ HG3     4.00  #     1    10560.0  e   1ceaug  2030
         HA     41 LYS+ QD      5.30  # m   1     6910.0*2e   1ceaug  2031
         HA     41 LYS+ QE      8.00  # m w 1      124.0*2e   1ceaug  3192
         HA     42 GLY  HN      3.70  #     2    13560.0  e   1ceaug   499
         HA     42 GLY  HA1     5.20  #     2     1655.0  e   1ceaug  4543
         HB2    41 LYS+ HG2     3.40  #     1    27880.0  e   1ceaug  3214
         HB2    41 LYS+ HG3     3.10  #     1    48930.0  e   1ceaug  3201
         HB2    41 LYS+ QD      3.90 <# m   1    74450.0*2e   1ceaug  3200
         HB2    41 LYS+ QE      5.30 <# m   1     6365.0*2e   1ceaug  3219
         HB2    42 GLY  HN      4.50 >#     2     4240.0  e   1ceaug  1869
         HB2    42 GLY  HA2     6.20  #     2      611.0  e   1ceaug  4548
         HB3    41 LYS+ HG2     3.20  #     1    38350.0  e   1ceaug  3197
         HB3    41 LYS+ HG3     3.40  #     1    29130.0  e   1ceaug  3196
         HB3    41 LYS+ QD      4.80 ># m   1    14410.0*2e   1ceaug  3195
         HB3    41 LYS+ QE      8.00 ># m w 1      106.0*2e   1ceaug  3220
         HB3    42 GLY  HN      3.70 <#     2    13140.0  e   1ceaug  2053
         HG2    41 LYS+ QD      4.30  # m   1    32920.0*2e   1ceaug  3215
         HG2    41 LYS+ QE      6.40  # m   1     1583.0*2e   1ceaug  3221
         HG3    41 LYS+ QD      4.70  # m   1    16715.0*2e   1ceaug  3210
         HG3    41 LYS+ QE      6.10  # m   1     2249.0*2e   1ceaug  3719
         QD     41 LYS+ QE      5.70  # mm  1    15340.0*4e   1ceaug  3718
         QD     42 GLY  HN      8.00  # m w 5     1044.0*2e   1ceaug  3720
 42 GLY  
         HN     42 GLY  HA1     3.10  #     2    42700.0  e   1ceaug   504
         HN     42 GLY  HA2     3.10  #     2    44030.0  e   1ceaug   502
         HN     43 MET  HN      5.00  #     2     5503.0  e   MPeaug  3642
         HA1    43 MET  HN      3.20  #     2    31980.0  e   1ceaug   509
         HA2    43 MET  HN      3.40  #     2    23720.0  e   1ceaug   507
         HA2    44 SER  HN      7.00  #   w 3     1036.0  e   1ceaug  4846
 43 MET  
         HN     43 MET  HA      4.20  #     2     6010.0  e   1ceaug  1365
         HN     43 MET  HB2     3.50 <#     2    17700.0  e   1ceaug  1369
         HN     43 MET  HB3     4.20 >#     2     6174.0  e   1ceaug  1368
         HN     43 MET  HG2     4.90  #     1     2858.0  e   1ceaug  3721
         HN     43 MET  HG3     5.00  #     1     2492.0  e   1ceaug  4552
         HN     44 SER  HN      5.0   #     2     fffff   e   MP
         HA     43 MET  HB2     3.70  #     2    13150.0  e   1ceaug  2040
         HA     43 MET  HB3     3.50  #     2    20760.0  e   1ceaug  2039
         HA     43 MET  HG2     4.80  #     1     3367.0  e   1ceaug  2038
         HA     43 MET  HG3     5.10  #     1     2270.0  e   1ceaug  2037
         HA     44 SER  HN      3.60  #     2    16220.0  e   1ceaug  1374
         HA     45 THR  HN      5.60  #     3     3302.0  e   1ceaug  4847
         HB2    43 MET  HG2     3.60  #     1    18000.0  e   1ceaug  3227
         HB2    43 MET  HG3     3.70  #     1    17020.0  e   1ceaug  3226
         HB2    44 SER  HN      3.40 <#     2    21070.0  e   1ceaug  1373
         HB3    43 MET  HG2     3.70  #     1    15320.0  e   1ceaug  3225
         HB3    43 MET  HG3     3.90  #     1    11780.0  e   1ceaug  3224
         HB3    44 SER  HN      4.30 >#     2     5557.0  e   1ceaug  1372
         HG3    44 SER  HN      7.00  #   w 5      620.0  e   1ceaug  2055
 44 SER  
         HN     44 SER  HA      3.70  #     2    13100.0  e   1ceaug   514
         HN     44 SER  HB2     3.50 <#     2    19120.0  e   1ceaug  1253
         HN     44 SER  HB3     4.60 >#     2     3636.0  e   1ceaug  3229
         HN     45 THR  HN      4.00  #     2     8045.0  e   1ceaug  3643
         HA     44 SER  HB2     3.70  #     2    12740.0  e   1ceaug   515
         HA     44 SER  HB3     3.30  #     2    27640.0  e   1ceaug   517
         HA     45 THR  HN      3.00  #     2    46470.0  e   1ceaug   519
         HB2    45 THR  HN      4.60  #     2     3546.0  e   1ceaug  1375
         HB2    48 GLU- HB2     6.40  #     5     4192.0  e   1ceaug  4559
         HB2    48 GLU- HB3     6.20  #     5     4550.0  e   1ceaug  4557
         HB2    49 LEU  HA      5.40  #     5     8373.0  e   1ceaug  4569
         HB2    49 LEU  HB3     7.00  #   w 5      600.0  e   1ceaug  5385
         HB2    49 LEU  QD1     8.00  #     5M    2539.0  e   1ceaug  4571
         HB3    45 THR  HN      4.60  #     2     3731.0  e   1ceaug  1376
         HB3    48 GLU- HB2     6.10  #     5     4891.0  e   1ceaug  4560
         HB3    48 GLU- HB3     6.50  #     5     3828.0  e   1ceaug  4563
         HB3    49 LEU  HN      7.00  #   w 5     1874.0  e   1ceaug  4565
         HB3    49 LEU  HA      4.70  #     5    14820.0  e   1ceaug  4568
         HB3    49 LEU  QD1     8.00  #     5M     604.0  e   1ceaug  5384
 45 THR  
         HN     45 THR  HA      3.30  #     2    27290.0  e   1ceaug   524
         HN     45 THR  HB      3.70  #     2    14260.0  e   1ceaug  1250
         HN     45 THR  QG2     3.60  #     1M   40310.0  e   1ceaug  1251
         HN     46 LEU  HN      4.60  #     2     3544.0  e   MPeaug  3644
         HN     47 ASP- HN      6.70  #     3     1592.0  e   1ceaug  4583
         HN     48 GLU- HN      5.40  #     3     3946.0  e   1ceaug  4587
         HN     48 GLU- HB2     4.80  #     3     5932.0  e   1ceaug  2067
         HN     48 GLU- HB3     4.50  #     3     7688.0  e   1ceaug  2068
         HN     48 GLU- HG2     7.00  #   w 5     1714.0  e   1ceaug  2069
         HN     48 GLU- HG3     7.00  #   w 5     2095.0  e   1ceaug  2070
         HN     49 LEU  HN      5.20  #     3     4543.0  e   1ceaug  2072
         HA     45 THR  HB      3.30  #     2    28750.0  e   1ceaug  3232
         HA     45 THR  QG2     3.40  #     1M   59050.0  e   1ceaug  1693
         HA     46 LEU  HN      3.00  #     2    50440.0  e   1ceaug   525
         HA     46 LEU  HA      5.40  #     2     1348.0  e   1ceaug  4581
         HA     47 ASP- HN      6.40  #     3     1941.0  e   1ceaug  1887
         HA     48 GLU- HN      6.70  #     3     1600.0  e   1ceaug  4588
         HB     45 THR  QG2     3.30  #   s 1M   79870.0  e   1ceaug  1694
         HB     46 LEU  HN      3.10  #     2    36550.0  e   1ceaug  1291
         HB     47 ASP- HN      4.20  #     3    11090.0  e   1ceaug  1470
         HB     47 ASP- HB2     7.00  #   w 5         .0  e   1ceaug  4585
         HB     48 GLU- HN      5.30  #     3     4167.0  e   1ceaug  4589
         QG2    46 LEU  HN      7.60  #     5M    8183.0  e   1ceaug  1292
         QG2    47 ASP- HN      8.00  #     5M    1765.0  e   1ceaug  5245
         QG2    48 GLU- HN      8.00  #     5M     801.0  e   1ceaug  4590
         QG2    48 GLU- HG3     8.00  #     5M    1875.0  e   1ceaug  4597
 46 LEU  
         HN     46 LEU  HA      3.30  #     2    25170.0  e   1ceaug   528
         HN     46 LEU  HB2     3.10  #     2    44060.0  e   1ceaug  1286
         HN     46 LEU  HB3     2.90  #     2    54430.0  e   1ceaug  1285
         HN     46 LEU  HG      4.80  #     1     3439.0  e   1ceaug  1287
         HN     46 LEU  QD1     5.50  #     1M    3247.0  e   1ceaug  1288
         HN     46 LEU  QD2     5.40  #     1M    3732.0  e   1ceaug  3723
         HN     47 ASP- HN      3.30  #     2    26420.0  e   1ceaug  3645
         HN     48 GLU- HN      6.40  #     3     1954.0  e   1ceaug  4602
         HN     49 LEU  HN      6.50  #     3     1806.0  e   1ceaug  4604
         HN     49 LEU  QD2     8.00  #     5M     337.0  e   1ceaug  4606
         HA     46 LEU  HB2     3.20 <#     2    35210.0  e   1ceaug   531
         HA     46 LEU  HB3     4.10 >#     2     7816.0  e   1ceaug   534
         HA     46 LEU  HG      4.20  #     1     7791.0  e   1ceaug   535
         HA     46 LEU  QD1     3.60 <#     1M   47300.0  e   1ceaug  3238
         HA     46 LEU  QD2     4.30 >#     1M   14010.0  e   1ceaug  3728
         HA     47 ASP- HN      3.80  #     2    10730.0  e   1ceaug   537
         HA     47 ASP- HA      5.60  #     2     1126.0  e   1ceaug  4598
         HA     49 LEU  HN      4.60  #     3     7198.0  e   1ceaug  2194
         HA     49 LEU  HB3     4.50  #     3     8043.0  e   1ceaug  4607
         HB2    46 LEU  HG      3.20  #     1    37990.0  e   1ceaug   541
         HB2    46 LEU  QD1     3.70  #     1M   34030.0  e   1ceaug  3241
         HB2    46 LEU  QD2     3.70  #     1M   35400.0  e   1ceaug  3730
         HB2    47 ASP- HN      3.80  #     2    12430.0  e   1ceaug   543
         HB2    47 ASP- HA      5.40  #     2     1380.0  e   1ceaug  4601
         HB3    46 LEU  HG      2.90  #     1    73590.0  e   1ceaug   546
         HB3    46 LEU  QD1     3.70  #     1M   36640.0  e   1ceaug  3235
         HB3    46 LEU  QD2     3.80  #     1M   32800.0  e   1ceaug  3726
         HB3    47 ASP- HN      3.20  #     2    30140.0  e   1ceaug   547
         HB3    47 ASP- HA      5.50  #     2     1252.0  e   1ceaug  4600
         HG     46 LEU  QD1     3.70  #     1M   38770.0  e   1ceaug  3242
         HG     46 LEU  QD2     3.90  #     1M   28310.0  e   1ceaug  3731
         HG     47 ASP- HN      5.80  #     5     6320.0  e   1ceaug  3735
         QD1    47 ASP- HN      6.50  #     5M   15810.0  e   1ceaug  1539
         QD1    50 PHE  HN      8.00  #     5M    1348.0  e   1ceaug  5218
         QD2    47 ASP- HN      6.90  #     5M   12420.0  e   1ceaug  3736
 47 ASP- 
         HN     47 ASP- HA      3.50  #     2    18210.0  e   1ceaug   550
         HN     47 ASP- HB2     3.00  #     2    44440.0  e   1ceaug  1151
         HN     47 ASP- HB3     3.50  #     2    18120.0  e   1ceaug  1150
         HN     48 GLU- HN      3.20  #     2    30950.0  e   1ceaug  1284
         HN     49 LEU  HN      4.30  #     3     9564.0  e ! 1ceaug  4609
         HN     50 PHE  HN      5.90  #     3     2682.0  e   1ceaug  4611
         HN     51 GLU- HN      7.00  #   w 3     1215.0  e   1ceaug  4620
         HA     47 ASP- HB2     3.40  #     2    21680.0  e   1ceaug   551
         HA     47 ASP- HB3     3.30  #     2    26520.0  e   1ceaug   553
         HA     48 GLU- HN      4.30  #     2     5786.0  e   1ceaug   555
         HA     49 LEU  HN      7.00  #   w 3      792.0  e   1ceaug  4610
         HA     50 PHE  HN      4.20  #     3    10430.0  e   1ceaug  2200
         HA     50 PHE  HB2     3.10 <#     3    34700.0  e   1ceaug  4615
         HA     50 PHE  HB3     4.40 >#     3     9124.0  e   1ceaug  1747
         HA     51 GLU- HN      7.00  #   w 3      968.0  e   1ceaug  2014
         HA     51 GLU- HB2     5.10 <#     3     4713.0  e   1ceaug  4622
         HA     51 GLU- HB3     7.00 >#   w 3     1287.0  e   1ceaug  4623
         HB2    48 GLU- HN      3.40  #     2    24220.0  e   1ceaug  1896
         HB3    48 GLU- HN      3.60  #     2    14830.0  e   1ceaug  1895
         HB3    50 PHE  HN      6.90  #     3     1406.0  e   1ceaug  4617
         HB3    50 PHE  QD      9.00  # r w 5     2155.0*2e   1ceaug  4619
 48 GLU- 
         HN     48 GLU- HA      3.50  #     2    19840.0  e   1ceaug   560
         HN     48 GLU- HB2     3.80 >#     2    11120.0  e   1ceaug  1282
         HN     48 GLU- HB3     3.20 <#     2    35760.0  e   1ceaug  1281
         HN     48 GLU- HG2     3.90  #     1    12740.0  e   1ceaug  1280
         HN     48 GLU- HG3     3.30  #     1    30250.0  e   1ceaug  1279
         HN     49 LEU  HN      3.10  #     2    40320.0  e   1ceaug  1283
         HN     50 PHE  HN      6.00  #     3     2491.0  e   1ceaug  4626
         HA     48 GLU- HB2     3.10  #     2    40000.0  e   1ceaug  3272
         HA     48 GLU- HB3     2.90  #     2    56750.0  e   1ceaug  3269
         HA     48 GLU- HG2     3.10  #     1    45990.0  e   1ceaug  3265
         HA     48 GLU- HG3     3.30  #     1    36060.0  e   1ceaug  3261
         HA     49 LEU  HN      3.80  #     2    10870.0  e   1ceaug   561
         HA     50 PHE  HN      7.00  #   w 3         .0  e   1ceaug  4627
         HA     51 GLU- HN      5.50  #     3     3476.0  e   1ceaug  1748
         HA     51 GLU- HB2     5.30  #     3     3993.0  e   1ceaug  4631
         HA     51 GLU- HB3     5.60  #     3     3337.0  e   1ceaug  4630
         HA     51 GLU- HG2     7.00  #   w 5         .0  e   1ceaug  2549
         HA     51 GLU- HG3     7.00  #   w 5     1275.0  e   1ceaug  4629
         HA     52 GLU- HN      6.30  #     3     2091.0  e   1ceaug  4634
         HB2    48 GLU- HG2     3.40  #     1    25400.0  e   1ceaug  3268
         HB2    48 GLU- HG3     3.10  #     1    51010.0  e   1ceaug  3264
         HB2    49 LEU  HN      3.30  #     2    28310.0  e   1ceaug  1513
         HB3    48 GLU- HG2     3.10  #     1    43820.0  e   1ceaug  3267
         HB3    48 GLU- HG3     3.30  #     1    30080.0  e   1ceaug  3263
         HB3    49 LEU  HN      3.40  #     2    23530.0  e   1ceaug  3819
         HG2    49 LEU  HN      7.00  #   w 5         .0  e   1ceaug  3816
         HG3    49 LEU  HN      7.00  #   w 5      471.0  e   1ceaug  3815
 49 LEU  
         HN     49 LEU  HA      3.50  #     2    19170.0  e   1ceaug  1274
         HN     49 LEU  HB2     2.90  #     2    64640.0  e   1ceaug  1275
         HN     49 LEU  HB3     3.10  #     2    37850.0  e   1ceaug  3292
         HN     49 LEU  HG      4.50  #     1     4927.0  e   1ceaug  3296
         HN     49 LEU  QD1     4.80  #     1M    7162.0  e   1ceaug  1278
         HN     49 LEU  QD2     5.20  #     1M    5645.0  e   1ceaug  3297
         HN     50 PHE  HN      3.00  #     2    46600.0  e   1ceaug  3609
         HN     51 GLU- HN      4.30  #     3    11120.0  e   1ceaug  4636
         HN     52 GLU- HN      5.70  #     3     3153.0  e   1ceaug  4643
         HN     52 GLU- QB      7.70  # m   3     1646.5*2e   1ceaug  4657
         HA     49 LEU  HB2     3.00  #     2    46960.0  e   1ceaug  3287
         HA     49 LEU  HB3     3.40  #     2    23540.0  e   1ceaug  3282
         HA     49 LEU  HG      4.40  #     1     5725.0  e   1ceaug  3295
         HA     49 LEU  QD1     3.90  #     1M   26310.0  e   1ceaug  3277
         HA     49 LEU  QD2     4.40  #     1M   13220.0  e   1ceaug  1858
         HA     50 PHE  HN      3.90  #     2    10140.0  e   1ceaug  1467
         HA     51 GLU- HN      6.20  #     3     2150.0  e   1ceaug  4638
         HA     52 GLU- HN      4.30  #     3     9973.0  e   1ceaug  1749
         HA     52 GLU- QB      5.20  # m   3    10680.0*2e   1ceaug  1750
         HA     53 LEU  HN      6.00  #     3     2454.0  e   1ceaug  4647
         HB2    49 LEU  HG      3.20 <#     1    37180.0  e   1ceaug  3285
         HB2    49 LEU  QD1     3.60  #     1M   43910.0  e   1ceaug  3302
         HB2    49 LEU  QD2     3.70  #     1M   34400.0  e   1ceaug  3306
         HB2    50 PHE  HN      3.70  #     2    12580.0  e   1ceaug  1481
         HB2    50 PHE  HA      5.30  #     2     1584.0  e   1ceaug  4650
         HB2    50 PHE  HB2     5.30  #     5     9161.0  e   1ceaug  4652
         HB3    49 LEU  HG      3.90 >#     1    12700.0  e   1ceaug  3293
         HB3    49 LEU  QD1     3.80  #     1M   29440.0  e   1ceaug  3279
         HB3    49 LEU  QD2     3.70  #     1M   37390.0  e   1ceaug  3307
         HB3    50 PHE  HN      3.40  #     2    24480.0  e   1ceaug  1476
         HB3    50 PHE  HB2     7.00  #   w 5     2453.0  e   1ceaug  4649
         HG     49 LEU  QD1     3.60  #     1M   45250.0  e   1ceaug  3304
         HG     49 LEU  QD2     3.70  #     1M   34690.0  e   1ceaug  3300
         HG     50 PHE  HN      5.70  #     5     6729.0  e   1ceaug  1482
         HG     50 PHE  HA      7.00  #   w 5     1997.0  e   1ceaug  4655
         QD1    50 PHE  HN      8.00 >#     5M    2019.0  e   1ceaug  5280
         QD1    50 PHE  HA      8.00 >#     5M    3898.0  e   1ceaug  5285
         QD1    69 LEU  QD1     4.30  # m s 5M  305100.0  e   1ceaug  4662
         QD1    69 LEU  QD2     4.90  # m   5M  119300.0  e   1ceaug  4660
         QD2    50 PHE  HN      6.70 <#     5M   13690.0  e   1ceaug  5281
         QD2    50 PHE  HA      5.90 <#     5M   22250.0  e ! 1ceaug  5283
         QD2    69 LEU  QD1     4.80  # m   5M  141000.0  e   1ceaug  4664
         QD2    69 LEU  QD2     5.00  # m   5M  115500.0  e   1ceaug  4659
 50 PHE  
         HN     50 PHE  HA      3.10  #     2    40620.0  e   1ceaug   568
         HN     50 PHE  HB2     2.70  #     2    89150.0  e   1ceaug   570
         HN     50 PHE  HB3     2.90  #     2    66300.0  e   1ceaug   572
         HN     50 PHE  QD      6.60  # r   1     4308.0*2e   1ceaug  1453
         HN     51 GLU- HN      3.10  #     2    39450.0  e   1ceaug  3651
         HN     52 GLU- HN      6.80  #     3     1524.0  e   1ceaug  4668
         HA     50 PHE  HB2     2.70 <#     2    83670.0  e   1ceaug   574
         HA     50 PHE  HB3     3.20 >#     2    30890.0  e   1ceaug   575
         HA     50 PHE  QD      4.50  # m   1    21970.0*2e   1ceaug  3310
         HA     51 GLU- HN      3.90  #     2     9444.0  e   1ceaug   578
         HA     52 GLU- HN      7.00  #   w 3         .0  e   1ceaug  4669
         HA     53 LEU  HN      4.30  #     3     9665.0  e   1ceaug  4670
         HA     53 LEU  HB2     4.50  #     3     7917.0  e   1ceaug  4672
         HA     53 LEU  HB3     5.30  #     3     4052.0  e   1ceaug  4671
         HA     53 LEU  HG      6.10  #     5     4896.0  e   1ceaug  4674
         HA     53 LEU  QD1     5.90 <#     5M   23590.0  e   1ceaug  4677
         HA     53 LEU  QD2     7.90 >#     5M    6884.0  e   1ceaug  4676
         HA     54 ASP- HN      5.50  #     3     3573.0  e   1ceaug  4680
         HA     61 VAL  QG2     6.70  #     5M   13506.0  e   paraug  5209
         HB2    50 PHE  QD      5.20  # r   1    37180.0*2e   1ceaug  3312
         HB2    50 PHE  QE      7.20  # r   1     2174.5*2e   1ceaug  1655
         HB2    51 GLU- HN      3.70  #     2    13720.0  e   1ceaug  1553
         HB3    50 PHE  QD      5.40  # r   1    27370.0*2e   1ceaug  3311
         HB3    51 GLU- HN      3.40  #     2    21150.0  e   1ceaug  1554
         QD     51 GLU- HN      5.80  # r   5    34635.0*2e   1ceaug  5006
         QD     51 GLU- HA      9.00  # r w 5     1232.5*2e   1ceaug  1960
         QD     53 LEU  QD1    10.00 <# r   5M    1683.0*2e   1ceaug  4679
         QD     53 LEU  QD2    10.00 ># r   5M     234.5*2e   1ceaug  2570
         QD     54 ASP- HB3     9.00  # r w 5      339.5*2e   1ceaug  1602
         QD     59 GLY  HN      9.00  # r w 5      390.0*2e   paraug  1401
         QD     61 VAL  QG2     8.70  # r   5M   13347.0*2e   paraug  5208
         QE     59 GLY  HN      8.50  # r   5     3981.0*2e   paraug  5216
         QE     61 VAL  QG2     8.80  # r   5M   13209.0*2e   paraug  5206
 51 GLU- 
         HN     51 GLU- HA      3.20  #     2    33890.0  e   1ceaug   584
         HN     51 GLU- HB2     3.40  #     2    21390.0  e   1ceaug  3333
         HN     51 GLU- HB3     3.20  #     2    35160.0  e   1ceaug  1147
         HN     51 GLU- HG2     4.60 >#     1     4629.0  e   1ceaug  3326
         HN     51 GLU- HG3     3.90 <#     1    12640.0  e   1ceaug  1145
         HN     52 GLU- HN      3.00  #     2    53520.0  e   1ceaug  1273
         HN     53 LEU  HN      4.40  #     3     8916.0  e   1ceaug  4683
         HN     54 ASP- HN      6.80  #     3     1558.0  e   1ceaug  4685
         HA     51 GLU- HB2     3.20  #     2    34060.0  e   1ceaug  3321
         HA     51 GLU- HB3     3.60  #     2    15890.0  e   1ceaug  3320
         HA     51 GLU- HG2     5.30  #     1     1773.0  e   1ceaug  3319
         HA     51 GLU- HG3     4.80  #     1     3367.0  e   1ceaug  3317
         HA     52 GLU- HN      3.80  #     2    12020.0  e   1ceaug   587
         HA     53 LEU  HN      6.90  #     3     1441.0  e   1ceaug  4682
         HA     54 ASP- HN      3.80  #     3    15860.0  e   1ceaug  1751
         HB2    51 GLU- HG2     3.20  #     1    39730.0  e   1ceaug  3329
         HB2    51 GLU- HG3     4.40  #     1     5778.0  e   1ceaug  3325
         HB2    52 GLU- HN      3.90  #     2    10600.0  e   1ceaug  3826
         HB3    51 GLU- HG2     3.00  #     1    54390.0  e   1ceaug  3332
         HB3    51 GLU- HG3     4.20  #     1     7667.0  e   1ceaug  3331
         HB3    52 GLU- HN      3.90  #     2     9187.0  e   1ceaug  3825
         HG2    52 GLU- HN      7.00 <#   w 5      630.0  e   1ceaug  3824
         HG3    52 GLU- HN      7.00 >#   w 5      221.0  e   1ceaug  3823
         HG3    54 ASP- HN      7.00  #   w 5      411.0  e   1ceaug  4999
 52 GLU- 
         HN     52 GLU- HA      3.20  #     2    34340.0  e   1ceaug  3827
         HN     52 GLU- QB      3.70  # i   2    38480.0*2e   1ceaug  3344
         HN     52 GLU- HG2     4.60  #     1     4457.0  e   1ceaug  3341
         HN     52 GLU- HG3     5.20  #     1     2053.0  e   1ceaug  3348
         HN     53 LEU  HN      2.90  #     2    66140.0  e   1ceaug   591
         HN     53 LEU  HB2     5.70  #     2      988.0  e   1ceaug  4689
         HN     53 LEU  HG      7.00  #   w 5     2633.0  e   1ceaug  4686
         HN     54 ASP- HN      5.60  #     3     3243.0  e   1ceaug  4996
         HA     52 GLU- QB      4.30  # m   2    27155.0*2e   1ceaug  3336
         HA     52 GLU- HG2     3.60  #     1    18630.0  e   1ceaug  3338
         HA     52 GLU- HG3     3.20  #     1    37720.0  e   1ceaug  3337
         HA     53 LEU  HN      4.00  #     2     9053.0  e   1ceaug  3829
         HA     53 LEU  HA      5.60  #     2     1124.0  e   1ceaug  4691
         QB     52 GLU- HG2     3.40 <# m   1   214250.0*2e   1ceaug  3342
         QB     52 GLU- HG3     4.10 ># m   1    48560.0*2e   1ceaug  3349
         QB     53 LEU  HN      4.20  # m   2    33135.0*2e   1ceaug  1548
         QB     53 LEU  HG      5.30  # m   5    20955.0*2e   1ceaug  4693
         QB     53 LEU  QD2     9.00  # m   5M    2913.5*2e   1ceaug  4695
         QB     54 ASP- HN      8.00  # m w 3         .0*2e   1ceaug  4998
         HG2    53 LEU  HB2     7.00  #   w 5      924.0  e   1ceaug  4697
 53 LEU  
         HN     53 LEU  HA      3.20  #     2    32020.0  e   1ceaug   594
         HN     53 LEU  HB2     3.10  #     2    37010.0  e   1ceaug   598
         HN     53 LEU  HB3     3.50  #     2    20140.0  e   1ceaug   596
         HN     53 LEU  HG      2.90  #     1    67120.0  e   1ceaug  3350
         HN     53 LEU  QD1     3.80  #     1M   31980.0  e   1ceaug  3359
         HN     53 LEU  QD2     4.20  #     1M   17290.0  e   1ceaug  1866
         HN     54 ASP- HN      3.00  #     2    45810.0  e   1ceaug  2590
         HA     53 LEU  HB2     3.70 >#     2    13250.0  e   1ceaug   601
         HA     53 LEU  HB3     3.00 <#     2    52590.0  e   1ceaug   600
         HA     53 LEU  HG      3.60  #     1    20050.0  e   1ceaug  1141
         HA     53 LEU  QD1     5.10 >#     1M    5079.0  e   1ceaug  1687
         HA     53 LEU  QD2     3.30 <#   s 1M   67480.0  e   1ceaug  1139
         HA     54 ASP- HN      3.90  #     2     9722.0  e   1ceaug   604
         HA     54 ASP- HA      4.90  #     2     2589.0  e   1ceaug  4700
         HB2    53 LEU  HG      3.70  #     1    17240.0  e   1ceaug   611
         HB2    53 LEU  QD1     3.30  #   s 1M  161500.0  e   1ceaug  3356
         HB2    53 LEU  QD2     3.90  #     1M   27440.0  e   1ceaug  3370
         HB2    54 ASP- HN      3.30  #     2    25780.0  e   1ceaug   614
         HB3    53 LEU  HG      3.50  #     1    22790.0  e   1ceaug   607
         HB3    53 LEU  QD1     3.70  #     1M   34520.0  e   1ceaug  3362
         HB3    53 LEU  QD2     3.70  #     1M   39070.0  e   1ceaug  3371
         HB3    54 ASP- HN      3.60  #     2    15090.0  e   1ceaug   609
         HG     53 LEU  QD1     3.30  #   s 1M  123000.0  e   1ceaug  3360
         HG     53 LEU  QD2     3.30  #   s 1M   81190.0  e   1ceaug  3364
         HG     54 ASP- HN      6.30  #     5     4511.0  e   1ceaug   615
         QD1    54 ASP- HN      6.50 <#     5M   15080.0  e   1ceaug  4706
         QD1    66 PHE  HA      6.80  #     5M   13120.0  e   1ceaug  5025
         QD1    66 PHE  HB2     8.00  #     5M    1660.0  e   1ceaug  5028
         QD1    66 PHE  QD      9.40 <# r   5M    9005.0*2e   1ceaug  4986
         QD1    69 LEU  QD2     6.60  # m   5M   27210.0  e   1ceaug  4984
         QD2    54 ASP- HN      8.00 >#     5M    1351.0  e   1ceaug  4705
         QD2    66 PHE  HA      6.20  #     5M   19140.0  e   1ceaug  5024
         QD2    66 PHE  HB2     8.00  #     5M        .0  e   1ceaug  5029
         QD2    66 PHE  QD     10.00 ># r   5M    2144.5*2e   1ceaug  4979
         QD2    68 VAL  HN      5.70  #     5M   26610.0  e   1ceaug  5022
         QD2    68 VAL  HB      4.90  #     5M   48290.0  e   1ceaug  5023
         QD2    69 LEU  QD2     9.00  # m   5M    3050.0  e   1ceaug  4985
 54 ASP- 
         HN     54 ASP- HA      3.60  #     2    17046.0  e   paraug  1138
         HN     54 ASP- HB2     2.90  #     2    56526.0  e   paraug  1137
         HN     54 ASP- HB3     3.30  #     2    25800.0  e   1ceaug  1136
         HN     61 VAL  QG1     6.80  #     5M   12810.0  e   paraug  4902
         HN     61 VAL  QG2     6.70  #     5M   13428.0  e   paraug  5195
         HA     54 ASP- HB2     4.10  #     2     7656.0  e   paraug  5194
         HA     54 ASP- HB3     4.20  #     2     6360.0  e   paraug  5193
         HA     61 VAL  QG1     8.00 >#     5M    4416.0  e   paraug  5196
         HA     61 VAL  QG2     6.40 <#     5M   16704.0  e   paraug  1682
         HB2    61 VAL  QG2     8.00  #     5M    2064.0  e   paraug  5198
         HB3    61 VAL  QG2     4.90  #     5M   49650.0  e   paraug  5199
 55 LYS+ 
         HB2    55 LYS+ QE      7.70  # m   1      452.0*2e   1ceaug  4036
         HB3    55 LYS+ QE      8.00  # m w 1         .0*2e   1ceaug  3402
         HG2    55 LYS+ QE      7.90 ># m   1      363.0*2e   1ceaug  4038
         HG3    55 LYS+ QE      5.10 <# m   1     8565.0*2e   1ceaug  4037
         QD     55 LYS+ QE      6.20  # mm  1     7747.5*4e   1ceaug  1881
 56 ASN  
         HN     56 ASN  HA      3.00  #     2    49284.0  e   paraug   628
         HN     56 ASN  HB2     3.60 <#     2    16302.0  e   paraug  1132
         HN     56 ASN  HB3     4.20 >#     2     6516.0  e   paraug  5228
         HN     56 ASN  HD21    4.30  #     1     6906.0  e   paraug  3406
         HN     57 GLY  HN      4.60  #     2     3552.0  e   paraug  1271
         HA     56 ASN  HB2     4.70  #     2     3237.0  e   1ceaug  2107
         HA     56 ASN  HD22    5.50  #     1     1524.0  e   paraug  2108
         HA     57 GLY  HN      5.20  #     2     1644.0  e   paraug   630
         HB2    56 ASN  HD21    3.20  #     1    42942.0  e   paraug  1629
         HB3    56 ASN  HD21    3.10  #     1    46458.0  e   paraug  3411
         HB3    56 ASN  HD22    6.70  #     1      432.0  e   paraug  3412
         HB3    57 GLY  HN      4.50  #     2     4026.0  e   paraug  2626
         HD21   58 ASP- HB2     7.00  #   w 5     2346.0  e   paraug  1625
 57 GLY  
         HN     57 GLY  QA      4.20  #     2     5889.0*2e   paraug  1130
         QA     59 GLY  HN      8.00  # m w 3      558.0*2e   paraug  1399
 58 ASP- 
         HN     58 ASP- HA      3.70  #     2    13206.0  e   paraug   631
         HN     58 ASP- HB2     4.10 <#     2     7842.0  e   paraug  3418
         HN     58 ASP- HB3     5.80 >#     2      870.0  e   paraug   633
         HN     59 GLY  HN      3.20  #     2    32742.0  e   paraug   636
         HA     58 ASP- HB2     3.10 <#     2    37614.0  e   paraug   638
         HA     58 ASP- HB3     3.70 >#     2    13332.0  e   paraug   640
         HA     59 GLY  HN      4.40  #     2     4752.0  e   paraug   642
 59 GLY  
         HN     59 GLY  HA1     5.50 >#     2     1170.0  e   paraug  1128
         HN     59 GLY  HA2     3.10 <#     2    37218.0  e   paraug  3421
         HN     60 GLU- HN      5.80  #     2      912.0  e   paraug   650
         HA2    60 GLU- HN      5.20  #     2     1692.0  e   paraug  5227
 60 GLU- 
         HN     60 GLU- HB3     5.20  #     2     1686.0  e   paraug   656
         HA     61 VAL  HN      3.00  #     2    47310.0  e   1ceaug  2631
 61 VAL  
         HN     61 VAL  HA      3.00  #     2    49338.0  e   paraug   670
         HN     61 VAL  HB      2.90  #     2    58800.0  e   paraug  3437
         HN     61 VAL  QG1     5.30 >#     1M    4266.0  e   paraug  3441
         HN     61 VAL  QG2     4.30 <#     1M   15282.0  e   paraug  3445
         HN     62 SER  HN      4.50  #     2     4278.0  e   paraug  1266
         HA     61 VAL  HB      3.70  #     2    12966.0  e   paraug  3438
         HA     61 VAL  QG1     3.70  #     1M   35334.0  e   paraug  1692
         HA     61 VAL  QG2     3.70  #     1M   39342.0  e   paraug  1680
         HA     62 SER  HN      4.90  #     2     2478.0  e   paraug   672
         HB     61 VAL  QG1     3.40  #     1M   65280.0  e   1ceaug  3439
         HB     61 VAL  QG2     3.80  #     1M   33846.0  e   paraug  1717
         HB     62 SER  HN      7.00  #   w 2         .0  e   1ceaug  1418
         QG1    62 SER  HN      7.80  #     5M    7498.0  e   1ceaug  1415
         QG1    65 GLU- HN      8.00  #     5M    2460.0  e   paraug  4901
         QG1    65 GLU- HB2     8.00  #     5M    6650.0  e   1ceaug  4897
         QG1    65 GLU- HB3     6.30  #     5M   16970.0  e   1ceaug  4898
         QG1    66 PHE  HN      5.30  #     5M   36090.0  e   1ceaug  1495
         QG1    66 PHE  HA      5.60  #     5M   28506.0  e   paraug  4892
         QG1    66 PHE  HB2     5.20  #     5M   37640.0  e   1ceaug  4894
         QG1    66 PHE  HB3     6.50  #     5M   15640.0  e   1ceaug  4893
         QG1    66 PHE  QD      8.70  # r   5M   13615.0*2e   1ceaug  4890
         QG1    66 PHE  QE     10.00  # r   5M     319.5*2e   1ceaug  4891
 62 SER  
         HN     62 SER  HG      3.80  #     1    14460.0  e   paraug  3446
         HN     63 PHE  HN      5.30  #     2     1584.0  e   paraug   679
         HN     65 GLU- HA      7.00  #   w 3      292.0  e   1ceaug  1813
         HA     62 SER  HB2     4.10 <#     2     7727.0  e   1ceaug   681
         HA     62 SER  HB3     5.30 >#     2     1491.0  e   1ceaug   683
         HA     63 PHE  HN      3.50  #     2    20050.0  e   1ceaug  1265
         HA     64 GLU- HN      7.00  #   w 3         .0  e   1ceaug  1466
         HB2    63 PHE  HN      3.10 <#     2    42040.0  e   1ceaug   691
         HB2    64 GLU- HN      4.10  #     3    11440.0  e   1ceaug  2637
         HB3    63 PHE  HN      3.60 >#     2    14850.0  e   1ceaug   696
         HB3    63 PHE  HB3     7.00  #   w 5      880.0  e   1ceaug   697
         HB3    64 GLU- HN      4.70  #     3     6513.0  e   1ceaug   700
         HG     65 GLU- HN      4.70  #     5    14298.0  e   paraug  5229
         HG     65 GLU- HG3     5.20  #     5     9900.0  e   paraug  1987
 63 PHE  
         HN     63 PHE  HA      3.40  #     2    23030.0  e   1ceaug   701
         HN     63 PHE  HB2     3.00  #     2    54030.0  e   1ceaug   703
         HN     63 PHE  HB3     3.00  #     2    48220.0  e   1ceaug   705
         HN     63 PHE  QD      6.50  # r   1     4910.0*2e   1ceaug  3456
         HN     64 GLU- HN      3.20  #     2    35050.0  e   1ceaug   707
         HN     64 GLU- HA      6.40  #     2      484.0  e   1ceaug  4851
         HN     65 GLU- HN      6.80  #     3     1503.0  e   1ceaug  1439
         HA     63 PHE  HB2     3.20  #     2    35850.0  e   1ceaug   710
         HA     63 PHE  HB3     3.10  #     2    37250.0  e   1ceaug   712
         HA     63 PHE  QD      4.30  # m   1    36045.0*2e   1ceaug  3457
         HA     63 PHE  QE      5.70  # i   1     2316.5*2e   1ceaug  3448
         HA     64 GLU- HN      4.00  #     2     8468.0  e   1ceaug  5109
         HA     65 GLU- HN      7.00  #   w 3      478.0  e   1ceaug  4854
         HA     66 PHE  HN      3.70  #     3    18400.0  e   1ceaug  3793
         HA     66 PHE  HB2     3.40  #     3    26220.0  e   1ceaug  2640
         HA     66 PHE  HB3     3.20  #     3    32310.0  e   1ceaug  5087
         HA     66 PHE  QD      7.60  # r   5     7295.0*2e   1ceaug  5092
         HA     67 GLN  HN      7.00  #   w 3      759.0  e   1ceaug  5074
         HB2    63 PHE  QD      5.70 ># r   1    16520.0*2e   1ceaug  3459
         HB2    64 GLU- HN      4.00 >#     2     9018.0  e   1ceaug  4841
         HB3    63 PHE  QD      5.10 <# r   1    48060.0*2e   1ceaug  1261
         HB3    64 GLU- HN      3.30 <#     2    25680.0  e   1ceaug   715
         HB3    65 GLU- HN      6.70  #     3     1599.0  e   1ceaug  4852
         QD     63 PHE  QE      7.50  # rr  1    21305.0*4e   1ceaug  3454
         QD     63 PHE  HZ      5.80  # r   1    13050.0*2e   1ceaug  1159
         QD     64 GLU- HN      8.50  # r   5     3765.5*2e   1ceaug  4840
         QD     66 PHE  HB2     9.00 ># r w 5     2182.0*2e   1ceaug  1945
         QD     66 PHE  HB3     6.70 <# r   5    14825.0*2e   1ceaug  5089
         QD     66 PHE  QD      9.40  # rr  5     8300.0*4e   1ceaug  1986
         QD     66 PHE  QE     10.60  # rr  5     3682.5*4e   1ceaug  4981
         QD     67 GLN  HG3     9.00  # r w 5     1181.0*2e   1ceaug  5075
         QD     67 GLN  HE21    8.10  # r   5     5000.0*2e   1ceaug  5288
         QD     67 GLN  HE22    8.80  # r   5     3151.5*2e   1ceaug  5289
         QE     63 PHE  HZ      4.70  # r   1   105800.0*2e   1ceaug  1160
         QE     66 PHE  QD     11.00  # rrw 5     2276.2*4e   1ceaug  5001
         QE     66 PHE  QE     11.00  # rrw 5     1641.2*4e   1ceaug  5003
         QE     67 GLN  HE21    7.70  # r   5     6500.0*2e   1ceaug  1983
         QE     67 GLN  HE22    8.00  # r   5     5300.0*2e   1ceaug  1978
         HZ     67 GLN  HE21    5.50  #     5     7748.0  e   1ceaug  1982
         HZ     67 GLN  HE22    6.20  #     5     4790.0  e   1ceaug  1980
         HZ     70 VAL  QG1     8.00  #     5M    3807.0  e   1ceaug  1919
 64 GLU- 
         HN     64 GLU- HA      3.10  #     2    40370.0  e   1ceaug   718
         HN     64 GLU- HB2     4.60  #     2     3669.0  e   1ceaug   722
         HN     64 GLU- HB3     4.30  #     2     5301.0  e   1ceaug   720
         HN     64 GLU- HG2     3.10  #     1    46650.0  e   1ceaug  3797
         HN     64 GLU- HG3     3.30  #     1    33620.0  e   1ceaug  1157
         HN     65 GLU- HN      3.20  #     2    32900.0  e   1ceaug  2644
         HN     66 PHE  HN      5.50  #     3     3675.0  e   1ceaug  4855
         HA     64 GLU- HB2     4.40 >#     2     4791.0  e   1ceaug   725
         HA     64 GLU- HB3     3.70 <#     2    13120.0  e   1ceaug   723
         HA     64 GLU- HG2     7.00  #   w 1         .0  e   1ceaug  3799
         HA     64 GLU- HG3     4.50  #     1     4896.0  e   1ceaug  3461
         HA     65 GLU- HN      5.00  #     2     2300.0  e   1ceaug   727
         HA     65 GLU- HA      6.20  #     2      572.0  e   1ceaug  4864
         HA     66 PHE  HN      7.00  #   w 3     1179.0  e   1ceaug  4863
         HA     67 GLN  HN      4.30  #     3    10050.0  e   1ceaug  1752
         HA     67 GLN  HA      7.00  #   w 3      469.0  e   1ceaug  5068
         HA     67 GLN  HB2     7.00  #     3     1329.0  e   1ceaug  5069
         HA     67 GLN  HG2     7.00  #   w 5     2736.0  e   1ceaug  3809
         HA     67 GLN  HG3     6.00  #     5     5531.0  e   1ceaug  3808
         HA     67 GLN  HE21    6.40  #     5     4070.0  e   1ceaug  1638
         HB2    64 GLU- HG2     3.50  #     1    24000.0  e   1ceaug  3801
         HB2    64 GLU- HG3     3.20  #     1    37350.0  e   1ceaug  3465
         HB3    64 GLU- HG2     5.40  #     1     1637.0  e   1ceaug  3805
         HB3    64 GLU- HG3     4.40  #     1     5610.0  e   1ceaug  3466
         HG2    65 GLU- HN      6.40  #     5     4261.0  e   1ceaug  3812
         HG3    65 GLU- HN      6.80  #     5     3160.0  e   1ceaug  3813
 65 GLU- 
         HN     65 GLU- HA      3.70  #     2    13932.0  e   paraug   736
         HN     65 GLU- HB2     2.80 <#     2    81120.0  e   paraug  1818
         HN     65 GLU- HB3     3.50 >#     2    17838.0  e ! paraug   738
         HN     65 GLU- HG2     3.70 <#     1    16800.0  e   paraug  1819
         HN     65 GLU- HG3     5.20 >#     1     2132.0  e   1ceaug  3467
         HN     66 PHE  HN      3.10  #     2    41560.0  e   1ceaug  1449
         HN     66 PHE  HB3     5.10  #     2     1998.0  e   1ceaug  5085
         HN     67 GLN  HN      6.90  #     3     1396.0  e   1ceaug  5066
         HA     65 GLU- HB2     3.90 >#     2    10200.0  e   paraug   744
         HA     65 GLU- HB3     3.10 <#     2    37956.0  e   paraug   742
         HA     65 GLU- HG2     3.30 <#     1    31482.0  e   paraug  3471
         HA     65 GLU- HG3     5.60 >#     1     1272.0  e   paraug  3472
         HA     66 PHE  HN      4.10  #     2     6862.0  e   1ceaug   745
         HA     67 GLN  HN      5.20  #     3     4478.0  e   1ceaug  4862
         HA     68 VAL  HN      7.00  #   w 3     1070.0  e   1ceaug  1753
         HA     68 VAL  HB      7.00  #   w 3         .0  e   1ceaug  3814
         HB2    65 GLU- HG2     3.10  #     1    45580.0  e   1ceaug  3478
         HB2    65 GLU- HG3     3.10  #     1    44960.0  e   1ceaug  3474
         HB2    66 PHE  HN      3.70  #     2    12730.0  e   1ceaug  5080
         HB2    66 PHE  HB2     6.20  #     5     4750.0  e   1ceaug   761
         HB3    65 GLU- HG2     3.30  #     1    33960.0  e   paraug  3483
         HB3    65 GLU- HG3     3.70  #     1    15456.0  e   paraug  3475
         HB3    66 PHE  HN      3.90  #     2     9436.0  e   1ceaug  5079
         HG3    66 PHE  HN      6.30  #     5     4453.0  e   1ceaug  1821
 66 PHE  
         HN     66 PHE  HA      3.20  #     2    31950.0  e   1ceaug   768
         HN     66 PHE  HB2     2.80  #     2    73000.0  e   1ceaug   770
         HN     66 PHE  HB3     2.80  #     2    82440.0  e   1ceaug   772
         HN     66 PHE  QD      6.30  # r   1     6905.0*2e   1ceaug  3484
         HN     67 GLN  HN      3.20  #     2    30210.0  e   1ceaug   773
         HN     67 GLN  HG3     7.00  #   w 5     1646.0  e   1ceaug  5063
         HA     66 PHE  HB2     3.00  #     2    45720.0  e   1ceaug   780
         HA     66 PHE  HB3     3.20  #     2    32140.0  e   1ceaug   782
         HA     66 PHE  QD      4.50  # m   1    22430.0*2e   1ceaug  1570
         HA     66 PHE  QE      5.60  # i   1     2488.0*2e   1ceaug  3487
         HA     67 GLN  HN      3.80  #     2    12180.0  e   1ceaug  1259
         HA     68 VAL  HN      5.40  #     3     3871.0  e   1ceaug  4837
         HA     69 LEU  HN      5.90  #     3     2752.0  e   1ceaug  1755
         HA     69 LEU  HB2     5.40 <#     3     3759.0  e   1ceaug  3792
         HA     69 LEU  HB3     7.00 >#   w 3     1025.0  e   1ceaug   784
         HA     69 LEU  QD1     8.00  #     5M    1625.0  e   1ceaug  5035
         HA     69 LEU  QD2     8.00  #     5M    2069.0  e   1ceaug  5034
         HB2    66 PHE  QD      5.20  # r   1    36660.0*2e   1ceaug  3488
         HB2    67 GLN  HN      4.30 >#     2     5298.0  e   1ceaug  1557
         HB3    66 PHE  QD      5.10  # r   1    51350.0*2e   1ceaug  1568
         HB3    66 PHE  QE      7.30  # r   1     1822.0*2e   1ceaug  3490
         HB3    67 GLN  HN      3.60 <#     2    15120.0  e   1ceaug  1558
         HB3    67 GLN  HA      4.50  #     2     3908.0  e   1ceaug  5060
         HB3    67 GLN  HG3     4.40  #     5    18300.0  e   1ceaug  5065
         QD     66 PHE  QE      7.20  # rr  1    43450.0*4e   1ceaug  3492
         QD     66 PHE  HZ      7.30  # r   1     1842.0*2e   1ceaug  1161
         QD     67 GLN  HN      8.80  # r   5     3224.5*2e   1ceaug  4859
         QD     67 GLN  HA      8.40  # r   5     4263.5*2e   1ceaug  5061
         QD     67 GLN  HE21    7.50  # r   5     7695.0*2e   1ceaug  1984
         QD     69 LEU  HB2     8.80  # r   5     3320.5*2e   1ceaug  1935
         QD     69 LEU  QD1    10.00 ># r   5M     963.5*2e   1ceaug  1573
         QD     69 LEU  QD2    10.00 <# r   5M    4798.0*2e   1ceaug  4932
         QD     70 VAL  QG1     8.00 <# r   5M   20815.0*2e   1ceaug  4026
         QD     70 VAL  QG2    10.00 ># r   5M     375.0*2e   1ceaug  4030
         QE     66 PHE  HZ      5.70  # r   1    16605.0*2e   1ceaug  3493
         QE     69 LEU  QD1    10.00 ># r   5M    3160.5*2e   1ceaug  4935
         QE     69 LEU  QD2     8.30 <# r   5M   17645.0*2e   1ceaug  4930
         QE     70 VAL  QG1     9.80 <# r   5M    7560.0*2e   1ceaug  4027
         QE     70 VAL  QG2    10.00 ># r   5M     701.5*2e   1ceaug  4031
 67 GLN  
         HN     67 GLN  HA      3.20  #     2    31240.0  e   1ceaug   788
         HN     67 GLN  HB2     3.10  #     2    37740.0  e   1ceaug  1164
         HN     67 GLN  HB3     3.60  #     2    17260.0  e   1ceaug   790
         HN     67 GLN  HG2     3.00  #     1    54760.0  e   1ceaug   794
         HN     67 GLN  HG3     3.40  #     1    26580.0  e   1ceaug   792
         HN     67 GLN  HE21    4.90 <#     1     2862.0  e   1ceaug  2010
         HN     67 GLN  HE22    5.90 >#     1     1008.0  e   1ceaug  3495
         HN     68 VAL  HN      3.40  #     2    23180.0  e   1ceaug   795
         HN     68 VAL  HB      6.50  #     2      436.0  e   1ceaug  4826
         HN     68 VAL  QG2     8.00  #     5M    1726.0  e   1ceaug  4834
         HN     69 LEU  HN      5.70  #     3     3131.0  e   1ceaug  4827
         HN     70 VAL  QG1     8.00  #     5M        .0  e   1ceaug  1917
         HA     67 GLN  HB2     3.30  #     2    29040.0  e   1ceaug   799
         HA     67 GLN  HB3     3.10  #     2    44060.0  e   1ceaug   798
         HA     67 GLN  HG2     4.10  #     1     9355.0  e   1ceaug  3506
         HA     67 GLN  HG3     4.60  #     1     4607.0  e   1ceaug   801
         HA     67 GLN  HE21    5.90  #     1      945.0  e   1ceaug  1637
         HA     67 GLN  HE22    6.10  #     1      767.0  e   1ceaug  1641
         HA     68 VAL  HN      4.10  #     2     6957.0  e   1ceaug  3786
         HA     69 LEU  HN      5.50  #     3     3600.0  e   1ceaug  4830
         HA     70 VAL  HN      3.90  #     3    14020.0  e   1ceaug  1769
         HA     70 VAL  HB      2.90  #     3    44870.0  e   1ceaug  3787
         HA     70 VAL  QG1     5.80 <#     5M   23920.0  e   1ceaug  1700
         HA     70 VAL  QG2     8.00 >#     5M    4584.0  e   1ceaug  3789
         HB2    67 GLN  HG2     3.40  #     1    26650.0  e   1ceaug   813
         HB2    67 GLN  HE21    6.60  #     1      477.0  e   1ceaug  3505
         HB2    68 VAL  HN      4.70  #     2     3387.0  e   1ceaug   815
         HB2    68 VAL  QG2     6.20  #     5M   18350.0  e   1ceaug  4836
         HB2    70 VAL  HB      5.20 >#     5     9589.0  e   1ceaug  4819
         HB3    67 GLN  HE21    7.00  #   w 1         .0  e   1ceaug  1991
         HB3    68 VAL  HN      4.60  #     2     3714.0  e   1ceaug   809
         HB3    68 VAL  QG2     8.00  #     5M    5801.0  e   1ceaug  4835
         HB3    70 VAL  HB      3.80 <#     5    33270.0  e   1ceaug  5322
         HG2    67 GLN  HE21    3.40  #     1    28380.0  e   1ceaug  1632
         HG2    67 GLN  HE22    4.50  #     1     4903.0  e   1ceaug  5077
         HG3    67 GLN  HE21    3.90  #     1    11180.0  e   1ceaug  1634
         HG3    67 GLN  HE22    6.10  #     1      756.0  e   1ceaug  5244
         HE21   70 VAL  QG1     8.00  #     5M     500.0  e   1ceaug  1999
         HE22   70 VAL  QG1     8.00  #     5M    1567.0  e   1ceaug  5236
 68 VAL  
         HN     68 VAL  HA      3.50  #     2    20770.0  e   1ceaug   822
         HN     68 VAL  HB      3.00  #     2    45760.0  e   1ceaug  1165
         HN     68 VAL  QG1     4.40  #     1M   12220.0  e   1ceaug  1167
         HN     68 VAL  QG2     4.00  #     1M   23310.0  e   1ceaug  3514
         HN     69 LEU  HN      2.90  #     2    58480.0  e   1ceaug   823
         HN     69 LEU  HA      5.70  #     2      978.0  e   1ceaug  4821
         HA     68 VAL  HB      3.40  #     2    24920.0  e   1ceaug  3782
         HA     68 VAL  QG1     3.70  #     1M   36500.0  e   1ceaug  3511
         HA     68 VAL  QG2     3.40  #     1M   64320.0  e   1ceaug  1703
         HA     69 LEU  HN      4.30  #     2     5219.0  e   1ceaug  3785
         HA     70 VAL  HN      5.30  #     3     4226.0  e   1ceaug  4816
         HA     71 LYS+ HN      4.50  #     3     7717.0  e   1ceaug   825
         HB     68 VAL  QG1     3.30  #   s 1M   73090.0  e   1ceaug  3518
         HB     68 VAL  QG2     3.50  #     1M   52630.0  e   1ceaug  3515
         HB     69 LEU  HN      4.00  #     2     8323.0  e   1ceaug  3784
         QG1    69 LEU  HN      7.80  #     5M    7251.0  e   1ceaug  3783
         QG1    69 LEU  HA      8.00  #     5M    5804.0  e   1ceaug  4825
 69 LEU  
         HN     69 LEU  HA      3.40  #     2    23760.0  e   1ceaug   828
         HN     69 LEU  HB2     3.20  #     2    30020.0  e   1ceaug   831
         HN     69 LEU  HB3     3.30  #     2    27060.0  e   1ceaug   830
         HN     69 LEU  HG      4.60  #     1     4413.0  e   1ceaug  1168
         HN     69 LEU  QD1     5.70 <#     1M    2594.0  e   1ceaug  3530
         HN     69 LEU  QD2     8.00 >#     1M     221.0  e   1ceaug  1761
         HN     70 VAL  HN      3.00  #     2    48010.0  e   1ceaug   833
         HN     73 ILE  QD1     6.50  #     5M   15650.0  e   1ceaug  4771
         HA     69 LEU  HB2     3.30  #     2    26880.0  e   1ceaug   838
         HA     69 LEU  HB3     3.10  #     2    43060.0  e   1ceaug   836
         HA     69 LEU  HG      3.40  #     1    27060.0  e   1ceaug  3520
         HA     69 LEU  QD1     3.40 <#     1M   57420.0  e   1ceaug  1690
         HA     69 LEU  QD2     4.60 >#     1M   10380.0  e   1ceaug  1170
         HA     70 VAL  HN      4.00  #     2     8042.0  e   1ceaug  1257
         HA     70 VAL  HA      5.60  #     2     1079.0  e   1ceaug  3777
         HA     72 LYS+ HN      4.80  #     3     6234.0  e   1ceaug  1562
         HA     72 LYS+ QB      5.60  # m   3     7595.0*2e   1ceaug  4797
         HA     72 LYS+ HG2     6.30 <#     5     4329.0  e   1ceaug  4802
         HA     72 LYS+ HG3     7.00 >#   w 5      780.0  e   1ceaug  4800
         HA     72 LYS+ QE      8.00  # m w 5      742.5*2e   1ceaug  4806
         HA     73 ILE  QD1     7.20  #     5M   10230.0  e   1ceaug  4772
         HB2    69 LEU  QD1     3.90  #     1M   25760.0  e   1ceaug  3531
         HB2    69 LEU  QD2     3.30  #   s 1M   72970.0  e   1ceaug  3521
         HB2    70 VAL  HN      3.50 <#     2    19610.0  e   1ceaug   844
         HB2    72 LYS+ HG2     6.80  #     5     3285.0  e   1ceaug  4804
         HB2    73 ILE  QD1     6.10  #     5M   20080.0  e   1ceaug  4775
         HB3    69 LEU  HG      2.90  #     1    77070.0  e   1ceaug  3767
         HB3    69 LEU  QD1     4.00  #     1M   22220.0  e   1ceaug  3533
         HB3    69 LEU  QD2     3.90  #     1M   24790.0  e   1ceaug  3525
         HB3    70 VAL  HN      4.20 >#     2     6670.0  e   1ceaug   841
         HB3    70 VAL  HA      6.00  #     2      712.0  e   1ceaug  3776
         HB3    72 LYS+ QB      6.70  # m   5     6775.0*2e   1ceaug  4799
         HB3    73 ILE  QD1     5.90  #     5M   22710.0  e   1ceaug  4774
         HG     69 LEU  QD1     3.40  #     1M   57280.0  e   1ceaug  3524
         HG     69 LEU  QD2     3.50  #     1M   47480.0  e   1ceaug  3523
         HG     70 VAL  HN      5.00  #     5    10950.0  e   1ceaug  4813
         QD1    70 VAL  HN      8.00  #     5M    3786.0  e   1ceaug  3772
         QD1    70 VAL  HA      8.00 >#     5M    1166.0  e   1ceaug  3778
         QD1    72 LYS+ QB      9.00  # m   5M    5195.0*2e   1ceaug  4795
         QD1    73 ILE  QD1     6.80 ># m   5M   24420.0  e   1ceaug  4776
         QD2    70 VAL  HN      8.00  #     5M    2201.0  e   1ceaug  3773
         QD2    70 VAL  HA      8.00 <#     5M    3828.0  e   1ceaug  3775
         QD2    73 ILE  QD1     5.50 <# m   5M   71300.0  e   1ceaug  4777
 70 VAL  
         HN     70 VAL  HA      3.30  #     2    26310.0  e   1ceaug   846
         HN     70 VAL  HB      2.90  #     2    59190.0  e   1ceaug  3536
         HN     70 VAL  QG1     4.20  #     1M   28790.0  e   1ceaug  3540
         HN     70 VAL  QG2     4.30  #     1M   13940.0  e   1ceaug  1173
         HN     71 LYS+ HN      3.30  #     2    27880.0  e   1ceaug   847
         HN     72 LYS+ HN      4.90  #     3     5514.0  e   1ceaug  4793
         HN     73 ILE  QD1     8.00  #     5M    4825.0  e   1ceaug  4770
         HA     70 VAL  HB      3.60  #     2    15890.0  e   1ceaug  2110
         HA     70 VAL  QG1     3.50  #     1M   53230.0  e   1ceaug  1701
         HA     70 VAL  QG2     3.60  #     1M   40700.0  e   1ceaug  1708
         HA     71 LYS+ HN      3.90  #     2    10110.0  e   1ceaug  1256
         HA     72 LYS+ HN      4.50  #     3     8177.0  e   1ceaug  4791
         HA     73 ILE  HN      4.80  #     3     6018.0  e   1ceaug  4758
         HA     73 ILE  HB      4.80  #     3     6107.0  e   1ceaug  5255
         HA     73 ILE  QG2     8.00  #     5M    2373.0  e   1ceaug  4764
         HA     73 ILE  HG13    4.20  #     5    22720.0  e   1ceaug  4762
         HA     73 ILE  QD1     6.40  #     5M   16480.0  e   1ceaug  1677
         HB     70 VAL  QG1     3.40  #     1M   60510.0  e   1ceaug  3539
         HB     70 VAL  QG2     3.30  #   s 1M   76620.0  e   1ceaug  3538
         HB     71 LYS+ HN      4.00  #     2     8380.0  e   1ceaug  1933
         HB     71 LYS+ HA      5.80  #     2      906.0  e   1ceaug  3764
         QG1    71 LYS+ HN      7.00  #     5M   11790.0  e   1ceaug  4810
         QG1    71 LYS+ HA      8.00 >#     5M    1180.0  e   1ceaug  3766
         QG2    71 LYS+ HN      6.70  #     5M   13300.0  e   1ceaug  3760
         QG2    71 LYS+ HA      8.00 <#     5M    5635.0  e   1ceaug  3765
         QG2    73 ILE  QD1     9.00  # m   5M    4261.0  e   1ceaug  4769
 71 LYS+ 
         HN     71 LYS+ HA      3.10  #     2    41320.0  e   1ceaug   850
         HN     71 LYS+ HB2     3.00  #     2    53360.0  e   1ceaug  3547
         HN     71 LYS+ HB3     3.00  #     2    45290.0  e   1ceaug  3550
         HN     71 LYS+ HG2     4.50  #     1     4777.0  e   1ceaug  1180
         HN     71 LYS+ HG3     4.40  #     1     5674.0  e   1ceaug  1179
         HN     71 LYS+ QD      7.20  # m   1      740.5*2e   1ceaug  1178
         HN     71 LYS+ QE      8.00  # m w 1      131.0*2e   1ceaug  3759
         HN     72 LYS+ HN      3.20  #     2    31130.0  e   1ceaug  2669
         HN     73 ILE  HN      4.20  #     3    10400.0  e   1ceaug  4757
         HA     71 LYS+ HB2     3.30  #     2    26580.0  e   1ceaug  3544
         HA     71 LYS+ HB3     3.50  #     2    19360.0  e   1ceaug  2219
         HA     71 LYS+ HG2     4.60  #     1     4380.0  e   1ceaug  3756
         HA     71 LYS+ HG3     5.10  #     1     2347.0  e   1ceaug  3755
         HA     72 LYS+ HN      3.90  #     2     9429.0  e   1ceaug  4786
         HA     74 SER  HN      4.30  #     3     9210.0  e   1ceaug  4742
         HA     74 SER  QB      4.70  # m   3    17415.0*2e   1ceaug  4746
         HA     75 GLN  HE21    5.70  #     5     6524.0  e   1ceaug  4727
         HB2    71 LYS+ HG2     3.10  #     1    47460.0  e   1ceaug  3557
         HB2    71 LYS+ HG3     2.70  #     1   118000.0  e   1ceaug  2224
         HB2    71 LYS+ QD      3.70  # m   1   112000.0*2e   1ceaug  2225
         HB2    72 LYS+ HN      3.60  #     2    17110.0  e   1ceaug  5324
         HB2    75 GLN  HE21    6.80  #     5     3245.0  e   1ceaug  4729
         HB3    71 LYS+ HG2     3.30  #     1    32540.0  e   1ceaug  2222
         HB3    71 LYS+ HG3     3.00  #     1    59020.0  e   1ceaug  3555
         HB3    71 LYS+ QD      4.00  # m   1    63950.0*2e   1ceaug  2228
         HB3    72 LYS+ HN      3.50  #     2    18100.0  e   1ceaug  5325
         HB3    75 GLN  HE21    7.00  #   w 5     2211.0  e   1ceaug  4730
         HG2    71 LYS+ QD      4.30  # m   1    33025.0*2e   1ceaug  2223
         HG2    71 LYS+ QE      5.70  # m   1     3764.5*2e   1ceaug  2116
         HG3    71 LYS+ QD      3.90  # m   1    75000.0*2e   1ceaug  2229
         HG3    71 LYS+ QE      5.90  # m   1     3053.5*2e   1ceaug  2117
         QD     71 LYS+ QE      5.70  # mm  1    17410.0*4e   1ceaug  3546
         QE     72 LYS+ HG3     7.90  # m   5     3015.5*2e   1ceaug  4788
 72 LYS+ 
         HN     72 LYS+ HA      3.20  #     2    30520.0  e   1ceaug  1181
         HN     72 LYS+ QB      3.80  # i   2    33920.0*2e   1ceaug  1182
         HN     72 LYS+ HG2     3.80  #     1    13120.0  e   1ceaug  1183
         HN     72 LYS+ HG3     4.40  #     1     5619.0  e   1ceaug  3566
         HN     72 LYS+ HD2     4.60  #     1     4344.0  e   1ceaug  3739
         HN     72 LYS+ HD3     4.20  #     1     7730.0  e   1ceaug  3565
         HN     73 ILE  HN      3.00  #     2    45820.0  e   1ceaug   853
         HN     74 SER  HN      5.10  #     3     4906.0  e   1ceaug  4738
         HN     75 GLN  HN      6.60  #     3     1735.0  e   1ceaug  4572
         HA     72 LYS+ QB      4.30  # m   2    28510.0*2e   1ceaug  3563
         HA     72 LYS+ HG2     3.50 <#     1    22020.0  e   1ceaug  3572
         HA     72 LYS+ HG3     4.90 >#     1     3163.0  e   1ceaug  4748
         HA     72 LYS+ HD2     4.20  #     1     7325.0  e   1ceaug  4749
         HA     72 LYS+ HD3     4.40  #     1     6082.0  e   1ceaug  3747
         HA     72 LYS+ QE      8.00  # m w 1      318.5*2e   1ceaug  3742
         HA     73 ILE  HN      4.20  #     2     6267.0  e   1ceaug  2671
         HA     73 ILE  HA      4.90  #     2     2594.0  e   1ceaug  4751
         HA     74 SER  HN      5.20  #     3     4638.0  e   1ceaug  4740
         HA     75 GLN  HN      6.80  #     3     1524.0  e   1ceaug  4575
         HA     75 GLN  HB2     4.00  #     3    13500.0  e   1ceaug  4580
         HA     75 GLN  HB3     3.90  #     3    13680.0  e   1ceaug  4579
         QB     72 LYS+ HG2     4.70  # m   1    17265.0*2e   1ceaug  2213
         QB     72 LYS+ HG3     4.20  # m   1    36385.0*2e   1ceaug  2214
         QB     72 LYS+ HD3     4.90  # m   1    12220.0*2e   1ceaug  2207
         QB     73 ILE  HN      5.00  # m   2     8890.0*2e   1ceaug  3754
         QB     73 ILE  HA      5.50  # m   2     4022.5*2e   1ceaug  4753
         QB     75 GLN  HN      6.10  # m   3     4662.5*2e   1ceaug  4574
         HG2    72 LYS+ HD3     3.00  #     1    54950.0  e   1ceaug  3571
         HG2    72 LYS+ QE      6.30  # m   1     1949.5*2e   1ceaug  3751
         HG3    72 LYS+ HD3     3.10  #     1    45890.0  e   1ceaug  3570
         HG3    72 LYS+ HE2     4.40  #     1     5500.0  e   1ceaug  2211
         HG3    72 LYS+ QE      6.30  # m   1     1764.5*2e   1ceaug  3753
         HD2    72 LYS+ QE      5.60  # m   1     4291.0*2e   1ceaug  3752
         HD3    72 LYS+ HE3     5.60  #     1     1349.0  e   1ceaug  2208
         HD3    72 LYS+ QE      5.60  # m   1     4617.0*2e   1ceaug  3750
 73 ILE  
         HN     73 ILE  HA      3.10  #     2    37210.0  e   1ceaug   856
         HN     73 ILE  HB      3.20  #     2    34790.0  e   1ceaug  1192
         HN     73 ILE  QG2     4.30  #     1M   15380.0  e   1ceaug  1190
         HN     73 ILE  HG12    4.10 >#     1     9244.0  e   1ceaug  1191
         HN     73 ILE  HG13    2.80 <#     1    86320.0  e   1ceaug  3576
         HN     73 ILE  QD1     5.50  #     1M    3204.0  e   1ceaug  1189
         HN     74 SER  HN      3.50  #     2    18950.0  e   1ceaug  2008
         HN     74 SER  QB      6.20  # m   2     1678.0*2e   1ceaug  4735
         HN     75 GLN  HN      4.60  #     3     7242.0  e   1ceaug  4714
         HA     73 ILE  HB      3.10  #     2    38790.0  e   1ceaug  3573
         HA     73 ILE  QG2     4.00  #     1M   23400.0  e   1ceaug  1689
         HA     73 ILE  HG12    4.60 <#     1     4104.0  e   1ceaug  2232
         HA     73 ILE  HG13    5.60 >#     1     1334.0  e   1ceaug  2231
         HA     73 ILE  QD1     8.00  #     1M     209.0  e   1ceaug  1679
         HA     74 SER  HN      3.70  #     2    13860.0  e   1ceaug   857
         HA     75 GLN  HN      7.00  #   w 3      785.0  e   1ceaug  4716
         HB     73 ILE  QG2     3.30  #   s 1M   70820.0  e   1ceaug  3579
         HB     73 ILE  HG12    4.20  #     1     7199.0  e   1ceaug  2240
         HB     73 ILE  HG13    3.70  #     1    15360.0  e   1ceaug  2241
         HB     73 ILE  QD1     3.70  #     1M   37780.0  e   1ceaug  1676
         HB     74 SER  HN      4.10  #     2     7480.0  e   1ceaug  4737
         HB     75 GLN  HN      6.20  #     3     2172.0  e   1ceaug  4718
         QG2    73 ILE  HG12    3.30 <#   s 1M   80810.0  e   1ceaug  2242
         QG2    73 ILE  HG13    3.90 >#     1M   27820.0  e   1ceaug  2243
         QG2    73 ILE  QD1     4.70  # m   1M   37710.0  e   1ceaug  2238
         QG2    74 SER  HN      8.00  #     5M    4821.0  e   1ceaug  1913
         QG2    74 SER  HA      8.00  #     5M     958.0  e   1ceaug  4734
         HG12   73 ILE  QD1     3.70  #     1M   34180.0  e   1ceaug  1672
         HG12   74 SER  HN      7.00  #   w 5     1301.0  e   1ceaug  1912
         HG13   73 ILE  QD1     3.30  #   s 1M   80040.0  e   1ceaug  2236
         HG13   74 SER  HN      7.00  #   w 5      758.0  e   1ceaug  2675
 74 SER  
         HN     74 SER  HA      3.20  #     2    30990.0  e   1ceaug   860
         HN     74 SER  QB      4.20  # i   2    17510.0*2e   1ceaug  1194
         HN     75 GLN  HN      3.30  #     2    28300.0  e   1ceaug  3673
         HN     75 GLN  HB3     5.40  #     2     1353.0  e   1ceaug  4711
         HN     75 GLN  HE21    5.50  #     5     7867.0  e   1ceaug  3597
         HA     74 SER  QB      4.80  # m   2    10915.0*2e   1ceaug  3584
         HA     75 GLN  HN      3.70  #     2    13170.0  e   1ceaug  3672
         QB     75 GLN  HN      5.30  # m   2     5815.0*2e   1ceaug  3737
         QB     75 GLN  HA      6.10  # m   2     2047.5*2e   1ceaug  4708
         QB     75 GLN  HB2     6.90  # m   5     5570.0*2e   1ceaug  4713
 75 GLN  
         HN     75 GLN  HA      4.60  #     2     3514.0  e   1ceaug  3652
         HN     75 GLN  HB2     3.70  #     2    13350.0  e   1ceaug  3655
         HN     75 GLN  HB3     4.30  #     2     5420.0  e   1ceaug  3654
         HN     75 GLN  QG      6.70  # m   1     1150.0*2e   1ceaug  3668
         HN     75 GLN  HE21    4.10 <#     1     9373.0  e   1ceaug  4480
         HN     75 GLN  HE22    5.00 >#     1     2739.0  e   1ceaug  4476
         HA     75 GLN  HB2     3.60  #     2    15970.0  e   1ceaug  3666
         HA     75 GLN  HB3     3.90  #     2     9284.0  e   1ceaug  3663
         HA     75 GLN  QG      4.60  # i   1    10125.0*2e   1ceaug  3662
         HA     75 GLN  HE21    5.40  #     1     1629.0  e   1ceaug  4481
         HA     75 GLN  HE22    6.20  #     1      694.0  e   1ceaug  4482
         HB2    75 GLN  QG      4.80  # m   1    14040.0*2e   1ceaug  3665
         HB2    75 GLN  HE21    4.60  #     1     4303.0  e   1ceaug  4732
         HB3    75 GLN  QG      4.40  # m   1    28760.0*2e   1ceaug  3664
         HB3    75 GLN  HE21    7.00  #   w 1      328.0  e   1ceaug  4484
         QG     75 GLN  HE21    8.00  # m w 1      117.5*2e   1ceaug  4483
#
Pseudocontact shifts from 11 lanthanide ions

  2 SER  CA     -0.14 1   0.15  0.25  1 
  3 PRO  CA     -0.01 1   0.15  0.25  1 
  4 GLU  CA     -0.04 1   0.15  0.25  1 
  5 GLU  CA     -0.15 1   0.15  0.25  1 
  6 LEU  CA     -0.12 1   0.15  0.25  1 
  7 LYS  CA     -0.21 1   0.30  0.02  1 
  8 GLY  CA     -0.18 1   0.15  0.25  1 
  9 ILE  CA     -0.15 1   0.15  0.25  1 
 10 PHE  CA     -0.19 1   0.15  0.25  1 
 11 GLU  CA     -0.22 1   0.15  0.25  1 
 12 LYS  CA     -0.22 1   0.15  0.25  1 
 13 TYR  CA     -0.37 1   0.30  0.02  1 
 14 ALA  CA     -0.35 1   0.15  0.25  1 
 15 ALA  CA     -0.22 1   0.15  0.25  1 
 16 LYS  CA     -0.33 1   0.30  0.02  1 
 17 GLU  CA     -0.18 1   0.15  0.25  1 
 18 GLY  CA     -0.22 1   0.30  0.02  1 
 19 ASP  CA     -0.18 1   0.15  0.25  1 
 20 PRO  CA     -0.32 1   0.15  0.25  1
 21 ASN  CA     -0.42 1   0.30  0.02  1
 23 LEU  CA     -0.72 1   0.70  0.02  1 
 24 SER  CA     -0.05 1   0.30  0.10  1 
 25 LYS  CA     -0.05 1   0.15  0.25  1 
 26 GLU  CA     -0.01 1   0.15  0.25  1 
 27 GLU  CA     -0.19 1   0.15  0.25  1 
 28 LEU  CA     -0.54 1   0.70  0.02  1 
 29 LYS  CA     -0.20 1   0.15  0.25  1 
 30 LEU  CA     -0.19 1   0.15  0.25  1 
 31 LEU  CA     -0.32 1   0.15  0.25  1
 32 LEU  CA     -0.14 1   0.15  0.25  1 
 33 GLN  CA     -0.13 1   0.15  0.25  1 
 34 THR  CA     -0.11 1   0.15  0.25  1 
 35 GLU  CA     -0.09 1   0.15  0.25  1 
 36 PHE  CA     -0.19 1   0.15  0.25  1 
 37 PRO  CA     -0.10 1   0.15  0.25  1 
 38 SER  CA     -0.11 1   0.15  0.25  1 
 39 LEU  CA     -0.17 1   0.15  0.25  1 
 40 LEU  CA     -0.28 1   0.30  0.02  1 
 41 LYS  CA     -0.33 1   0.30  0.02  1 
 42 GLY  CA     -0.15 1   0.15  0.25  1 
 43 MET  CA     -0.03 1   0.15  0.25  1
 44 SER  CA     -0.08 1   0.15  0.25  1 
 45 THR  CA     -0.03 1   0.15  0.25  1 
 46 LEU  CA     -0.11 1   0.15  0.25  1 
 47 ASP  CA     -0.18 1   0.30  0.02  1 
 48 GLU  CA     -0.19 1   0.15  0.25  1 
 49 LEU  CA     -0.33 1   0.15  0.25  1 
 50 PHE  CA     -0.48 1   0.15  0.25  1 
 51 GLU  CA     -0.43 1   0.70  0.02  1 
 52 GLU  CA     -0.61 1   0.70  0.02  1 
 53 LEU  CA     -1.49 1   0.70  0.02  1 
 62 SER  CA     -0.03 1   0.70  0.02  1
 63 PHE  CA      0.24 1   0.30  0.10  1
 64 GLU  CA      1.33 1   0.15  0.25  1 
 66 PHE  CA     -0.30 1   0.15  0.25  1 
 67 GLN  CA      0.23 1   0.15  0.25  1 
 69 LEU  CA     -0.23 1   0.15  0.25  1 
 70 VAL  CA     -0.33 1   0.30  0.02  1 
 71 LYS  CA     -0.24 1   0.30  0.02  1 
 72 LYS  CA     -0.41 1   0.30  0.02  1 
 73 ILE  CA     -0.36 1   0.30  0.02  1 
 74 SER  CA     -0.20 1   0.30  0.02  1 
 75 GLN  CA     -0.07 1   0.15  0.25  1 
  1 LYS  C       0.06 1   0.15  0.25  1
  2 SER  C      -0.00 1   0.15  0.25  1
  3 PRO  C      -0.03 1   0.15  0.25  1
  4 GLU  C      -0.07 1   0.15  0.25  1
  5 GLU  C      -0.03 1   0.15  0.25  1
  6 LEU  C      -0.01 1   0.15  0.25  1
  7 LYS  C      -0.03 1   0.15  0.25  1
  9 ILE  C      -0.10 1   0.15  0.25  1
 13 TYR  C      -0.10 1   0.15  0.25  1
 14 ALA  C      -0.14 1   0.15  0.25  1
 15 ALA  C      -0.32 1   0.30  0.02  1
 16 LYS  C      -0.14 1   0.15  0.25  1
 17 GLU  C      -0.07 1   0.15  0.25  1
 18 GLY  C      -0.42 1   0.30  0.02  1
 19 ASP  C       0.00 1   0.30  0.02  1
 20 PRO  C      -0.18 1   0.15  0.25  1
 23 LEU  C      -0.34 1   0.15  0.02  1    
 24 SER  C      -0.35 1   0.15  0.25  1
 25 LYS  C      -0.13 1   0.15  0.25  1
 26 GLU  C      -0.06 1   0.15  0.25  1
 27 GLU  C      -0.23 1   0.15  0.25  1
 28 LEU  C      -0.30 1   0.15  0.25  1
 29 LYS  C      -0.17 1   0.15  0.25  1
 30 LEU  C      -0.57 1   0.15  0.02  1
 31 LEU  C      -0.50 1   0.15  0.02  1
 33 GLN  C      -0.07 1   0.15  0.25  1
 34 THR  C      -0.11 1   0.15  0.25  1
 36 PHE  C      -0.00 1   0.15  0.25  1
 37 PRO  C      -0.06 1   0.15  0.25  1
 39 LEU  C      -0.14 1   0.15  0.25  1
 40 LEU  C      -0.20 1   0.15  0.25  1
 41 LYS  C      -0.13 1   0.15  0.25  1
 44 SER  C      -0.00 1   0.15  0.25  1
 45 THR  C      -0.06 1   0.15  0.25  1                                        
 46 LEU  C      -0.07 1   0.15  0.25  1
 47 ASP  C      -0.11 1   0.15  0.25  1
 50 PHE  C      -0.29 1   0.15  0.25  1
 51 GLU  C      -0.75 1   0.30  0.02  1
 62 SER  C       0.31 1   0.30  0.02  1
 63 PHE  C       0.33 1   0.30  0.02  1
 66 PHE  C      -0.22 1   0.15  0.25  1
 67 GLN  C      -0.17 1   0.30  0.02  1
 68 VAL  C      -0.01 1   0.15  0.25  1
 69 LEU  C      -0.20 1   0.15  0.25  1
 70 VAL  C      -0.27 1   0.30  0.02  1
 71 LYS  C      -0.06 1   0.15  0.25  1
 72 LYS  C      -0.14 1   0.15  0.25  1
 73 ILE  C      -0.11 1   0.15  0.25  1
 74 SER  C       0.01 1   0.15  0.25  1
  1 LYS  HA     -0.01 1   0.15  0.25  1 
  2 SER  HA      0.02 1   0.15  0.25  1 
  3 PRO  HA      0.01 1   0.15  0.25  1 
  4 GLU  HA      0.02 1   0.15  0.25  1 
  5 GLU  HA     -0.02 1   0.15  0.25  1 
  6 LEU  HA     -0.04 1   0.15  0.25  1 
  7 LYS  HA     -0.04 1   0.15  0.25  1 
  8 GLY  HA1    -0.05 1   0.15  0.25  1 
  8 GLY  HA2    -0.03 1   0.15  0.25  1 
  9 ILE  HA     -0.09 1   0.15  0.25  1 
 10 PHE  HA     -0.27 1   0.15  0.25  1 
 11 GLU  HA     -0.15 1   0.15  0.25  1 
 12 LYS  HA     -0.12 1   0.15  0.25  1 
 13 TYR  HA     -0.13 1   0.15  0.25  1 
 14 ALA  HA     -0.27 1   0.15  0.25  1 
 15 ALA  HA     -0.20 1   0.15  0.25  1 
 16 LYS  HA     -0.08 1   0.15  0.25  1 
 17 GLU  HA     -0.07 1   0.15  0.25  1 
 18 GLY  HA1    -0.01 1   0.15  0.25  1 
 18 GLY  HA2    -0.10 1   0.15  0.25  1 
 19 ASP  HA     -0.14 1   0.15  0.25  1 
 20 PRO  HA     -0.05 1   0.15  0.25  1
 21 ASN  HA     -0.12 1   0.15  0.25  1
 22 GLN  HA     -1.23 1   0.70  0.02  1 
 23 LEU  HA     -0.66 1   0.15  0.25  1 
 24 SER  HA      0.14 1   0.30  0.02  1 
 25 LYS  HA     -0.14 1   0.15  0.25  1 
 26 GLU  HA     -0.04 1   0.15  0.25  1 
 27 GLU  HA     -0.14 1   0.15  0.25  1 
 28 LEU  HA     -0.35 1   0.15  0.25  1 
 29 LYS  HA     -0.14 1   0.15  0.25  1 
 30 LEU  HA     -0.09 1   0.15  0.25  1 
 31 LEU  HA     -0.22 1   0.15  0.25  1
 32 LEU  HA     -0.17 1   0.15  0.25  1 
 33 GLN  HA     -0.09 1   0.15  0.25  1 
 34 THR  HA     -0.06 1   0.15  0.25  1 
 35 GLU  HA     -0.15 1   0.15  0.25  1 
 36 PHE  HA     -0.08 1   0.15  0.25  1 
 37 PRO  HA     -0.07 1   0.15  0.25  1 
 38 SER  HA     -0.07 1   0.15  0.25  1 
 39 LEU  HA     -0.09 1   0.15  0.25  1 
 40 LEU  HA     -0.07 1   0.15  0.25  1 
 41 LYS  HA     -0.03 1   0.15  0.25  1 
 42 GLY  HA1    -0.04 1   0.15  0.25  1 
 42 GLY  HA2    -0.07 1   0.15  0.25  1 
 43 MET  HA     -0.05 1   0.15  0.25  1
 44 SER  HA     -0.07 1   0.15  0.25  1 
 45 THR  HA     -0.05 1   0.15  0.25  1 
 46 LEU  HA     -0.14 1   0.15  0.25  1 
 47 ASP  HA      0.02 1   0.15  0.25  1 
 48 GLU  HA      0.05 1   0.15  0.25  1 
 49 LEU  HA     -0.28 1   0.15  0.25  1 
 50 PHE  HA     -0.64 1   0.15  0.25  1 
 51 GLU  HA     -0.02 1   0.15  0.25  1 
 52 GLU  HA     -0.45 1   0.15  0.25  1 
 62 SER  HA     -0.62 1   0.15  0.25  1
 66 PHE  HA     -0.53 1   0.15  0.25  1 
 67 GLN  HA     -0.01 1   0.15  0.25  1 
 68 VAL  HA      0.05 1   0.15  0.25  1 
 69 LEU  HA     -0.22 1   0.15  0.25  1 
 70 VAL  HA      0.00 1   0.15  0.25  1 
 71 LYS  HA     -0.01 1   0.15  0.25  1 
 72 LYS  HA     -0.04 1   0.15  0.25  1 
 73 ILE  HA     -0.03 1   0.15  0.25  1 
 74 SER  HA     -0.05 1   0.15  0.25  1 
 75 GLN  HA     -0.02 1   0.15  0.25  1 
 75 GLN  NE2    -0.03 1   0.15  0.25  1
  1 MET  HB2    -0.00 1   0.15  0.25  1
  1 MET  HB3    -0.00 1   0.15  0.25  1
  1 MET  HG2    -0.00d2   0.15  0.10  1
  1 MET  HG3    -0.00 1   0.15  0.25  1
  1 MET  HD2    -0.02d2   0.15  0.10  1
  1 MET  HD3    -0.02 1   0.15  0.25  1
  1 MET  HE2    -0.00d2   0.15  0.10  1
  1 MET  HE3    -0.00 1   0.15  0.25  1
  2 SER  HB2    -0.00 1   0.15  0.25  1
  2 SER  HB3    -0.01 1   0.15  0.25  1
  3 PRO  HB2     0.04 1   0.15  0.25  1
  3 PRO  HB3     0.04 1   0.15  0.25  1
  3 PRO  HG2     0.04 1   0.15  0.25  1
  3 PRO  HG3     0.02 1   0.15  0.25  1
  3 PRO  HD2     0.01 1   0.15  0.25  1
  3 PRO  HD3     0.01 1   0.15  0.25  1
  4 GLU  HB2     0.03 1   0.15  0.25  1
  4 GLU  HB3    -0.00 1   0.15  0.25  1
  4 GLU  HG2    -0.00 1   0.15  0.25  1
  4 GLU  HG3    -0.01 1   0.15  0.25  1
  5 GLU  HB2    -0.02 1   0.15  0.25  1
  5 GLU  HB3    -0.03 1   0.15  0.25  1
  5 GLU  HG2    -0.02 1   0.15  0.25  1
  5 GLU  HG3    -0.02 1   0.15  0.25  1
  6 LEU  HB2    -0.01 1   0.15  0.25  1
  6 LEU  HB3    -0.00 1   0.15  0.25  1
  6 LEU  HG     -0.02 1   0.15  0.25  1
  6 LEU  HD11   -0.09d3   0.15  0.10  1
  6 LEU  HD12   -0.09 1   0.15  0.25  1
  6 LEU  HD13   -0.09 1   0.15  0.25  1
  6 LEU  HD21   -0.05d3   0.15  0.10  1
  6 LEU  HD22   -0.05 1   0.15  0.25  1
  6 LEU  HD23   -0.05 1   0.15  0.25  1
  7 LYS  HB2    -0.01 1   0.15  0.25  1
  7 LYS  HB3    -0.02 1   0.15  0.25  1
  7 LYS  HG2    -0.01 1   0.15  0.25  1
  7 LYS  HG3    -0.00 1   0.15  0.25  1
  7 LYS  HD2     0.02d2   0.15  0.10  1
  7 LYS  HD3     0.02 1   0.15  0.25  1
  7 LYS  HE2     0.05 1   0.15  0.25  1
  7 LYS  HE3     0.04 1   0.15  0.25  1
  9 ILE  HB     -0.07 1   0.15  0.25  1
  9 ILE  HG12   -0.07 1   0.15  0.25  1
  9 ILE  HG21   -0.11d3   0.15  0.10  1
  9 ILE  HG22   -0.11 1   0.15  0.25  1
  9 ILE  HG23   -0.11 1   0.15  0.25  1
  9 ILE  HD11   -0.06d3   0.15  0.10  1
  9 ILE  HD12   -0.06 1   0.15  0.25  1
  9 ILE  HD13   -0.06 1   0.15  0.25  1
 10 PHE  HB2    -0.13 1   0.15  0.25  1
 10 PHE  HB3    -0.12 1   0.15  0.25  1
 10 PHE  HD1    -0.16d2   0.15  0.10  1
 10 PHE  HD2    -0.16 1   0.15  0.25  1
 10 PHE  HE1    -0.52d2   0.30  0.02  1 
 10 PHE  HE2    -0.52 1   0.30  0.02  1 
 10 PHE  HZ     -0.74 1   0.30  0.10  1
 11 GLU  HB2    -0.08 1   0.15  0.25  1
 11 GLU  HB3    -0.08 1   0.15  0.25  1
 11 GLU  HG2    -0.07 1   0.15  0.25  1
 11 GLU  HG3    -0.06 1   0.15  0.25  1
 12 LYS  HB2    -0.04 1   0.15  0.25  1
 12 LYS  HB3    -0.06 1   0.15  0.25  1
 12 LYS  HG2    -0.15 1   0.15  0.25  1
 12 LYS  HG3    -0.11 1   0.15  0.25  1
 12 LYS  HD2    -0.11 1   0.15  0.25  1
 12 LYS  HD3    -0.11 1   0.15  0.25  1
 12 LYS  HE2    -0.06d2   0.15  0.10  1
 12 LYS  HE3    -0.06 1   0.15  0.25  1
 13 TYR  HB2    -0.25 1   0.15  0.25  1
 13 TYR  HB3    -0.14 1   0.15  0.25  1
 13 TYR  HD1    -0.14d2   0.15  0.10  1
 13 TYR  HD2    -0.14 1   0.15  0.25  1
 13 TYR  HE1    -0.10d2   0.15  0.10  1
 13 TYR  HE2    -0.10 1   0.15  0.25  1
 14 ALA  HB1    -0.37d3   0.30  0.02  1 
 14 ALA  HB2    -0.37 1   0.30  0.02  1 
 14 ALA  HB3    -0.37 1   0.30  0.02  1
 15 ALA  HB1    -0.10d3   0.15  0.10  1
 15 ALA  HB2    -0.10 1   0.15  0.25  1
 15 ALA  HB3    -0.10 1   0.15  0.25  1
 16 LYS  HB2    -0.12 1   0.15  0.25  1
 16 LYS  HB3    -0.10 1   0.15  0.25  1
 16 LYS  HG2    -0.08 1   0.15  0.25  1
 16 LYS  HG3    -0.19 1   0.15  0.25  1
 16 LYS  HD2    -0.10 1   0.15  0.25  1
 16 LYS  HD3    -0.07 1   0.15  0.25  1
 16 LYS  HE2    -0.09 1   0.15  0.25  1
 16 LYS  HE3    -0.07 1   0.15  0.25  1
 17 GLU  HB2    -0.01 1   0.15  0.25  1
 17 GLU  HB3    -0.06 1   0.15  0.25  1
 17 GLU  HG2    -0.08 1   0.15  0.25  1
 17 GLU  HG3    -0.04 1   0.15  0.25  1
 19 ASP  HB2    -0.24 1   0.30  0.10  1 
 19 ASP  HB3    -0.41 1   0.30  0.10  1
 20 PRO  HB2    -0.05 1   0.15  0.25  1
 20 PRO  HB3    -0.05 1   0.15  0.25  1
 20 PRO  HG2    -0.15 1   0.15  0.25  1
 20 PRO  HG3    -0.08 1   0.15  0.25  1
 20 PRO  HD2    -0.16 1   0.15  0.25  1
 20 PRO  HD3    -0.19 1   0.15  0.25  1
 21 ASN  HB2    -0.18 1   0.15  0.25  1
 21 ASN  HB3    -0.08 1   0.15  0.25  1
 21 ASN  HD21   -0.05 1   0.15  0.25  1
 21 ASN  HD22   -0.04 1   0.15  0.25  1
 22 GLN  HB2    -1.07 1   0.70  0.02  1
 22 GLN  HB3    -1.67 1   0.70  0.02  1
 22 GLN  HG2    -0.78 1   0.70  0.02  1
 22 GLN  HG3    -0.91 1   0.70  0.02  1
 22 GLN  HE22   -1.00 1   0.70  0.02  1
 22 GLN  HE21   -0.75 1   0.70  0.02  1
 23 LEU  HB2    -1.18 1   0.70  0.02  1 
 23 LEU  HB3    -0.88 1   0.70  0.02  1 
 23 LEU  HG     -0.66 1   0.70  0.02  1 
 23 LEU  HD11   -0.71d3   0.30  0.02  1 
 23 LEU  HD12   -0.71 1   0.30  0.02  1 
 23 LEU  HD13   -0.71 1   0.30  0.02  1 
 23 LEU  HD21   -0.40d3   0.30  0.02  1 
 23 LEU  HD22   -0.40 1   0.30  0.02  1 
 23 LEU  HD23   -0.40 1   0.30  0.02  1 
 24 SER  HB2     0.18 1   0.30  0.02  1
 24 SER  HB3    -0.02 1   0.30  0.02  1
 25 LYS  HB2     0.26 1   0.15  0.25  1
 25 LYS  HB3     0.19 1   0.15  0.25  1
 25 LYS  HG2     0.05 1   0.15  0.25  1
 25 LYS  HG3    -0.07 1   0.15  0.25  1
 25 LYS  HD2     0.21d2   0.30  0.02  1 
 25 LYS  HD3     0.21 1   0.30  0.02  1 
 25 LYS  HE2     0.25d2   0.30  0.02  1 
 25 LYS  HE3     0.25 1   0.30  0.02  1
 26 GLU  HB2    -0.01 1   0.15  0.25  1
 26 GLU  HB3    -0.06 1   0.15  0.25  1
 26 GLU  HG2     0.01 1   0.15  0.25  1
 26 GLU  HG3     0.01 1   0.15  0.25  1
 27 GLU  HB2    -0.31 1   0.15  0.25  1 
 27 GLU  HB3    -0.20 1   0.15  0.25  1
 27 GLU  HG2    -0.18 1   0.15  0.25  1
 27 GLU  HG2    -0.05 1   0.15  0.25  1
 28 LEU  HB2    -0.32 1   0.30  0.02  1
 28 LEU  HB3    -0.18 1   0.30  0.02  1 
 28 LEU  HG     -0.36 1   0.30  0.02  1
 29 LYS  HB2    -0.08 1   0.15  0.25  1
 29 LYS  HB3    -0.07 1   0.15  0.25  1
 29 LYS  HG2    -0.08 1   0.15  0.25  1
 29 LYS  HG3    -0.08 1   0.15  0.25  1
 29 LYS  HD2    -0.06d2   0.15  0.10  1
 29 LYS  HD3    -0.06 1   0.15  0.25  1
 29 LYS  HE2    -0.07d2   0.15  0.10  1
 29 LYS  HE3    -0.07 1   0.15  0.25  1
 30 LEU  HB2    -0.11 1   0.15  0.25  1
 30 LEU  HB3    -0.10 1   0.15  0.25  1
 30 LEU  HG     -0.10 1   0.15  0.25  1
 30 LEU  HD11   -0.06d3   0.15  0.10  1
 30 LEU  HD12   -0.06 1   0.15  0.25  1
 30 LEU  HD13   -0.06 1   0.15  0.25  1
 30 LEU  HD21   -0.02d3   0.15  0.10  1
 30 LEU  HD22   -0.02 1   0.15  0.25  1
 30 LEU  HD23   -0.02 1   0.15  0.25  1
 31 LEU  HB2    -0.21 1   0.15  0.25  1 
 31 LEU  HB3    -0.24 1   0.15  0.25  1 
 31 LEU  HD11   -0.27d3   0.15  0.10  1 
 31 LEU  HD12   -0.27 1   0.15  0.25  1 
 31 LEU  HD13   -0.27 1   0.15  0.25  1 
 31 LEU  HD21   -0.22d3   0.15  0.10  1 
 31 LEU  HD22   -0.22 1   0.15  0.25  1 
 31 LEU  HD23   -0.22 1   0.15  0.25  1
 32 LEU  HB2    -0.17 1   0.15  0.25  1
 32 LEU  HB3    -0.16 1   0.15  0.25  1
 32 LEU  HG     -0.23 1   0.15  0.25  1 
 32 LEU  HD11   -0.21d3   0.15  0.10  1 
 32 LEU  HD12   -0.21 1   0.15  0.25  1 
 32 LEU  HD13   -0.21 1   0.15  0.25  1 
 32 LEU  HD21   -0.20d3   0.15  0.10  1 
 32 LEU  HD22   -0.20 1   0.15  0.25  1 
 32 LEU  HD23   -0.20 1   0.15  0.25  1 
 33 GLN  HB2    -0.08 1   0.15  0.25  1
 33 GLN  HB3    -0.08 1   0.15  0.25  1
 33 GLN  HG2    -0.07 1   0.15  0.25  1
 33 GLN  HG3    -0.08 1   0.15  0.25  1
 33 GLN  HE21   -0.05 1   0.15  0.25  1
 33 GLN  HE22   -0.05 1   0.15  0.25  1
 34 THR  HB     -0.10 1   0.15  0.25  1
 34 THR  HG21   -0.07d3   0.15  0.10  1
 34 THR  HG22   -0.07 1   0.15  0.25  1
 34 THR  HG23   -0.07 1   0.15  0.25  1
 35 GLU  HB2    -0.13 1   0.15  0.25  1
 35 GLU  HB3    -0.10 1   0.15  0.25  1
 36 PHE  HB2    -0.12 1   0.15  0.25  1
 36 PHE  HB3    -0.11 1   0.15  0.25  1
 37 PRO  HB2    -0.07 1   0.15  0.25  1
 37 PRO  HB3    -0.07 1   0.15  0.25  1
 37 PRO  HG2    -0.06 1   0.15  0.25  1
 37 PRO  HG3    -0.06 1   0.15  0.25  1
 37 PRO  HD2    -0.08 1   0.15  0.25  1
 37 PRO  HD3    -0.06 1   0.15  0.25  1
 38 SER  HB2    -0.06 1   0.15  0.25  1
 38 SER  HB3    -0.05 1   0.15  0.25  1
 39 LEU  HB2    -0.11 1   0.15  0.25  1
 39 LEU  HB3    -0.15 1   0.15  0.25  1
 39 LEU  HG     -0.10 1   0.15  0.25  1
 39 LEU  HD11   -0.14d6   0.15  0.10  1
 39 LEU  HD12   -0.14 1   0.15  0.25  1
 39 LEU  HD13   -0.14 1   0.15  0.25  1
 39 LEU  HD21   -0.14 1   0.15  0.25  1
 39 LEU  HD22   -0.14 1   0.15  0.25  1
 39 LEU  HD23   -0.14 1   0.15  0.25  1
 40 LEU  HB2    -0.07 1   0.15  0.25  1
 40 LEU  HB3    -0.08 1   0.15  0.25  1
 40 LEU  HG     -0.13 1   0.15  0.25  1
 40 LEU  HD11   -0.09d3   0.15  0.10  1
 40 LEU  HD12   -0.09 1   0.15  0.25  1
 40 LEU  HD13   -0.09 1   0.15  0.25  1
 40 LEU  HD21   -0.11d3   0.15  0.10  1
 40 LEU  HD22   -0.11 1   0.15  0.25  1
 40 LEU  HD23   -0.11 1   0.15  0.25  1
 41 LYS  HB2    -0.06 1   0.15  0.25  1
 41 LYS  HB3    -0.02 1   0.15  0.25  1
 41 LYS  HG2    -0.06 1   0.15  0.25  1
 41 LYS  HG3    -0.05 1   0.15  0.25  1
 41 LYS  HD2    -0.06d2   0.15  0.10  1
 41 LYS  HD3    -0.06 1   0.15  0.25  1
 41 LYS  HE2    -0.05d2   0.15  0.10  1
 41 LYS  HE3    -0.05 1   0.15  0.25  1
 43 MET  HB2    -0.06 1   0.15  0.25  1
 43 MET  HB3    -0.05 1   0.15  0.25  1
 43 MET  HG2    -0.04 1   0.15  0.25  1
 43 MET  HG3    -0.03 1   0.15  0.25  1
 44 SER  HB2    -0.09 1   0.15  0.25  1
 44 SER  HB3    -0.08 1   0.15  0.25  1
 45 THR  HB     -0.04 1   0.15  0.25  1
 45 THR  HG21   -0.05d3   0.15  0.10  1
 45 THR  HG22   -0.05 1   0.15  0.25  1
 45 THR  HG23   -0.05 1   0.15  0.25  1
 46 LEU  HB2    -0.09 1   0.15  0.25  1
 46 LEU  HB3    -0.05 1   0.15  0.25  1
 46 LEU  HG     -0.11 1   0.15  0.25  1
 46 LEU  HD11   -0.08d3   0.15  0.10  1
 46 LEU  HD12   -0.08 1   0.15  0.25  1
 46 LEU  HD13   -0.08 1   0.15  0.25  1
 46 LEU  HD21   -0.13d3   0.15  0.10  1
 46 LEU  HD22   -0.13 1   0.15  0.25  1
 46 LEU  HD23   -0.13 1   0.15  0.25  1
 47 ASP  HB2     0.01 1   0.15  0.25  1
 47 ASP  HB3     0.05 1   0.15  0.25  1
 48 GLU  HB2    -0.04 1   0.15  0.25  1
 48 GLU  HB3    -0.04 1   0.15  0.25  1
 49 LEU  HB2    -0.20 1   0.15  0.25  1
 49 LEU  HB3    -0.31 1   0.15  0.25  1 
 49 LEU  HG     -0.30 1   0.15  0.25  1 
 49 LEU  HD11   -0.26d3   0.15  0.10  1 
 49 LEU  HD12   -0.26 1   0.15  0.25  1 
 49 LEU  HD13   -0.26 1   0.15  0.25  1 
 49 LEU  HD21   -0.24d3   0.15  0.10  1 
 49 LEU  HD22   -0.24 1   0.15  0.25  1 
 49 LEU  HD23   -0.24 1   0.15  0.25  1
 50 PHE  HB2    -0.18 1   0.30  0.02  1
 50 PHE  HB3    -0.02 1   0.30  0.02  1
 50 PHE  HD1     0.01d2   0.30  0.02  1
 50 PHE  HD2     0.01 1   0.30  0.02  1
 50 PHE  HE1     0.59d2   0.30  0.02  1 
 50 PHE  HE2     0.59 1   0.30  0.02  1 
 50 PHE  HZ      1.03 1   0.30  0.02  1
 51 GLU  HB2     0.05 1   0.15  0.25  1
 51 GLU  HB3     0.03 1   0.15  0.25  1
 51 GLU  HG2     0.29 1   0.15  0.25  1 
 51 GLU  HG3     0.27 1   0.15  0.25  1 
 52 GLU  HB2    -0.40 1   0.15  0.25  1 
 52 GLU  HB3    -0.40 1   0.15  0.25  1 
 52 GLU  HG2    -0.29 1   0.15  0.25  1 
 53 LEU  HG     -0.71 1   0.30  0.10  1 
 53 LEU  HD11   -0.70d3   0.30  0.02  1 
 53 LEU  HD12   -0.70 1   0.30  0.02  1 
 53 LEU  HD13   -0.70 1   0.30  0.02  1 
 53 LEU  HD21   -0.70d3   0.30  0.02  1 
 53 LEU  HD22   -0.70 1   0.30  0.02  1 
 53 LEU  HD23   -0.70 1   0.30  0.02  1 
 55 LYS  HB2    -0.57 1   0.30  0.02  1
 55 LYS  HB3    -0.64 1   0.30  0.02  1
 55 LYS  HG2    -0.48 1   0.30  0.02  1
 55 LYS  HG3    -0.54 1   0.30  0.02  1
 61 VAL  HG21   -3.75d3   0.30  0.02  1 
 61 VAL  HG22   -3.75d3   0.30  0.02  1 
 61 VAL  HG23   -3.75d3   0.30  0.02  1 
 61 VAL  HG12   -2.32d3   0.30  0.02  1 
 61 VAL  HG13   -2.32d3   0.30  0.02  1 
 62 SER  HB2     2.33d3   0.30  0.10  1 
 62 SER  HB3     2.36 1   0.30  0.02  1 
 62 SER  HG      6.86 1   0.30  0.02  1
 63 PHE  HD1     0.26d2   0.30  0.02  1 
 63 PHE  HD2     0.26 1   0.30  0.02  1
 63 PHE  HE1     0.12d2   0.15  0.10  1
 63 PHE  HE2     0.12 1   0.15  0.25  1
 64 GLU  HB2     1.4  1   0.30  0.02  1 
 64 GLU  HB3     1.6  1   0.30  0.02  1 
 64 GLU  HG2     1.44 1   0.30  0.02  1 
 64 GLU  HG3     1.54 1   0.30  0.02  1 
 66 PHE  HB2    -0.44 1   0.30  0.02  1 
 66 PHE  HB3    -0.28 1   0.30  0.02  1 
 66 PHE  HD1    -0.33d2   0.30  0.02  1 
 66 PHE  HD2    -0.33 1   0.30  0.02  1
 66 PHE  HE1    -0.20d2   0.30  0.02  1
 66 PHE  HE2    -0.20 1   0.30  0.02  1
 67 GLN  HB2     0.18 1   0.30  0.02  1
 67 GLN  HB3     0.18 1   0.30  0.02  1
 67 GLN  HG2     0.18 1   0.30  0.02  1
 67 GLN  HG3     0.22 1   0.30  0.02  1 
 67 GLN  HE21    0.43 1   0.30  0.02  1 
 67 GLN  HE22    0.28 1   0.30  0.10  1
 68 VAL  HB     -0.12 1   0.15  0.02  1
 68 VAL  HG12   -0.09 1   0.15  0.25  1
 68 VAL  HG13   -0.09 1   0.15  0.25  1
 68 VAL  HG21    0.07d3   0.15  0.10  1
 68 VAL  HG22    0.07 1   0.15  0.25  1
 68 VAL  HG23    0.07 1   0.15  0.25  1
 69 LEU  HB2    -0.32 1   0.15  0.25  1
 69 LEU  HB3    -0.33 1   0.15  0.25  1
 69 LEU  HG     -0.20 1   0.15  0.25  1
 69 LEU  HD21   -0.29d3   0.15  0.10  1 
 69 LEU  HD22   -0.29 1   0.15  0.25  1 
 69 LEU  HD23   -0.29 1   0.15  0.25  1 
 69 LEU  HD11   -0.32d3   0.15  0.10  1 
 69 LEU  HD12   -0.32 1   0.15  0.25  1 
 69 LEU  HD13   -0.32 1   0.15  0.25  1
 70 VAL  HB      0.01 1   0.15  0.25  1
 70 VAL  HG12    0.01 1   0.15  0.25  1
 70 VAL  HG13    0.01 1   0.15  0.25  1
 70 VAL  HG21   -0.00d3   0.15  0.10  1
 70 VAL  HG22   -0.00 1   0.15  0.25  1
 70 VAL  HG23   -0.00 1   0.15  0.25  1
 71 LYS  HB2    -0.03 1   0.15  0.25  1
 71 LYS  HB3    -0.05 1   0.15  0.25  1
 71 LYS  HG2    -0.02 1   0.15  0.25  1
 71 LYS  HG3    -0.02 1   0.15  0.25  1
 71 LYS  HD2     0.01d2   0.15  0.10  1
 71 LYS  HD3     0.01 1   0.15  0.25  1
 71 LYS  HE2     0.03d2   0.15  0.10  1
 71 LYS  HE3     0.03 1   0.15  0.25  1
 72 LYS  HB2    -0.13d2   0.15  0.10  1
 72 LYS  HB3    -0.13 1   0.15  0.25  1
 72 LYS  HG2    -0.07 1   0.15  0.25  1
 72 LYS  HG3    -0.07 1   0.15  0.25  1
 72 LYS  HE2    -0.15 1   0.15  0.25  1
 72 LYS  HE3    -0.15 1   0.15  0.25  1
 73 ILE  HB     -0.05 1   0.15  0.25  1
 73 ILE  HG12   -0.10 1   0.15  0.25  1
 73 ILE  HG21   -0.09d3   0.15  0.10  1
 73 ILE  HG22   -0.09 1   0.15  0.25  1
 73 ILE  HG23   -0.09 1   0.15  0.25  1
 73 ILE  HD11   -0.05d3   0.15  0.10  1
 73 ILE  HD12   -0.05 1   0.15  0.25  1
 73 ILE  HD13   -0.05 1   0.15  0.25  1
 74 SER  HB2    -0.04d2   0.15  0.10  1
 74 SER  HB3    -0.04 1   0.15  0.25  1
 75 GLN  HB2    -0.07 1   0.15  0.25  1
 75 GLN  HB3    -0.08 1   0.15  0.25  1
 75 GLN  HG2    -0.06 1   0.15  0.25  1
 75 GLN  HG3    -0.06 1   0.15  0.25  1
 75 GLN  HE22   -0.03 1   0.15  0.25  1
 75 GLN  HE21   -0.03 1   0.15  0.25  1
  1 LYS  N       0.00 1   0.15  0.25  1
  1 LYS  HN     -0.02 1   0.15  0.25  1
  2 SER  N      -0.03 1   0.15  0.25  1
  2 SER  HN     -0.02 1   0.15  0.25  1
  4 GLU  N      -0.02 1   0.15  0.25  1
  4 GLU  HN      0.00 1   0.15  0.25  1
  5 GLU  N       0.01 1   0.15  0.25  1
  5 GLU  HN     -0.01 1   0.15  0.25  1
  6 LEU  N      -0.01 1   0.15  0.25  1
  6 LEU  HN     -0.03 1   0.15  0.25  1
  7 LYS  N      -0.04 1   0.15  0.25  1
  7 LYS  HN      0.00 1   0.15  0.25  1
  8 GLY  N       0.02 1   0.15  0.25  1
  8 GLY  HN     -0.04 1   0.15  0.25  1
  9 ILE  N      -0.08 1   0.15  0.25  1
  9 ILE  HN     -0.08 1   0.15  0.25  1
 10 PHE  N      -0.16 1   0.15  0.25  1
 10 PHE  HN     -0.10 1   0.15  0.25  1
 11 GLU  N      -0.17 1   0.26  0.25  1
 11 GLU  HN     -0.11 1   0.15  0.25  1
 12 LYS  N      -0.14 1   0.15  0.25  1
 12 LYS  HN     -0.11 1   0.15  0.25  1
 13 TYR  N      -0.18 1   0.15  0.25  1
 13 TYR  HN     -0.17 1   0.15  0.25  1
 14 ALA  N      -0.23 1   0.15  0.25  1
 14 ALA  HN     -0.21 1   0.15  0.25  1
 15 ALA  N      -0.17 1   0.15  0.25  1
 15 ALA  HN     -0.17 1   0.15  0.25  1
 16 LYS  N      -0.22 1   0.45  0.25  1
 16 LYS  HN     -0.14 1   0.15  0.25  1
 17 GLU  N      -0.09 1   0.15  0.25  1
 17 GLU  HN     -0.12 1   0.15  0.25  1
 18 GLY  N      -0.06 1   0.56  0.25  1
 18 GLY  HN     -0.04 1   0.15  0.25  1
 19 ASP  N      -0.28 1   0.41  0.25  1
 19 ASP  HN     -0.18 1   0.15  0.25  1
 21 ASN  N      -0.32 1   0.81  0.25  1
 21 ASN  HN     -0.26 1   0.19  0.25  1
 22 GLN  N      -0.64 1   0.15  0.25  1
 22 GLN  HN      0.06 1   0.15  0.25  1
 22 GLN  NE2    -2.34 1   0.10 -1.00  1
 23 LEU  N      -1.14 1   0.46  0.25  1
 23 LEU  HN     -1.54 1   0.15  0.25  1
 24 SER  N      -0.41 1   0.18  0.25  1
 24 SER  HN     -0.35 1   0.15  0.25  1
 25 LYS  N       0.02 1   0.15  0.25  1
 25 LYS  HN      0.24 1   0.15  0.25  1
 26 GLU  N       0.01 1   0.22  0.25  1
 26 GLU  HN      0.05 1   0.15  0.25  1
 27 GLU  N      -0.18 1   0.15  0.25  1
 27 GLU  HN     -0.11 1   0.15  0.25  1
 28 LEU  N      -0.30 1   0.15  0.25  1
 28 LEU  HN     -0.29 1   0.15  0.25  1
 29 LYS  N      -0.27 1   0.24  0.25  1
 29 LYS  HN     -0.14 1   0.15  0.25  1
 30 LEU  N      -0.19 1   0.15  0.25  1
 30 LEU  HN     -0.13 1   0.15  0.25  1
 31 LEU  N      -0.17 1   0.15  0.25  1
 31 LEU  HN     -0.18 1   0.15  0.25  1
 32 LEU  N      -0.17 1   0.15  0.25  1
 32 LEU  HN     -0.18 1   0.15  0.25  1
 33 GLN  N      -0.12 1   0.15  0.25  1
 33 GLN  HN     -0.13 1   0.15  0.25  1
 34 THR  N      -0.09 1   0.15  0.25  1
 34 THR  HN     -0.10 1   0.15  0.25  1
 35 GLU  N      -0.11 1   0.15  0.25  1
 35 GLU  HN     -0.11 1   0.15  0.25  1
 36 PHE  N      -0.12 1   0.15  0.25  1
 36 PHE  HN     -0.11 1   0.15  0.25  1
 38 SER  N      -0.04 1   0.15  0.25  1
 38 SER  HN     -0.08 1   0.15  0.25  1
 39 LEU  N      -0.09 1   0.15  0.25  1
 39 LEU  HN     -0.09 1   0.15  0.25  1
 40 LEU  N      -0.08 1   0.15  0.25  1
 40 LEU  HN     -0.09 1   0.15  0.25  1
 41 LYS  N      -0.09 1   0.18  0.25  1
 41 LYS  HN     -0.08 1   0.15  0.25  1
 42 GLY  N      -0.03 1   0.22  0.25  1
 42 GLY  HN     -0.07 1   0.15  0.25  1
 43 MET  N        .04 1    .29 -1.00  1
 43 MET  HN      -.10 1    .15 -1.00  1
 44 SER  N       -.03 1    .15 -1.00  1
 44 SER  HN      -.07 1    .15 -1.00  1
 45 THR  N      -0.17 1   0.89  0.25  1
 45 THR  HN     -0.07 1   0.18  0.25  1
 46 LEU  N      -0.01 1   0.74  0.25  1
 46 LEU  HN     -0.06 1   0.15  0.25  1
 47 ASP  N      -0.14 1   0.56  0.25  1
 47 ASP  HN      0.01 1   0.15  0.25  1
 48 GLU  N      -0.07 1   0.64  0.25  1
 48 GLU  HN     -0.03 1   0.15  0.25  1
 49 LEU  N      -0.22 1   1.08  0.25  1
 49 LEU  HN     -0.13 1   0.15  0.25  1
 50 PHE  N      -0.34 1   0.15  0.25  1
 50 PHE  HN     -0.22 1   0.15  0.25  1
 51 GLU  N       0.24 1   0.15  0.25  1
 51 GLU  HN     -0.11 1   0.15  0.25  1
 52 GLU  N      -0.50 1   0.15  0.25  1
 52 GLU  HN     -0.34 1   0.15  0.25  1
 53 LEU  N      -1.32 1   0.93  0.25  1
 53 LEU  HN     -0.98 1   0.15  0.25  1
 61 VAL  N      -8.22 1   2.18 -1.00  1
 61 VAL  HN     -2.77 1    .24 -1.00  1
 63 PHE  N       0.37 1   0.22  0.25  1
 63 PHE  HN      0.40 1   0.15  0.25  1
 64 GLU  N       0.73 1   0.15  0.25  1
 64 GLU  HN      1.30 1   0.15  0.25  1
 65 GLU  N       1.74 1   0.24  0.25  1
 65 GLU  HN      2.41 1   0.15  0.25  1
 66 PHE  N       0.17 1   0.27  0.25  1
 66 PHE  HN      0.01 1   0.15  0.25  1
 67 GLN  N      -0.16 1   0.15  0.25  1
 67 GLN  HN      0.24 1   0.15  0.25  1
 68 VAL  N      -0.07 1   0.23  0.25  1
 68 VAL  HN      0.02 1   0.15  0.25  1
 69 LEU  N      -0.31 1   0.17  0.25  1
 69 LEU  HN     -0.19 1   0.15  0.25  1
 70 VAL  N      -0.30 1   0.15  0.25  1
 70 VAL  HN     -0.08 1   0.15  0.25  1
 71 LYS  N       0.03 1   0.15  0.25  1
 71 LYS  HN     -0.02 1   0.15  0.25  1
 72 LYS  N      -0.08 1   0.15  0.25  1
 72 LYS  HN     -0.08 1   0.15  0.25  1
 73 ILE  N      -0.01 1   0.23  0.25  1
 73 ILE  HN     -0.06 1   0.15  0.25  1
 74 SER  N      -0.09 1   0.18  0.25  1
 74 SER  HN     -0.04 1   0.15  0.25  1
 75 GLN  N      -0.07 1   0.15  0.25  1
 75 GLN  HN     -0.02 1   0.15  0.25  1
 21 ASN  ND2     0.13 1   0.34  0.02  1
 22 GLN  NE2    -1.17 1   1.16  0.02  1
 33 GLN  NE2    -0.05 1   0.27  0.02  1
 67 GLN  NE2     0.17 1   0.15  0.02  1
 75 GLN  NE2    -0.03 1   0.15  0.02  1
 53 LEU  CA     -1.52 1   0.10  0.02  1
 53 LEU  HA     -1.07 1   0.10  0.02  1
 53 LEU  HB2    -1.93 1   0.20  0.02  1
 53 LEU  HB3    -1.83 1   0.20  0.02  1
 53 LEU  C      -2.60 1   0.10  0.02  1
 54 ASP  HN     -1.52 1   0.20  0.02  1
 54 ASP  N      -2.02 1   0.20  0.02  1
 55 LYS  HN     -2.85 1   0.30  0.02  1
 56 ASN  HN     -5.66 1   0.20  0.02  1
 57 GLY  HN     -1.40 1   0.20  0.02  1
 57 GLY  CA      0.47 1   0.10  0.02  1
 57 GLY  HA1     0.73d2   0.10  0.02  1
 57 GLY  HA2     0.73d2   0.10  0.02  1
 57 GLY  C       0.60 1   0.10  0.02  1
 58 ASP  HN      9.66 1   0.30  0.02  1
 58 ASP  N       3.56 1   0.20  0.02  1
 58 ASP  C       6.70 1   0.30  0.02  1
 59 GLY  CA      5.10 1   0.10  0.02  1
 59 GLY  HA1     3.97 1   0.20  0.02  1
 59 GLY  HA2     3.58 1   0.20  0.02  1
 61 VAL  HB     -2.71 1   0.20  0.02  1
 62 SER  CA      0.00 1   0.10  0.02  1
 62 SER  C       0.28 1   0.10  0.02  1
 63 PHE  CA      0.30 1   0.10  0.02  1
 63 PHE  HA      0.03 1   0.10  0.02  1
 63 PHE  C       1.20 1   0.10  0.02  1
 64 GLU  CA      1.30 1   0.10  0.02  1
 65 GLU  CA      0.80 1   0.10  0.02  1
 65 GLU  HA      1.12 1   0.10  0.02  1
 66 PHE  CA     -0.30 1   0.10  0.02  1
 66 PHE  C      -0.12 1   0.10  0.02  1
 67 GLN  CA      0.23 1   0.10  0.02  1
 67 GLN  C      -0.17 1   0.10  0.02  1
  1 LYS  N       0.02 1   0.15  0.50  2
  1 LYS  HN      0.00 1   0.15  0.50  2
  2 SER  N       0.00 1   0.15  0.50  2
  2 SER  HN      0.00 1   0.15  0.50  2
  4 GLU  N       0.04 1   0.15  0.50  2
  4 GLU  HN      0.06 1   0.15  0.50  2
  5 GLU  N       0.02 1   0.15  0.50  2
  5 GLU  HN      0.00 1   0.15  0.50  2
  6 LEU  N      -0.02 1   0.15  0.50  2
  6 LEU  HN      0.00 1   0.15  0.50  2
  7 LYS  N       0.00 1   0.15  0.50  2
  7 LYS  HN      0.00 1   0.15  0.50  2
  8 GLY  N      -0.07 1   0.15  0.50  2
  8 GLY  HN     -0.05 1   0.15  0.50  2
  9 ILE  N      -0.16 1   0.15  0.50  2
  9 ILE  HN     -0.14 1   0.15  0.50  2
 10 PHE  N      -0.16 1   0.15  0.50  2
 10 PHE  HN     -0.13 1   0.15  0.50  2
 11 GLU  N      -0.31 1   0.26  0.50  2
 11 GLU  HN     -0.25 1   0.15  0.50  2
 12 LYS  N      -0.34 1   0.15  0.50  2
 12 LYS  HN     -0.29 1   0.15  0.50  2
 13 TYR  N      -0.43 1   0.15  0.50  2
 13 TYR  HN     -0.41 1   0.15  0.50  2
 14 ALA  N      -0.76 1   0.15  0.50  2
 14 ALA  HN     -0.63 1   0.15  0.50  2
 15 ALA  N      -0.55 1   0.15  0.50  2
 15 ALA  HN     -0.48 1   0.15  0.50  2
 16 LYS  N      -0.43 1   0.45  0.50  2
 16 LYS  HN     -0.45 1   0.15  0.50  2
 17 GLU  N      -0.33 1   0.15  0.50  2
 17 GLU  HN     -0.44 1   0.15  0.50  2
 18 GLY  N      -0.29 1   0.56  0.50  2
 18 GLY  HN     -0.22 1   0.15  0.50  2
 19 ASP  N      -0.50 1   0.41  0.50  2
 19 ASP  HN     -0.48 1   0.15  0.50  2
 21 ASN  N      -0.60 1   0.81  0.50  2
 21 ASN  HN     -0.63 1   0.19  0.50  2
 21 ASN  ND2    -0.24 1   0.34  0.50  2
 22 GLN  N      -1.53 1   0.15  0.50  2
 22 GLN  HN     -1.32 1   0.15  0.50  2
 24 SER  N      -1.83 1   0.18  0.50  2
 24 SER  HN     -1.46 1   0.15  0.50  2
 25 LYS  N      -0.56 1   0.15  0.50  2
 25 LYS  HN     -0.82 1   0.15  0.50  2
 26 GLU  N      -0.32 1   0.22  0.50  2
 26 GLU  HN     -0.35 1   0.15  0.50  2
 27 GLU  N      -0.54 1   0.15  0.50  2
 27 GLU  HN     -0.63 1   0.15  0.50  2
 28 LEU  N      -0.81 1   0.15  0.50  2
 28 LEU  HN     -0.93 1   0.15  0.50  2
 29 LYS  N      -0.66 1   0.24  0.50  2
 29 LYS  HN     -0.47 1   0.15  0.50  2
 30 LEU  N      -0.35 1   0.15  0.50  2
 30 LEU  HN     -0.37 1   0.15  0.50  2
 31 LEU  N      -0.34 1   0.15  0.50  2
 31 LEU  HN     -0.44 1   0.15  0.50  2
 32 LEU  N      -0.19 1   0.15  0.50  2
 32 LEU  HN     -0.35 1   0.15  0.50  2
 33 GLN  N      -0.19 1   0.15  0.50  2
 33 GLN  HN     -0.23 1   0.15  0.50  2
 33 GLN  NE2    -0.09 1   0.27  0.50  2
 34 THR  N      -0.16 1   0.15  0.50  2
 34 THR  HN     -0.20 1   0.15  0.50  2
 35 GLU  N      -0.17 1   0.15  0.50  2
 35 GLU  HN     -0.18 1   0.15  0.50  2
 36 PHE  N      -0.15 1   0.15  0.50  2
 36 PHE  HN     -0.16 1   0.15  0.50  2
 38 SER  N      -0.08 1   0.15  0.50  2
 38 SER  HN     -0.09 1   0.15  0.50  2
 39 LEU  N      -0.07 1   0.15  0.50  2
 39 LEU  HN     -0.10 1   0.15  0.50  2
 40 LEU  N      -0.14 1   0.15  0.50  2
 40 LEU  HN     -0.11 1   0.15  0.50  2
 41 LYS  N      -0.06 1   0.18  0.50  2
 41 LYS  HN     -0.08 1   0.15  0.50  2
 42 GLY  N      -0.04 1   0.22  0.50  2
 42 GLY  HN     -0.05 1   0.15  0.50  2
 43 MET  N       -.18 1    .29 -1.00  2
 43 MET  HN      -.11 1    .15 -1.00  2
 44 SER  N       -.01 1    .15 -1.00  2
 44 SER  HN      -.05 1    .15 -1.00  2
 45 THR  N      -0.14 1   0.89  0.50  2
 45 THR  HN      0.00 1   0.18  0.50  2
 46 LEU  N      -0.02 1   0.74  0.50  2
 46 LEU  HN     -0.06 1   0.15  0.50  2
 47 ASP  N      -0.07 1   0.56  0.50  2
 47 ASP  HN      0.03 1   0.15  0.50  2
 48 GLU  N       0.20 1   0.64  0.50  2
 48 GLU  HN      0.15 1   0.15  0.50  2
 49 LEU  N       0.00 1   1.08  0.50  2
 49 LEU  HN      0.00 1   0.15  0.50  2
 50 PHE  N      -0.16 1   0.15  0.50  2
 50 PHE  HN     -0.14 1   0.15  0.50  2
 51 GLU  N       0.38 1   0.15  0.50  2
 51 GLU  HN      0.12 1   0.15  0.50  2
 52 GLU  N       0.00 1   0.15  0.50  2
 52 GLU  HN      0.03 1   0.15  0.50  2
 53 LEU  N      -0.16 1   0.93  0.50  2
 53 LEU  HN     -0.23 1   0.15  0.50  2
 61 VAL  N     -21.93 1   2.18 -1.00  2
 61 VAL  HN     -9.66 1    .24 -1.00  2
 63 PHE  N       0.50 1   0.22  0.50  2
 63 PHE  HN      0.38 1   0.15  0.50  2
 64 GLU  N       2.02 1   0.15  0.50  2
 64 GLU  HN      2.29 1   0.15  0.50  2
 65 GLU  N       4.06 1   0.24  0.50  2
 65 GLU  HN      5.07 1   0.15  0.50  2
 66 PHE  N       1.19 1   0.27  0.50  2
 66 PHE  HN      0.89 1   0.15  0.50  2
 67 GLN  N       0.49 1   0.15  0.50  2
 67 GLN  HN      0.89 1   0.15  0.50  2
 67 GLN  NE2     0.50 1   0.15  0.50  2
 68 VAL  N       0.42 1   0.23  0.50  2
 68 VAL  HN      0.71 1   0.15  0.50  2
 69 LEU  N       0.17 1   0.17  0.50  2
 69 LEU  HN      0.21 1   0.15  0.50  2
 70 VAL  N      -0.04 1   0.15  0.50  2
 70 VAL  HN      0.11 1   0.15  0.50  2
 71 LYS  N       0.11 1   0.15  0.50  2
 71 LYS  HN      0.15 1   0.15  0.50  2
 72 LYS  N       0.08 1   0.15  0.50  2
 72 LYS  HN      0.07 1   0.15  0.50  2
 73 ILE  N       0.00 1   0.23  0.50  2
 73 ILE  HN      0.00 1   0.15  0.50  2
 74 SER  N       0.00 1   0.18  0.50  2
 74 SER  HN      0.00 1   0.15  0.50  2
 75 GLN  N       0.00 1   0.15  0.50  2
 75 GLN  HN      0.02 1   0.15  0.50  2
 75 GLN  NE2     0.00 1   0.15  0.50  2
  1 LYS  HN      0.00 1   0.15  1.00  3
  1 LYS  N       0.00 1   0.15  1.00  3
  2 SER  HN      0.00 1   0.15  1.00  3
  2 SER  N       0.00 1   0.15  1.00  3
  4 GLU  HN      0.03 1   0.15  1.00  3
  4 GLU  N       0.15 1   0.15  1.00  3
  5 GLU  HN      0.01 1   0.15  1.00  3
  5 GLU  N       0.10 1   0.15  1.00  3
  6 LEU  HN      0.00 1   0.15  1.00  3
  6 LEU  N       0.00 1   0.15  1.00  3
  7 LYS  HN      0.01 1   0.15  1.00  3
  7 LYS  N       0.02 1   0.15  1.00  3
  8 GLY  HN     -0.02 1   0.15  1.00  3
  8 GLY  N      -0.05 1   0.15  1.00  3
  9 ILE  HN     -0.06 1   0.15  1.00  3
  9 ILE  N      -0.09 1   0.15  1.00  3
 10 PHE  HN     -0.10 1   0.15  1.00  3
 10 PHE  N      -0.13 1   0.15  1.00  3
 11 GLU  HN     -0.09 1   0.15  1.00  3
 11 GLU  N      -0.08 1   0.26  1.00  3
 12 LYS  HN     -0.11 1   0.15  1.00  3
 12 LYS  N      -0.18 1   0.15  1.00  3
 13 TYR  HN     -0.17 1   0.15  1.00  3
 13 TYR  N      -0.18 1   0.15  1.00  3
 14 ALA  HN     -0.22 1   0.15  1.00  3
 14 ALA  N      -0.26 1   0.15  1.00  3
 15 ALA  HN     -0.17 1   0.15  1.00  3
 15 ALA  N      -0.19 1   0.15  1.00  3
 16 LYS  HN     -0.16 1   0.15  1.00  3
 16 LYS  N      -0.13 1   0.45  1.00  3
 17 GLU  HN     -0.14 1   0.15  1.00  3
 17 GLU  N      -0.06 1   0.15  1.00  3
 18 GLY  HN     -0.06 1   0.15  1.00  3
 18 GLY  N      -0.13 1   0.56  1.00  3
 19 ASP  HN     -0.03 1   0.15  1.00  3
 19 ASP  N      -0.09 1   0.41  1.00  3
 21 ASN  HN     -0.22 1   0.19  1.00  3
 21 ASN  HN     -0.11 1   0.19  1.00  3
 21 ASN  ND2    -0.07 1   0.34  1.00  3
 22 GLN  HN     -0.47 1   0.15  1.00  3
 22 GLN  N      -0.52 1   0.15  1.00  3
 22 GLN  NE2    -1.31 1   1.16  1.00  3
 23 LEU  HN     -1.75 1   0.15  1.00  3
 23 LEU  N      -1.23 1   0.46  1.00  3
 24 SER  HN     -0.50 1   0.15  1.00  3
 24 SER  N      -0.65 1   0.18  1.00  3
 25 LYS  HN     -0.04 1   0.15  1.00  3
 25 LYS  N      -0.28 1   0.15  1.00  3
 26 GLU  HN     -0.08 1   0.15  1.00  3
 26 GLU  N       0.02 1   0.22  1.00  3
 27 GLU  HN     -0.20 1   0.15  1.00  3
 27 GLU  N      -0.13 1   0.15  1.00  3
 28 LEU  HN     -0.39 1   0.15  1.00  3
 28 LEU  N      -0.36 1   0.15  1.00  3
 29 LYS  HN     -0.18 1   0.15  1.00  3
 29 LYS  N      -0.30 1   0.24  1.00  3
 30 LEU  HN     -0.15 1   0.15  1.00  3
 30 LEU  N      -0.13 1   0.15  1.00  3
 31 LEU  HN     -0.21 1   0.15  1.00  3
 31 LEU  N      -0.18 1   0.15  1.00  3
 32 LEU  HN     -0.18 1   0.15  1.00  3
 32 LEU  N      -0.14 1   0.15  1.00  3
 33 GLN  HN     -0.12 1   0.15  1.00  3
 33 GLN  N      -0.08 1   0.15  1.00  3
 33 GLN  NE2     0.00 1   0.27  1.00  3
 34 THR  HN     -0.10 1   0.15  1.00  3
 34 THR  N      -0.05 1   0.15  1.00  3
 35 GLU  HN     -0.09 1   0.15  1.00  3
 35 GLU  N      -0.09 1   0.15  1.00  3
 36 PHE  HN     -0.08 1   0.15  1.00  3
 36 PHE  N      -0.09 1   0.15  1.00  3
 38 SER  HN     -0.05 1   0.15  1.00  3
 38 SER  N       0.00 1   0.15  1.00  3
 39 LEU  HN     -0.07 1   0.15  1.00  3
 39 LEU  N      -0.06 1   0.15  1.00  3
 40 LEU  HN     -0.06 1   0.15  1.00  3
 40 LEU  N      -0.03 1   0.15  1.00  3
 41 LYS  HN      0.04 1   0.15  1.00  3
 41 LYS  N       0.00 1   0.18  1.00  3
 42 GLY  HN     -0.04 1   0.15  1.00  3
 42 GLY  N       0.00 1   0.22  1.00  3
 44 SER  HN     -0.03 1   0.15  1.00  3
 44 SER  N       0.05 1   0.15  1.00  3
 45 THR  HN     -0.03 1   0.18  1.00  3
 45 THR  N      -0.38 1   0.89  1.00  3
 46 LEU  HN     -0.05 1   0.15  1.00  3
 46 LEU  N       0.15 1   0.74  1.00  3
 47 ASP  HN      0.05 1   0.15  1.00  3
 47 ASP  N      -0.14 1   0.56  1.00  3
 48 GLU  HN      0.11 1   0.15  1.00  3
 48 GLU  N      -0.15 1   0.64  1.00  3
 49 LEU  HN      0.05 1   0.15  1.00  3
 49 LEU  N       0.37 1   1.08  1.00  3
 50 PHE  HN     -0.17 1   0.15  1.00  3
 50 PHE  N      -0.08 1   0.15  1.00  3
 51 GLU  HN     -0.02 1   0.15  1.00  3
 51 GLU  N      -0.02 1   0.15  1.00  3
 52 GLU  HN     -0.14 1   0.15  1.00  3
 52 GLU  N      -0.06 1   0.15  1.00  3
 53 LEU  HN     -0.48 1   0.15  1.00  3
 53 LEU  N      -0.50 1   0.93  1.00  3
 54 ASP  HN     -1.52 1   0.50  1.00  3
 54 ASP  N      -2.02 1   1.96  1.00  3
 63 PHE  HN      0.31 1   0.15  1.00  3
 63 PHE  N       0.36 1   0.22  1.00  3
 64 GLU  HN      1.22 1   0.15  1.00  3
 64 GLU  N       1.11 1   0.15  1.00  3
 65 GLU  HN      2.59 1   0.15  1.00  3
 65 GLU  N       1.93 1   0.24  1.00  3
 66 PHE  HN      0.35 1   0.15  1.00  3
 66 PHE  N       0.60 1   0.27  1.00  3
 67 GLN  HN      0.41 1   0.15  1.00  3
 67 GLN  N       0.22 1   0.15  1.00  3
 67 GLN  NE2     0.22 1   0.15  1.00  3
 68 VAL  HN      0.24 1   0.15  1.00  3
 68 VAL  N       0.00 1   0.23  1.00  3
 69 LEU  HN      0.05 1   0.15  1.00  3
 69 LEU  N       0.10 1   0.17  1.00  3
 70 VAL  HN      0.00 1   0.15  1.00  3
 70 VAL  N      -0.19 1   0.15  1.00  3
 71 LYS  HN      0.04 1   0.15  1.00  3
 71 LYS  N       0.08 1   0.15  1.00  3
 72 LYS  HN      0.00 1   0.15  1.00  3
 72 LYS  N      -0.04 1   0.15  1.00  3
 73 ILE  HN     -0.03 1   0.15  1.00  3
 73 ILE  N       0.06 1   0.23  1.00  3
 74 SER  HN     -0.01 1   0.15  1.00  3
 74 SER  N      -0.02 1   0.18  1.00  3
 75 GLN  HN      0.00 1   0.15  1.00  3
 75 GLN  N       0.00 1   0.15  1.00  3
 75 GLN  NE2     0.00 1   0.15  1.00  3
  2 SER  N       0.17 1   0.15  0.50  4
  2 SER  HN      0.07 1   0.15  0.50  4
  4 GLU  N      -0.01 1   0.15  0.50  4
  4 GLU  HN     -0.02 1   0.15  0.50  4
  5 GLU  N      -0.03 1   0.15  0.50  4
  5 GLU  HN     -0.02 1   0.15  0.50  4
  6 LEU  N      -0.19 1   0.15  0.50  4
  6 LEU  HN     -0.16 1   0.15  0.50  4
  7 LYS  N       0.03 1   0.15  0.50  4
  7 LYS  HN     -0.03 1   0.15  0.50  4
  8 GLY  N      -0.11 1   0.15  0.50  4
  8 GLY  HN      0.00 1   0.15  0.50  4
  9 ILE  N      -0.02 1   0.15  0.50  4
  9 ILE  HN      0.03 1   0.15  0.50  4
 10 PHE  N       0.10 1   0.15  0.50  4
 10 PHE  HN      0.26 1   0.15  0.50  4
 11 GLU  N       0.13 1   0.26  0.50  4
 11 GLU  HN      0.09 1   0.15  0.50  4
 12 LYS  N      -0.01 1   0.15  0.50  4
 12 LYS  HN     -0.04 1   0.15  0.50  4
 13 TYR  N       0.12 1   0.15  0.50  4
 13 TYR  HN      0.17 1   0.15  0.50  4
 14 ALA  N       0.27 1   0.15  0.50  4
 14 ALA  HN      0.27 1   0.15  0.50  4
 15 ALA  N       0.16 1   0.15  0.50  4
 15 ALA  HN      0.17 1   0.15  0.50  4
 16 LYS  N       0.51 1   0.45  0.50  4
 16 LYS  HN      0.10 1   0.15  0.50  4
 17 GLU  N       0.16 1   0.15  0.50  4
 17 GLU  HN      0.19 1   0.15  0.50  4
 18 GLY  N       0.02 1   0.56  0.50  4
 18 GLY  HN      0.07 1   0.15  0.50  4
 19 ASP  N       0.28 1   0.41  0.50  4
 19 ASP  HN      0.24 1   0.15  0.50  4
 21 ASN  N       0.31 1   0.81  0.50  4
 21 ASN  HN      0.23 1   0.19  0.50  4
 21 ASN  ND2     0.04 1   0.34  0.50  4
 22 GLN  N       0.63 1   0.15  0.50  4
 22 GLN  HN      0.43 1   0.15  0.50  4
 24 SER  N       0.87 1   0.18  0.50  4
 24 SER  HN      0.71 1   0.15  0.50  4
 25 LYS  N       0.27 1   0.15  0.50  4
 25 LYS  HN      0.29 1   0.15  0.50  4
 26 GLU  N       0.35 1   0.22  0.50  4
 26 GLU  HN      0.20 1   0.15  0.50  4
 27 GLU  N       0.37 1   0.15  0.50  4
 27 GLU  HN      0.38 1   0.15  0.50  4
 28 LEU  N       0.43 1   0.15  0.50  4
 28 LEU  HN      0.52 1   0.15  0.50  4
 29 LYS  N       0.29 1   0.24  0.50  4
 30 LEU  N       0.23 1   0.15  0.50  4
 30 LEU  HN      0.22 1   0.15  0.50  4
 31 LEU  N       0.25 1   0.15  0.50  4
 31 LEU  HN      0.24 1   0.15  0.50  4
 32 LEU  N       0.17 1   0.15  0.50  4
 32 LEU  HN      0.21 1   0.15  0.50  4
 33 GLN  N       0.16 1   0.15  0.50  4
 33 GLN  HN      0.13 1   0.15  0.50  4
 33 GLN  NE2     0.08 1   0.27  0.50  4
 34 THR  N       0.13 1   0.15  0.50  4
 34 THR  HN      0.11 1   0.15  0.50  4
 35 GLU  N       0.05 1   0.15  0.50  4
 35 GLU  HN      0.11 1   0.15  0.50  4
 36 PHE  N       0.07 1   0.15  0.50  4
 36 PHE  HN      0.10 1   0.15  0.50  4
 38 SER  N       0.11 1   0.15  0.50  4
 38 SER  HN      0.05 1   0.15  0.50  4
 39 LEU  N       0.09 1   0.15  0.50  4
 39 LEU  HN      0.06 1   0.15  0.50  4
 40 LEU  N       0.09 1   0.15  0.50  4
 40 LEU  HN      0.07 1   0.15  0.50  4
 41 LYS  N       0.08 1   0.18  0.50  4
 41 LYS  HN      0.05 1   0.15  0.50  4
 42 GLY  N      -0.02 1   0.22  0.50  4
 42 GLY  HN      0.05 1   0.15  0.50  4
 43 MET  N        .28 1    .29 -0.50  4
 43 MET  HN       .11 1    .15 -0.50  4
 44 SER  N        .38 1    .15 -0.50  4
 44 SER  HN       .05 1    .15 -0.50  4
 45 THR  N       0.07 1   0.89  0.50  4
 45 THR  HN      0.02 1   0.18  0.50  4
 46 LEU  N       0.12 1   0.74  0.50  4
 46 LEU  HN      0.06 1   0.15  0.50  4
 47 ASP  N      -0.04 1   0.56  0.50  4
 47 ASP  HN      0.06 1   0.15  0.50  4
 48 GLU  N      -0.12 1   0.64  0.50  4
 48 GLU  HN      0.08 1   0.15  0.50  4
 49 LEU  N       0.42 1   1.08  0.50  4
 49 LEU  HN      0.06 1   0.15  0.50  4
 50 PHE  N       0.23 1   0.15  0.50  4
 50 PHE  HN      0.12 1   0.15  0.50  4
 51 GLU  N       0.29 1   0.15  0.50  4
 51 GLU  HN     -0.12 1   0.15  0.50  4
 67 GLN  N      -0.39 1   0.15  0.50  4
 67 GLN  HN     -0.47 1   0.15  0.50  4
 67 GLN  NE2    -0.29 1   0.15  0.50  4
 68 VAL  N      -0.36 1   0.23  0.50  4
 68 VAL  HN     -0.36 1   0.15  0.50  4
 69 LEU  N      -0.11 1   0.17  0.50  4
 69 LEU  HN     -0.07 1   0.15  0.50  4
 70 VAL  N      -0.22 1   0.15  0.50  4
 70 VAL  HN     -0.05 1   0.15  0.50  4
 71 LYS  N      -0.07 1   0.15  0.50  4
 71 LYS  HN     -0.07 1   0.15  0.50  4
 72 LYS  N      -0.05 1   0.15  0.50  4
 72 LYS  HN      0.00 1   0.15  0.50  4
 73 ILE  N      -0.03 1   0.23  0.50  4
 73 ILE  HN      0.00 1   0.15  0.50  4
 74 SER  N      -0.01 1   0.18  0.50  4
 74 SER  HN      0.00 1   0.15  0.50  4
 75 GLN  N      -0.03 1   0.15  0.50  4
 75 GLN  HN      0.00 1   0.15  0.50  4
 75 GLN  NE2     0.00 1   0.15  0.50  4
  2 SER  N       0.23 1   0.15  0.25  5
  2 SER  HN      0.14 1   0.15  0.25  5
  4 GLU  N       1.05 1   0.15  0.25  5
  4 GLU  HN      0.96 1   0.15  0.25  5
  5 GLU  N       0.59 1   0.15  0.25  5
  5 GLU  HN      0.49 1   0.15  0.25  5
  6 LEU  N       0.36 1   0.15  0.25  5
  6 LEU  HN      0.44 1   0.15  0.25  5
  7 LYS  N       1.08 1   0.15  0.25  5
  7 LYS  HN      1.01 1   0.15  0.25  5
  8 GLY  N       0.39 1   0.15  0.25  5
  8 GLY  HN      0.46 1   0.15  0.25  5
  9 ILE  N      -0.45 1   0.15  0.25  5
  9 ILE  HN     -0.33 1   0.15  0.25  5
 18 GLY  N      -1.24 1   0.56  0.25  5
 18 GLY  HN     -1.28 1   0.15  0.25  5
 32 LEU  N      -3.16 1   0.15  0.25  5
 32 LEU  HN     -3.76 1   0.15  0.25  5
 33 GLN  N      -2.28 1   0.15  0.25  5
 33 GLN  HN     -2.46 1   0.15  0.25  5
 33 GLN  NE2    -1.51 1   0.27  0.25  5
 34 THR  N      -1.56 1   0.15  0.25  5
 34 THR  HN     -1.95 1   0.15  0.25  5
 35 GLU  N      -1.53 1   0.15  0.25  5
 35 GLU  HN     -1.89 1   0.15  0.25  5
 36 PHE  N      -1.90 1   0.15  0.25  5
 36 PHE  HN     -2.06 1   0.15  0.25  5
 38 SER  N      -1.43 1   0.15  0.25  5
 38 SER  HN     -1.41 1   0.15  0.25  5
 39 LEU  N      -1.63 1   0.15  0.25  5
 39 LEU  HN     -1.81 1   0.15  0.25  5
 40 LEU  N      -1.66 1   0.15  0.25  5
 40 LEU  HN     -1.99 1   0.15  0.25  5
 41 LYS  N      -1.28 1   0.18  0.25  5
 41 LYS  HN     -1.60 1   0.15  0.25  5
 42 GLY  N      -1.45 1   0.22  0.25  5
 42 GLY  HN     -1.40 1   0.15  0.25  5
 70 VAL  N      -0.79 1   0.15  0.25  5
 70 VAL  HN     -1.22 1   0.15  0.25  5
 71 LYS  N      -0.77 1   0.15  0.25  5
 71 LYS  HN     -0.88 1   0.15  0.25  5
 73 ILE  N      -1.61 1   0.23  0.25  5
 73 ILE  HN     -1.57 1   0.15  0.25  5
 74 SER  N      -0.70 1   0.18  0.25  5
 74 SER  HN     -0.99 1   0.15  0.25  5
 75 GLN  N      -0.46 1   0.15  0.25  5
 75 GLN  HN     -0.64 1   0.15  0.25  5
 75 GLN  NE2    -0.53 1   0.15  0.25  5
  2 SER  N       0.08 1   0.15  0.05  6
  2 SER  HN      0.11 1   0.15  0.05  6
  4 GLU  N       0.74 1   0.15  0.05  6
  4 GLU  HN      0.81 1   0.15  0.05  6
  5 GLU  N       0.14 1   0.15  0.05  6
  5 GLU  HN      0.31 1   0.15  0.05  6
  6 LEU  N       0.01 1   0.15  0.05  6
  6 LEU  HN      0.24 1   0.15  0.05  6
  7 LYS  N       0.46 1   0.15  0.05  6
  7 LYS  HN      0.59 1   0.15  0.05  6
  8 GLY  N      -0.17 1   0.15  0.05  6
  8 GLY  HN     -0.04 1   0.15  0.05  6
  9 ILE  N      -1.14 1   0.15  0.05  6
  9 ILE  HN     -0.83 1   0.15  0.05  6
 10 PHE  N      -1.84 1   0.15  0.05  6
 10 PHE  HN     -1.44 1   0.15  0.05  6
 12 LYS  N      -2.29 1   0.15  0.05  6
 12 LYS  HN     -1.98 1   0.15  0.05  6
 13 TYR  N      -3.23 1   0.15  0.05  6
 13 TYR  HN     -3.32 1   0.15  0.05  6
 15 ALA  N      -3.87 1   0.15  0.05  6
 15 ALA  HN     -3.79 1   0.15  0.05  6
 16 LYS  N      -2.84 1   0.45  0.05  6
 16 LYS  HN     -3.99 1   0.15  0.05  6
 18 GLY  N      -2.50 1   0.56  0.05  6
 18 GLY  HN     -2.34 1   0.15  0.05  6
 27 GLU  N      -6.24 1   0.15  0.05  6
 27 GLU  HN     -7.10 1   0.15  0.05  6
 30 LEU  N      -3.27 1   0.15  0.05  6
 30 LEU  HN     -3.86 1   0.15  0.05  6
 31 LEU  N      -3.59 1   0.15  0.05  6
 31 LEU  HN     -4.38 1   0.15  0.05  6
 33 GLN  N      -2.16 1   0.15  0.05  6
 33 GLN  HN     -2.43 1   0.15  0.05  6
 33 GLN  NE2    -1.79 1   0.27  0.05  6
 34 THR  N      -1.64 1   0.15  0.05  6
 34 THR  HN     -2.01 1   0.15  0.05  6
 35 GLU  N      -1.43 1   0.15  0.05  6
 35 GLU  HN     -1.88 1   0.15  0.05  6
 36 PHE  N      -1.55 1   0.15  0.05  6
 36 PHE  HN     -1.75 1   0.15  0.05  6
 38 SER  N      -1.02 1   0.15  0.05  6
 38 SER  HN     -0.96 1   0.15  0.05  6
 39 LEU  N      -1.04 1   0.15  0.05  6
 39 LEU  HN     -1.12 1   0.15  0.05  6
 40 LEU  N      -1.13 1   0.15  0.05  6
 40 LEU  HN     -1.25 1   0.15  0.05  6
 41 LYS  N      -0.61 1   0.18  0.05  6
 41 LYS  HN     -0.88 1   0.15  0.05  6
 42 GLY  N      -1.00 1   0.22  0.05  6
 42 GLY  HN     -0.76 1   0.15  0.05  6
 71 LYS  N       0.57 1   0.15  0.05  6
 71 LYS  HN      0.68 1   0.15  0.05  6
 72 LYS  N      -0.17 1   0.15  0.05  6
 72 LYS  HN     -0.09 1   0.15  0.05  6
 73 ILE  N      -0.70 1   0.23  0.05  6
 73 ILE  HN     -0.42 1   0.15  0.05  6
 74 SER  N      -0.08 1   0.18  0.05  6
 74 SER  HN     -0.20 1   0.15  0.05  6
 75 GLN  N       0.14 1   0.15  0.05  6
 75 GLN  HN     -0.09 1   0.15  0.05  6
 75 GLN  NE2    -0.19 1   0.15  0.05  6
  2 SER  N       0.34 1   0.15  0.50  7
  2 SER  HN      0.28 1   0.15  0.50  7
  4 GLU  N       0.66 1   0.15  0.50  7
  4 GLU  HN      0.63 1   0.15  0.50  7
  5 GLU  N       0.42 1   0.15  0.50  7
  5 GLU  HN      0.42 1   0.15  0.50  7
  6 LEU  N       0.36 1   0.15  0.50  7
  6 LEU  HN      0.43 1   0.15  0.50  7
  7 LYS  N       0.65 1   0.15  0.50  7
  7 LYS  HN      0.63 1   0.15  0.50  7
  8 GLY  N       0.23 1   0.15  0.50  7
  8 GLY  HN      0.24 1   0.15  0.50  7
  9 ILE  N      -0.14 1   0.15  0.50  7
  9 ILE  HN     -0.07 1   0.15  0.50  7
 10 PHE  N      -0.38 1   0.15  0.50  7
 10 PHE  HN     -0.18 1   0.15  0.50  7
 11 GLU  N      -0.61 1   0.26  0.50  7
 11 GLU  HN     -0.17 1   0.15  0.50  7
 12 LYS  N      -0.69 1   0.15  0.50  7
 12 LYS  HN     -0.75 1   0.15  0.50  7
 13 TYR  N      -1.15 1   0.15  0.50  7
 13 TYR  HN     -1.17 1   0.15  0.50  7
 14 ALA  N      -2.06 1   0.15  0.50  7
 14 ALA  HN     -1.76 1   0.15  0.50  7
 15 ALA  N      -1.39 1   0.15  0.50  7
 15 ALA  HN     -1.35 1   0.15  0.50  7
 16 LYS  N      -0.85 1   0.45  0.50  7
 16 LYS  HN     -1.40 1   0.15  0.50  7
 17 GLU  N      -1.03 1   0.15  0.50  7
 17 GLU  HN     -1.81 1   0.15  0.50  7
 21 ASN  N      -1.72 1   0.81  0.50  7
 21 ASN  HN     -2.83 1   0.19  0.50  7
 28 LEU  N      -3.82 1   0.15  0.50  7
 28 LEU  HN     -4.45 1   0.15  0.50  7
 29 LYS  N      -2.39 1   0.24  0.50  7
 29 LYS  HN     -2.62 1   0.15  0.50  7
 30 LEU  N      -1.50 1   0.15  0.50  7
 30 LEU  HN     -1.71 1   0.15  0.50  7
 31 LEU  N      -1.55 1   0.15  0.50  7
 31 LEU  HN     -1.92 1   0.15  0.50  7
 32 LEU  N      -1.38 1   0.15  0.50  7
 32 LEU  HN     -1.58 1   0.15  0.50  7
 33 GLN  N      -1.06 1   0.15  0.50  7
 33 GLN  HN     -1.19 1   0.15  0.50  7
 33 GLN  NE2    -0.76 1   0.27  0.50  7
 34 THR  N      -0.72 1   0.15  0.50  7
 34 THR  HN     -0.87 1   0.15  0.50  7
 35 GLU  N      -0.59 1   0.15  0.50  7
 35 GLU  HN     -0.80 1   0.15  0.50  7
 36 PHE  N      -0.68 1   0.15  0.50  7
 36 PHE  HN     -0.79 1   0.15  0.50  7
 38 SER  N      -0.49 1   0.15  0.50  7
 38 SER  HN     -0.50 1   0.15  0.50  7
 39 LEU  N      -0.52 1   0.15  0.50  7
 39 LEU  HN     -0.63 1   0.15  0.50  7
 40 LEU  N      -0.74 1   0.15  0.50  7
 40 LEU  HN     -0.73 1   0.15  0.50  7
 41 LYS  N      -0.47 1   0.18  0.50  7
 41 LYS  HN     -0.62 1   0.15  0.50  7
 42 GLY  N      -0.60 1   0.22  0.50  7
 42 GLY  HN     -0.58 1   0.15  0.50  7
 46 LEU  N      -1.33 1   0.74  0.50  7
 46 LEU  HN     -0.74 1   0.15  0.50  7
 67 GLN  NE2     3.55 1   0.15  0.50  7
 68 VAL  N       2.86 1   0.23  0.50  7
 68 VAL  HN      3.86 1   0.15  0.50  7
 69 LEU  N       0.66 1   0.17  0.50  7
 69 LEU  HN      0.80 1   0.15  0.50  7
 70 VAL  N       0.21 1   0.15  0.50  7
 70 VAL  HN      0.76 1   0.15  0.50  7
 71 LYS  N       0.67 1   0.15  0.50  7
 71 LYS  HN      0.77 1   0.15  0.50  7
 72 LYS  N       0.15 1   0.15  0.50  7
 72 LYS  HN      0.16 1   0.15  0.50  7
 73 ILE  N      -0.17 1   0.23  0.50  7
 73 ILE  HN     -0.04 1   0.15  0.50  7
 74 SER  N       0.16 1   0.18  0.50  7
 74 SER  HN      0.06 1   0.15  0.50  7
 75 GLN  N       0.30 1   0.15  0.50  7
 75 GLN  HN      0.15 1   0.15  0.50  7
 75 GLN  NE2     0.14 1   0.15  0.50  7
  2 SER  N       0.11 1   0.15  1.00  8
  2 SER  HN      0.06 1   0.15  1.00  8
  4 GLU  N      -0.19 1   0.15  1.00  8
  4 GLU  HN     -0.17 1   0.15  1.00  8
  5 GLU  N      -0.02 1   0.15  1.00  8
  5 GLU  HN     -0.07 1   0.15  1.00  8
  6 LEU  N       0.01 1   0.15  1.00  8
  6 LEU  HN      0.01 1   0.15  1.00  8
  7 LYS  N       0.01 1   0.15  1.00  8
  7 LYS  HN     -0.18 1   0.15  1.00  8
  8 GLY  N      -0.05 1   0.15  1.00  8
  8 GLY  HN     -0.06 1   0.15  1.00  8
  9 ILE  N       0.19 1   0.15  1.00  8
  9 ILE  HN      0.18 1   0.15  1.00  8
 10 PHE  N       0.46 1   0.15  1.00  8
 10 PHE  HN      0.29 1   0.15  1.00  8
 11 GLU  N      -0.14 1   0.26  1.00  8
 11 GLU  HN     -0.03 1   0.15  1.00  8
 12 LYS  N       0.15 1   0.15  1.00  8
 12 LYS  HN      0.19 1   0.15  1.00  8
 13 TYR  N       0.53 1   0.15  1.00  8
 13 TYR  HN      0.53 1   0.15  1.00  8
 14 ALA  N       0.60 1   0.15  1.00  8
 14 ALA  HN      0.63 1   0.15  1.00  8
 15 ALA  N       0.38 1   0.15  1.00  8
 15 ALA  HN      0.26 1   0.15  1.00  8
 16 LYS  N       0.53 1   0.45  1.00  8
 16 LYS  HN      0.36 1   0.15  1.00  8
 17 GLU  N       0.16 1   0.15  1.00  8
 17 GLU  HN      0.26 1   0.15  1.00  8
 28 LEU  N       2.13 1   0.15  1.00  8
 28 LEU  HN      2.22 1   0.15  1.00  8
 29 LYS  N       1.64 1   0.24  1.00  8
 29 LYS  HN      1.51 1   0.15  1.00  8
 30 LEU  N       1.01 1   0.15  1.00  8
 30 LEU  HN      0.97 1   0.15  1.00  8
 31 LEU  N       1.11 1   0.15  1.00  8
 31 LEU  HN      1.21 1   0.15  1.00  8
 32 LEU  N       1.27 1   0.15  1.00  8
 32 LEU  HN      1.42 1   0.15  1.00  8
 33 GLN  N       0.86 1   0.15  1.00  8
 33 GLN  HN      0.91 1   0.15  1.00  8
 33 GLN  NE2     0.31 1   0.27  1.00  8
 34 THR  N       0.62 1   0.15  1.00  8
 34 THR  HN      0.69 1   0.15  1.00  8
 35 GLU  N       0.61 1   0.15  1.00  8
 35 GLU  HN      0.70 1   0.15  1.00  8
 36 PHE  N       0.66 1   0.15  1.00  8
 36 PHE  HN      0.75 1   0.15  1.00  8
 38 SER  N       0.46 1   0.15  1.00  8
 38 SER  HN      0.56 1   0.15  1.00  8
 39 LEU  N       0.74 1   0.15  1.00  8
 39 LEU  HN      0.76 1   0.15  1.00  8
 40 LEU  N       0.85 1   0.15  1.00  8
 40 LEU  HN      0.80 1   0.15  1.00  8
 41 LYS  N       0.73 1   0.18  1.00  8
 41 LYS  HN      0.66 1   0.15  1.00  8
 42 GLY  N       0.55 1   0.22  1.00  8
 42 GLY  HN      0.54 1   0.15  1.00  8
 43 MET  N        .59 1    .29 -1.00  8
 43 MET  HN       .61 1    .15 -1.00  8
 70 VAL  N       0.87 1   0.15  1.00  8
 70 VAL  HN      1.06 1   0.15  1.00  8
 71 LYS  N       0.57 1   0.15  1.00  8
 71 LYS  HN      0.62 1   0.15  1.00  8
 72 LYS  N       0.75 1   0.15  1.00  8
 72 LYS  HN      0.85 1   0.15  1.00  8
 73 ILE  N       0.60 1   0.23  1.00  8
 73 ILE  HN      0.71 1   0.15  1.00  8
 74 SER  N       0.52 1   0.18  1.00  8
 74 SER  HN      0.47 1   0.15  1.00  8
 75 GLN  N       0.30 1   0.15  1.00  8
 75 GLN  HN      0.28 1   0.15  1.00  8
 75 GLN  NE2     0.23 1   0.15  1.00  8
  2 SER  N      -0.01 1   0.15  0.25  9
  2 SER  HN     -0.14 1   0.15  0.25  9
  4 GLU  N      -0.56 1   0.15  0.25  9
  4 GLU  HN     -0.42 1   0.15  0.25  9
  5 GLU  N      -0.33 1   0.15  0.25  9
  5 GLU  HN     -0.43 1   0.15  0.25  9
  6 LEU  N      -0.27 1   0.15  0.25  9
  6 LEU  HN     -0.38 1   0.15  0.25  9
  7 LYS  N      -0.62 1   0.15  0.25  9
  7 LYS  HN     -0.81 1   0.15  0.25  9
  8 GLY  N      -0.53 1   0.15  0.25  9
  8 GLY  HN     -0.52 1   0.15  0.25  9
  9 ILE  N      -0.05 1   0.15  0.25  9
  9 ILE  HN     -0.15 1   0.15  0.25  9
 10 PHE  N       0.17 1   0.15  0.25  9
 10 PHE  HN     -0.17 1   0.15  0.25  9
 11 GLU  N      -0.73 1   0.26  0.25  9
 11 GLU  HN     -0.76 1   0.15  0.25  9
 12 LYS  N      -0.19 1   0.15  0.25  9
 12 LYS  HN     -0.21 1   0.15  0.25  9
 13 TYR  N       0.41 1   0.15  0.25  9
 13 TYR  HN      0.32 1   0.15  0.25  9
 14 ALA  N       0.17 1   0.15  0.25  9
 14 ALA  HN      0.12 1   0.15  0.25  9
 15 ALA  N      -0.09 1   0.15  0.25  9
 15 ALA  HN     -0.28 1   0.15  0.25  9
 16 LYS  N       0.33 1   0.45  0.25  9
 16 LYS  HN     -0.04 1   0.15  0.25  9
 28 LEU  N       3.95 1   0.15  0.25  9
 28 LEU  HN      4.09 1   0.15  0.25  9
 29 LYS  N       3.50 1   0.24  0.25  9
 29 LYS  HN      3.27 1   0.15  0.25  9
 30 LEU  N       2.00 1   0.15  0.25  9
 30 LEU  HN      1.86 1   0.15  0.25  9
 31 LEU  N       2.03 1   0.15  0.25  9
 31 LEU  HN      2.10 1   0.15  0.25  9
 32 LEU  N       2.48 1   0.15  0.25  9
 32 LEU  HN      2.69 1   0.15  0.25  9
 33 GLN  N       1.80 1   0.15  0.25  9
 33 GLN  HN      1.78 1   0.15  0.25  9
 33 GLN  NE2     0.81 1   0.27  0.25  9
 34 THR  N       1.16 1   0.15  0.25  9
 34 THR  HN      1.21 1   0.15  0.25  9
 35 GLU  N       1.10 1   0.15  0.25  9
 35 GLU  HN      1.18 1   0.15  0.25  9
 36 PHE  N       1.29 1   0.15  0.25  9
 36 PHE  HN      1.36 1   0.15  0.25  9
 38 SER  N       1.08 1   0.15  0.25  9
 38 SER  HN      1.03 1   0.15  0.25  9
 39 LEU  N       1.58 1   0.15  0.25  9
 39 LEU  HN      1.49 1   0.15  0.25  9
 40 LEU  N       1.88 1   0.15  0.25  9
 40 LEU  HN      1.68 1   0.15  0.25  9
 41 LYS  N       1.52 1   0.18  0.25  9
 41 LYS  HN      1.42 1   0.15  0.25  9
 42 GLY  N       1.21 1   0.22  0.25  9
 42 GLY  HN      1.19 1   0.15  0.25  9
 43 MET  N       1.43 1    .29 -1.00  9
 43 MET  HN      1.23 1    .15 -1.00  9
 44 SER  N       2.30 1    .15 -1.00  9
 44 SER  HN      1.72 1    .15 -1.00  9
 67 GLN  NE2    -3.37 1   0.15  0.25  9
 69 LEU  N       3.34 1   0.17  0.25  9
 69 LEU  HN      3.30 1   0.15  0.25  9
 70 VAL  N       1.44 1   0.15  0.25  9
 70 VAL  HN      1.16 1   0.15  0.25  9
 71 LYS  N       0.78 1   0.15  0.25  9
 71 LYS  HN      0.73 1   0.15  0.25  9
 72 LYS  N       1.29 1   0.15  0.25  9
 72 LYS  HN      1.38 1   0.15  0.25  9
 73 ILE  N       1.14 1   0.23  0.25  9
 73 ILE  HN      1.18 1   0.15  0.25  9
 74 SER  N       0.80 1   0.18  0.25  9
 74 SER  HN      0.68 1   0.15  0.25  9
 75 GLN  N       0.46 1   0.15  0.25  9
 75 GLN  HN      0.41 1   0.15  0.25  9
 75 GLN  NE2     0.39 1   0.15  0.25  9
  2 SER  N      -0.05 1   0.15  0.10 10
  2 SER  HN     -0.02 1   0.15  0.10 10
  4 GLU  N      -0.23 1   0.15  0.10 10
  4 GLU  HN     -0.13 1   0.15  0.10 10
  5 GLU  N      -0.10 1   0.15  0.10 10
  5 GLU  HN     -0.11 1   0.15  0.10 10
  6 LEU  N      -0.11 1   0.15  0.10 10
  6 LEU  HN     -0.08 1   0.15  0.10 10
  7 LYS  N      -0.14 1   0.15  0.10 10
  7 LYS  HN     -0.16 1   0.15  0.10 10
  8 GLY  N      -0.07 1   0.15  0.10 10
  8 GLY  HN     -0.02 1   0.15  0.10 10
  9 ILE  N       0.07 1   0.15  0.10 10
  9 ILE  HN      0.08 1   0.15  0.10 10
 10 PHE  N       0.38 1   0.15  0.10 10
 10 PHE  HN      0.08 1   0.15  0.10 10
 11 GLU  N      -0.02 1   0.26  0.10 10
 11 GLU  HN      0.06 1   0.15  0.10 10
 12 LYS  N       0.17 1   0.15  0.10 10
 12 LYS  HN      0.21 1   0.15  0.10 10
 13 TYR  N       0.51 1   0.15  0.10 10
 13 TYR  HN      0.49 1   0.15  0.10 10
 14 ALA  N       0.62 1   0.15  0.10 10
 14 ALA  HN      0.64 1   0.15  0.10 10
 15 ALA  N       0.51 1   0.15  0.10 10
 15 ALA  HN      0.43 1   0.15  0.10 10
 16 LYS  N       0.69 1   0.45  0.10 10
 16 LYS  HN      0.53 1   0.15  0.10 10
 17 GLU  N       0.40 1   0.15  0.10 10
 17 GLU  HN      0.50 1   0.15  0.10 10
 18 GLY  N       0.53 1   0.56  0.10 10
 18 GLY  HN      0.26 1   0.15  0.10 10
 19 ASP  N      -0.69 1   0.41  0.10 10
 19 ASP  HN     -0.78 1   0.15  0.10 10
 21 ASN  ND2    -0.14 1   0.34  0.10 10
 24 SER  N       3.09 1   0.18  0.10 10
 24 SER  HN      2.37 1   0.15  0.10 10
 25 LYS  N       1.98 1   0.15  0.10 10
 25 LYS  HN      1.61 1   0.15  0.10 10
 26 GLU  N       0.79 1   0.22  0.10 10
 26 GLU  HN      1.19 1   0.15  0.10 10
 28 LEU  N       1.77 1   0.15  0.10 10
 28 LEU  HN      2.05 1   0.15  0.10 10
 29 LYS  N       1.28 1   0.24  0.10 10
 29 LYS  HN      1.32 1   0.15  0.10 10
 30 LEU  N       0.83 1   0.15  0.10 10
 30 LEU  HN      0.88 1   0.15  0.10 10
 31 LEU  N       0.77 1   0.15  0.10 10
 31 LEU  HN      0.90 1   0.15  0.10 10
 32 LEU  N       0.76 1   0.15  0.10 10
 32 LEU  HN      0.88 1   0.15  0.10 10
 33 GLN  N       0.53 1   0.15  0.10 10
 33 GLN  HN      0.62 1   0.15  0.10 10
 33 GLN  NE2     0.16 1   0.27  0.10 10
 34 THR  N       0.36 1   0.15  0.10 10
 34 THR  HN      0.46 1   0.15  0.10 10
 35 GLU  N       0.33 1   0.15  0.10 10
 35 GLU  HN      0.41 1   0.15  0.10 10
 36 PHE  N       0.30 1   0.15  0.10 10
 36 PHE  HN      0.40 1   0.15  0.10 10
 38 SER  N       0.18 1   0.15  0.10 10
 38 SER  HN      0.24 1   0.15  0.10 10
 39 LEU  N       0.32 1   0.15  0.10 10
 39 LEU  HN      0.34 1   0.15  0.10 10
 40 LEU  N       0.39 1   0.15  0.10 10
 40 LEU  HN      0.40 1   0.15  0.10 10
 41 LYS  N       0.34 1   0.18  0.10 10
 41 LYS  HN      0.33 1   0.15  0.10 10
 42 GLY  N       0.20 1   0.22  0.10 10
 42 GLY  HN      0.25 1   0.15  0.10 10
 43 MET  N        .70 1    .29 -1.00 10
 43 MET  HN       .73 1    .15 -1.00 10
 44 SER  N        .95 1    .15 -1.00 10
 44 SER  HN       .47 1    .15 -1.00 10
 45 THR  N       0.73 1   0.89  0.10 10
 45 THR  HN      0.60 1   0.18  0.10 10
 46 LEU  N       0.68 1   0.74  0.10 10
 46 LEU  HN      0.74 1   0.15  0.10 10
 47 ASP  N       0.64 1   0.56  0.10 10
 47 ASP  HN      0.78 1   0.15  0.10 10
 48 GLU  N       1.86 1   0.64  0.10 10
 48 GLU  HN      0.82 1   0.15  0.10 10
 49 LEU  N       1.29 1   1.08  0.10 10
 49 LEU  HN      1.42 1   0.15  0.10 10
 50 PHE  N       2.05 1   0.15  0.10 10
 50 PHE  HN      1.83 1   0.15  0.10 10
 67 GLN  N      -1.29 1   0.15  0.10 10
 67 GLN  HN     -1.93 1   0.15  0.10 10
 68 VAL  N      -0.87 1   0.23  0.10 10
 68 VAL  HN     -1.22 1   0.15  0.10 10
 69 LEU  N      -0.05 1   0.17  0.10 10
 69 LEU  HN     -0.13 1   0.15  0.10 10
 70 VAL  N      -0.11 1   0.15  0.10 10
 70 VAL  HN     -0.15 1   0.15  0.10 10
 71 LYS  N      -0.23 1   0.15  0.10 10
 71 LYS  HN     -0.23 1   0.15  0.10 10
 72 LYS  N      -0.05 1   0.15  0.10 10
 72 LYS  HN     -0.04 1   0.15  0.10 10
 73 ILE  N      -0.06 1   0.23  0.10 10
 73 ILE  HN      0.04 1   0.15  0.10 10
 74 SER  N       0.00 1   0.18  0.10 10
 74 SER  HN      0.01 1   0.15  0.10 10
 75 GLN  N      -0.10 1   0.15  0.10 10
 75 GLN  HN     -0.04 1   0.15  0.10 10
 75 GLN  NE2    -0.03 1   0.15  0.10 10
  1 LYS  N       0.00 1   0.15  0.10 11
  1 LYS  HN     -0.02 1   0.15  0.10 11
  2 SER  N       0.00 1   0.15  0.10 11
  2 SER  HN      0.00 1   0.15  0.10 11
  4 GLU  N       0.00 1   0.15  0.10 11
  4 GLU  HN      0.00 1   0.15  0.10 11
  5 GLU  N       0.00 1   0.15  0.10 11
  5 GLU  HN     -0.01 1   0.15  0.10 11
  6 LEU  N       0.00 1   0.15  0.10 11
  6 LEU  HN      0.00 1   0.15  0.10 11
  7 LYS  N       0.00 1   0.15  0.10 11
  7 LYS  HN      0.00 1   0.15  0.10 11
  8 GLY  N       0.00 1   0.15  0.10 11
  8 GLY  HN      0.00 1   0.15  0.10 11
  9 ILE  N      -0.03 1   0.15  0.10 11
  9 ILE  HN     -0.02 1   0.15  0.10 11
 10 PHE  N      -0.02 1   0.15  0.10 11
 10 PHE  HN     -0.01 1   0.15  0.10 11
 11 GLU  N       0.00 1   0.26  0.10 11
 11 GLU  HN      0.00 1   0.15  0.10 11
 12 LYS  N       0.00 1   0.15  0.10 11
 12 LYS  HN      0.00 1   0.15  0.10 11
 13 TYR  N      -0.04 1   0.15  0.10 11
 13 TYR  HN     -0.02 1   0.15  0.10 11
 14 ALA  N       0.00 1   0.15  0.10 11
 14 ALA  HN      0.00 1   0.15  0.10 11
 15 ALA  N      -0.06 1   0.15  0.10 11
 15 ALA  HN     -0.01 1   0.15  0.10 11
 16 LYS  N      -0.04 1   0.45  0.10 11
 16 LYS  HN     -0.02 1   0.15  0.10 11
 17 GLU  N       0.05 1   0.15  0.10 11
 17 GLU  HN     -0.02 1   0.15  0.10 11
 18 GLY  N      -0.10 1   0.56  0.10 11
 18 GLY  HN     -0.02 1   0.15  0.10 11
 19 ASP  N      -0.01 1   0.41  0.10 11
 19 ASP  HN      0.07 1   0.15  0.10 11
 21 ASN  N       0.00 1   0.81  0.10 11
 21 ASN  HN      0.00 1   0.19  0.10 11
 21 ASN  ND2     0.00 1   0.34  0.10 11
 22 GLN  N       0.03 1   0.15  0.10 11
 22 GLN  HN     -0.04 1   0.15  0.10 11
 22 GLN  NE2    -0.08 1   1.16  0.10 11
 23 LEU  N      -0.12 1   0.46  0.10 11
 23 LEU  HN     -0.21 1   0.15  0.10 11
 24 SER  N      -0.11 1   0.18  0.10 11
 24 SER  HN     -0.06 1   0.15  0.10 11
 25 LYS  N      -0.09 1   0.15  0.10 11
 25 LYS  HN      0.03 1   0.15  0.10 11
 26 GLU  N       0.15 1   0.22  0.10 11
 26 GLU  HN     -0.01 1   0.15  0.10 11
 27 GLU  N       0.06 1   0.15  0.10 11
 27 GLU  HN     -0.01 1   0.15  0.10 11
 28 LEU  N      -0.08 1   0.15  0.10 11
 28 LEU  HN     -0.07 1   0.15  0.10 11
 29 LYS  N      -0.08 1   0.24  0.10 11
 29 LYS  HN     -0.02 1   0.15  0.10 11
 30 LEU  N      -0.03 1   0.15  0.10 11
 30 LEU  HN     -0.03 1   0.15  0.10 11
 31 LEU  N      -0.04 1   0.15  0.10 11
 31 LEU  HN     -0.05 1   0.15  0.10 11
 32 LEU  N      -0.03 1   0.15  0.10 11
 32 LEU  HN     -0.05 1   0.15  0.10 11
 33 GLN  N       0.00 1   0.15  0.10 11
 33 GLN  HN     -0.03 1   0.15  0.10 11
 33 GLN  NE2     0.02 1   0.27  0.10 11
 34 THR  N       0.03 1   0.15  0.10 11
 34 THR  HN     -0.03 1   0.15  0.10 11
 35 GLU  N       0.00 1   0.15  0.10 11
 35 GLU  HN      0.00 1   0.15  0.10 11
 36 PHE  N      -0.02 1   0.15  0.10 11
 36 PHE  HN     -0.02 1   0.15  0.10 11
 38 SER  N       0.05 1   0.15  0.10 11
 38 SER  HN     -0.01 1   0.15  0.10 11
 39 LEU  N      -0.04 1   0.15  0.10 11
 39 LEU  HN     -0.03 1   0.15  0.10 11
 40 LEU  N       0.05 1   0.15  0.10 11
 40 LEU  HN     -0.02 1   0.15  0.10 11
 41 LYS  N       0.00 1   0.18  0.10 11
 41 LYS  HN      0.00 1   0.15  0.10 11
 42 GLY  N       0.08 1   0.22  0.10 11
 42 GLY  HN      0.01 1   0.15  0.10 11
 43 MET  N        .53 1    .29 -1.00 11
 43 MET  HN       .05 1    .15 -1.00 11
 44 SER  N        .24 1    .15 -1.00 11
 44 SER  HN       .02 1    .15 -1.00 11
 45 THR  N      -0.33 1   0.89  0.10 11
 45 THR  HN     -0.07 1   0.18  0.10 11
 46 LEU  N       0.32 1   0.74  0.10 11
 46 LEU  HN     -0.03 1   0.15  0.10 11
 47 ASP  N      -0.18 1   0.56  0.10 11
 47 ASP  HN      0.09 1   0.15  0.10 11
 48 GLU  N       0.00 1   0.64  0.10 11
 48 GLU  HN      0.00 1   0.15  0.10 11
 49 LEU  N       0.57 1   1.08  0.10 11
 49 LEU  HN     -0.02 1   0.15  0.10 11
 50 PHE  N       0.12 1   0.15  0.10 11
 50 PHE  HN     -0.09 1   0.15  0.10 11
 51 GLU  N       0.33 1   0.15  0.10 11
 51 GLU  HN      0.12 1   0.15  0.10 11
 52 GLU  N       0.11 1   0.15  0.10 11
 52 GLU  HN     -0.05 1   0.15  0.10 11
 53 LEU  N       0.36 1   0.93  0.10 11
 53 LEU  HN     -0.16 1   0.15  0.10 11
 55 LYS  N       0.49 1   2.32  0.10 11
 55 LYS  HN     -0.47 1   0.34  0.10 11
 59 GLY  N       1.74 1   0.25  0.10 11
 59 GLY  HN      2.21 1   0.15  0.10 11
 60 GLU  N      -0.17 1   0.69  0.10 11
 60 GLU  HN     -0.04 1   0.15  0.10 11
 61 VAL  N       -.88 1   2.18 -1.00 11
 61 VAL  HN      -.70 1    .24 -1.00 11
 62 SER  N       0.02 1   0.15  0.10 11
 62 SER  HN      0.30 1   0.22  0.10 11
 63 PHE  N       0.18 1   0.22  0.10 11
 63 PHE  HN      0.16 1   0.15  0.10 11
 64 GLU  N      -0.04 1   0.15  0.10 11
 64 GLU  HN      0.27 1   0.15  0.10 11
 65 GLU  N       0.07 1   0.24  0.10 11
 65 GLU  HN      0.01 1   0.15  0.10 11
 66 PHE  N       0.14 1   0.27  0.10 11
 66 PHE  HN     -0.03 1   0.15  0.10 11
 67 GLN  N      -0.01 1   0.15  0.10 11
 67 GLN  HN      0.07 1   0.15  0.10 11
 67 GLN  NE2     0.01 1   0.15  0.10 11
 68 VAL  N      -0.20 1   0.23  0.10 11
 68 VAL  HN     -0.02 1   0.15  0.10 11
 69 LEU  N       0.03 1   0.17  0.10 11
 69 LEU  HN      0.01 1   0.15  0.10 11
 70 VAL  N      -0.24 1   0.15  0.10 11
 70 VAL  HN     -0.03 1   0.15  0.10 11
 71 LYS  N       0.05 1   0.15  0.10 11
 71 LYS  HN     -0.01 1   0.15  0.10 11
 72 LYS  N       0.00 1   0.15  0.10 11
 72 LYS  HN      0.00 1   0.15  0.10 11
 73 ILE  N       0.05 1   0.23  0.10 11
 73 ILE  HN     -0.02 1   0.15  0.10 11
 74 SER  N      -0.02 1   0.18  0.10 11
 74 SER  HN     -0.01 1   0.15  0.10 11
 75 GLN  N       0.00 1   0.15  0.10 11
 75 GLN  HN      0.00 1   0.15  0.10 11
 75 GLN  NE2     0.00 1   0.15  0.10 11
105 LTNS PCN
115 LTNS PCN  
125 LTNS PCN   
135 LTNS PCN  
145 LTNS PCN  
155 LTNS PCN  
165 LTNS PCN  
175 LTNS PCN  
185 LTNS PCN  
195 LTNS PCN  
205 LTNS PCN  
#
Residual Dipolar Couplings from Cerium

  2 SER  HN       0.31  0.05  0.40  
  4 GLU- HN      -0.66  0.05  0.40  
  5 GLU- HN      -0.23  0.05  0.40  
  6 LEU  HN      -0.77  0.05  0.40  
  7 LYS+ HN      -1.06  0.05  0.40  
  8 GLY  HN      -0.82  0.05  0.40  
  9 ILE  HN      -0.65  0.05  0.40  
 10 PHE  HN      -1.16  0.05  0.40  
 11 GLU- HN      -1.26  0.05  0.40  
 12 LYS+ HN      -0.53  0.05  0.40  
 13 TYR  HN      -0.61  0.05  0.40  
 14 ALA  HN      -1.16  0.05  0.40  
 15 ALA  HN      -0.30  0.05  0.40 
 16 LYS+ HN      -0.13  0.05  0.40  
 17 GLU- HN       0.02  0.05  0.40  
 18 GLY  HN      -0.12  0.05  0.40  
 19 ASP- HN       0.15  0.05  0.40  
 21 ASN  HN      -0.15  0.05  0.40  
 22 GLN  HN       0.22  0.05  0.40  
 23 LEU  HN      -0.07  0.05  0.40  
 24 SER  HN       0.46  0.05  0.40  
 25 LYS+ HN      -0.13  0.05  0.40  
 26 GLU- HN       0.17  0.05  0.40  
 27 GLU- HN       0.60  0.05  0.40  
 28 LEU  HN       0.05  0.05  0.40  
 29 LYS+ HN      -0.18  0.05  0.40  
 30 LEU  HN       0.29  0.05  0.40  
 31 LEU  HN       0.21  0.05  0.40  
 32 LEU  HN       0.01  0.05  0.40  
 33 GLN  HN       0.14  0.05  0.40  
 34 THR  HN       0.33  0.05  0.40  
 35 GLU- HN       0.08  0.05  0.40  
 36 PHE  HN      -1.01  0.05  0.40  
 38 SER  HN      -0.50  0.05  0.40  
 39 LEU  HN       0.41  0.05  0.40  
 40 LEU  HN       0.33  0.05  0.40  
 41 LYS+ HN      -0.49  0.05  0.40  
 42 GLY  HN      -0.39  0.05  0.40  
 43 MET  HN      -0.91  0.05  0.40  
 44 SER  HN      -0.28  0.05  0.40  
 45 THR  HN       0.38  0.05  0.40  
 46 LEU  HN      -0.41  0.05  0.40  
 47 ASP- HN      -0.41  0.05  0.40  
 48 GLU- HN       0.19  0.05  0.40  
 49 LEU  HN       0.20  0.05  0.40  
 50 PHE  HN      -0.74  0.05  0.40  
 51 GLU- HN      -0.27  0.05  0.40  
 52 GLU- HN       0.23  0.05  0.40  
 53 LEU  HN      -0.28  0.05  0.40  
 54 ASP- HN      -0.63  0.05  0.40  
 61 VAL  HN      -0.08  0.05  0.40  
 63 PHE  HN       0.31  0.05  0.40  
 64 GLU- HN       0.14  0.05  0.40  
 65 GLU- HN       0.04  0.05  0.40  
 66 PHE  HN       0.27  0.05  0.40  
 67 GLN  HN       0.38  0.05  0.40  
 68 VAL  HN      -0.29  0.05  0.40  
 69 LEU  HN       0.37  0.05  0.40  
 70 VAL  HN       0.41  0.05  0.40  
 71 LYS+ HN      -0.12  0.05  0.40  
 72 LYS+ HN       0.10  0.05  0.40  
 73 ILE  HN       0.20  0.05  0.40  
 74 SER  HN       0.18  0.05  0.40  
 75 GLN  HN      -0.17  0.55  0.40  
105 LTNS 
#
Relaxation rates as upper limit constraints

 22 GLN
         HB2   105 LTNS ME      7.02
 54 ASP-
         HA    105 LTNS ME      4.49
         CG    105 LTNS ME      4.23
 56 ASN  
         HB2   105 LTNS ME      7.01
         HD22  105 LTNS ME      4.97
         CG    105 LTNS ME      3.52
 57 GLY 
         HA1   105 LTNS ME      5.79
 58 ASP-
         HN    105 LTNS ME      4.13
         HB2   105 LTNS ME      5.98
         HB3   105 LTNS ME      6.67
 59 GLY 
         HN    105 LTNS ME      4.33
         HA1   105 LTNS ME      6.88
 60 GLU-
         HN    105 LTNS ME      3.30
         HA    105 LTNS ME      6.69
 61 VAL
         HA    105 LTNS ME      4.70
         QG1   105 LTNS ME      7.00
         QG2   105 LTNS ME      6.25 
         CA    105 LTNS ME      4.78
 62 SER 
         HB2   105 LTNS ME      6.37
 64 GLU
         HB2   105 LTNS ME      7.09
         HB3   105 LTNS ME      7.64
         HG2   105 LTNS ME      6.25
 65 GLU
         HA    105 LTNS ME      6.77
         HG2   105 LTNS ME      6.25
         HG3   105 LTNS ME      4.98
         CG    105 LTNS ME      4.15
#
Dihedral angles

atom stereo HA1 18 
atom stereo HB3 2
atom stereo HB2 4 
atom stereo HB2 6
atom stereo HB2 7
atom stereo HB2 10
atom stereo HB2 11
atom stereo HB2 12
atom stereo HB2 13
atom stereo HB2 16
atom stereo HB2 17 
atom stereo HB2 19
atom stereo HB2 20
atom stereo HB2 21
atom stereo HB2 22
atom stereo HB2 23 
atom stereo HB2 24
atom stereo HB2 25
atom stereo HB2 26
atom stereo HB2 27
atom stereo HB3 28
atom stereo HB2 29
atom stereo HB2 30
atom stereo HB2 31
atom stereo HB2 32
atom stereo HB2 33
atom stereo HB2 36
atom stereo HB2 38
atom stereo HB2 39
atom stereo HB2 40
atom stereo HB2 43
atom stereo HB2 44
atom stereo HB2 46
atom stereo HB2 47
atom stereo HB3 48
atom stereo HB2 49
atom stereo HB2 50
atom stereo HB2 53
atom stereo HB2 54
atom stereo HB2 63
atom stereo HB2 64
atom stereo HB2 65
atom stereo HB2 66
atom stereo HB2 67
atom stereo HB2 71 
atom stereo HB2 75 
atom stereo HG2 4
atom stereo HG2 5
atom stereo HG2 11
atom stereo HG2 16 
atom stereo HG2 17
atom stereo HG2 22
atom stereo HG2 25
atom stereo HG2 26
atom stereo HG2 29
atom stereo HG2 33
atom stereo HG2 41
atom stereo HG2 48
atom stereo HG2 51
atom stereo HG2 52
atom stereo HG2 64
atom stereo HG2 65
atom stereo HG2 67
atom stereo HG2 71
atom stereo HG2 72
atom stereo HD2 12
atom stereo HD2 72
atom stereo HG12 9
atom stereo HG12 73 
atom stereo QG1 61
atom stereo QG1 68
atom stereo QG1 70 
atom stereo QD1 6
atom stereo QD1 23
atom stereo QD1 30
atom stereo QD1 31
atom stereo QD1 32
atom stereo QD1 40
atom stereo QD1 49
atom stereo QD1 53
atom stereo QD1 69
atom stereo HD21 21
atom stereo HE21 22
atom stereo HE21 33
atom stereo HE21 67
atom stereo HE21 75 
#
Hydrogen bonds as lower limits constraints

  6 LEU
         N       3 PRO  O       2.60
  9 ILE
         N       5 GLU  O       2.60
 10 PHE
         N       6 LEU  O       2.60
 13 TYR 
         N      10 PHE  O       2.60
 14 ALA
         N      10 PHE  O       2.60
 15 ALA
         N      11 GLU  O       2.60
 17 GLU 
         N      27 GLU  OE2     2.60
 21 ASN
         N      19 ASP  OD1     2.60
 28 LEU 
         N      24 SER  O       2.60
 32 LEU 
         N      28 LEU  O       2.60
 35 GLU
         N      31 LEU  O       2.60
 41 LYS
         N      38 SER  O       2.60
 49 LEU  
         N      45 THR  O       2.60
 53 LEU
         N      49 LEU  O       2.60
 75 GLN
         N      71 LYS  O       2.60
#




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   1.367  -0.202  -2.051
    3   1HB   LYS   1          2HB       LYS   1   2.922   1.861  -0.561
    4   2HB   LYS   1          3HB       LYS   1   3.609   1.275  -2.062
    5   1HG   LYS   1          2HG       LYS   1   0.784   1.713  -2.488
    6   2HG   LYS   1          3HG       LYS   1   1.438   3.136  -1.702
    7   1HD   LYS   1          2HD       LYS   1   3.066   1.981  -3.946
    8   2HD   LYS   1          3HD       LYS   1   1.555   2.748  -4.392
    9   1HE   LYS   1          2HE       LYS   1   2.821   4.666  -4.391
   10   2HE   LYS   1          3HE       LYS   1   2.515   4.638  -2.666
   11   1HZ   LYS   1          1HZ       LYS   1   4.581   3.713  -2.266
   12   2HZ   LYS   1          2HZ       LYS   1   4.803   3.217  -3.806
   13   3HZ   LYS   1          3HZ       LYS   1   4.894   4.805  -3.439
   14    H    SER   2           HN       SER   2   3.727  -0.567   0.667
   15    HA   SER   2           HA       SER   2   5.551  -2.060  -0.757
   16   1HB   SER   2          2HB       SER   2   5.137  -1.221   1.953
   17   2HB   SER   2          3HB       SER   2   5.451  -2.945   1.998
   18    HG   SER   2           HG       SER   2   7.279  -1.083   1.844
   19    HA   PRO   3           HA       PRO   3   3.932  -6.112  -0.728
   20   1HB   PRO   3          2HB       PRO   3   5.904  -7.758   0.204
   21   2HB   PRO   3          3HB       PRO   3   5.893  -7.100  -1.420
   22   1HG   PRO   3          2HG       PRO   3   7.553  -6.302   0.892
   23   2HG   PRO   3          3HG       PRO   3   7.809  -5.970  -0.810
   24   1HD   PRO   3          2HD       PRO   3   6.819  -4.141   1.166
   25   2HD   PRO   3          3HD       PRO   3   6.966  -3.846  -0.555
   26    H    GLU   4           HN       GLU   4   5.323  -5.318   2.372
   27    HA   GLU   4           HA       GLU   4   4.201  -7.322   3.831
   28   1HB   GLU   4          2HB       GLU   4   5.629  -4.975   4.347
   29   2HB   GLU   4          3HB       GLU   4   4.119  -4.706   5.196
   30   1HG   GLU   4          2HG       GLU   4   5.212  -7.445   5.554
   31   2HG   GLU   4          3HG       GLU   4   6.264  -6.186   6.168
   32    H    GLU   5           HN       GLU   5   2.781  -4.125   2.896
   33    HA   GLU   5           HA       GLU   5   0.396  -4.566   4.290
   34   1HB   GLU   5          2HB       GLU   5   1.500  -2.565   2.413
   35   2HB   GLU   5          3HB       GLU   5  -0.233  -2.766   2.258
   36   1HG   GLU   5          2HG       GLU   5   0.171  -2.735   5.041
   37   2HG   GLU   5          3HG       GLU   5   1.319  -1.549   4.451
   38    H    LEU   6           HN       LEU   6   1.611  -5.517   1.102
   39    HA   LEU   6           HA       LEU   6  -0.874  -6.016  -0.106
   40   1HB   LEU   6          2HB       LEU   6   1.969  -6.765  -0.596
   41   2HB   LEU   6          3HB       LEU   6   0.723  -7.679  -1.424
   42    HG   LEU   6           HG       LEU   6   0.962  -4.662  -1.546
   43   1HD1  LEU   6          1HD1      LEU   6   2.941  -5.451  -2.557
   44   2HD1  LEU   6          2HD1      LEU   6   2.095  -6.798  -3.356
   45   3HD1  LEU   6          3HD1      LEU   6   1.814  -5.125  -3.896
   46   1HD2  LEU   6          1HD2      LEU   6  -1.211  -5.045  -2.151
   47   2HD2  LEU   6          2HD2      LEU   6  -0.409  -5.235  -3.728
   48   3HD2  LEU   6          3HD2      LEU   6  -0.870  -6.673  -2.786
   49    H    LYS   7           HN       LYS   7   1.321  -7.978   1.962
   50    HA   LYS   7           HA       LYS   7  -0.056 -10.390   1.644
   51   1HB   LYS   7          2HB       LYS   7   2.284  -9.685   2.757
   52   2HB   LYS   7          3HB       LYS   7   1.323  -9.786   4.218
   53   1HG   LYS   7          2HG       LYS   7   1.228 -12.016   2.155
   54   2HG   LYS   7          3HG       LYS   7   2.521 -11.953   3.337
   55   1HD   LYS   7          2HD       LYS   7  -0.438 -11.886   4.087
   56   2HD   LYS   7          3HD       LYS   7   0.501 -13.364   4.013
   57   1HE   LYS   7          2HE       LYS   7   1.194 -12.981   6.138
   58   2HE   LYS   7          3HE       LYS   7   2.071 -11.576   5.566
   59   1HZ   LYS   7          1HZ       LYS   7   0.600 -10.814   7.174
   60   2HZ   LYS   7          2HZ       LYS   7  -0.106 -10.380   5.767
   61   3HZ   LYS   7          3HZ       LYS   7  -0.667 -11.669   6.598
   62    H    GLY   8           HN       GLY   8  -0.302  -7.798   4.171
   63   1HA   GLY   8          1HA       GLY   8  -2.306  -8.975   5.697
   64   2HA   GLY   8          2HA       GLY   8  -1.975  -7.259   5.569
   65    H    ILE   9           HN       ILE   9  -2.621  -6.469   3.071
   66    HA   ILE   9           HA       ILE   9  -5.376  -6.371   3.085
   67    HB   ILE   9           HB       ILE   9  -3.222  -5.714   1.137
   68   1HG1  ILE   9          2HG1      ILE   9  -5.421  -4.140   2.507
   69   2HG1  ILE   9          3HG1      ILE   9  -3.721  -4.157   2.933
   70   1HG2  ILE   9          1HG2      ILE   9  -6.068  -6.211   0.422
   71   2HG2  ILE   9          2HG2      ILE   9  -5.297  -4.750  -0.242
   72   3HG2  ILE   9          3HG2      ILE   9  -4.589  -6.352  -0.559
   73   1HD1  ILE   9          1HD1      ILE   9  -5.102  -2.683   0.778
   74   2HD1  ILE   9          2HD1      ILE   9  -3.536  -2.351   1.557
   75   3HD1  ILE   9          3HD1      ILE   9  -3.635  -3.525   0.222
   76    H    PHE  10           HN       PHE  10  -3.144  -8.502   1.196
   77    HA   PHE  10           HA       PHE  10  -4.992  -9.760  -0.367
   78   1HB   PHE  10          2HB       PHE  10  -2.675 -10.273  -0.688
   79   2HB   PHE  10          3HB       PHE  10  -2.387 -10.470   1.029
   80    HD1  PHE  10           HD1      PHE  10  -2.990 -12.578   2.155
   81    HD2  PHE  10           HD2      PHE  10  -3.420 -12.115  -2.041
   82    HE1  PHE  10           HE1      PHE  10  -3.163 -15.069   1.898
   83    HE2  PHE  10           HE2      PHE  10  -3.593 -14.606  -2.298
   84    HZ   PHE  10           HZ       PHE  10  -3.462 -16.053  -0.325
   85    H    GLU  11           HN       GLU  11  -3.858 -10.799   2.931
   86    HA   GLU  11           HA       GLU  11  -5.572 -12.965   3.068
   87   1HB   GLU  11          2HB       GLU  11  -3.575 -11.801   4.674
   88   2HB   GLU  11          3HB       GLU  11  -5.009 -11.744   5.679
   89   1HG   GLU  11          2HG       GLU  11  -5.051 -14.311   4.445
   90   2HG   GLU  11          3HG       GLU  11  -3.386 -14.052   4.924
   91    H    LYS  12           HN       LYS  12  -5.990  -9.503   3.876
   92    HA   LYS  12           HA       LYS  12  -8.329  -9.732   5.363
   93   1HB   LYS  12          2HB       LYS  12  -6.661  -7.712   4.709
   94   2HB   LYS  12          3HB       LYS  12  -7.973  -7.360   3.603
   95   1HG   LYS  12          2HG       LYS  12  -9.565  -7.621   5.629
   96   2HG   LYS  12          3HG       LYS  12  -8.131  -7.617   6.635
   97   1HD   LYS  12          2HD       LYS  12  -7.479  -5.400   5.495
   98   2HD   LYS  12          3HD       LYS  12  -9.078  -5.390   4.779
   99   1HE   LYS  12          2HE       LYS  12  -9.745  -4.317   6.679
  100   2HE   LYS  12          3HE       LYS  12  -9.670  -5.891   7.446
  101   1HZ   LYS  12          1HZ       LYS  12  -7.162  -4.508   7.254
  102   2HZ   LYS  12          2HZ       LYS  12  -8.261  -3.806   8.236
  103   3HZ   LYS  12          3HZ       LYS  12  -7.797  -5.348   8.502
  104    H    TYR  13           HN       TYR  13  -7.681 -10.038   1.905
  105    HA   TYR  13           HA       TYR  13 -10.532  -9.882   1.309
  106   1HB   TYR  13          2HB       TYR  13  -7.843  -9.809  -0.079
  107   2HB   TYR  13          3HB       TYR  13  -9.146 -10.510  -1.017
  108    HD1  TYR  13           HD1      TYR  13 -10.858  -9.142  -1.991
  109    HD2  TYR  13           HD2      TYR  13  -8.009  -7.426   0.700
  110    HE1  TYR  13           HE1      TYR  13 -11.623  -6.811  -2.656
  111    HE2  TYR  13           HE2      TYR  13  -8.784  -5.100   0.026
  112    HH   TYR  13           HH       TYR  13 -11.293  -4.686  -2.456
  113    H    ALA  14           HN       ALA  14  -7.753 -12.172   1.330
  114    HA   ALA  14           HA       ALA  14  -9.154 -14.290   0.115
  115   1HB   ALA  14          1HB       ALA  14  -6.576 -13.806   0.631
  116   2HB   ALA  14          2HB       ALA  14  -6.938 -14.779   2.077
  117   3HB   ALA  14          3HB       ALA  14  -7.197 -15.465   0.455
  118    H    ALA  15           HN       ALA  15  -9.122 -12.904   3.353
  119    HA   ALA  15           HA       ALA  15 -10.223 -15.277   4.566
  120   1HB   ALA  15          1HB       ALA  15  -8.649 -13.510   5.624
  121   2HB   ALA  15          2HB       ALA  15 -10.107 -12.498   5.765
  122   3HB   ALA  15          3HB       ALA  15 -10.035 -14.073   6.590
  123    H    LYS  16           HN       LYS  16 -11.328 -12.478   2.799
  124    HA   LYS  16           HA       LYS  16 -13.805 -12.050   3.935
  125   1HB   LYS  16          2HB       LYS  16 -12.369 -11.129   1.729
  126   2HB   LYS  16          3HB       LYS  16 -13.805 -11.842   1.022
  127   1HG   LYS  16          2HG       LYS  16 -15.154 -10.539   2.816
  128   2HG   LYS  16          3HG       LYS  16 -13.672  -9.663   3.147
  129   1HD   LYS  16          2HD       LYS  16 -13.689  -8.557   1.094
  130   2HD   LYS  16          3HD       LYS  16 -14.497  -9.872   0.264
  131   1HE   LYS  16          2HE       LYS  16 -16.058  -8.454   2.412
  132   2HE   LYS  16          3HE       LYS  16 -15.768  -7.570   0.927
  133   1HZ   LYS  16          1HZ       LYS  16 -16.794  -9.282  -0.304
  134   2HZ   LYS  16          2HZ       LYS  16 -16.876 -10.288   0.980
  135   3HZ   LYS  16          3HZ       LYS  16 -17.798  -8.940   0.938
  136    H    GLU  17           HN       GLU  17 -13.141 -14.067   0.980
  137    HA   GLU  17           HA       GLU  17 -15.420 -15.678   1.834
  138   1HB   GLU  17          2HB       GLU  17 -14.489 -14.809  -0.914
  139   2HB   GLU  17          3HB       GLU  17 -15.442 -16.269  -0.737
  140   1HG   GLU  17          2HG       GLU  17 -16.790 -14.358   0.854
  141   2HG   GLU  17          3HG       GLU  17 -16.295 -13.464  -0.569
  142    H    GLY  18           HN       GLY  18 -15.066 -17.850   2.185
  143   1HA   GLY  18          1HA       GLY  18 -14.003 -19.828   2.289
  144   2HA   GLY  18          2HA       GLY  18 -13.148 -19.392   0.822
  145    H    ASP  19           HN       ASP  19 -11.565 -20.801   2.352
  146    HA   ASP  19           HA       ASP  19 -10.386 -19.624   4.519
  147   1HB   ASP  19          2HB       ASP  19 -10.098 -21.992   3.289
  148   2HB   ASP  19          3HB       ASP  19  -8.720 -21.200   2.550
  149    HA   PRO  20           HA       PRO  20  -8.050 -16.453   2.559
  150   1HB   PRO  20          2HB       PRO  20  -6.469 -15.694   4.654
  151   2HB   PRO  20          3HB       PRO  20  -8.116 -15.133   4.444
  152   1HG   PRO  20          2HG       PRO  20  -7.071 -17.140   6.346
  153   2HG   PRO  20          3HG       PRO  20  -8.588 -16.265   6.397
  154   1HD   PRO  20          2HD       PRO  20  -8.207 -18.997   5.611
  155   2HD   PRO  20          3HD       PRO  20  -9.705 -18.089   5.552
  156    H    ASN  21           HN       ASN  21  -6.962 -19.432   3.242
  157    HA   ASN  21           HA       ASN  21  -4.213 -18.827   2.691
  158   1HB   ASN  21          2HB       ASN  21  -5.792 -21.353   3.310
  159   2HB   ASN  21          3HB       ASN  21  -4.164 -21.485   2.675
  160   1HD2  ASN  21          1HD2      ASN  21  -6.002 -19.649   5.113
  161   2HD2  ASN  21          2HD2      ASN  21  -4.820 -19.718   6.378
  162    H    GLN  22           HN       GLN  22  -7.067 -19.126   0.924
  163    HA   GLN  22           HA       GLN  22  -5.569 -19.755  -1.457
  164   1HB   GLN  22          2HB       GLN  22  -7.749 -21.188  -2.104
  165   2HB   GLN  22          3HB       GLN  22  -6.360 -21.914  -1.320
  166   1HG   GLN  22          2HG       GLN  22  -7.475 -21.457   0.926
  167   2HG   GLN  22          3HG       GLN  22  -8.897 -20.915   0.056
  168   1HE2  GLN  22          1HE2      GLN  22  -7.698 -23.406   1.685
  169   2HE2  GLN  22          2HE2      GLN  22  -8.464 -24.758   0.919
  170    H    LEU  23           HN       LEU  23  -6.064 -18.271  -3.022
  171    HA   LEU  23           HA       LEU  23  -8.258 -16.477  -2.507
  172   1HB   LEU  23          2HB       LEU  23  -5.926 -16.569  -4.377
  173   2HB   LEU  23          3HB       LEU  23  -7.283 -15.528  -4.756
  174    HG   LEU  23           HG       LEU  23  -5.253 -14.568  -3.463
  175   1HD1  LEU  23          1HD1      LEU  23  -7.541 -13.686  -1.910
  176   2HD1  LEU  23          2HD1      LEU  23  -6.589 -12.821  -3.140
  177   3HD1  LEU  23          3HD1      LEU  23  -7.946 -13.861  -3.634
  178   1HD2  LEU  23          1HD2      LEU  23  -4.897 -16.066  -1.713
  179   2HD2  LEU  23          2HD2      LEU  23  -5.716 -14.692  -0.932
  180   3HD2  LEU  23          3HD2      LEU  23  -6.629 -16.171  -1.316
  181    H    SER  24           HN       SER  24  -9.790 -15.886  -4.326
  182    HA   SER  24           HA       SER  24 -10.305 -18.177  -6.030
  183   1HB   SER  24          2HB       SER  24 -12.366 -16.801  -4.251
  184   2HB   SER  24          3HB       SER  24 -12.775 -17.935  -5.523
  185    HG   SER  24           HG       SER  24 -12.104 -18.499  -2.987
  186    H    LYS  25           HN       LYS  25 -12.028 -17.550  -7.773
  187    HA   LYS  25           HA       LYS  25 -11.126 -15.326  -9.146
  188   1HB   LYS  25          2HB       LYS  25 -12.304 -17.341 -10.077
  189   2HB   LYS  25          3HB       LYS  25 -13.811 -16.697  -9.458
  190   1HG   LYS  25          2HG       LYS  25 -13.221 -14.521 -10.766
  191   2HG   LYS  25          3HG       LYS  25 -11.995 -15.477 -11.575
  192   1HD   LYS  25          2HD       LYS  25 -13.805 -15.759 -13.032
  193   2HD   LYS  25          3HD       LYS  25 -13.974 -17.179 -12.018
  194   1HE   LYS  25          2HE       LYS  25 -15.906 -16.410 -11.023
  195   2HE   LYS  25          3HE       LYS  25 -15.343 -14.752 -10.960
  196   1HZ   LYS  25          1HZ       LYS  25 -16.327 -14.316 -12.878
  197   2HZ   LYS  25          2HZ       LYS  25 -15.774 -15.664 -13.615
  198   3HZ   LYS  25          3HZ       LYS  25 -17.132 -15.727 -12.710
  199    H    GLU  26           HN       GLU  26 -14.263 -15.743  -7.353
  200    HA   GLU  26           HA       GLU  26 -15.049 -13.125  -7.673
  201   1HB   GLU  26          2HB       GLU  26 -15.823 -15.440  -6.000
  202   2HB   GLU  26          3HB       GLU  26 -16.181 -13.897  -5.249
  203   1HG   GLU  26          2HG       GLU  26 -18.042 -14.813  -6.722
  204   2HG   GLU  26          3HG       GLU  26 -17.535 -13.184  -7.120
  205    H    GLU  27           HN       GLU  27 -13.073 -14.712  -5.109
  206    HA   GLU  27           HA       GLU  27 -12.998 -12.560  -3.386
  207   1HB   GLU  27          2HB       GLU  27 -11.438 -15.057  -3.817
  208   2HB   GLU  27          3HB       GLU  27 -10.565 -13.791  -2.976
  209   1HG   GLU  27          2HG       GLU  27 -12.898 -13.618  -1.613
  210   2HG   GLU  27          3HG       GLU  27 -13.034 -15.289  -2.125
  211    H    LEU  28           HN       LEU  28 -10.619 -13.574  -5.945
  212    HA   LEU  28           HA       LEU  28  -8.908 -11.410  -5.600
  213   1HB   LEU  28          2HB       LEU  28  -8.700 -13.660  -6.906
  214   2HB   LEU  28          3HB       LEU  28  -9.340 -12.737  -8.252
  215    HG   LEU  28           HG       LEU  28  -7.431 -11.534  -8.539
  216   1HD1  LEU  28          1HD1      LEU  28  -5.801 -11.015  -6.698
  217   2HD1  LEU  28          2HD1      LEU  28  -7.428 -10.325  -6.486
  218   3HD1  LEU  28          3HD1      LEU  28  -6.946 -11.767  -5.561
  219   1HD2  LEU  28          1HD2      LEU  28  -6.667 -14.148  -7.285
  220   2HD2  LEU  28          2HD2      LEU  28  -6.541 -13.610  -8.977
  221   3HD2  LEU  28          3HD2      LEU  28  -5.400 -12.991  -7.759
  222    H    LYS  29           HN       LYS  29 -11.856 -11.846  -7.620
  223    HA   LYS  29           HA       LYS  29 -11.741  -9.660  -9.201
  224   1HB   LYS  29          2HB       LYS  29 -13.520 -11.338  -9.267
  225   2HB   LYS  29          3HB       LYS  29 -14.158 -10.766  -7.739
  226   1HG   LYS  29          2HG       LYS  29 -14.994  -8.781  -8.660
  227   2HG   LYS  29          3HG       LYS  29 -13.796  -8.737  -9.937
  228   1HD   LYS  29          2HD       LYS  29 -15.208  -9.788 -11.365
  229   2HD   LYS  29          3HD       LYS  29 -15.375 -11.141 -10.263
  230   1HE   LYS  29          2HE       LYS  29 -16.902  -8.565  -9.754
  231   2HE   LYS  29          3HE       LYS  29 -17.512  -9.735 -10.907
  232   1HZ   LYS  29          1HZ       LYS  29 -16.736 -11.050  -8.567
  233   2HZ   LYS  29          2HZ       LYS  29 -17.737  -9.821  -8.174
  234   3HZ   LYS  29          3HZ       LYS  29 -18.221 -10.959  -9.241
  235    H    LEU  30           HN       LEU  30 -13.071  -9.723  -5.818
  236    HA   LEU  30           HA       LEU  30 -13.597  -7.027  -5.639
  237   1HB   LEU  30          2HB       LEU  30 -12.688  -8.892  -3.443
  238   2HB   LEU  30          3HB       LEU  30 -13.516  -7.363  -3.226
  239    HG   LEU  30           HG       LEU  30 -14.588  -9.987  -4.201
  240   1HD1  LEU  30          1HD1      LEU  30 -15.909  -7.962  -2.398
  241   2HD1  LEU  30          2HD1      LEU  30 -16.211  -9.711  -2.534
  242   3HD1  LEU  30          3HD1      LEU  30 -14.702  -9.123  -1.793
  243   1HD2  LEU  30          1HD2      LEU  30 -16.707  -8.615  -4.820
  244   2HD2  LEU  30          2HD2      LEU  30 -15.561  -7.270  -5.038
  245   3HD2  LEU  30          3HD2      LEU  30 -15.379  -8.759  -5.997
  246    H    LEU  31           HN       LEU  31 -10.606  -8.784  -4.545
  247    HA   LEU  31           HA       LEU  31  -9.179  -6.588  -3.760
  248   1HB   LEU  31          2HB       LEU  31  -8.705  -9.144  -3.668
  249   2HB   LEU  31          3HB       LEU  31  -7.881  -8.882  -5.192
  250    HG   LEU  31           HG       LEU  31  -7.028  -6.925  -3.227
  251   1HD1  LEU  31          1HD1      LEU  31  -7.068  -8.160  -1.368
  252   2HD1  LEU  31          2HD1      LEU  31  -7.386  -9.666  -2.261
  253   3HD1  LEU  31          3HD1      LEU  31  -5.718  -9.065  -2.095
  254   1HD2  LEU  31          1HD2      LEU  31  -5.866  -7.543  -5.337
  255   2HD2  LEU  31          2HD2      LEU  31  -4.829  -7.636  -3.893
  256   3HD2  LEU  31          3HD2      LEU  31  -5.480  -9.125  -4.619
  257    H    LEU  32           HN       LEU  32  -8.905  -8.199  -7.012
  258    HA   LEU  32           HA       LEU  32  -7.340  -6.306  -8.195
  259   1HB   LEU  32          2HB       LEU  32  -9.569  -7.872  -9.500
  260   2HB   LEU  32          3HB       LEU  32  -8.197  -7.141 -10.309
  261    HG   LEU  32           HG       LEU  32  -7.902  -9.297  -8.207
  262   1HD1  LEU  32          1HD1      LEU  32  -7.391 -10.676 -10.410
  263   2HD1  LEU  32          2HD1      LEU  32  -9.039 -10.535  -9.751
  264   3HD1  LEU  32          3HD1      LEU  32  -8.536  -9.511 -11.117
  265   1HD2  LEU  32          1HD2      LEU  32  -6.043  -7.595  -9.480
  266   2HD2  LEU  32          2HD2      LEU  32  -5.717  -8.996  -8.431
  267   3HD2  LEU  32          3HD2      LEU  32  -5.828  -9.212 -10.194
  268    H    GLN  33           HN       GLN  33 -10.668  -6.050  -7.144
  269    HA   GLN  33           HA       GLN  33 -11.408  -4.009  -8.918
  270   1HB   GLN  33          2HB       GLN  33 -12.723  -5.596  -7.095
  271   2HB   GLN  33          3HB       GLN  33 -12.698  -4.070  -6.233
  272   1HG   GLN  33          2HG       GLN  33 -13.541  -3.007  -8.467
  273   2HG   GLN  33          3HG       GLN  33 -13.890  -4.648  -8.972
  274   1HE2  GLN  33          1HE2      GLN  33 -15.444  -5.872  -7.906
  275   2HE2  GLN  33          2HE2      GLN  33 -16.665  -5.170  -6.897
  276    H    THR  34           HN       THR  34 -10.536  -3.924  -5.380
  277    HA   THR  34           HA       THR  34 -10.131  -1.058  -5.569
  278    HB   THR  34           HB       THR  34 -10.583  -3.133  -3.483
  279    HG1  THR  34           HG1      THR  34 -10.846  -0.215  -3.634
  280   1HG2  THR  34          1HG2      THR  34  -8.697  -0.764  -3.049
  281   2HG2  THR  34          2HG2      THR  34  -9.619  -1.517  -1.725
  282   3HG2  THR  34          3HG2      THR  34  -8.407  -2.467  -2.618
  283    H    GLU  35           HN       GLU  35  -8.174  -4.010  -4.821
  284    HA   GLU  35           HA       GLU  35  -5.820  -2.815  -4.327
  285   1HB   GLU  35          2HB       GLU  35  -6.092  -5.215  -4.129
  286   2HB   GLU  35          3HB       GLU  35  -6.410  -5.388  -5.843
  287   1HG   GLU  35          2HG       GLU  35  -4.192  -5.751  -6.142
  288   2HG   GLU  35          3HG       GLU  35  -3.921  -4.065  -5.751
  289    H    PHE  36           HN       PHE  36  -6.895  -3.963  -7.614
  290    HA   PHE  36           HA       PHE  36  -5.634  -1.642  -8.780
  291   1HB   PHE  36          2HB       PHE  36  -4.836  -4.574  -9.231
  292   2HB   PHE  36          3HB       PHE  36  -4.445  -3.333 -10.404
  293    HD1  PHE  36           HD1      PHE  36  -3.306  -1.159  -9.220
  294    HD2  PHE  36           HD2      PHE  36  -3.149  -5.149  -7.783
  295    HE1  PHE  36           HE1      PHE  36  -1.209  -0.620  -7.951
  296    HE2  PHE  36           HE2      PHE  36  -1.051  -4.610  -6.514
  297    HZ   PHE  36           HZ       PHE  36  -0.106  -2.351  -6.613
  298    HA   PRO  37           HA       PRO  37  -9.377  -2.807 -10.933
  299   1HB   PRO  37          2HB       PRO  37 -10.337  -0.274 -11.291
  300   2HB   PRO  37          3HB       PRO  37 -10.747  -1.267  -9.907
  301   1HG   PRO  37          2HG       PRO  37  -8.900   1.036 -10.053
  302   2HG   PRO  37          3HG       PRO  37  -9.642   0.311  -8.640
  303   1HD   PRO  37          2HD       PRO  37  -6.929  -0.015  -9.512
  304   2HD   PRO  37          3HD       PRO  37  -7.703  -0.830  -8.168
  305    H    SER  38           HN       SER  38  -6.775  -0.730 -11.712
  306    HA   SER  38           HA       SER  38  -7.529  -0.235 -14.345
  307   1HB   SER  38          2HB       SER  38  -5.649   0.821 -12.825
  308   2HB   SER  38          3HB       SER  38  -4.640  -0.462 -13.461
  309    HG   SER  38           HG       SER  38  -5.412   1.883 -14.661
  310    H    LEU  39           HN       LEU  39  -5.948  -2.967 -12.700
  311    HA   LEU  39           HA       LEU  39  -4.909  -4.169 -15.040
  312   1HB   LEU  39          2HB       LEU  39  -4.835  -4.575 -12.248
  313   2HB   LEU  39          3HB       LEU  39  -5.481  -6.049 -12.941
  314    HG   LEU  39           HG       LEU  39  -2.838  -4.732 -13.613
  315   1HD1  LEU  39          1HD1      LEU  39  -2.919  -5.942 -11.463
  316   2HD1  LEU  39          2HD1      LEU  39  -3.436  -7.410 -12.327
  317   3HD1  LEU  39          3HD1      LEU  39  -1.830  -6.710 -12.644
  318   1HD2  LEU  39          1HD2      LEU  39  -3.149  -7.369 -14.734
  319   2HD2  LEU  39          2HD2      LEU  39  -4.439  -6.293 -15.322
  320   3HD2  LEU  39          3HD2      LEU  39  -2.731  -5.835 -15.534
  321    H    LEU  40           HN       LEU  40  -8.096  -3.872 -13.649
  322    HA   LEU  40           HA       LEU  40  -9.138  -6.252 -14.827
  323   1HB   LEU  40          2HB       LEU  40 -10.458  -3.810 -13.638
  324   2HB   LEU  40          3HB       LEU  40 -11.323  -5.229 -14.194
  325    HG   LEU  40           HG       LEU  40  -9.224  -5.268 -12.010
  326   1HD1  LEU  40          1HD1      LEU  40 -11.216  -5.577 -10.487
  327   2HD1  LEU  40          2HD1      LEU  40 -11.000  -3.946 -11.166
  328   3HD1  LEU  40          3HD1      LEU  40 -12.234  -5.036 -11.844
  329   1HD2  LEU  40          1HD2      LEU  40 -10.668  -7.346 -13.458
  330   2HD2  LEU  40          2HD2      LEU  40  -9.259  -7.465 -12.378
  331   3HD2  LEU  40          3HD2      LEU  40 -10.904  -7.450 -11.697
  332    H    LYS  41           HN       LYS  41  -8.502  -2.935 -15.848
  333    HA   LYS  41           HA       LYS  41 -10.324  -2.966 -18.025
  334   1HB   LYS  41          2HB       LYS  41  -7.938  -1.219 -17.364
  335   2HB   LYS  41          3HB       LYS  41  -8.989  -0.952 -18.740
  336   1HG   LYS  41          2HG       LYS  41 -10.836  -1.243 -16.691
  337   2HG   LYS  41          3HG       LYS  41  -9.503  -0.480 -15.847
  338   1HD   LYS  41          2HD       LYS  41  -9.952   1.525 -16.812
  339   2HD   LYS  41          3HD       LYS  41  -9.875   0.828 -18.418
  340   1HE   LYS  41          2HE       LYS  41 -12.339   0.035 -17.014
  341   2HE   LYS  41          3HE       LYS  41 -12.188   1.778 -17.114
  342   1HZ   LYS  41          1HZ       LYS  41 -12.291   1.726 -19.354
  343   2HZ   LYS  41          2HZ       LYS  41 -11.602   0.253 -19.504
  344   3HZ   LYS  41          3HZ       LYS  41 -13.168   0.380 -19.060
  345    H    GLY  42           HN       GLY  42  -6.946  -3.982 -17.482
  346   1HA   GLY  42          1HA       GLY  42  -5.862  -4.152 -19.934
  347   2HA   GLY  42          2HA       GLY  42  -5.686  -5.402 -18.718
  348    H    MET  43           HN       MET  43  -5.610  -6.081 -21.432
  349    HA   MET  43           HA       MET  43  -8.163  -6.791 -22.375
  350   1HB   MET  43          2HB       MET  43  -5.360  -7.809 -23.105
  351   2HB   MET  43          3HB       MET  43  -6.796  -8.104 -24.065
  352   1HG   MET  43          2HG       MET  43  -6.923  -5.360 -23.801
  353   2HG   MET  43          3HG       MET  43  -5.188  -5.603 -23.779
  354   1HE   MET  43          1HE       MET  43  -3.831  -6.739 -25.506
  355   2HE   MET  43          2HE       MET  43  -4.198  -6.448 -27.224
  356   3HE   MET  43          3HE       MET  43  -4.102  -5.079 -26.090
  357    H    SER  44           HN       SER  44  -6.414  -7.982 -19.779
  358    HA   SER  44           HA       SER  44  -7.098 -10.740 -20.265
  359   1HB   SER  44          2HB       SER  44  -5.575  -9.321 -18.044
  360   2HB   SER  44          3HB       SER  44  -5.976 -11.025 -17.957
  361    HG   SER  44           HG       SER  44  -3.808 -10.161 -18.995
  362    H    THR  45           HN       THR  45  -9.330 -11.004 -20.036
  363    HA   THR  45           HA       THR  45 -10.867  -9.573 -18.154
  364    HB   THR  45           HB       THR  45 -12.645 -11.075 -18.939
  365    HG1  THR  45           HG1      THR  45 -10.485 -12.551 -20.233
  366   1HG2  THR  45          1HG2      THR  45 -11.455 -11.339 -21.508
  367   2HG2  THR  45          2HG2      THR  45 -12.526 -10.024 -20.968
  368   3HG2  THR  45          3HG2      THR  45 -10.760  -9.852 -20.822
  369    H    LEU  46           HN       LEU  46 -12.303 -10.800 -16.496
  370    HA   LEU  46           HA       LEU  46 -10.700 -11.550 -14.408
  371   1HB   LEU  46          2HB       LEU  46 -13.247 -10.912 -14.640
  372   2HB   LEU  46          3HB       LEU  46 -13.467 -12.651 -14.651
  373    HG   LEU  46           HG       LEU  46 -11.814 -12.327 -12.483
  374   1HD1  LEU  46          1HD1      LEU  46 -11.767 -10.026 -12.273
  375   2HD1  LEU  46          2HD1      LEU  46 -13.451  -9.831 -12.816
  376   3HD1  LEU  46          3HD1      LEU  46 -13.108 -10.471 -11.191
  377   1HD2  LEU  46          1HD2      LEU  46 -14.841 -12.360 -12.582
  378   2HD2  LEU  46          2HD2      LEU  46 -13.748 -13.763 -12.528
  379   3HD2  LEU  46          3HD2      LEU  46 -13.864 -12.671 -11.127
  380    H    ASP  47           HN       ASP  47 -12.730 -13.797 -16.426
  381    HA   ASP  47           HA       ASP  47 -11.912 -16.115 -15.420
  382   1HB   ASP  47          2HB       ASP  47 -12.943 -15.168 -17.984
  383   2HB   ASP  47          3HB       ASP  47 -11.841 -16.505 -18.247
  384    H    GLU  48           HN       GLU  48 -10.300 -14.242 -18.098
  385    HA   GLU  48           HA       GLU  48  -8.240 -15.977 -18.555
  386   1HB   GLU  48          2HB       GLU  48  -8.925 -13.228 -19.212
  387   2HB   GLU  48          3HB       GLU  48  -7.206 -13.342 -18.891
  388   1HG   GLU  48          2HG       GLU  48  -7.444 -15.554 -20.425
  389   2HG   GLU  48          3HG       GLU  48  -8.831 -14.681 -21.045
  390    H    LEU  49           HN       LEU  49  -8.455 -13.227 -16.210
  391    HA   LEU  49           HA       LEU  49  -5.823 -13.493 -15.271
  392   1HB   LEU  49          2HB       LEU  49  -7.873 -11.707 -14.981
  393   2HB   LEU  49          3HB       LEU  49  -7.845 -12.464 -13.400
  394    HG   LEU  49           HG       LEU  49  -5.211 -11.976 -13.669
  395   1HD1  LEU  49          1HD1      LEU  49  -4.623 -10.455 -15.181
  396   2HD1  LEU  49          2HD1      LEU  49  -6.232 -10.678 -15.911
  397   3HD1  LEU  49          3HD1      LEU  49  -5.964  -9.376 -14.727
  398   1HD2  LEU  49          1HD2      LEU  49  -5.922 -11.099 -11.735
  399   2HD2  LEU  49          2HD2      LEU  49  -6.038  -9.575 -12.648
  400   3HD2  LEU  49          3HD2      LEU  49  -7.483 -10.589 -12.422
  401    H    PHE  50           HN       PHE  50  -8.976 -14.903 -14.236
  402    HA   PHE  50           HA       PHE  50  -8.049 -16.112 -11.918
  403   1HB   PHE  50          2HB       PHE  50 -10.445 -15.802 -12.786
  404   2HB   PHE  50          3HB       PHE  50 -10.135 -17.045 -13.981
  405    HD1  PHE  50           HD1      PHE  50  -9.376 -16.848 -10.327
  406    HD2  PHE  50           HD2      PHE  50 -11.371 -18.916 -13.450
  407    HE1  PHE  50           HE1      PHE  50 -10.115 -18.603  -8.692
  408    HE2  PHE  50           HE2      PHE  50 -12.110 -20.671 -11.815
  409    HZ   PHE  50           HZ       PHE  50 -11.473 -20.494  -9.456
  410    H    GLU  51           HN       GLU  51  -8.405 -17.480 -15.270
  411    HA   GLU  51           HA       GLU  51  -7.264 -19.929 -14.518
  412   1HB   GLU  51          2HB       GLU  51  -8.383 -18.694 -16.918
  413   2HB   GLU  51          3HB       GLU  51  -6.944 -19.611 -17.317
  414   1HG   GLU  51          2HG       GLU  51  -8.086 -21.434 -15.694
  415   2HG   GLU  51          3HG       GLU  51  -9.547 -20.576 -16.141
  416    H    GLU  52           HN       GLU  52  -6.005 -16.887 -15.954
  417    HA   GLU  52           HA       GLU  52  -3.518 -17.878 -16.658
  418   1HB   GLU  52          2HB       GLU  52  -4.361 -15.737 -17.493
  419   2HB   GLU  52          3HB       GLU  52  -4.405 -15.069 -15.874
  420   1HG   GLU  52          2HG       GLU  52  -2.061 -14.894 -15.725
  421   2HG   GLU  52          3HG       GLU  52  -1.783 -16.163 -16.901
  422    H    LEU  53           HN       LEU  53  -4.555 -16.033 -13.697
  423    HA   LEU  53           HA       LEU  53  -2.108 -16.145 -12.406
  424   1HB   LEU  53          2HB       LEU  53  -4.884 -16.076 -11.215
  425   2HB   LEU  53          3HB       LEU  53  -3.397 -15.678 -10.376
  426    HG   LEU  53           HG       LEU  53  -4.095 -14.174 -12.876
  427   1HD1  LEU  53          1HD1      LEU  53  -5.950 -14.377 -10.828
  428   2HD1  LEU  53          2HD1      LEU  53  -5.083 -12.865 -10.465
  429   3HD1  LEU  53          3HD1      LEU  53  -5.856 -13.088 -12.053
  430   1HD2  LEU  53          1HD2      LEU  53  -2.238 -13.111 -12.284
  431   2HD2  LEU  53          2HD2      LEU  53  -3.115 -12.479 -10.869
  432   3HD2  LEU  53          3HD2      LEU  53  -2.166 -13.979 -10.732
  433    H    ASP  54           HN       ASP  54  -4.956 -18.381 -12.190
  434    HA   ASP  54           HA       ASP  54  -3.620 -20.104 -10.428
  435   1HB   ASP  54          2HB       ASP  54  -6.177 -19.829 -10.963
  436   2HB   ASP  54          3HB       ASP  54  -5.872 -20.917 -12.302
  437    H    LYS  55           HN       LYS  55  -1.697 -21.059 -11.193
  438    HA   LYS  55           HA       LYS  55  -1.886 -22.404 -13.799
  439   1HB   LYS  55          2HB       LYS  55   0.517 -21.975 -14.082
  440   2HB   LYS  55          3HB       LYS  55  -0.411 -20.492 -13.983
  441   1HG   LYS  55          2HG       LYS  55   0.800 -19.807 -12.195
  442   2HG   LYS  55          3HG       LYS  55   0.346 -21.243 -11.298
  443   1HD   LYS  55          2HD       LYS  55   2.196 -22.431 -12.786
  444   2HD   LYS  55          3HD       LYS  55   2.780 -20.800 -13.049
  445   1HE   LYS  55          2HE       LYS  55   3.548 -20.579 -10.891
  446   2HE   LYS  55          3HE       LYS  55   2.168 -21.412 -10.203
  447   1HZ   LYS  55          1HZ       LYS  55   4.466 -22.523 -10.210
  448   2HZ   LYS  55          2HZ       LYS  55   3.145 -23.431 -10.523
  449   3HZ   LYS  55          3HZ       LYS  55   4.105 -22.937 -11.748
  450    H    ASN  56           HN       ASN  56  -1.963 -22.842 -10.515
  451    HA   ASN  56           HA       ASN  56  -0.195 -25.116 -10.518
  452   1HB   ASN  56          2HB       ASN  56  -1.971 -23.933  -8.317
  453   2HB   ASN  56          3HB       ASN  56  -0.840 -25.250  -8.077
  454   1HD2  ASN  56          1HD2      ASN  56   1.403 -24.888  -8.337
  455   2HD2  ASN  56          2HD2      ASN  56   2.102 -23.316  -8.136
  456    H    GLY  57           HN       GLY  57  -3.048 -24.656 -11.898
  457   1HA   GLY  57          1HA       GLY  57  -5.035 -25.745 -12.104
  458   2HA   GLY  57          2HA       GLY  57  -3.973 -27.137 -12.176
  459    H    ASP  58           HN       ASP  58  -5.395 -24.921  -9.660
  460    HA   ASP  58           HA       ASP  58  -6.129 -27.335  -8.214
  461   1HB   ASP  58          2HB       ASP  58  -5.711 -25.712  -6.122
  462   2HB   ASP  58          3HB       ASP  58  -4.420 -26.690  -6.791
  463    H    GLY  59           HN       GLY  59  -6.379 -23.691  -8.252
  464   1HA   GLY  59          1HA       GLY  59  -8.680 -22.935  -8.945
  465   2HA   GLY  59          2HA       GLY  59  -9.259 -23.952  -7.641
  466    H    GLU  60           HN       GLU  60  -6.311 -22.955  -6.510
  467    HA   GLU  60           HA       GLU  60  -7.532 -20.625  -5.251
  468   1HB   GLU  60          2HB       GLU  60  -6.069 -21.083  -3.311
  469   2HB   GLU  60          3HB       GLU  60  -7.081 -22.467  -3.675
  470   1HG   GLU  60          2HG       GLU  60  -4.836 -22.966  -5.246
  471   2HG   GLU  60          3HG       GLU  60  -4.130 -22.191  -3.841
  472    H    VAL  61           HN       VAL  61  -6.492 -18.644  -5.385
  473    HA   VAL  61           HA       VAL  61  -4.009 -18.651  -6.938
  474    HB   VAL  61           HB       VAL  61  -6.176 -16.601  -6.480
  475   1HG1  VAL  61          1HG1      VAL  61  -3.358 -16.203  -7.195
  476   2HG1  VAL  61          2HG1      VAL  61  -4.490 -15.524  -8.387
  477   3HG1  VAL  61          3HG1      VAL  61  -4.589 -15.025  -6.681
  478   1HG2  VAL  61          1HG2      VAL  61  -6.272 -18.573  -8.228
  479   2HG2  VAL  61          2HG2      VAL  61  -6.799 -16.933  -8.676
  480   3HG2  VAL  61          3HG2      VAL  61  -5.188 -17.515  -9.162
  481    H    SER  62           HN       SER  62  -3.472 -19.504  -4.452
  482    HA   SER  62           HA       SER  62  -3.303 -17.846  -2.380
  483   1HB   SER  62          2HB       SER  62  -0.734 -19.175  -2.655
  484   2HB   SER  62          3HB       SER  62  -2.043 -19.527  -1.545
  485    HG   SER  62           HG       SER  62  -1.766 -20.483  -4.264
  486    H    PHE  63           HN       PHE  63  -1.254 -16.676  -1.472
  487    HA   PHE  63           HA       PHE  63  -0.705 -14.472  -2.963
  488   1HB   PHE  63          2HB       PHE  63  -0.261 -15.010  -0.476
  489   2HB   PHE  63          3HB       PHE  63   1.142 -15.931  -0.980
  490    HD1  PHE  63           HD1      PHE  63   3.038 -14.802  -0.312
  491    HD2  PHE  63           HD2      PHE  63  -0.143 -12.586  -2.038
  492    HE1  PHE  63           HE1      PHE  63   4.438 -12.721  -0.221
  493    HE2  PHE  63           HE2      PHE  63   1.257 -10.505  -1.947
  494    HZ   PHE  63           HZ       PHE  63   3.530 -10.597  -1.039
  495    H    GLU  64           HN       GLU  64   0.903 -17.660  -3.034
  496    HA   GLU  64           HA       GLU  64   3.253 -16.989  -4.208
  497   1HB   GLU  64          2HB       GLU  64   2.888 -19.349  -5.387
  498   2HB   GLU  64          3HB       GLU  64   3.136 -19.236  -3.656
  499   1HG   GLU  64          2HG       GLU  64   1.036 -19.994  -3.201
  500   2HG   GLU  64          3HG       GLU  64   0.302 -18.882  -4.340
  501    H    GLU  65           HN       GLU  65   0.132 -17.835  -5.873
  502    HA   GLU  65           HA       GLU  65   1.161 -17.321  -8.417
  503   1HB   GLU  65          2HB       GLU  65  -1.723 -17.366  -7.422
  504   2HB   GLU  65          3HB       GLU  65  -1.255 -17.370  -9.111
  505   1HG   GLU  65          2HG       GLU  65  -0.640 -19.581  -9.074
  506   2HG   GLU  65          3HG       GLU  65   0.124 -19.449  -7.503
  507    H    PHE  66           HN       PHE  66  -0.214 -15.287  -5.870
  508    HA   PHE  66           HA       PHE  66  -1.065 -13.136  -7.388
  509   1HB   PHE  66          2HB       PHE  66  -1.119 -13.788  -4.793
  510   2HB   PHE  66          3HB       PHE  66   0.417 -12.948  -4.717
  511    HD1  PHE  66           HD1      PHE  66   0.356 -10.741  -4.076
  512    HD2  PHE  66           HD2      PHE  66  -3.012 -12.358  -6.089
  513    HE1  PHE  66           HE1      PHE  66  -0.851  -8.556  -3.812
  514    HE2  PHE  66           HE2      PHE  66  -4.219 -10.173  -5.825
  515    HZ   PHE  66           HZ       PHE  66  -3.124  -8.299  -4.690
  516    H    GLN  67           HN       GLN  67   2.206 -14.076  -6.241
  517    HA   GLN  67           HA       GLN  67   3.442 -11.664  -6.762
  518   1HB   GLN  67          2HB       GLN  67   4.608 -14.479  -6.922
  519   2HB   GLN  67          3HB       GLN  67   5.545 -13.004  -6.790
  520   1HG   GLN  67          2HG       GLN  67   3.894 -12.633  -4.661
  521   2HG   GLN  67          3HG       GLN  67   3.870 -14.385  -4.713
  522   1HE2  GLN  67          1HE2      GLN  67   5.035 -12.487  -2.786
  523   2HE2  GLN  67          2HE2      GLN  67   6.710 -12.897  -2.625
  524    H    VAL  68           HN       VAL  68   1.992 -13.913  -8.917
  525    HA   VAL  68           HA       VAL  68   3.768 -13.467 -11.118
  526    HB   VAL  68           HB       VAL  68   0.966 -14.600 -11.055
  527   1HG1  VAL  68          1HG1      VAL  68   3.210 -15.011 -13.059
  528   2HG1  VAL  68          2HG1      VAL  68   1.571 -15.701 -13.136
  529   3HG1  VAL  68          3HG1      VAL  68   1.806 -13.944 -13.296
  530   1HG2  VAL  68          1HG2      VAL  68   3.046 -15.616  -9.631
  531   2HG2  VAL  68          2HG2      VAL  68   1.739 -16.600 -10.332
  532   3HG2  VAL  68          3HG2      VAL  68   3.288 -16.435 -11.193
  533    H    LEU  69           HN       LEU  69   0.675 -12.133  -9.878
  534    HA   LEU  69           HA       LEU  69   0.266 -10.521 -12.198
  535   1HB   LEU  69          2HB       LEU  69  -1.426 -11.490 -10.476
  536   2HB   LEU  69          3HB       LEU  69  -1.025 -10.072  -9.529
  537    HG   LEU  69           HG       LEU  69  -1.857  -8.589 -11.207
  538   1HD1  LEU  69          1HD1      LEU  69  -1.747 -11.002 -12.972
  539   2HD1  LEU  69          2HD1      LEU  69  -2.961  -9.744 -13.304
  540   3HD1  LEU  69          3HD1      LEU  69  -1.230  -9.328 -13.283
  541   1HD2  LEU  69          1HD2      LEU  69  -4.178 -10.105 -11.613
  542   2HD2  LEU  69          2HD2      LEU  69  -3.496 -10.687 -10.075
  543   3HD2  LEU  69          3HD2      LEU  69  -3.847  -8.956 -10.294
  544    H    VAL  70           HN       VAL  70   1.956 -10.240  -9.090
  545    HA   VAL  70           HA       VAL  70   2.115  -7.517  -8.833
  546    HB   VAL  70           HB       VAL  70   3.834  -9.842  -8.103
  547   1HG1  VAL  70          1HG1      VAL  70   5.425  -8.320  -6.938
  548   2HG1  VAL  70          2HG1      VAL  70   5.514  -8.209  -8.713
  549   3HG1  VAL  70          3HG1      VAL  70   4.677  -6.943  -7.782
  550   1HG2  VAL  70          1HG2      VAL  70   2.184  -9.594  -6.526
  551   2HG2  VAL  70          2HG2      VAL  70   3.439  -8.550  -5.817
  552   3HG2  VAL  70          3HG2      VAL  70   2.093  -7.829  -6.732
  553    H    LYS  71           HN       LYS  71   3.441  -9.600 -11.314
  554    HA   LYS  71           HA       LYS  71   5.565  -7.894 -12.083
  555   1HB   LYS  71          2HB       LYS  71   4.771 -10.474 -12.658
  556   2HB   LYS  71          3HB       LYS  71   4.415  -9.636 -14.155
  557   1HG   LYS  71          2HG       LYS  71   6.702  -8.806 -14.329
  558   2HG   LYS  71          3HG       LYS  71   7.088  -9.358 -12.711
  559   1HD   LYS  71          2HD       LYS  71   6.204 -11.274 -14.911
  560   2HD   LYS  71          3HD       LYS  71   7.886 -10.846 -14.668
  561   1HE   LYS  71          2HE       LYS  71   6.139 -11.959 -12.427
  562   2HE   LYS  71          3HE       LYS  71   7.078 -12.990 -13.489
  563   1HZ   LYS  71          1HZ       LYS  71   9.007 -12.259 -12.604
  564   2HZ   LYS  71          2HZ       LYS  71   8.447 -10.773 -12.225
  565   3HZ   LYS  71          3HZ       LYS  71   8.061 -12.054 -11.289
  566    H    LYS  72           HN       LYS  72   2.170  -8.387 -13.245
  567    HA   LYS  72           HA       LYS  72   2.390  -6.364 -15.214
  568   1HB   LYS  72          2HB       LYS  72  -0.024  -7.711 -13.965
  569   2HB   LYS  72          3HB       LYS  72  -0.086  -6.638 -15.349
  570   1HG   LYS  72          2HG       LYS  72   0.065  -8.704 -16.427
  571   2HG   LYS  72          3HG       LYS  72   1.760  -8.265 -16.352
  572   1HD   LYS  72          2HD       LYS  72   2.229  -9.789 -14.620
  573   2HD   LYS  72          3HD       LYS  72   0.579  -9.793 -14.030
  574   1HE   LYS  72          2HE       LYS  72   1.272 -10.914 -16.775
  575   2HE   LYS  72          3HE       LYS  72   1.416 -11.896 -15.331
  576   1HZ   LYS  72          1HZ       LYS  72  -1.011 -10.635 -16.383
  577   2HZ   LYS  72          2HZ       LYS  72  -0.722 -12.227 -16.165
  578   3HZ   LYS  72          3HZ       LYS  72  -0.935 -11.252 -14.873
  579    H    ILE  73           HN       ILE  73   1.597  -6.459 -11.755
  580    HA   ILE  73           HA       ILE  73   0.435  -3.853 -11.741
  581    HB   ILE  73           HB       ILE  73   1.272  -5.856  -9.675
  582   1HG1  ILE  73          2HG1      ILE  73  -1.418  -4.552  -9.887
  583   2HG1  ILE  73          3HG1      ILE  73  -0.969  -5.753 -11.082
  584   1HG2  ILE  73          1HG2      ILE  73   0.611  -4.359  -7.891
  585   2HG2  ILE  73          2HG2      ILE  73   1.951  -3.642  -8.818
  586   3HG2  ILE  73          3HG2      ILE  73   0.288  -3.057  -9.061
  587   1HD1  ILE  73          1HD1      ILE  73  -2.162  -6.542  -8.882
  588   2HD1  ILE  73          2HD1      ILE  73  -0.772  -7.480  -9.480
  589   3HD1  ILE  73          3HD1      ILE  73  -0.560  -6.334  -8.134
  590    H    SER  74           HN       SER  74   3.605  -5.047 -12.130
  591    HA   SER  74           HA       SER  74   4.809  -2.825 -10.756
  592   1HB   SER  74          2HB       SER  74   5.728  -5.395 -11.948
  593   2HB   SER  74          3HB       SER  74   6.864  -4.070 -12.104
  594    HG   SER  74           HG       SER  74   6.317  -3.761  -9.661
  595    H    GLN  75           HN       GLN  75   4.289  -4.099 -14.092
  596    HA   GLN  75           HA       GLN  75   5.760  -2.048 -15.320
  597   1HB   GLN  75          2HB       GLN  75   4.481  -4.452 -16.102
  598   2HB   GLN  75          3HB       GLN  75   3.684  -3.195 -17.027
  599   1HG   GLN  75          2HG       GLN  75   5.478  -3.551 -18.440
  600   2HG   GLN  75          3HG       GLN  75   6.220  -2.356 -17.395
  601   1HE2  GLN  75          1HE2      GLN  75   5.493  -5.845 -17.236
  602   2HE2  GLN  75          2HE2      GLN  75   7.068  -6.375 -16.747
  Start of MODEL    2
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   3.128   0.111  -0.993
    3   1HB   LYS   1          2HB       LYS   1   1.790  -2.139  -1.230
    4   2HB   LYS   1          3HB       LYS   1   1.019  -1.328  -2.579
    5   1HG   LYS   1          2HG       LYS   1   2.824  -2.174  -3.736
    6   2HG   LYS   1          3HG       LYS   1   3.591  -0.704  -3.168
    7   1HD   LYS   1          2HD       LYS   1   5.107  -2.495  -2.634
    8   2HD   LYS   1          3HD       LYS   1   4.384  -2.003  -1.116
    9   1HE   LYS   1          2HE       LYS   1   2.792  -3.885  -1.204
   10   2HE   LYS   1          3HE       LYS   1   3.353  -4.333  -2.803
   11   1HZ   LYS   1          1HZ       LYS   1   5.115  -5.340  -1.944
   12   2HZ   LYS   1          2HZ       LYS   1   5.449  -4.144  -0.882
   13   3HZ   LYS   1          3HZ       LYS   1   4.339  -5.283  -0.508
   14    H    SER   2           HN       SER   2   1.948   0.142  -3.830
   15    HA   SER   2           HA       SER   2   1.706   2.974  -3.902
   16   1HB   SER   2          2HB       SER   2   2.265   0.794  -5.776
   17   2HB   SER   2          3HB       SER   2   1.131   1.936  -6.470
   18    HG   SER   2           HG       SER   2   2.861   3.560  -5.455
   19    HA   PRO   3           HA       PRO   3  -2.624   3.196  -4.270
   20   1HB   PRO   3          2HB       PRO   3  -3.025   5.295  -5.974
   21   2HB   PRO   3          3HB       PRO   3  -2.618   5.499  -4.282
   22   1HG   PRO   3          2HG       PRO   3  -0.897   5.859  -6.658
   23   2HG   PRO   3          3HG       PRO   3  -0.655   6.453  -5.027
   24   1HD   PRO   3          2HD       PRO   3   0.665   4.222  -6.255
   25   2HD   PRO   3          3HD       PRO   3   0.821   4.746  -4.590
   26    H    GLU   4           HN       GLU   4  -1.003   3.185  -7.374
   27    HA   GLU   4           HA       GLU   4  -3.235   2.503  -8.846
   28   1HB   GLU   4          2HB       GLU   4  -0.447   2.862  -9.289
   29   2HB   GLU   4          3HB       GLU   4  -0.824   1.270  -9.916
   30   1HG   GLU   4          2HG       GLU   4  -2.822   3.370 -10.610
   31   2HG   GLU   4          3HG       GLU   4  -1.229   3.636 -11.289
   32    H    GLU   5           HN       GLU   5  -1.048   0.576  -6.807
   33    HA   GLU   5           HA       GLU   5  -1.781  -1.909  -7.855
   34   1HB   GLU   5          2HB       GLU   5  -0.221  -0.867  -5.577
   35   2HB   GLU   5          3HB       GLU   5  -1.036  -2.372  -5.201
   36   1HG   GLU   5          2HG       GLU   5  -0.074  -3.010  -7.673
   37   2HG   GLU   5          3HG       GLU   5   1.136  -1.832  -7.201
   38    H    LEU   6           HN       LEU   6  -3.180   0.268  -5.406
   39    HA   LEU   6           HA       LEU   6  -4.837  -1.584  -4.139
   40   1HB   LEU   6          2HB       LEU   6  -4.945   1.398  -4.520
   41   2HB   LEU   6          3HB       LEU   6  -6.198   0.537  -3.648
   42    HG   LEU   6           HG       LEU   6  -3.271   0.372  -2.901
   43   1HD1  LEU   6          1HD1      LEU   6  -4.891   2.659  -2.725
   44   2HD1  LEU   6          2HD1      LEU   6  -4.843   1.971  -1.084
   45   3HD1  LEU   6          3HD1      LEU   6  -3.326   2.365  -1.928
   46   1HD2  LEU   6          1HD2      LEU   6  -5.836  -0.583  -1.677
   47   2HD2  LEU   6          2HD2      LEU   6  -4.279  -1.424  -1.872
   48   3HD2  LEU   6          3HD2      LEU   6  -4.459  -0.162  -0.631
   49    H    LYS   7           HN       LYS   7  -5.278   0.444  -7.087
   50    HA   LYS   7           HA       LYS   7  -7.965  -0.309  -7.473
   51   1HB   LYS   7          2HB       LYS   7  -6.353   1.611  -8.490
   52   2HB   LYS   7          3HB       LYS   7  -6.302   0.463  -9.813
   53   1HG   LYS   7          2HG       LYS   7  -9.031   0.568  -8.988
   54   2HG   LYS   7          3HG       LYS   7  -8.477   2.230  -9.005
   55   1HD   LYS   7          2HD       LYS   7  -7.504   1.754 -11.346
   56   2HD   LYS   7          3HD       LYS   7  -8.369   0.231 -11.305
   57   1HE   LYS   7          2HE       LYS   7 -10.359   1.236 -11.775
   58   2HE   LYS   7          3HE       LYS   7 -10.129   2.446 -10.529
   59   1HZ   LYS   7          1HZ       LYS   7  -8.910   2.523 -13.203
   60   2HZ   LYS   7          2HZ       LYS   7 -10.182   3.422 -12.711
   61   3HZ   LYS   7          3HZ       LYS   7  -8.710   3.654 -12.042
   62    H    GLY   8           HN       GLY   8  -4.855  -1.457  -8.953
   63   1HA   GLY   8          1HA       GLY   8  -5.912  -3.406 -10.608
   64   2HA   GLY   8          2HA       GLY   8  -4.313  -3.426  -9.890
   65    H    ILE   9           HN       ILE   9  -4.523  -3.867  -7.270
   66    HA   ILE   9           HA       ILE   9  -5.196  -6.531  -7.049
   67    HB   ILE   9           HB       ILE   9  -4.605  -4.318  -5.138
   68   1HG1  ILE   9          2HG1      ILE   9  -3.299  -6.968  -5.816
   69   2HG1  ILE   9          3HG1      ILE   9  -2.757  -5.373  -6.299
   70   1HG2  ILE   9          1HG2      ILE   9  -5.945  -5.244  -3.591
   71   2HG2  ILE   9          2HG2      ILE   9  -6.080  -6.785  -4.471
   72   3HG2  ILE   9          3HG2      ILE   9  -4.650  -6.459  -3.463
   73   1HD1  ILE   9          1HD1      ILE   9  -3.035  -5.207  -3.487
   74   2HD1  ILE   9          2HD1      ILE   9  -2.288  -6.794  -3.793
   75   3HD1  ILE   9          3HD1      ILE   9  -1.514  -5.312  -4.406
   76    H    PHE  10           HN       PHE  10  -7.083  -3.584  -6.130
   77    HA   PHE  10           HA       PHE  10  -9.211  -4.808  -4.940
   78   1HB   PHE  10          2HB       PHE  10  -9.117  -2.411  -4.971
   79   2HB   PHE  10          3HB       PHE  10  -8.727  -2.359  -6.679
   80    HD1  PHE  10           HD1      PHE  10 -11.399  -2.456  -4.220
   81    HD2  PHE  10           HD2      PHE  10 -10.509  -2.618  -8.366
   82    HE1  PHE  10           HE1      PHE  10 -13.804  -1.982  -4.755
   83    HE2  PHE  10           HE2      PHE  10 -12.914  -2.143  -8.901
   84    HZ   PHE  10           HZ       PHE  10 -14.534  -1.831  -7.089
   85    H    GLU  11           HN       GLU  11  -8.864  -3.981  -8.467
   86    HA   GLU  11           HA       GLU  11 -11.279  -5.124  -9.183
   87   1HB   GLU  11          2HB       GLU  11  -9.153  -3.760 -10.459
   88   2HB   GLU  11          3HB       GLU  11  -9.271  -5.291 -11.304
   89   1HG   GLU  11          2HG       GLU  11 -11.958  -4.469 -10.941
   90   2HG   GLU  11          3HG       GLU  11 -11.101  -2.999 -11.360
   91    H    LYS  12           HN       LYS  12  -7.961  -6.469  -8.888
   92    HA   LYS  12           HA       LYS  12  -8.403  -8.887 -10.166
   93   1HB   LYS  12          2HB       LYS  12  -6.230  -7.776  -9.282
   94   2HB   LYS  12          3HB       LYS  12  -6.599  -8.579  -7.770
   95   1HG   LYS  12          2HG       LYS  12  -6.952 -10.698  -9.408
   96   2HG   LYS  12          3HG       LYS  12  -5.865  -9.783 -10.432
   97   1HD   LYS  12          2HD       LYS  12  -4.502  -9.542  -8.100
   98   2HD   LYS  12          3HD       LYS  12  -5.344 -11.038  -7.749
   99   1HE   LYS  12          2HE       LYS  12  -4.147 -10.941 -10.471
  100   2HE   LYS  12          3HE       LYS  12  -2.971 -10.848  -9.175
  101   1HZ   LYS  12          1HZ       LYS  12  -3.487 -12.910  -8.470
  102   2HZ   LYS  12          2HZ       LYS  12  -5.055 -12.837  -8.919
  103   3HZ   LYS  12          3HZ       LYS  12  -3.897 -13.115 -10.037
  104    H    TYR  13           HN       TYR  13  -9.509  -7.656  -7.055
  105    HA   TYR  13           HA       TYR  13 -10.286 -10.337  -6.209
  106   1HB   TYR  13          2HB       TYR  13  -9.977  -7.529  -5.094
  107   2HB   TYR  13          3HB       TYR  13 -11.165  -8.547  -4.306
  108    HD1  TYR  13           HD1      TYR  13 -10.481  -9.872  -2.522
  109    HD2  TYR  13           HD2      TYR  13  -7.588  -8.678  -5.440
  110    HE1  TYR  13           HE1      TYR  13  -8.635 -10.947  -1.143
  111    HE2  TYR  13           HE2      TYR  13  -5.753  -9.757  -4.051
  112    HH   TYR  13           HH       TYR  13  -6.351 -11.933  -1.653
  113    H    ALA  14           HN       ALA  14 -11.705  -7.093  -6.972
  114    HA   ALA  14           HA       ALA  14 -14.351  -7.804  -6.466
  115   1HB   ALA  14          1HB       ALA  14 -14.851  -5.720  -7.375
  116   2HB   ALA  14          2HB       ALA  14 -13.141  -5.503  -6.932
  117   3HB   ALA  14          3HB       ALA  14 -13.587  -5.842  -8.622
  118    H    ALA  15           HN       ALA  15 -12.142  -8.661  -9.045
  119    HA   ALA  15           HA       ALA  15 -14.271  -9.322 -10.884
  120   1HB   ALA  15          1HB       ALA  15 -11.252  -9.398 -10.891
  121   2HB   ALA  15          2HB       ALA  15 -12.173 -10.288 -12.127
  122   3HB   ALA  15          3HB       ALA  15 -12.360  -8.524 -11.975
  123    H    LYS  16           HN       LYS  16 -12.459 -10.775  -8.261
  124    HA   LYS  16           HA       LYS  16 -12.466 -13.429  -9.012
  125   1HB   LYS  16          2HB       LYS  16 -11.768 -11.936  -6.768
  126   2HB   LYS  16          3HB       LYS  16 -13.024 -13.003  -6.173
  127   1HG   LYS  16          2HG       LYS  16 -11.755 -14.918  -7.387
  128   2HG   LYS  16          3HG       LYS  16 -10.431 -13.785  -7.567
  129   1HD   LYS  16          2HD       LYS  16  -9.956 -13.745  -5.283
  130   2HD   LYS  16          3HD       LYS  16 -11.617 -14.052  -4.818
  131   1HE   LYS  16          2HE       LYS  16 -10.476 -16.306  -6.336
  132   2HE   LYS  16          3HE       LYS  16  -9.534 -15.945  -4.903
  133   1HZ   LYS  16          1HZ       LYS  16 -12.329 -16.733  -5.083
  134   2HZ   LYS  16          2HZ       LYS  16 -11.154 -17.313  -4.108
  135   3HZ   LYS  16          3HZ       LYS  16 -11.832 -15.862  -3.794
  136    H    GLU  17           HN       GLU  17 -14.912 -11.808  -6.860
  137    HA   GLU  17           HA       GLU  17 -16.826 -13.712  -7.967
  138   1HB   GLU  17          2HB       GLU  17 -16.529 -12.628  -5.144
  139   2HB   GLU  17          3HB       GLU  17 -18.034 -13.336  -5.696
  140   1HG   GLU  17          2HG       GLU  17 -16.072 -15.186  -6.526
  141   2HG   GLU  17          3HG       GLU  17 -15.516 -14.662  -4.949
  142    H    GLY  18           HN       GLY  18 -18.653 -12.861  -8.920
  143   1HA   GLY  18          1HA       GLY  18 -20.169 -11.350  -9.609
  144   2HA   GLY  18          2HA       GLY  18 -19.853 -10.429  -8.152
  145    H    ASP  19           HN       ASP  19 -20.350  -8.786 -10.128
  146    HA   ASP  19           HA       ASP  19 -18.388  -8.298 -11.978
  147   1HB   ASP  19          2HB       ASP  19 -20.813  -7.250 -11.503
  148   2HB   ASP  19          3HB       ASP  19 -19.882  -6.009 -10.688
  149    HA   PRO  20           HA       PRO  20 -15.293  -6.512  -9.415
  150   1HB   PRO  20          2HB       PRO  20 -13.654  -5.462 -11.334
  151   2HB   PRO  20          3HB       PRO  20 -13.619  -7.149 -10.862
  152   1HG   PRO  20          2HG       PRO  20 -14.750  -5.931 -13.307
  153   2HG   PRO  20          3HG       PRO  20 -14.324  -7.605 -13.010
  154   1HD   PRO  20          2HD       PRO  20 -16.963  -6.482 -13.024
  155   2HD   PRO  20          3HD       PRO  20 -16.527  -8.129 -12.614
  156    H    ASN  21           HN       ASN  21 -17.602  -4.846 -10.988
  157    HA   ASN  21           HA       ASN  21 -16.445  -2.275 -10.459
  158   1HB   ASN  21          2HB       ASN  21 -19.032  -3.278 -11.701
  159   2HB   ASN  21          3HB       ASN  21 -18.918  -1.602 -11.203
  160   1HD2  ASN  21          1HD2      ASN  21 -18.716  -3.500 -13.770
  161   2HD2  ASN  21          2HD2      ASN  21 -17.547  -2.684 -14.754
  162    H    GLN  22           HN       GLN  22 -17.978  -4.711  -8.694
  163    HA   GLN  22           HA       GLN  22 -18.772  -2.799  -6.686
  164   1HB   GLN  22          2HB       GLN  22 -20.869  -4.420  -6.339
  165   2HB   GLN  22          3HB       GLN  22 -20.944  -3.054  -7.434
  166   1HG   GLN  22          2HG       GLN  22 -19.846  -5.522  -8.674
  167   2HG   GLN  22          3HG       GLN  22 -21.502  -5.685  -8.125
  168   1HE2  GLN  22          1HE2      GLN  22 -22.825  -5.428  -9.748
  169   2HE2  GLN  22          2HE2      GLN  22 -22.764  -4.205 -10.973
  170    H    LEU  23           HN       LEU  23 -18.035  -3.445  -4.694
  171    HA   LEU  23           HA       LEU  23 -16.858  -6.091  -4.546
  172   1HB   LEU  23          2HB       LEU  23 -16.686  -3.593  -2.880
  173   2HB   LEU  23          3HB       LEU  23 -16.084  -5.129  -2.288
  174    HG   LEU  23           HG       LEU  23 -14.530  -3.381  -3.536
  175   1HD1  LEU  23          1HD1      LEU  23 -12.975  -4.984  -3.391
  176   2HD1  LEU  23          2HD1      LEU  23 -14.289  -5.986  -2.730
  177   3HD1  LEU  23          3HD1      LEU  23 -13.871  -6.093  -4.457
  178   1HD2  LEU  23          1HD2      LEU  23 -15.788  -4.951  -5.792
  179   2HD2  LEU  23          2HD2      LEU  23 -15.663  -3.185  -5.605
  180   3HD2  LEU  23          3HD2      LEU  23 -14.203  -4.152  -5.924
  181    H    SER  24           HN       SER  24 -17.310  -7.565  -2.763
  182    HA   SER  24           HA       SER  24 -19.954  -7.085  -1.631
  183   1HB   SER  24          2HB       SER  24 -18.867  -9.792  -2.519
  184   2HB   SER  24          3HB       SER  24 -20.470  -9.471  -1.887
  185    HG   SER  24           HG       SER  24 -20.113  -9.607  -4.342
  186    H    LYS  25           HN       LYS  25 -20.332  -8.493   0.405
  187    HA   LYS  25           HA       LYS  25 -18.375  -7.972   2.270
  188   1HB   LYS  25          2HB       LYS  25 -20.723  -8.343   2.819
  189   2HB   LYS  25          3HB       LYS  25 -20.610 -10.020   2.325
  190   1HG   LYS  25          2HG       LYS  25 -18.525  -9.908   4.108
  191   2HG   LYS  25          3HG       LYS  25 -19.582  -8.695   4.802
  192   1HD   LYS  25          2HD       LYS  25 -21.139 -11.035   4.009
  193   2HD   LYS  25          3HD       LYS  25 -19.809 -11.524   5.040
  194   1HE   LYS  25          2HE       LYS  25 -20.574  -9.465   6.539
  195   2HE   LYS  25          3HE       LYS  25 -22.084  -9.622   5.664
  196   1HZ   LYS  25          1HZ       LYS  25 -22.532 -11.177   7.152
  197   2HZ   LYS  25          2HZ       LYS  25 -21.497 -12.154   6.352
  198   3HZ   LYS  25          3HZ       LYS  25 -20.986 -11.318   7.658
  199    H    GLU  26           HN       GLU  26 -19.234 -11.222   0.876
  200    HA   GLU  26           HA       GLU  26 -17.128 -12.543   2.007
  201   1HB   GLU  26          2HB       GLU  26 -19.186 -13.081   0.086
  202   2HB   GLU  26          3HB       GLU  26 -17.682 -13.657  -0.606
  203   1HG   GLU  26          2HG       GLU  26 -17.481 -14.518   2.040
  204   2HG   GLU  26          3HG       GLU  26 -19.197 -14.683   1.726
  205    H    GLU  27           HN       GLU  27 -17.310 -10.635  -1.028
  206    HA   GLU  27           HA       GLU  27 -14.859 -11.451  -2.042
  207   1HB   GLU  27          2HB       GLU  27 -16.900  -9.448  -2.636
  208   2HB   GLU  27          3HB       GLU  27 -15.300  -8.783  -2.896
  209   1HG   GLU  27          2HG       GLU  27 -15.327 -11.473  -3.951
  210   2HG   GLU  27          3HG       GLU  27 -16.748 -10.643  -4.554
  211    H    LEU  28           HN       LEU  28 -15.774  -8.463  -0.178
  212    HA   LEU  28           HA       LEU  28 -13.223  -7.412  -0.006
  213   1HB   LEU  28          2HB       LEU  28 -15.618  -6.525   0.632
  214   2HB   LEU  28          3HB       LEU  28 -15.185  -7.104   2.228
  215    HG   LEU  28           HG       LEU  28 -13.510  -5.533   2.514
  216   1HD1  LEU  28          1HD1      LEU  28 -13.366  -5.367  -0.498
  217   2HD1  LEU  28          2HD1      LEU  28 -12.579  -4.178   0.568
  218   3HD1  LEU  28          3HD1      LEU  28 -12.114  -5.894   0.653
  219   1HD2  LEU  28          1HD2      LEU  28 -14.424  -3.351   1.877
  220   2HD2  LEU  28          2HD2      LEU  28 -15.527  -4.145   0.727
  221   3HD2  LEU  28          3HD2      LEU  28 -15.694  -4.447   2.473
  222    H    LYS  29           HN       LYS  29 -14.914  -9.843   2.041
  223    HA   LYS  29           HA       LYS  29 -13.264 -10.022   4.159
  224   1HB   LYS  29          2HB       LYS  29 -15.293 -11.359   3.840
  225   2HB   LYS  29          3HB       LYS  29 -14.501 -12.312   2.602
  226   1HG   LYS  29          2HG       LYS  29 -13.158 -13.454   4.127
  227   2HG   LYS  29          3HG       LYS  29 -13.090 -12.108   5.247
  228   1HD   LYS  29          2HD       LYS  29 -14.568 -13.372   6.466
  229   2HD   LYS  29          3HD       LYS  29 -15.761 -12.669   5.391
  230   1HE   LYS  29          2HE       LYS  29 -16.209 -14.682   4.428
  231   2HE   LYS  29          3HE       LYS  29 -14.511 -14.994   4.128
  232   1HZ   LYS  29          1HZ       LYS  29 -14.492 -15.448   6.651
  233   2HZ   LYS  29          2HZ       LYS  29 -16.097 -15.681   6.463
  234   3HZ   LYS  29          3HZ       LYS  29 -15.036 -16.598   5.627
  235    H    LEU  30           HN       LEU  30 -12.752 -11.712   0.983
  236    HA   LEU  30           HA       LEU  30 -10.331 -12.858   1.626
  237   1HB   LEU  30          2HB       LEU  30 -11.251 -11.833  -1.063
  238   2HB   LEU  30          3HB       LEU  30  -9.976 -13.002  -0.783
  239    HG   LEU  30           HG       LEU  30 -12.949 -13.334  -0.502
  240   1HD1  LEU  30          1HD1      LEU  30 -12.472 -15.407  -1.791
  241   2HD1  LEU  30          2HD1      LEU  30 -12.004 -13.912  -2.637
  242   3HD1  LEU  30          3HD1      LEU  30 -10.761 -14.925  -1.865
  243   1HD2  LEU  30          1HD2      LEU  30 -12.208 -14.124   1.622
  244   2HD2  LEU  30          2HD2      LEU  30 -12.512 -15.547   0.597
  245   3HD2  LEU  30          3HD2      LEU  30 -10.843 -15.003   0.890
  246    H    LEU  31           HN       LEU  31 -10.902  -9.720  -0.124
  247    HA   LEU  31           HA       LEU  31  -8.288  -8.939  -0.294
  248   1HB   LEU  31          2HB       LEU  31 -10.526  -7.924  -1.172
  249   2HB   LEU  31          3HB       LEU  31 -10.467  -6.968   0.296
  250    HG   LEU  31           HG       LEU  31  -7.900  -6.742  -0.853
  251   1HD1  LEU  31          1HD1      LEU  31  -8.979  -5.615  -3.081
  252   2HD1  LEU  31          2HD1      LEU  31  -8.231  -7.230  -3.020
  253   3HD1  LEU  31          3HD1      LEU  31  -9.999  -7.063  -2.901
  254   1HD2  LEU  31          1HD2      LEU  31  -8.559  -4.861   0.231
  255   2HD2  LEU  31          2HD2      LEU  31  -8.991  -4.369  -1.425
  256   3HD2  LEU  31          3HD2      LEU  31 -10.245  -4.989  -0.325
  257    H    LEU  32           HN       LEU  32 -10.614  -7.859   2.289
  258    HA   LEU  32           HA       LEU  32  -8.801  -6.614   3.890
  259   1HB   LEU  32          2HB       LEU  32 -11.159  -8.259   4.815
  260   2HB   LEU  32          3HB       LEU  32 -10.374  -6.964   5.698
  261    HG   LEU  32           HG       LEU  32 -11.679  -6.495   3.014
  262   1HD1  LEU  32          1HD1      LEU  32 -13.503  -5.497   4.734
  263   2HD1  LEU  32          2HD1      LEU  32 -13.602  -7.121   4.012
  264   3HD1  LEU  32          3HD1      LEU  32 -12.950  -6.916   5.656
  265   1HD2  LEU  32          1HD2      LEU  32 -10.940  -4.422   3.267
  266   2HD2  LEU  32          2HD2      LEU  32 -11.826  -4.280   4.804
  267   3HD2  LEU  32          3HD2      LEU  32 -10.152  -4.884   4.794
  268    H    GLN  33           HN       GLN  33  -9.111 -10.033   3.192
  269    HA   GLN  33           HA       GLN  33  -7.883 -10.952   5.535
  270   1HB   GLN  33          2HB       GLN  33  -9.182 -12.123   3.411
  271   2HB   GLN  33          3HB       GLN  33  -7.521 -12.550   3.047
  272   1HG   GLN  33          2HG       GLN  33  -7.309 -13.368   5.473
  273   2HG   GLN  33          3HG       GLN  33  -9.039 -13.141   5.627
  274   1HE2  GLN  33          1HE2      GLN  33 -10.453 -14.523   4.686
  275   2HE2  GLN  33          2HE2      GLN  33 -10.010 -15.994   3.885
  276    H    THR  34           HN       THR  34  -6.605 -10.666   2.134
  277    HA   THR  34           HA       THR  34  -3.899 -10.871   3.138
  278    HB   THR  34           HB       THR  34  -5.373 -11.092   0.563
  279    HG1  THR  34           HG1      THR  34  -4.348 -12.920   1.456
  280   1HG2  THR  34          1HG2      THR  34  -2.608  -9.808   0.756
  281   2HG2  THR  34          2HG2      THR  34  -3.107 -10.761  -0.662
  282   3HG2  THR  34          3HG2      THR  34  -3.990  -9.277  -0.232
  283    H    GLU  35           HN       GLU  35  -5.942  -8.394   1.468
  284    HA   GLU  35           HA       GLU  35  -4.096  -6.457   1.216
  285   1HB   GLU  35          2HB       GLU  35  -6.309  -6.143   0.331
  286   2HB   GLU  35          3HB       GLU  35  -7.051  -6.293   1.911
  287   1HG   GLU  35          2HG       GLU  35  -7.024  -3.938   1.387
  288   2HG   GLU  35          3HG       GLU  35  -5.805  -4.187   2.621
  289    H    PHE  36           HN       PHE  36  -6.313  -6.834   4.084
  290    HA   PHE  36           HA       PHE  36  -4.146  -6.001   5.801
  291   1HB   PHE  36          2HB       PHE  36  -6.783  -4.506   5.320
  292   2HB   PHE  36          3HB       PHE  36  -5.884  -4.288   6.808
  293    HD1  PHE  36           HD1      PHE  36  -3.113  -4.179   5.915
  294    HD2  PHE  36           HD2      PHE  36  -6.591  -2.542   4.117
  295    HE1  PHE  36           HE1      PHE  36  -1.711  -2.416   4.808
  296    HE2  PHE  36           HE2      PHE  36  -5.188  -0.779   3.010
  297    HZ   PHE  36           HZ       PHE  36  -2.765  -0.737   3.369
  298    HA   PRO  37           HA       PRO  37  -6.745  -9.099   7.715
  299   1HB   PRO  37          2HB       PRO  37  -4.724 -10.568   8.822
  300   2HB   PRO  37          3HB       PRO  37  -5.391 -10.898   7.235
  301   1HG   PRO  37          2HG       PRO  37  -2.815  -9.628   7.935
  302   2HG   PRO  37          3HG       PRO  37  -3.308 -10.344   6.414
  303   1HD   PRO  37          2HD       PRO  37  -3.151  -7.545   7.023
  304   2HD   PRO  37          3HD       PRO  37  -3.754  -8.264   5.542
  305    H    SER  38           HN       SER  38  -4.278  -7.049   8.953
  306    HA   SER  38           HA       SER  38  -4.789  -7.562  11.643
  307   1HB   SER  38          2HB       SER  38  -3.707  -5.229  11.926
  308   2HB   SER  38          3HB       SER  38  -2.743  -6.476  11.160
  309    HG   SER  38           HG       SER  38  -2.495  -4.926   9.670
  310    H    LEU  39           HN       LEU  39  -6.322  -5.502   9.178
  311    HA   LEU  39           HA       LEU  39  -7.733  -3.850  10.982
  312   1HB   LEU  39          2HB       LEU  39  -7.402  -4.164   8.158
  313   2HB   LEU  39          3HB       LEU  39  -9.116  -4.089   8.514
  314    HG   LEU  39           HG       LEU  39  -7.900  -1.902   7.982
  315   1HD1  LEU  39          1HD1      LEU  39  -9.382  -0.641   9.303
  316   2HD1  LEU  39          2HD1      LEU  39 -10.195  -2.204   9.050
  317   3HD1  LEU  39          3HD1      LEU  39  -9.398  -1.856  10.603
  318   1HD2  LEU  39          1HD2      LEU  39  -7.079  -1.937  10.880
  319   2HD2  LEU  39          2HD2      LEU  39  -5.990  -2.521   9.599
  320   3HD2  LEU  39          3HD2      LEU  39  -6.571  -0.839   9.574
  321    H    LEU  40           HN       LEU  40  -8.096  -7.155   9.894
  322    HA   LEU  40           HA       LEU  40 -10.901  -7.296  10.398
  323   1HB   LEU  40          2HB       LEU  40  -8.765  -9.386   9.970
  324   2HB   LEU  40          3HB       LEU  40 -10.459  -9.765  10.214
  325    HG   LEU  40           HG       LEU  40  -9.506  -7.962   7.981
  326   1HD1  LEU  40          1HD1      LEU  40 -10.214 -10.812   7.445
  327   2HD1  LEU  40          2HD1      LEU  40  -9.130  -9.710   6.563
  328   3HD1  LEU  40          3HD1      LEU  40  -8.596 -10.448   8.092
  329   1HD2  LEU  40          1HD2      LEU  40 -11.643  -8.340   6.997
  330   2HD2  LEU  40          2HD2      LEU  40 -12.051  -9.584   8.204
  331   3HD2  LEU  40          3HD2      LEU  40 -11.911  -7.879   8.696
  332    H    LYS  41           HN       LYS  41  -7.922  -7.544  12.279
  333    HA   LYS  41           HA       LYS  41  -9.060  -8.980  14.438
  334   1HB   LYS  41          2HB       LYS  41  -6.987  -8.848  15.373
  335   2HB   LYS  41          3HB       LYS  41  -6.555  -8.537  13.704
  336   1HG   LYS  41          2HG       LYS  41  -5.503  -6.705  14.622
  337   2HG   LYS  41          3HG       LYS  41  -7.092  -5.986  14.455
  338   1HD   LYS  41          2HD       LYS  41  -7.619  -6.292  16.757
  339   2HD   LYS  41          3HD       LYS  41  -6.392  -7.524  16.975
  340   1HE   LYS  41          2HE       LYS  41  -5.650  -4.660  16.251
  341   2HE   LYS  41          3HE       LYS  41  -5.898  -5.145  17.916
  342   1HZ   LYS  41          1HZ       LYS  41  -3.627  -5.391  17.385
  343   2HZ   LYS  41          2HZ       LYS  41  -4.237  -6.900  17.522
  344   3HZ   LYS  41          3HZ       LYS  41  -3.937  -6.271  16.045
  345    H    GLY  42           HN       GLY  42  -8.975  -5.581  13.422
  346   1HA   GLY  42          1HA       GLY  42  -9.402  -4.169  15.686
  347   2HA   GLY  42          2HA       GLY  42 -10.208  -3.840  14.165
  348    H    MET  43           HN       MET  43 -11.572  -3.177  16.449
  349    HA   MET  43           HA       MET  43 -13.139  -5.316  17.403
  350   1HB   MET  43          2HB       MET  43 -13.543  -2.273  17.498
  351   2HB   MET  43          3HB       MET  43 -14.461  -3.416  18.459
  352   1HG   MET  43          2HG       MET  43 -12.234  -4.244  19.429
  353   2HG   MET  43          3HG       MET  43 -11.452  -2.909  18.607
  354   1HE   MET  43          1HE       MET  43 -14.365  -3.010  22.006
  355   2HE   MET  43          2HE       MET  43 -13.556  -4.306  21.094
  356   3HE   MET  43          3HE       MET  43 -12.678  -3.440  22.377
  357    H    SER  44           HN       SER  44 -13.087  -3.843  14.399
  358    HA   SER  44           HA       SER  44 -15.955  -3.813  14.093
  359   1HB   SER  44          2HB       SER  44 -13.696  -3.108  12.168
  360   2HB   SER  44          3HB       SER  44 -15.397  -2.981  11.770
  361    HG   SER  44           HG       SER  44 -14.304  -1.658  14.087
  362    H    THR  45           HN       THR  45 -16.707  -5.943  14.016
  363    HA   THR  45           HA       THR  45 -15.268  -8.056  12.841
  364    HB   THR  45           HB       THR  45 -17.462  -9.242  13.152
  365    HG1  THR  45           HG1      THR  45 -19.270  -7.900  13.603
  366   1HG2  THR  45          1HG2      THR  45 -17.771  -8.850  15.550
  367   2HG2  THR  45          2HG2      THR  45 -16.028  -8.729  15.208
  368   3HG2  THR  45          3HG2      THR  45 -16.996  -7.252  15.432
  369    H    LEU  46           HN       LEU  46 -16.289  -9.447  11.019
  370    HA   LEU  46           HA       LEU  46 -15.953  -8.095   8.659
  371   1HB   LEU  46          2HB       LEU  46 -16.059 -10.638   9.305
  372   2HB   LEU  46          3HB       LEU  46 -17.734 -10.494   8.812
  373    HG   LEU  46           HG       LEU  46 -16.030 -11.315   7.086
  374   1HD1  LEU  46          1HD1      LEU  46 -18.410  -9.854   6.855
  375   2HD1  LEU  46          2HD1      LEU  46 -17.300  -9.143   5.659
  376   3HD1  LEU  46          3HD1      LEU  46 -17.646 -10.889   5.625
  377   1HD2  LEU  46          1HD2      LEU  46 -14.670  -9.771   5.932
  378   2HD2  LEU  46          2HD2      LEU  46 -15.432  -8.375   6.732
  379   3HD2  LEU  46          3HD2      LEU  46 -14.380  -9.470   7.663
  380    H    ASP  47           HN       ASP  47 -19.143  -9.287   9.943
  381    HA   ASP  47           HA       ASP  47 -20.748  -8.123   8.175
  382   1HB   ASP  47          2HB       ASP  47 -21.094  -9.377  10.583
  383   2HB   ASP  47          3HB       ASP  47 -21.565  -7.752  11.037
  384    H    GLU  48           HN       GLU  48 -19.473  -6.625  11.242
  385    HA   GLU  48           HA       GLU  48 -20.701  -4.199  10.994
  386   1HB   GLU  48          2HB       GLU  48 -18.552  -5.372  12.561
  387   2HB   GLU  48          3HB       GLU  48 -18.126  -3.729  12.128
  388   1HG   GLU  48          2HG       GLU  48 -20.689  -3.269  12.851
  389   2HG   GLU  48          3HG       GLU  48 -20.427  -4.719  13.800
  390    H    LEU  49           HN       LEU  49 -17.522  -5.316   9.678
  391    HA   LEU  49           HA       LEU  49 -16.768  -2.847   8.609
  392   1HB   LEU  49          2HB       LEU  49 -15.632  -5.304   8.924
  393   2HB   LEU  49          3HB       LEU  49 -15.901  -5.280   7.192
  394    HG   LEU  49           HG       LEU  49 -14.766  -2.863   7.438
  395   1HD1  LEU  49          1HD1      LEU  49 -14.595  -3.456  10.001
  396   2HD1  LEU  49          2HD1      LEU  49 -13.135  -4.328   9.474
  397   3HD1  LEU  49          3HD1      LEU  49 -13.289  -2.581   9.166
  398   1HD2  LEU  49          1HD2      LEU  49 -13.479  -3.937   5.984
  399   2HD2  LEU  49          2HD2      LEU  49 -12.544  -4.573   7.358
  400   3HD2  LEU  49          3HD2      LEU  49 -13.898  -5.516   6.691
  401    H    PHE  50           HN       PHE  50 -18.684  -5.598   7.279
  402    HA   PHE  50           HA       PHE  50 -18.880  -4.649   4.684
  403   1HB   PHE  50          2HB       PHE  50 -19.554  -6.916   5.699
  404   2HB   PHE  50          3HB       PHE  50 -20.939  -6.129   6.430
  405    HD1  PHE  50           HD1      PHE  50 -22.715  -7.232   5.367
  406    HD2  PHE  50           HD2      PHE  50 -19.609  -5.552   3.013
  407    HE1  PHE  50           HE1      PHE  50 -24.056  -7.663   3.289
  408    HE2  PHE  50           HE2      PHE  50 -20.950  -5.982   0.936
  409    HZ   PHE  50           HZ       PHE  50 -23.158  -7.033   1.098
  410    H    GLU  51           HN       GLU  51 -21.107  -4.167   7.514
  411    HA   GLU  51           HA       GLU  51 -22.884  -2.579   6.071
  412   1HB   GLU  51          2HB       GLU  51 -22.608  -3.596   8.752
  413   2HB   GLU  51          3HB       GLU  51 -22.946  -1.880   8.865
  414   1HG   GLU  51          2HG       GLU  51 -24.832  -2.333   7.107
  415   2HG   GLU  51          3HG       GLU  51 -24.609  -4.027   7.496
  416    H    GLU  52           HN       GLU  52 -20.111  -1.799   8.264
  417    HA   GLU  52           HA       GLU  52 -20.467   0.935   8.224
  418   1HB   GLU  52          2HB       GLU  52 -18.878  -0.627   9.637
  419   2HB   GLU  52          3HB       GLU  52 -17.720  -0.333   8.355
  420   1HG   GLU  52          2HG       GLU  52 -18.149   2.180   8.688
  421   2HG   GLU  52          3HG       GLU  52 -19.072   1.759  10.117
  422    H    LEU  53           HN       LEU  53 -18.201  -1.116   6.244
  423    HA   LEU  53           HA       LEU  53 -17.174   0.884   4.680
  424   1HB   LEU  53          2HB       LEU  53 -17.783  -1.978   3.925
  425   2HB   LEU  53          3HB       LEU  53 -16.721  -0.901   3.041
  426    HG   LEU  53           HG       LEU  53 -16.162  -1.400   5.943
  427   1HD1  LEU  53          1HD1      LEU  53 -14.713  -3.278   4.300
  428   2HD1  LEU  53          2HD1      LEU  53 -15.708  -3.563   5.748
  429   3HD1  LEU  53          3HD1      LEU  53 -16.467  -3.533   4.138
  430   1HD2  LEU  53          1HD2      LEU  53 -14.168  -0.489   5.502
  431   2HD2  LEU  53          2HD2      LEU  53 -13.974  -1.402   3.986
  432   3HD2  LEU  53          3HD2      LEU  53 -14.930   0.100   4.005
  433    H    ASP  54           HN       ASP  54 -20.114  -1.150   4.046
  434    HA   ASP  54           HA       ASP  54 -20.739   0.244   1.707
  435   1HB   ASP  54          2HB       ASP  54 -21.547  -2.090   2.599
  436   2HB   ASP  54          3HB       ASP  54 -22.760  -1.180   3.476
  437    H    LYS  55           HN       LYS  55 -20.341   2.459   2.950
  438    HA   LYS  55           HA       LYS  55 -22.538   3.261   4.638
  439   1HB   LYS  55          2HB       LYS  55 -19.937   3.895   4.690
  440   2HB   LYS  55          3HB       LYS  55 -20.489   5.196   3.655
  441   1HG   LYS  55          2HG       LYS  55 -22.162   5.886   5.334
  442   2HG   LYS  55          3HG       LYS  55 -21.760   4.513   6.347
  443   1HD   LYS  55          2HD       LYS  55 -20.244   5.856   7.377
  444   2HD   LYS  55          3HD       LYS  55 -19.269   5.724   5.927
  445   1HE   LYS  55          2HE       LYS  55 -21.259   7.692   5.351
  446   2HE   LYS  55          3HE       LYS  55 -20.689   8.048   6.969
  447   1HZ   LYS  55          1HZ       LYS  55 -18.719   8.650   6.185
  448   2HZ   LYS  55          2HZ       LYS  55 -18.596   7.394   5.148
  449   3HZ   LYS  55          3HZ       LYS  55 -19.428   8.731   4.716
  450    H    ASN  56           HN       ASN  56 -22.266   2.720   1.398
  451    HA   ASN  56           HA       ASN  56 -23.523   5.167   0.573
  452   1HB   ASN  56          2HB       ASN  56 -21.825   3.983  -0.878
  453   2HB   ASN  56          3HB       ASN  56 -22.906   2.610  -0.999
  454   1HD2  ASN  56          1HD2      ASN  56 -22.939   6.152  -1.376
  455   2HD2  ASN  56          2HD2      ASN  56 -23.900   6.211  -2.816
  456    H    GLY  57           HN       GLY  57 -24.510   2.482   2.230
  457   1HA   GLY  57          1HA       GLY  57 -26.376   1.185   2.324
  458   2HA   GLY  57          2HA       GLY  57 -27.160   2.745   2.170
  459    H    ASP  58           HN       ASP  58 -25.259   0.774  -0.220
  460    HA   ASP  58           HA       ASP  58 -27.567   1.019  -1.974
  461   1HB   ASP  58          2HB       ASP  58 -25.751   0.283  -3.727
  462   2HB   ASP  58          3HB       ASP  58 -25.750   1.935  -3.141
  463    H    GLY  59           HN       GLY  59 -25.091  -1.171  -0.548
  464   1HA   GLY  59          1HA       GLY  59 -25.927  -3.374   0.101
  465   2HA   GLY  59          2HA       GLY  59 -26.681  -3.490  -1.477
  466    H    GLU  60           HN       GLU  60 -23.952  -1.828  -2.227
  467    HA   GLU  60           HA       GLU  60 -22.264  -4.192  -2.279
  468   1HB   GLU  60          2HB       GLU  60 -21.684  -3.763  -4.652
  469   2HB   GLU  60          3HB       GLU  60 -23.389  -4.121  -4.463
  470   1HG   GLU  60          2HG       GLU  60 -23.472  -1.403  -4.183
  471   2HG   GLU  60          3HG       GLU  60 -22.060  -1.541  -5.213
  472    H    VAL  61           HN       VAL  61 -19.973  -3.732  -2.340
  473    HA   VAL  61           HA       VAL  61 -19.397  -1.014  -1.449
  474    HB   VAL  61           HB       VAL  61 -17.870  -3.616  -1.278
  475   1HG1  VAL  61          1HG1      VAL  61 -17.103  -0.828  -0.364
  476   2HG1  VAL  61          2HG1      VAL  61 -16.317  -2.314   0.221
  477   3HG1  VAL  61          3HG1      VAL  61 -16.233  -1.882  -1.504
  478   1HG2  VAL  61          1HG2      VAL  61 -18.660  -2.102   1.151
  479   2HG2  VAL  61          2HG2      VAL  61 -19.984  -2.857   0.232
  480   3HG2  VAL  61          3HG2      VAL  61 -18.643  -3.855   0.842
  481    H    SER  62           HN       SER  62 -17.133  -0.181  -2.183
  482    HA   SER  62           HA       SER  62 -16.166  -1.114  -4.637
  483   1HB   SER  62          2HB       SER  62 -17.079   1.592  -5.251
  484   2HB   SER  62          3HB       SER  62 -17.261   0.123  -6.188
  485    HG   SER  62           HG       SER  62 -19.085   1.400  -4.510
  486    H    PHE  63           HN       PHE  63 -14.515   0.622  -5.564
  487    HA   PHE  63           HA       PHE  63 -12.679   1.201  -3.652
  488   1HB   PHE  63          2HB       PHE  63 -12.531   1.243  -6.228
  489   2HB   PHE  63          3HB       PHE  63 -13.334   2.800  -6.199
  490    HD1  PHE  63           HD1      PHE  63 -10.600   1.450  -4.048
  491    HD2  PHE  63           HD2      PHE  63 -11.780   4.364  -6.898
  492    HE1  PHE  63           HE1      PHE  63  -8.378   2.591  -3.800
  493    HE2  PHE  63           HE2      PHE  63  -9.558   5.506  -6.650
  494    HZ   PHE  63           HZ       PHE  63  -7.884   4.606  -5.104
  495    H    GLU  64           HN       GLU  64 -15.471   3.179  -4.720
  496    HA   GLU  64           HA       GLU  64 -14.693   5.569  -3.629
  497   1HB   GLU  64          2HB       GLU  64 -17.313   5.853  -3.388
  498   2HB   GLU  64          3HB       GLU  64 -16.583   5.734  -4.976
  499   1HG   GLU  64          2HG       GLU  64 -17.663   3.785  -5.426
  500   2HG   GLU  64          3HG       GLU  64 -17.136   3.064  -3.917
  501    H    GLU  65           HN       GLU  65 -16.725   2.941  -2.147
  502    HA   GLU  65           HA       GLU  65 -16.789   4.266   0.341
  503   1HB   GLU  65          2HB       GLU  65 -17.469   1.401  -0.451
  504   2HB   GLU  65          3HB       GLU  65 -17.783   2.075   1.135
  505   1HG   GLU  65          2HG       GLU  65 -18.817   3.936  -0.804
  506   2HG   GLU  65          3HG       GLU  65 -19.360   2.338  -1.276
  507    H    PHE  66           HN       PHE  66 -14.636   1.947  -1.248
  508    HA   PHE  66           HA       PHE  66 -13.437   0.830   0.988
  509   1HB   PHE  66          2HB       PHE  66 -13.259   0.336  -1.582
  510   2HB   PHE  66          3HB       PHE  66 -12.116   1.663  -1.659
  511    HD1  PHE  66           HD1      PHE  66  -9.990   0.838  -1.967
  512    HD2  PHE  66           HD2      PHE  66 -12.560  -1.155   0.759
  513    HE1  PHE  66           HE1      PHE  66  -8.128  -0.730  -1.358
  514    HE2  PHE  66           HE2      PHE  66 -10.698  -2.724   1.368
  515    HZ   PHE  66           HZ       PHE  66  -8.504  -2.493   0.302
  516    H    GLN  67           HN       GLN  67 -12.870   3.944  -0.710
  517    HA   GLN  67           HA       GLN  67 -10.451   4.554   0.427
  518   1HB   GLN  67          2HB       GLN  67 -12.731   6.411  -0.382
  519   2HB   GLN  67          3HB       GLN  67 -11.095   6.944  -0.051
  520   1HG   GLN  67          2HG       GLN  67 -10.818   4.780  -1.876
  521   2HG   GLN  67          3HG       GLN  67 -12.176   5.713  -2.473
  522   1HE2  GLN  67          1HE2      GLN  67 -10.225   5.738  -4.120
  523   2HE2  GLN  67          2HE2      GLN  67  -9.271   7.183  -4.097
  524    H    VAL  68           HN       VAL  68 -13.550   4.206   1.914
  525    HA   VAL  68           HA       VAL  68 -13.135   6.093   4.015
  526    HB   VAL  68           HB       VAL  68 -15.036   3.751   3.795
  527   1HG1  VAL  68          1HG1      VAL  68 -15.994   4.397   5.725
  528   2HG1  VAL  68          2HG1      VAL  68 -14.464   5.254   6.026
  529   3HG1  VAL  68          3HG1      VAL  68 -15.850   6.127   5.330
  530   1HG2  VAL  68          1HG2      VAL  68 -16.142   4.896   2.236
  531   2HG2  VAL  68          2HG2      VAL  68 -16.344   6.246   3.378
  532   3HG2  VAL  68          3HG2      VAL  68 -14.927   6.195   2.303
  533    H    LEU  69           HN       LEU  69 -12.475   2.630   3.420
  534    HA   LEU  69           HA       LEU  69 -11.760   2.146   6.149
  535   1HB   LEU  69          2HB       LEU  69 -12.693   0.544   4.303
  536   2HB   LEU  69          3HB       LEU  69 -11.008   0.383   3.847
  537    HG   LEU  69           HG       LEU  69 -10.428  -0.491   6.025
  538   1HD1  LEU  69          1HD1      LEU  69 -11.566   0.220   7.799
  539   2HD1  LEU  69          2HD1      LEU  69 -12.965   0.698   6.808
  540   3HD1  LEU  69          3HD1      LEU  69 -12.808  -0.982   7.373
  541   1HD2  LEU  69          1HD2      LEU  69 -11.786  -1.845   4.135
  542   2HD2  LEU  69          2HD2      LEU  69 -11.172  -2.587   5.632
  543   3HD2  LEU  69          3HD2      LEU  69 -12.876  -2.085   5.521
  544    H    VAL  70           HN       VAL  70 -10.167   3.182   3.148
  545    HA   VAL  70           HA       VAL  70  -7.560   2.570   3.697
  546    HB   VAL  70           HB       VAL  70  -8.972   4.746   2.221
  547   1HG1  VAL  70          1HG1      VAL  70  -7.269   6.169   2.705
  548   2HG1  VAL  70          2HG1      VAL  70  -6.151   4.857   3.149
  549   3HG1  VAL  70          3HG1      VAL  70  -6.436   5.240   1.435
  550   1HG2  VAL  70          1HG2      VAL  70  -8.657   2.421   1.316
  551   2HG2  VAL  70          2HG2      VAL  70  -7.987   3.713   0.291
  552   3HG2  VAL  70          3HG2      VAL  70  -6.904   2.726   1.302
  553    H    LYS  71           HN       LYS  71  -9.693   4.948   5.227
  554    HA   LYS  71           HA       LYS  71  -7.598   6.447   6.422
  555   1HB   LYS  71          2HB       LYS  71 -10.293   6.805   6.016
  556   2HB   LYS  71          3HB       LYS  71 -10.239   6.462   7.733
  557   1HG   LYS  71          2HG       LYS  71  -8.049   8.220   7.227
  558   2HG   LYS  71          3HG       LYS  71  -9.399   8.871   6.319
  559   1HD   LYS  71          2HD       LYS  71  -9.675   9.872   8.439
  560   2HD   LYS  71          3HD       LYS  71 -10.791   8.523   8.507
  561   1HE   LYS  71          2HE       LYS  71  -8.395   7.378   9.390
  562   2HE   LYS  71          3HE       LYS  71  -8.318   8.994  10.063
  563   1HZ   LYS  71          1HZ       LYS  71 -10.206   6.882  10.615
  564   2HZ   LYS  71          2HZ       LYS  71  -9.554   7.986  11.626
  565   3HZ   LYS  71          3HZ       LYS  71 -10.791   8.406  10.645
  566    H    LYS  72           HN       LYS  72  -9.733   3.728   7.472
  567    HA   LYS  72           HA       LYS  72  -8.499   3.635  10.050
  568   1HB   LYS  72          2HB       LYS  72 -10.458   1.822   8.618
  569   2HB   LYS  72          3HB       LYS  72  -9.880   1.525  10.245
  570   1HG   LYS  72          2HG       LYS  72 -11.218   4.131   9.383
  571   2HG   LYS  72          3HG       LYS  72 -12.086   2.794  10.109
  572   1HD   LYS  72          2HD       LYS  72 -10.099   3.038  11.949
  573   2HD   LYS  72          3HD       LYS  72 -10.118   4.688  11.361
  574   1HE   LYS  72          2HE       LYS  72 -12.845   3.673  11.812
  575   2HE   LYS  72          3HE       LYS  72 -11.872   3.567  13.265
  576   1HZ   LYS  72          1HZ       LYS  72 -12.737   5.900  11.825
  577   2HZ   LYS  72          2HZ       LYS  72 -12.489   5.695  13.426
  578   3HZ   LYS  72          3HZ       LYS  72 -11.223   5.975  12.433
  579    H    ILE  73           HN       ILE  73  -7.539   2.739   6.917
  580    HA   ILE  73           HA       ILE  73  -6.217   0.306   7.604
  581    HB   ILE  73           HB       ILE  73  -6.378   2.105   5.229
  582   1HG1  ILE  73          2HG1      ILE  73  -6.716  -0.894   5.476
  583   2HG1  ILE  73          3HG1      ILE  73  -8.019   0.244   5.752
  584   1HG2  ILE  73          1HG2      ILE  73  -4.678   0.856   4.041
  585   2HG2  ILE  73          2HG2      ILE  73  -3.970   1.623   5.483
  586   3HG2  ILE  73          3HG2      ILE  73  -4.336  -0.119   5.490
  587   1HD1  ILE  73          1HD1      ILE  73  -8.265   0.710   3.523
  588   2HD1  ILE  73          2HD1      ILE  73  -6.508   0.714   3.233
  589   3HD1  ILE  73          3HD1      ILE  73  -7.397  -0.827   3.298
  590    H    SER  74           HN       SER  74  -5.154   3.719   6.972
  591    HA   SER  74           HA       SER  74  -2.506   3.111   7.722
  592   1HB   SER  74          2HB       SER  74  -3.747   5.165   6.348
  593   2HB   SER  74          3HB       SER  74  -3.381   5.948   7.873
  594    HG   SER  74           HG       SER  74  -1.133   5.198   7.603
  595    H    GLN  75           HN       GLN  75  -5.408   4.488   9.325
  596    HA   GLN  75           HA       GLN  75  -4.029   5.308  11.628
  597   1HB   GLN  75          2HB       GLN  75  -6.503   5.806  10.614
  598   2HB   GLN  75          3HB       GLN  75  -6.934   4.596  11.806
  599   1HG   GLN  75          2HG       GLN  75  -7.028   6.906  12.749
  600   2HG   GLN  75          3HG       GLN  75  -5.874   5.899  13.601
  601   1HE2  GLN  75          1HE2      GLN  75  -5.887   7.802  10.584
  602   2HE2  GLN  75          2HE2      GLN  75  -4.433   8.696  10.883
  Start of MODEL    3
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   3.035  -0.475  -1.049
    3   1HB   LYS   1          2HB       LYS   1   0.280  -0.788  -2.149
    4   2HB   LYS   1          3HB       LYS   1   1.562  -0.445  -3.293
    5   1HG   LYS   1          2HG       LYS   1   2.889  -2.364  -2.376
    6   2HG   LYS   1          3HG       LYS   1   1.600  -2.709  -1.241
    7   1HD   LYS   1          2HD       LYS   1   0.027  -2.977  -3.243
    8   2HD   LYS   1          3HD       LYS   1   1.430  -2.842  -4.285
    9   1HE   LYS   1          2HE       LYS   1   1.093  -5.197  -3.980
   10   2HE   LYS   1          3HE       LYS   1   2.466  -4.793  -2.968
   11   1HZ   LYS   1          1HZ       LYS   1   0.286  -6.053  -2.117
   12   2HZ   LYS   1          2HZ       LYS   1   1.308  -5.235  -1.140
   13   3HZ   LYS   1          3HZ       LYS   1  -0.064  -4.523  -1.666
   14    H    SER   2           HN       SER   2   0.346   1.926  -1.395
   15    HA   SER   2           HA       SER   2   1.714   3.613  -3.087
   16   1HB   SER   2          2HB       SER   2  -0.754   3.607  -1.602
   17   2HB   SER   2          3HB       SER   2   0.020   5.157  -1.338
   18    HG   SER   2           HG       SER   2  -1.016   4.030  -3.727
   19    HA   PRO   3           HA       PRO   3   4.308   5.946  -0.467
   20   1HB   PRO   3          2HB       PRO   3   3.867   8.578  -1.057
   21   2HB   PRO   3          3HB       PRO   3   4.820   7.515  -2.073
   22   1HG   PRO   3          2HG       PRO   3   2.074   8.522  -2.504
   23   2HG   PRO   3          3HG       PRO   3   3.184   7.828  -3.669
   24   1HD   PRO   3          2HD       PRO   3   0.924   6.533  -2.471
   25   2HD   PRO   3          3HD       PRO   3   2.101   5.805  -3.545
   26    H    GLU   4           HN       GLU   4   1.017   7.101  -0.291
   27    HA   GLU   4           HA       GLU   4   1.232   8.569   1.986
   28   1HB   GLU   4          2HB       GLU   4  -0.831   7.641   0.345
   29   2HB   GLU   4          3HB       GLU   4  -1.218   6.925   1.897
   30   1HG   GLU   4          2HG       GLU   4  -0.373   9.782   2.028
   31   2HG   GLU   4          3HG       GLU   4  -1.869   9.506   1.158
   32    H    GLU   5           HN       GLU   5   0.711   5.004   1.633
   33    HA   GLU   5           HA       GLU   5   0.503   4.569   4.388
   34   1HB   GLU   5          2HB       GLU   5   0.638   2.954   1.918
   35   2HB   GLU   5          3HB       GLU   5   1.384   2.158   3.290
   36   1HG   GLU   5          2HG       GLU   5  -0.988   3.257   4.353
   37   2HG   GLU   5          3HG       GLU   5  -1.463   2.687   2.765
   38    H    LEU   6           HN       LEU   6   3.218   4.860   2.119
   39    HA   LEU   6           HA       LEU   6   5.155   3.583   3.691
   40   1HB   LEU   6          2HB       LEU   6   5.147   5.506   1.407
   41   2HB   LEU   6          3HB       LEU   6   6.643   5.256   2.284
   42    HG   LEU   6           HG       LEU   6   5.053   2.956   1.137
   43   1HD1  LEU   6          1HD1      LEU   6   5.749   3.341  -0.941
   44   2HD1  LEU   6          2HD1      LEU   6   6.184   4.979  -0.398
   45   3HD1  LEU   6          3HD1      LEU   6   7.410   3.689  -0.404
   46   1HD2  LEU   6          1HD2      LEU   6   7.990   3.177   1.847
   47   2HD2  LEU   6          2HD2      LEU   6   6.738   2.464   2.892
   48   3HD2  LEU   6          3HD2      LEU   6   7.114   1.721   1.319
   49    H    LYS   7           HN       LYS   7   3.896   6.951   3.577
   50    HA   LYS   7           HA       LYS   7   5.813   8.017   5.323
   51   1HB   LYS   7          2HB       LYS   7   3.823   9.018   3.741
   52   2HB   LYS   7          3HB       LYS   7   3.112   9.220   5.330
   53   1HG   LYS   7          2HG       LYS   7   4.350  11.133   5.447
   54   2HG   LYS   7          3HG       LYS   7   5.703  10.074   5.797
   55   1HD   LYS   7          2HD       LYS   7   6.475  11.412   3.989
   56   2HD   LYS   7          3HD       LYS   7   6.037   9.893   3.233
   57   1HE   LYS   7          2HE       LYS   7   3.707  11.655   3.363
   58   2HE   LYS   7          3HE       LYS   7   5.045  12.484   2.593
   59   1HZ   LYS   7          1HZ       LYS   7   3.960   9.864   1.826
   60   2HZ   LYS   7          2HZ       LYS   7   3.837  11.257   0.982
   61   3HZ   LYS   7          3HZ       LYS   7   5.291  10.534   1.156
   62    H    GLY   8           HN       GLY   8   2.435   6.812   5.897
   63   1HA   GLY   8          1HA       GLY   8   2.383   7.195   8.647
   64   2HA   GLY   8          2HA       GLY   8   1.455   6.009   7.751
   65    H    ILE   9           HN       ILE   9   3.156   4.147   6.804
   66    HA   ILE   9           HA       ILE   9   3.797   2.625   9.010
   67    HB   ILE   9           HB       ILE   9   4.579   2.539   6.115
   68   1HG1  ILE   9          2HG1      ILE   9   2.806   0.814   7.869
   69   2HG1  ILE   9          3HG1      ILE   9   2.272   1.987   6.681
   70   1HG2  ILE   9          1HG2      ILE   9   6.476   1.651   7.468
   71   2HG2  ILE   9          2HG2      ILE   9   5.361   0.451   8.164
   72   3HG2  ILE   9          3HG2      ILE   9   5.701   0.441   6.417
   73   1HD1  ILE   9          1HD1      ILE   9   3.339   0.691   4.865
   74   2HD1  ILE   9          2HD1      ILE   9   3.967  -0.475   6.053
   75   3HD1  ILE   9          3HD1      ILE   9   2.213  -0.338   5.782
   76    H    PHE  10           HN       PHE  10   5.919   4.714   6.950
   77    HA   PHE  10           HA       PHE  10   8.317   4.135   8.113
   78   1HB   PHE  10          2HB       PHE  10   8.115   5.595   6.166
   79   2HB   PHE  10          3HB       PHE  10   7.000   6.663   6.995
   80    HD1  PHE  10           HD1      PHE  10  10.462   5.923   6.309
   81    HD2  PHE  10           HD2      PHE  10   7.863   8.182   8.789
   82    HE1  PHE  10           HE1      PHE  10  12.371   7.425   6.943
   83    HE2  PHE  10           HE2      PHE  10   9.772   9.683   9.423
   84    HZ   PHE  10           HZ       PHE  10  12.003   9.287   8.492
   85    H    GLU  11           HN       GLU  11   5.999   6.766   9.084
   86    HA   GLU  11           HA       GLU  11   7.525   7.605  11.233
   87   1HB   GLU  11          2HB       GLU  11   5.115   8.353   9.996
   88   2HB   GLU  11          3HB       GLU  11   4.630   7.936  11.627
   89   1HG   GLU  11          2HG       GLU  11   7.033   9.418  11.935
   90   2HG   GLU  11          3HG       GLU  11   6.138  10.263  10.689
   91    H    LYS  12           HN       LYS  12   5.009   5.069  10.901
   92    HA   LYS  12           HA       LYS  12   4.576   4.597  13.602
   93   1HB   LYS  12          2HB       LYS  12   3.162   3.747  11.776
   94   2HB   LYS  12          3HB       LYS  12   4.447   2.674  11.261
   95   1HG   LYS  12          2HG       LYS  12   4.220   2.120  14.002
   96   2HG   LYS  12          3HG       LYS  12   2.559   2.390  13.514
   97   1HD   LYS  12          2HD       LYS  12   2.519   0.548  12.091
   98   2HD   LYS  12          3HD       LYS  12   4.221   0.679  11.691
   99   1HE   LYS  12          2HE       LYS  12   4.443   0.076  14.345
  100   2HE   LYS  12          3HE       LYS  12   2.913  -0.709  14.008
  101   1HZ   LYS  12          1HZ       LYS  12   4.456  -1.414  11.919
  102   2HZ   LYS  12          2HZ       LYS  12   5.520  -1.433  13.157
  103   3HZ   LYS  12          3HZ       LYS  12   4.164  -2.340  13.232
  104    H    TYR  13           HN       TYR  13   7.302   3.848  11.493
  105    HA   TYR  13           HA       TYR  13   8.393   2.005  13.473
  106   1HB   TYR  13          2HB       TYR  13   8.786   2.844  10.590
  107   2HB   TYR  13          3HB       TYR  13  10.236   2.317  11.423
  108    HD1  TYR  13           HD1      TYR  13   6.760   1.236  10.578
  109    HD2  TYR  13           HD2      TYR  13  10.723   0.024  11.642
  110    HE1  TYR  13           HE1      TYR  13   6.148  -1.189  10.122
  111    HE2  TYR  13           HE2      TYR  13  10.097  -2.397  11.183
  112    HH   TYR  13           HH       TYR  13   7.221  -3.538  11.146
  113    H    ALA  14           HN       ALA  14   9.083   5.167  11.862
  114    HA   ALA  14           HA       ALA  14  11.549   5.605  13.080
  115   1HB   ALA  14          1HB       ALA  14  10.240   6.813  11.129
  116   2HB   ALA  14          2HB       ALA  14   9.638   7.847  12.446
  117   3HB   ALA  14          3HB       ALA  14  11.387   7.727  12.137
  118    H    ALA  15           HN       ALA  15   8.264   5.693  14.315
  119    HA   ALA  15           HA       ALA  15   8.982   7.354  16.567
  120   1HB   ALA  15          1HB       ALA  15   6.741   7.406  15.397
  121   2HB   ALA  15          2HB       ALA  15   6.435   5.775  16.042
  122   3HB   ALA  15          3HB       ALA  15   6.650   7.147  17.155
  123    H    LYS  16           HN       LYS  16   9.008   3.987  15.626
  124    HA   LYS  16           HA       LYS  16   8.580   2.742  18.050
  125   1HB   LYS  16          2HB       LYS  16   9.282   1.993  15.474
  126   2HB   LYS  16          3HB       LYS  16  10.682   1.517  16.413
  127   1HG   LYS  16          2HG       LYS  16   9.011   0.445  18.084
  128   2HG   LYS  16          3HG       LYS  16   7.785   0.685  16.855
  129   1HD   LYS  16          2HD       LYS  16   8.698  -0.908  15.418
  130   2HD   LYS  16          3HD       LYS  16  10.338  -0.631  15.970
  131   1HE   LYS  16          2HE       LYS  16   9.789  -2.774  16.850
  132   2HE   LYS  16          3HE       LYS  16   9.605  -1.697  18.219
  133   1HZ   LYS  16          1HZ       LYS  16   7.184  -1.622  17.085
  134   2HZ   LYS  16          2HZ       LYS  16   7.617  -3.174  16.815
  135   3HZ   LYS  16          3HZ       LYS  16   7.594  -2.586  18.338
  136    H    GLU  17           HN       GLU  17  11.821   3.531  16.594
  137    HA   GLU  17           HA       GLU  17  12.731   3.878  19.345
  138   1HB   GLU  17          2HB       GLU  17  14.128   2.586  16.975
  139   2HB   GLU  17          3HB       GLU  17  15.025   3.157  18.368
  140   1HG   GLU  17          2HG       GLU  17  12.901   1.691  19.499
  141   2HG   GLU  17          3HG       GLU  17  13.347   0.752  18.088
  142    H    GLY  18           HN       GLY  18  13.706   5.826  19.821
  143   1HA   GLY  18          1HA       GLY  18  14.622   7.861  19.527
  144   2HA   GLY  18          2HA       GLY  18  15.153   7.359  17.934
  145    H    ASP  19           HN       ASP  19  14.481   9.886  17.864
  146    HA   ASP  19           HA       ASP  19  11.822  10.553  17.790
  147   1HB   ASP  19          2HB       ASP  19  14.038  11.987  17.618
  148   2HB   ASP  19          3HB       ASP  19  13.856  11.764  15.889
  149    HA   PRO  20           HA       PRO  20  10.645   8.674  13.990
  150   1HB   PRO  20          2HB       PRO  20   8.199   9.842  13.643
  151   2HB   PRO  20          3HB       PRO  20   8.461   8.458  14.685
  152   1HG   PRO  20          2HG       PRO  20   8.022  11.284  15.434
  153   2HG   PRO  20          3HG       PRO  20   7.862   9.848  16.426
  154   1HD   PRO  20          2HD       PRO  20  10.028  11.727  16.463
  155   2HD   PRO  20          3HD       PRO  20   9.922  10.231  17.370
  156    H    ASN  21           HN       ASN  21  11.560  11.808  14.346
  157    HA   ASN  21           HA       ASN  21  10.912  12.521  11.643
  158   1HB   ASN  21          2HB       ASN  21  12.437  13.955  13.877
  159   2HB   ASN  21          3HB       ASN  21  12.209  14.653  12.286
  160   1HD2  ASN  21          1HD2      ASN  21  10.024  14.932  11.494
  161   2HD2  ASN  21          2HD2      ASN  21   8.736  15.287  12.597
  162    H    GLN  22           HN       GLN  22  13.121  10.496  13.028
  163    HA   GLN  22           HA       GLN  22  14.972  10.889  10.881
  164   1HB   GLN  22          2HB       GLN  22  16.872  10.627  12.776
  165   2HB   GLN  22          3HB       GLN  22  16.319  12.192  12.213
  166   1HG   GLN  22          2HG       GLN  22  14.613  12.206  14.093
  167   2HG   GLN  22          3HG       GLN  22  15.308  10.710  14.686
  168   1HE2  GLN  22          1HE2      GLN  22  15.969  11.557  16.612
  169   2HE2  GLN  22          2HE2      GLN  22  17.284  12.672  16.785
  170    H    LEU  23           HN       LEU  23  15.541   8.897  10.092
  171    HA   LEU  23           HA       LEU  23  14.724   6.596  11.643
  172   1HB   LEU  23          2HB       LEU  23  15.385   7.181   8.806
  173   2HB   LEU  23          3HB       LEU  23  15.682   5.551   9.374
  174    HG   LEU  23           HG       LEU  23  13.356   6.344   8.306
  175   1HD1  LEU  23          1HD1      LEU  23  12.689   4.450  10.364
  176   2HD1  LEU  23          2HD1      LEU  23  12.925   4.192   8.618
  177   3HD1  LEU  23          3HD1      LEU  23  14.314   4.103   9.727
  178   1HD2  LEU  23          1HD2      LEU  23  13.125   7.955  10.321
  179   2HD2  LEU  23          2HD2      LEU  23  11.714   7.000   9.808
  180   3HD2  LEU  23          3HD2      LEU  23  12.661   6.496  11.228
  181    H    SER  24           HN       SER  24  16.141   4.820  12.166
  182    HA   SER  24           HA       SER  24  18.939   5.647  12.205
  183   1HB   SER  24          2HB       SER  24  17.343   4.192  14.356
  184   2HB   SER  24          3HB       SER  24  19.091   4.312  14.376
  185    HG   SER  24           HG       SER  24  19.001   6.456  14.834
  186    H    LYS  25           HN       LYS  25  20.467   3.673  12.458
  187    HA   LYS  25           HA       LYS  25  20.040   1.910  10.381
  188   1HB   LYS  25          2HB       LYS  25  22.239   2.482  11.312
  189   2HB   LYS  25          3HB       LYS  25  21.857   1.628  12.793
  190   1HG   LYS  25          2HG       LYS  25  21.383  -0.429  11.212
  191   2HG   LYS  25          3HG       LYS  25  22.290   0.477  10.017
  192   1HD   LYS  25          2HD       LYS  25  23.625   0.408  12.659
  193   2HD   LYS  25          3HD       LYS  25  23.383  -1.189  11.980
  194   1HE   LYS  25          2HE       LYS  25  24.954  -0.860  10.354
  195   2HE   LYS  25          3HE       LYS  25  24.332   0.728   9.950
  196   1HZ   LYS  25          1HZ       LYS  25  26.619   0.538  11.009
  197   2HZ   LYS  25          2HZ       LYS  25  25.620   1.706  11.560
  198   3HZ   LYS  25          3HZ       LYS  25  25.829   0.335  12.424
  199    H    GLU  26           HN       GLU  26  19.877   1.188  13.944
  200    HA   GLU  26           HA       GLU  26  18.911  -1.349  13.648
  201   1HB   GLU  26          2HB       GLU  26  19.348   0.520  15.777
  202   2HB   GLU  26          3HB       GLU  26  17.737  -0.133  15.998
  203   1HG   GLU  26          2HG       GLU  26  19.203  -2.408  15.329
  204   2HG   GLU  26          3HG       GLU  26  20.369  -1.479  16.250
  205    H    GLU  27           HN       GLU  27  17.186   1.799  13.668
  206    HA   GLU  27           HA       GLU  27  14.630   0.739  13.880
  207   1HB   GLU  27          2HB       GLU  27  15.875   3.330  13.329
  208   2HB   GLU  27          3HB       GLU  27  14.437   3.113  12.352
  209   1HG   GLU  27          2HG       GLU  27  13.811   2.144  14.984
  210   2HG   GLU  27          3HG       GLU  27  14.625   3.682  15.188
  211    H    LEU  28           HN       LEU  28  16.489   1.863  10.959
  212    HA   LEU  28           HA       LEU  28  14.617   1.205   9.066
  213   1HB   LEU  28          2HB       LEU  28  16.997   2.359   9.008
  214   2HB   LEU  28          3HB       LEU  28  17.515   0.761   8.510
  215    HG   LEU  28           HG       LEU  28  16.275   0.829   6.519
  216   1HD1  LEU  28          1HD1      LEU  28  14.685   2.831   6.087
  217   2HD1  LEU  28          2HD1      LEU  28  14.123   1.475   7.094
  218   3HD1  LEU  28          3HD1      LEU  28  14.666   2.987   7.860
  219   1HD2  LEU  28          1HD2      LEU  28  18.277   2.360   6.642
  220   2HD2  LEU  28          2HD2      LEU  28  17.097   2.730   5.363
  221   3HD2  LEU  28          3HD2      LEU  28  17.135   3.709   6.849
  222    H    LYS  29           HN       LYS  29  17.205  -0.870  10.516
  223    HA   LYS  29           HA       LYS  29  16.984  -3.105   9.058
  224   1HB   LYS  29          2HB       LYS  29  18.521  -2.832  10.932
  225   2HB   LYS  29          3HB       LYS  29  17.196  -2.899  12.076
  226   1HG   LYS  29          2HG       LYS  29  16.670  -5.212  11.415
  227   2HG   LYS  29          3HG       LYS  29  17.856  -5.156  10.126
  228   1HD   LYS  29          2HD       LYS  29  19.641  -4.715  11.907
  229   2HD   LYS  29          3HD       LYS  29  18.416  -5.012  13.124
  230   1HE   LYS  29          2HE       LYS  29  18.101  -7.230  11.490
  231   2HE   LYS  29          3HE       LYS  29  19.824  -6.942  11.346
  232   1HZ   LYS  29          1HZ       LYS  29  18.509  -8.103  13.451
  233   2HZ   LYS  29          2HZ       LYS  29  20.096  -7.727  13.369
  234   3HZ   LYS  29          3HZ       LYS  29  19.038  -6.666  14.017
  235    H    LEU  30           HN       LEU  30  14.818  -2.272  11.855
  236    HA   LEU  30           HA       LEU  30  13.172  -4.471  11.638
  237   1HB   LEU  30          2HB       LEU  30  12.477  -1.665  12.520
  238   2HB   LEU  30          3HB       LEU  30  11.529  -3.103  12.846
  239    HG   LEU  30           HG       LEU  30  14.182  -2.281  13.997
  240   1HD1  LEU  30          1HD1      LEU  30  13.118  -2.246  16.011
  241   2HD1  LEU  30          2HD1      LEU  30  11.736  -1.880  14.950
  242   3HD1  LEU  30          3HD1      LEU  30  11.974  -3.535  15.562
  243   1HD2  LEU  30          1HD2      LEU  30  13.097  -5.100  13.845
  244   2HD2  LEU  30          2HD2      LEU  30  14.683  -4.496  13.306
  245   3HD2  LEU  30          3HD2      LEU  30  14.303  -4.573  15.043
  246    H    LEU  31           HN       LEU  31  12.704  -1.169  10.189
  247    HA   LEU  31           HA       LEU  31  10.400  -1.706   8.819
  248   1HB   LEU  31          2HB       LEU  31  11.845   0.450   9.149
  249   2HB   LEU  31          3HB       LEU  31  12.555  -0.009   7.614
  250    HG   LEU  31           HG       LEU  31   9.791  -0.186   7.183
  251   1HD1  LEU  31          1HD1      LEU  31   9.515   2.460   7.863
  252   2HD1  LEU  31          2HD1      LEU  31   8.834   1.080   8.758
  253   3HD1  LEU  31          3HD1      LEU  31  10.384   1.792   9.266
  254   1HD2  LEU  31          1HD2      LEU  31  12.058   1.495   6.310
  255   2HD2  LEU  31          2HD2      LEU  31  10.838   0.613   5.360
  256   3HD2  LEU  31          3HD2      LEU  31  10.442   2.199   6.065
  257    H    LEU  32           HN       LEU  32  13.739  -1.818   7.375
  258    HA   LEU  32           HA       LEU  32  13.022  -2.982   5.010
  259   1HB   LEU  32          2HB       LEU  32  15.570  -3.463   6.559
  260   2HB   LEU  32          3HB       LEU  32  15.339  -3.682   4.836
  261    HG   LEU  32           HG       LEU  32  14.994  -1.002   6.195
  262   1HD1  LEU  32          1HD1      LEU  32  17.241  -1.643   6.682
  263   2HD1  LEU  32          2HD1      LEU  32  17.501  -2.225   5.020
  264   3HD1  LEU  32          3HD1      LEU  32  17.291  -0.485   5.331
  265   1HD2  LEU  32          1HD2      LEU  32  15.621  -0.293   3.771
  266   2HD2  LEU  32          2HD2      LEU  32  15.124  -1.948   3.346
  267   3HD2  LEU  32          3HD2      LEU  32  13.967  -0.845   4.128
  268    H    GLN  33           HN       GLN  33  12.993  -4.345   8.226
  269    HA   GLN  33           HA       GLN  33  13.302  -7.021   7.461
  270   1HB   GLN  33          2HB       GLN  33  13.208  -5.656   9.851
  271   2HB   GLN  33          3HB       GLN  33  11.643  -6.445   9.865
  272   1HG   GLN  33          2HG       GLN  33  12.873  -8.632   9.274
  273   2HG   GLN  33          3HG       GLN  33  14.372  -7.778   9.582
  274   1HE2  GLN  33          1HE2      GLN  33  14.795  -6.933  11.663
  275   2HE2  GLN  33          2HE2      GLN  33  14.061  -7.597  13.085
  276    H    THR  34           HN       THR  34  10.420  -4.914   8.070
  277    HA   THR  34           HA       THR  34   8.722  -7.051   6.993
  278    HB   THR  34           HB       THR  34   8.458  -4.848   8.990
  279    HG1  THR  34           HG1      THR  34   8.363  -7.243   9.299
  280   1HG2  THR  34          1HG2      THR  34   6.814  -3.949   7.425
  281   2HG2  THR  34          2HG2      THR  34   6.231  -5.582   7.024
  282   3HG2  THR  34          3HG2      THR  34   5.917  -4.896   8.636
  283    H    GLU  35           HN       GLU  35   9.345  -3.497   6.657
  284    HA   GLU  35           HA       GLU  35   7.679  -3.003   4.608
  285   1HB   GLU  35          2HB       GLU  35   8.904  -1.201   5.608
  286   2HB   GLU  35          3HB       GLU  35  10.452  -1.923   5.217
  287   1HG   GLU  35          2HG       GLU  35  10.129  -0.165   3.612
  288   2HG   GLU  35          3HG       GLU  35   9.849  -1.661   2.742
  289    H    PHE  36           HN       PHE  36  11.142  -4.080   4.297
  290    HA   PHE  36           HA       PHE  36  10.407  -5.543   1.917
  291   1HB   PHE  36          2HB       PHE  36  12.416  -3.221   2.076
  292   2HB   PHE  36          3HB       PHE  36  12.418  -4.364   0.748
  293    HD1  PHE  36           HD1      PHE  36  11.784  -1.209   1.090
  294    HD2  PHE  36           HD2      PHE  36   9.506  -4.698   0.285
  295    HE1  PHE  36           HE1      PHE  36  10.075   0.183  -0.112
  296    HE2  PHE  36           HE2      PHE  36   7.798  -3.306  -0.916
  297    HZ   PHE  36           HZ       PHE  36   8.103  -0.882  -1.100
  298    HA   PRO  37           HA       PRO  37  13.494  -7.676   4.363
  299   1HB   PRO  37          2HB       PRO  37  12.402 -10.172   4.148
  300   2HB   PRO  37          3HB       PRO  37  12.033  -9.075   5.464
  301   1HG   PRO  37          2HG       PRO  37  10.368  -9.794   3.129
  302   2HG   PRO  37          3HG       PRO  37   9.878  -9.057   4.642
  303   1HD   PRO  37          2HD       PRO  37  10.212  -7.736   2.118
  304   2HD   PRO  37          3HD       PRO  37   9.835  -6.981   3.654
  305    H    SER  38           HN       SER  38  12.747  -7.440   1.213
  306    HA   SER  38           HA       SER  38  14.493  -9.573   0.398
  307   1HB   SER  38          2HB       SER  38  12.284  -8.325  -0.757
  308   2HB   SER  38          3HB       SER  38  13.618  -7.640  -1.664
  309    HG   SER  38           HG       SER  38  12.529  -9.896  -2.231
  310    H    LEU  39           HN       LEU  39  14.458  -6.048   0.860
  311    HA   LEU  39           HA       LEU  39  16.749  -5.489  -0.686
  312   1HB   LEU  39          2HB       LEU  39  14.838  -4.089   0.902
  313   2HB   LEU  39          3HB       LEU  39  16.439  -3.619   1.439
  314    HG   LEU  39           HG       LEU  39  15.319  -2.224  -0.394
  315   1HD1  LEU  39          1HD1      LEU  39  17.481  -1.587  -0.074
  316   2HD1  LEU  39          2HD1      LEU  39  18.127  -3.225  -0.332
  317   3HD1  LEU  39          3HD1      LEU  39  17.621  -2.239  -1.724
  318   1HD2  LEU  39          1HD2      LEU  39  16.411  -3.897  -2.519
  319   2HD2  LEU  39          2HD2      LEU  39  15.062  -4.676  -1.658
  320   3HD2  LEU  39          3HD2      LEU  39  14.839  -3.072  -2.397
  321    H    LEU  40           HN       LEU  40  16.232  -7.008   2.410
  322    HA   LEU  40           HA       LEU  40  18.784  -6.333   3.488
  323   1HB   LEU  40          2HB       LEU  40  16.690  -8.375   4.232
  324   2HB   LEU  40          3HB       LEU  40  18.184  -8.154   5.122
  325    HG   LEU  40           HG       LEU  40  16.100  -5.993   4.701
  326   1HD1  LEU  40          1HD1      LEU  40  16.588  -7.284   7.356
  327   2HD1  LEU  40          2HD1      LEU  40  15.129  -6.488   6.716
  328   3HD1  LEU  40          3HD1      LEU  40  15.568  -8.122   6.162
  329   1HD2  LEU  40          1HD2      LEU  40  17.362  -4.895   6.599
  330   2HD2  LEU  40          2HD2      LEU  40  18.651  -6.091   6.321
  331   3HD2  LEU  40          3HD2      LEU  40  18.201  -4.952   5.030
  332    H    LYS  41           HN       LYS  41  17.443  -8.836   1.359
  333    HA   LYS  41           HA       LYS  41  19.612 -10.632   1.665
  334   1HB   LYS  41          2HB       LYS  41  17.470 -10.349  -0.461
  335   2HB   LYS  41          3HB       LYS  41  18.638 -11.654  -0.417
  336   1HG   LYS  41          2HG       LYS  41  17.699 -11.682   2.190
  337   2HG   LYS  41          3HG       LYS  41  16.266 -11.178   1.316
  338   1HD   LYS  41          2HD       LYS  41  16.011 -13.216   0.285
  339   2HD   LYS  41          3HD       LYS  41  17.732 -13.413   0.017
  340   1HE   LYS  41          2HE       LYS  41  17.007 -13.534   2.884
  341   2HE   LYS  41          3HE       LYS  41  16.209 -14.772   1.934
  342   1HZ   LYS  41          1HZ       LYS  41  18.841 -14.713   2.748
  343   2HZ   LYS  41          2HZ       LYS  41  18.108 -15.847   1.828
  344   3HZ   LYS  41          3HZ       LYS  41  18.865 -14.585   1.120
  345    H    GLY  42           HN       GLY  42  18.896  -7.819  -0.423
  346   1HA   GLY  42          1HA       GLY  42  20.609  -8.008  -2.476
  347   2HA   GLY  42          2HA       GLY  42  20.355  -6.524  -1.579
  348    H    MET  43           HN       MET  43  22.826  -7.072  -2.836
  349    HA   MET  43           HA       MET  43  24.616  -8.268  -1.024
  350   1HB   MET  43          2HB       MET  43  25.059  -6.334  -3.367
  351   2HB   MET  43          3HB       MET  43  26.339  -7.244  -2.590
  352   1HG   MET  43          2HG       MET  43  24.562  -9.274  -3.162
  353   2HG   MET  43          3HG       MET  43  24.234  -8.181  -4.491
  354   1HE   MET  43          1HE       MET  43  25.417 -10.919  -5.470
  355   2HE   MET  43          2HE       MET  43  24.957  -9.434  -6.337
  356   3HE   MET  43          3HE       MET  43  26.550 -10.176  -6.624
  357    H    SER  44           HN       SER  44  22.890  -5.412  -0.776
  358    HA   SER  44           HA       SER  44  25.060  -3.870   0.312
  359   1HB   SER  44          2HB       SER  44  22.095  -3.173   0.264
  360   2HB   SER  44          3HB       SER  44  23.434  -2.067   0.495
  361    HG   SER  44           HG       SER  44  22.836  -3.568  -1.910
  362    H    THR  45           HN       THR  45  25.718  -4.756   2.285
  363    HA   THR  45           HA       THR  45  23.963  -5.965   4.115
  364    HB   THR  45           HB       THR  45  25.981  -5.819   5.601
  365    HG1  THR  45           HG1      THR  45  27.708  -4.472   4.799
  366   1HG2  THR  45          1HG2      THR  45  26.560  -7.593   4.224
  367   2HG2  THR  45          2HG2      THR  45  26.162  -6.692   2.742
  368   3HG2  THR  45          3HG2      THR  45  27.721  -6.419   3.558
  369    H    LEU  46           HN       LEU  46  23.795  -5.153   6.482
  370    HA   LEU  46           HA       LEU  46  22.096  -3.003   6.502
  371   1HB   LEU  46          2HB       LEU  46  22.687  -4.899   8.234
  372   2HB   LEU  46          3HB       LEU  46  23.727  -3.665   8.917
  373    HG   LEU  46           HG       LEU  46  21.905  -2.239   9.426
  374   1HD1  LEU  46          1HD1      LEU  46  20.438  -2.117   7.692
  375   2HD1  LEU  46          2HD1      LEU  46  20.438  -3.875   7.412
  376   3HD1  LEU  46          3HD1      LEU  46  19.507  -3.189   8.765
  377   1HD2  LEU  46          1HD2      LEU  46  21.008  -3.413  11.139
  378   2HD2  LEU  46          2HD2      LEU  46  20.526  -4.779  10.105
  379   3HD2  LEU  46          3HD2      LEU  46  22.217  -4.618  10.636
  380    H    ASP  47           HN       ASP  47  25.489  -2.996   7.818
  381    HA   ASP  47           HA       ASP  47  25.723  -0.398   8.318
  382   1HB   ASP  47          2HB       ASP  47  27.548  -2.580   7.557
  383   2HB   ASP  47          3HB       ASP  47  28.173  -1.021   7.057
  384    H    GLU  48           HN       GLU  48  26.410  -2.043   5.139
  385    HA   GLU  48           HA       GLU  48  27.141   0.183   3.738
  386   1HB   GLU  48          2HB       GLU  48  26.382  -2.564   3.169
  387   2HB   GLU  48          3HB       GLU  48  25.702  -1.509   1.946
  388   1HG   GLU  48          2HG       GLU  48  28.175  -0.422   2.042
  389   2HG   GLU  48          3HG       GLU  48  28.592  -2.022   2.621
  390    H    LEU  49           HN       LEU  49  23.851  -1.239   4.244
  391    HA   LEU  49           HA       LEU  49  22.514   0.594   2.600
  392   1HB   LEU  49          2HB       LEU  49  21.883  -1.700   3.915
  393   2HB   LEU  49          3HB       LEU  49  21.072  -0.516   4.921
  394    HG   LEU  49           HG       LEU  49  20.243   0.326   2.485
  395   1HD1  LEU  49          1HD1      LEU  49  21.103  -2.501   2.158
  396   2HD1  LEU  49          2HD1      LEU  49  19.528  -2.046   1.465
  397   3HD1  LEU  49          3HD1      LEU  49  21.002  -1.179   0.970
  398   1HD2  LEU  49          1HD2      LEU  49  18.431  -1.728   3.206
  399   2HD2  LEU  49          2HD2      LEU  49  19.150  -1.108   4.712
  400   3HD2  LEU  49          3HD2      LEU  49  18.345   0.009   3.584
  401    H    PHE  50           HN       PHE  50  23.320   0.579   6.118
  402    HA   PHE  50           HA       PHE  50  21.899   2.870   6.778
  403   1HB   PHE  50          2HB       PHE  50  23.039   1.129   8.283
  404   2HB   PHE  50          3HB       PHE  50  24.591   1.799   7.819
  405    HD1  PHE  50           HD1      PHE  50  21.450   3.601   8.683
  406    HD2  PHE  50           HD2      PHE  50  25.440   2.684   9.797
  407    HE1  PHE  50           HE1      PHE  50  21.302   5.250  10.570
  408    HE2  PHE  50           HE2      PHE  50  25.292   4.333  11.684
  409    HZ   PHE  50           HZ       PHE  50  23.225   5.596  12.048
  410    H    GLU  51           HN       GLU  51  25.398   2.474   5.872
  411    HA   GLU  51           HA       GLU  51  25.879   5.229   5.992
  412   1HB   GLU  51          2HB       GLU  51  27.360   2.792   5.417
  413   2HB   GLU  51          3HB       GLU  51  27.781   4.025   4.245
  414   1HG   GLU  51          2HG       GLU  51  27.871   5.572   6.459
  415   2HG   GLU  51          3HG       GLU  51  28.172   4.028   7.232
  416    H    GLU  52           HN       GLU  52  24.987   2.944   3.360
  417    HA   GLU  52           HA       GLU  52  25.394   4.726   1.275
  418   1HB   GLU  52          2HB       GLU  52  25.136   2.282   0.976
  419   2HB   GLU  52          3HB       GLU  52  23.465   2.373   1.495
  420   1HG   GLU  52          2HG       GLU  52  22.757   3.442  -0.475
  421   2HG   GLU  52          3HG       GLU  52  24.333   4.140  -0.793
  422    H    LEU  53           HN       LEU  53  22.322   3.770   2.980
  423    HA   LEU  53           HA       LEU  53  20.672   5.544   1.652
  424   1HB   LEU  53          2HB       LEU  53  20.457   4.518   4.486
  425   2HB   LEU  53          3HB       LEU  53  19.159   5.238   3.554
  426    HG   LEU  53           HG       LEU  53  20.560   2.821   2.460
  427   1HD1  LEU  53          1HD1      LEU  53  19.342   2.851   5.028
  428   2HD1  LEU  53          2HD1      LEU  53  18.258   1.974   3.922
  429   3HD1  LEU  53          3HD1      LEU  53  19.953   1.461   4.100
  430   1HD2  LEU  53          1HD2      LEU  53  17.684   2.881   2.232
  431   2HD2  LEU  53          2HD2      LEU  53  18.387   4.415   1.668
  432   3HD2  LEU  53          3HD2      LEU  53  18.927   2.874   0.959
  433    H    ASP  54           HN       ASP  54  22.376   5.959   4.834
  434    HA   ASP  54           HA       ASP  54  21.546   8.615   5.075
  435   1HB   ASP  54          2HB       ASP  54  22.597   6.844   6.795
  436   2HB   ASP  54          3HB       ASP  54  24.105   7.605   6.329
  437    H    LYS  55           HN       LYS  55  22.185   9.227   2.733
  438    HA   LYS  55           HA       LYS  55  25.054   9.586   2.384
  439   1HB   LYS  55          2HB       LYS  55  23.038   8.797   0.660
  440   2HB   LYS  55          3HB       LYS  55  23.272  10.478   0.227
  441   1HG   LYS  55          2HG       LYS  55  25.896   9.567   0.527
  442   2HG   LYS  55          3HG       LYS  55  25.087   8.168  -0.150
  443   1HD   LYS  55          2HD       LYS  55  24.703   9.194  -2.179
  444   2HD   LYS  55          3HD       LYS  55  24.371  10.753  -1.450
  445   1HE   LYS  55          2HE       LYS  55  27.181   9.569  -1.594
  446   2HE   LYS  55          3HE       LYS  55  26.524  10.601  -2.849
  447   1HZ   LYS  55          1HZ       LYS  55  26.014  12.115  -0.821
  448   2HZ   LYS  55          2HZ       LYS  55  27.232  11.281  -0.123
  449   3HZ   LYS  55          3HZ       LYS  55  27.499  12.113  -1.502
  450    H    ASN  56           HN       ASN  56  22.594  11.168   3.938
  451    HA   ASN  56           HA       ASN  56  23.149  13.775   2.916
  452   1HB   ASN  56          2HB       ASN  56  21.492  14.532   4.546
  453   2HB   ASN  56          3HB       ASN  56  20.881  13.058   3.822
  454   1HD2  ASN  56          1HD2      ASN  56  19.738  13.656   6.063
  455   2HD2  ASN  56          2HD2      ASN  56  20.278  12.707   7.408
  456    H    GLY  57           HN       GLY  57  25.026  11.723   4.582
  457   1HA   GLY  57          1HA       GLY  57  26.488  11.812   6.324
  458   2HA   GLY  57          2HA       GLY  57  26.911  13.329   5.556
  459    H    ASP  58           HN       ASP  58  24.002  12.268   7.467
  460    HA   ASP  58           HA       ASP  58  24.465  14.624   9.115
  461   1HB   ASP  58          2HB       ASP  58  22.308  14.873   8.218
  462   2HB   ASP  58          3HB       ASP  58  22.004  13.148   8.195
  463    H    GLY  59           HN       GLY  59  23.524  11.128   9.049
  464   1HA   GLY  59          1HA       GLY  59  24.666   9.730  10.704
  465   2HA   GLY  59          2HA       GLY  59  24.270  10.940  11.908
  466    H    GLU  60           HN       GLU  60  21.648  11.022   9.870
  467    HA   GLU  60           HA       GLU  60  20.372   8.695  11.012
  468   1HB   GLU  60          2HB       GLU  60  19.758  11.528  11.724
  469   2HB   GLU  60          3HB       GLU  60  18.364  10.525  11.376
  470   1HG   GLU  60          2HG       GLU  60  18.526   9.728  13.496
  471   2HG   GLU  60          3HG       GLU  60  19.965   8.868  12.986
  472    H    VAL  61           HN       VAL  61  18.542   7.952   9.779
  473    HA   VAL  61           HA       VAL  61  18.565   8.989   7.070
  474    HB   VAL  61           HB       VAL  61  17.307   6.558   8.355
  475   1HG1  VAL  61          1HG1      VAL  61  17.321   7.482   5.468
  476   2HG1  VAL  61          2HG1      VAL  61  16.967   5.810   5.965
  477   3HG1  VAL  61          3HG1      VAL  61  15.914   7.141   6.503
  478   1HG2  VAL  61          1HG2      VAL  61  19.935   6.942   7.869
  479   2HG2  VAL  61          2HG2      VAL  61  19.136   5.356   7.743
  480   3HG2  VAL  61          3HG2      VAL  61  19.423   6.328   6.279
  481    H    SER  62           HN       SER  62  16.301   9.050   5.950
  482    HA   SER  62           HA       SER  62  14.125   9.677   7.630
  483   1HB   SER  62          2HB       SER  62  14.615  12.081   6.011
  484   2HB   SER  62          3HB       SER  62  14.153  11.949   7.697
  485    HG   SER  62           HG       SER  62  16.746  12.103   6.531
  486    H    PHE  63           HN       PHE  63  12.231  10.601   6.160
  487    HA   PHE  63           HA       PHE  63  11.741   8.833   4.151
  488   1HB   PHE  63          2HB       PHE  63  10.166  10.459   5.346
  489   2HB   PHE  63          3HB       PHE  63  10.864  11.772   4.419
  490    HD1  PHE  63           HD1      PHE  63   9.309  12.547   2.908
  491    HD2  PHE  63           HD2      PHE  63   9.694   8.356   3.451
  492    HE1  PHE  63           HE1      PHE  63   7.625  12.157   1.088
  493    HE2  PHE  63           HE2      PHE  63   8.010   7.966   1.631
  494    HZ   PHE  63           HZ       PHE  63   6.995   9.871   0.472
  495    H    GLU  64           HN       GLU  64  13.742  11.734   4.071
  496    HA   GLU  64           HA       GLU  64  13.576  12.141   1.301
  497   1HB   GLU  64          2HB       GLU  64  16.044  12.934   2.821
  498   2HB   GLU  64          3HB       GLU  64  15.121  13.849   1.645
  499   1HG   GLU  64          2HG       GLU  64  14.536  13.411   4.584
  500   2HG   GLU  64          3HG       GLU  64  14.600  14.919   3.693
  501    H    GLU  65           HN       GLU  65  16.202  10.711   3.382
  502    HA   GLU  65           HA       GLU  65  17.682   9.833   1.195
  503   1HB   GLU  65          2HB       GLU  65  17.664   8.875   4.091
  504   2HB   GLU  65          3HB       GLU  65  18.890   8.438   2.917
  505   1HG   GLU  65          2HG       GLU  65  19.910  10.493   3.017
  506   2HG   GLU  65          3HG       GLU  65  18.389  11.361   3.073
  507    H    PHE  66           HN       PHE  66  14.932   8.479   2.974
  508    HA   PHE  66           HA       PHE  66  15.242   5.803   2.308
  509   1HB   PHE  66          2HB       PHE  66  13.581   7.110   3.883
  510   2HB   PHE  66          3HB       PHE  66  12.632   7.414   2.441
  511    HD1  PHE  66           HD1      PHE  66  14.408   4.354   3.643
  512    HD2  PHE  66           HD2      PHE  66  10.716   6.136   2.546
  513    HE1  PHE  66           HE1      PHE  66  13.255   2.144   3.935
  514    HE2  PHE  66           HE2      PHE  66   9.563   3.925   2.838
  515    HZ   PHE  66           HZ       PHE  66  10.846   1.956   3.529
  516    H    GLN  67           HN       GLN  67  13.880   8.575   0.479
  517    HA   GLN  67           HA       GLN  67  12.592   7.128  -1.469
  518   1HB   GLN  67          2HB       GLN  67  14.010   9.817  -1.725
  519   2HB   GLN  67          3HB       GLN  67  12.816   9.198  -2.849
  520   1HG   GLN  67          2HG       GLN  67  11.589   8.948  -0.311
  521   2HG   GLN  67          3HG       GLN  67  12.416  10.491  -0.244
  522   1HE2  GLN  67          1HE2      GLN  67   9.667  10.254  -0.180
  523   2HE2  GLN  67          2HE2      GLN  67   8.967  10.939  -1.609
  524    H    VAL  68           HN       VAL  68  15.967   7.376  -0.763
  525    HA   VAL  68           HA       VAL  68  16.913   7.018  -3.429
  526    HB   VAL  68           HB       VAL  68  18.251   6.543  -0.758
  527   1HG1  VAL  68          1HG1      VAL  68  20.021   5.837  -1.912
  528   2HG1  VAL  68          2HG1      VAL  68  19.122   6.029  -3.436
  529   3HG1  VAL  68          3HG1      VAL  68  20.070   7.387  -2.785
  530   1HG2  VAL  68          1HG2      VAL  68  17.935   8.769  -0.530
  531   2HG2  VAL  68          2HG2      VAL  68  19.275   8.890  -1.696
  532   3HG2  VAL  68          3HG2      VAL  68  17.591   9.004  -2.261
  533    H    LEU  69           HN       LEU  69  15.944   4.928  -0.692
  534    HA   LEU  69           HA       LEU  69  16.956   2.563  -1.945
  535   1HB   LEU  69          2HB       LEU  69  16.599   3.132   0.570
  536   2HB   LEU  69          3HB       LEU  69  14.947   2.623   0.282
  537    HG   LEU  69           HG       LEU  69  15.679   0.404  -0.370
  538   1HD1  LEU  69          1HD1      LEU  69  18.353   0.173   0.275
  539   2HD1  LEU  69          2HD1      LEU  69  17.667   0.224  -1.366
  540   3HD1  LEU  69          3HD1      LEU  69  18.282   1.714  -0.612
  541   1HD2  LEU  69          1HD2      LEU  69  16.173   1.573   2.237
  542   2HD2  LEU  69          2HD2      LEU  69  15.465  -0.001   1.804
  543   3HD2  LEU  69          3HD2      LEU  69  17.231   0.172   1.940
  544    H    VAL  70           HN       VAL  70  13.880   4.369  -1.794
  545    HA   VAL  70           HA       VAL  70  12.146   2.441  -2.681
  546    HB   VAL  70           HB       VAL  70  12.337   5.414  -2.930
  547   1HG1  VAL  70          1HG1      VAL  70  10.489   3.630  -4.488
  548   2HG1  VAL  70          2HG1      VAL  70   9.893   5.192  -3.877
  549   3HG1  VAL  70          3HG1      VAL  70  11.293   5.142  -4.975
  550   1HG2  VAL  70          1HG2      VAL  70  11.017   3.446  -1.226
  551   2HG2  VAL  70          2HG2      VAL  70  11.329   5.176  -0.946
  552   3HG2  VAL  70          3HG2      VAL  70   9.881   4.667  -1.847
  553    H    LYS  71           HN       LYS  71  14.823   3.985  -4.345
  554    HA   LYS  71           HA       LYS  71  13.871   3.516  -6.973
  555   1HB   LYS  71          2HB       LYS  71  15.904   4.982  -5.835
  556   2HB   LYS  71          3HB       LYS  71  16.785   3.663  -6.578
  557   1HG   LYS  71          2HG       LYS  71  14.895   4.337  -8.536
  558   2HG   LYS  71          3HG       LYS  71  15.323   5.893  -7.851
  559   1HD   LYS  71          2HD       LYS  71  17.566   3.980  -8.481
  560   2HD   LYS  71          3HD       LYS  71  16.764   4.761  -9.829
  561   1HE   LYS  71          2HE       LYS  71  17.116   6.984  -8.460
  562   2HE   LYS  71          3HE       LYS  71  18.284   6.057  -7.540
  563   1HZ   LYS  71          1HZ       LYS  71  18.360   6.795 -10.350
  564   2HZ   LYS  71          2HZ       LYS  71  19.541   6.885  -9.225
  565   3HZ   LYS  71          3HZ       LYS  71  19.140   5.441  -9.875
  566    H    LYS  72           HN       LYS  72  15.994   1.733  -4.663
  567    HA   LYS  72           HA       LYS  72  16.558  -0.340  -6.508
  568   1HB   LYS  72          2HB       LYS  72  16.850  -0.110  -3.502
  569   2HB   LYS  72          3HB       LYS  72  17.369  -1.513  -4.416
  570   1HG   LYS  72          2HG       LYS  72  18.299   1.325  -5.050
  571   2HG   LYS  72          3HG       LYS  72  19.177   0.247  -3.984
  572   1HD   LYS  72          2HD       LYS  72  18.889  -1.428  -6.103
  573   2HD   LYS  72          3HD       LYS  72  18.813   0.096  -6.964
  574   1HE   LYS  72          2HE       LYS  72  20.995  -0.105  -4.929
  575   2HE   LYS  72          3HE       LYS  72  21.157  -1.180  -6.304
  576   1HZ   LYS  72          1HZ       LYS  72  21.576   1.574  -6.205
  577   2HZ   LYS  72          2HZ       LYS  72  21.851   0.549  -7.446
  578   3HZ   LYS  72          3HZ       LYS  72  20.395   1.273  -7.292
  579    H    ILE  73           HN       ILE  73  14.116   0.181  -3.915
  580    HA   ILE  73           HA       ILE  73  13.033  -2.439  -4.217
  581    HB   ILE  73           HB       ILE  73  11.914   0.019  -2.865
  582   1HG1  ILE  73          2HG1      ILE  73  13.148  -2.190  -1.305
  583   2HG1  ILE  73          3HG1      ILE  73  14.252  -1.169  -2.206
  584   1HG2  ILE  73          1HG2      ILE  73  11.031  -2.333  -1.601
  585   2HG2  ILE  73          2HG2      ILE  73  10.072  -1.180  -2.561
  586   3HG2  ILE  73          3HG2      ILE  73  10.805  -2.599  -3.347
  587   1HD1  ILE  73          1HD1      ILE  73  13.463  -0.510   0.263
  588   2HD1  ILE  73          2HD1      ILE  73  13.731   0.740  -0.975
  589   3HD1  ILE  73          3HD1      ILE  73  12.079   0.183  -0.616
  590    H    SER  74           HN       SER  74  13.028   0.307  -6.184
  591    HA   SER  74           HA       SER  74  10.322  -0.076  -7.083
  592   1HB   SER  74          2HB       SER  74  12.452   1.972  -7.426
  593   2HB   SER  74          3HB       SER  74  11.466   1.712  -8.851
  594    HG   SER  74           HG       SER  74   9.801   2.678  -7.902
  595    H    GLN  75           HN       GLN  75  13.724  -0.579  -8.150
  596    HA   GLN  75           HA       GLN  75  13.016  -1.410 -10.736
  597   1HB   GLN  75          2HB       GLN  75  15.368  -0.737  -9.431
  598   2HB   GLN  75          3HB       GLN  75  15.554  -2.469  -9.624
  599   1HG   GLN  75          2HG       GLN  75  16.402  -1.772 -11.671
  600   2HG   GLN  75          3HG       GLN  75  14.718  -1.968 -12.115
  601   1HE2  GLN  75          1HE2      GLN  75  16.609   0.493 -10.357
  602   2HE2  GLN  75          2HE2      GLN  75  16.089   1.866 -11.277
  Start of MODEL    4
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   2.426   1.017  -1.415
    3   1HB   LYS   1          2HB       LYS   1   3.023  -1.868  -0.733
    4   2HB   LYS   1          3HB       LYS   1   3.736  -1.063  -2.116
    5   1HG   LYS   1          2HG       LYS   1   5.359  -0.497  -0.583
    6   2HG   LYS   1          3HG       LYS   1   4.263   0.828  -0.244
    7   1HD   LYS   1          2HD       LYS   1   3.977   0.089   1.879
    8   2HD   LYS   1          3HD       LYS   1   3.371  -1.445   1.288
    9   1HE   LYS   1          2HE       LYS   1   6.095  -1.731   0.848
   10   2HE   LYS   1          3HE       LYS   1   6.082  -0.746   2.298
   11   1HZ   LYS   1          1HZ       LYS   1   5.333  -2.443   3.480
   12   2HZ   LYS   1          2HZ       LYS   1   4.193  -2.867   2.390
   13   3HZ   LYS   1          3HZ       LYS   1   5.726  -3.405   2.219
   14    H    SER   2           HN       SER   2   1.877   1.137  -3.566
   15    HA   SER   2           HA       SER   2  -0.561  -0.152  -4.259
   16   1HB   SER   2          2HB       SER   2   1.024   1.309  -6.336
   17   2HB   SER   2          3HB       SER   2  -0.688   1.398  -5.973
   18    HG   SER   2           HG       SER   2   0.588   3.341  -5.392
   19    HA   PRO   3           HA       PRO   3   1.107  -3.363  -6.679
   20   1HB   PRO   3          2HB       PRO   3  -0.607  -3.576  -8.797
   21   2HB   PRO   3          3HB       PRO   3  -0.968  -4.212  -7.204
   22   1HG   PRO   3          2HG       PRO   3  -2.043  -1.794  -8.522
   23   2HG   PRO   3          3HG       PRO   3  -2.683  -2.671  -7.146
   24   1HD   PRO   3          2HD       PRO   3  -1.251  -0.186  -7.082
   25   2HD   PRO   3          3HD       PRO   3  -1.790  -1.122  -5.701
   26    H    GLU   4           HN       GLU   4   0.371  -0.541  -8.630
   27    HA   GLU   4           HA       GLU   4   1.965  -1.236 -10.758
   28   1HB   GLU   4          2HB       GLU   4   0.437   1.013  -9.916
   29   2HB   GLU   4          3HB       GLU   4   2.036   1.635 -10.275
   30   1HG   GLU   4          2HG       GLU   4   0.914  -0.322 -12.250
   31   2HG   GLU   4          3HG       GLU   4   0.117   1.236 -12.178
   32    H    GLU   5           HN       GLU   5   2.762   0.163  -7.577
   33    HA   GLU   5           HA       GLU   5   5.322   1.031  -8.272
   34   1HB   GLU   5          2HB       GLU   5   3.715   0.694  -5.815
   35   2HB   GLU   5          3HB       GLU   5   5.430   0.453  -5.545
   36   1HG   GLU   5          2HG       GLU   5   5.101   2.749  -7.277
   37   2HG   GLU   5          3HG       GLU   5   4.021   2.936  -5.909
   38    H    LEU   6           HN       LEU   6   3.967  -2.094  -7.183
   39    HA   LEU   6           HA       LEU   6   6.348  -3.338  -6.475
   40   1HB   LEU   6          2HB       LEU   6   3.601  -4.144  -7.202
   41   2HB   LEU   6          3HB       LEU   6   4.830  -5.374  -7.424
   42    HG   LEU   6           HG       LEU   6   4.497  -3.872  -4.821
   43   1HD1  LEU   6          1HD1      LEU   6   2.474  -4.856  -4.708
   44   2HD1  LEU   6          2HD1      LEU   6   2.868  -6.067  -5.952
   45   3HD1  LEU   6          3HD1      LEU   6   3.428  -6.297  -4.278
   46   1HD2  LEU   6          1HD2      LEU   6   6.232  -5.052  -4.102
   47   2HD2  LEU   6          2HD2      LEU   6   5.477  -6.578  -4.624
   48   3HD2  LEU   6          3HD2      LEU   6   6.468  -5.638  -5.766
   49    H    LYS   7           HN       LYS   7   4.703  -2.954  -9.660
   50    HA   LYS   7           HA       LYS   7   6.516  -4.590 -11.057
   51   1HB   LYS   7          2HB       LYS   7   4.109  -3.470 -11.612
   52   2HB   LYS   7          3HB       LYS   7   5.156  -2.378 -12.496
   53   1HG   LYS   7          2HG       LYS   7   6.283  -4.743 -13.245
   54   2HG   LYS   7          3HG       LYS   7   4.651  -5.304 -12.938
   55   1HD   LYS   7          2HD       LYS   7   4.647  -4.669 -15.239
   56   2HD   LYS   7          3HD       LYS   7   3.834  -3.353 -14.415
   57   1HE   LYS   7          2HE       LYS   7   5.487  -1.848 -14.921
   58   2HE   LYS   7          3HE       LYS   7   6.769  -2.981 -14.541
   59   1HZ   LYS   7          1HZ       LYS   7   5.247  -3.558 -16.916
   60   2HZ   LYS   7          2HZ       LYS   7   6.196  -2.231 -16.987
   61   3HZ   LYS   7          3HZ       LYS   7   6.853  -3.688 -16.649
   62    H    GLY   8           HN       GLY   8   6.282  -0.991 -10.645
   63   1HA   GLY   8          1HA       GLY   8   8.504  -0.284 -12.135
   64   2HA   GLY   8          2HA       GLY   8   7.855   0.608 -10.773
   65    H    ILE   9           HN       ILE   9   8.331  -0.723  -8.521
   66    HA   ILE   9           HA       ILE   9  11.033  -0.430  -8.070
   67    HB   ILE   9           HB       ILE   9   8.753  -1.694  -6.627
   68   1HG1  ILE   9          2HG1      ILE   9  10.679   0.569  -6.033
   69   2HG1  ILE   9          3HG1      ILE   9   9.005   0.713  -6.531
   70   1HG2  ILE   9          1HG2      ILE   9  10.570  -3.264  -6.210
   71   2HG2  ILE   9          2HG2      ILE   9  11.638  -1.925  -5.728
   72   3HG2  ILE   9          3HG2      ILE   9  10.203  -2.315  -4.750
   73   1HD1  ILE   9          1HD1      ILE   9   8.450  -0.715  -4.413
   74   2HD1  ILE   9          2HD1      ILE   9  10.102  -0.304  -3.891
   75   3HD1  ILE   9          3HD1      ILE   9   8.911   0.988  -4.179
   76    H    PHE  10           HN       PHE  10   9.119  -3.421  -8.768
   77    HA   PHE  10           HA       PHE  10  11.110  -5.263  -8.465
   78   1HB   PHE  10          2HB       PHE  10   8.874  -6.006  -8.943
   79   2HB   PHE  10          3HB       PHE  10   8.688  -4.877 -10.270
   80    HD1  PHE  10           HD1      PHE  10   9.649  -5.385 -12.477
   81    HD2  PHE  10           HD2      PHE  10   9.867  -8.172  -9.285
   82    HE1  PHE  10           HE1      PHE  10  10.210  -7.208 -14.108
   83    HE2  PHE  10           HE2      PHE  10  10.428  -9.996 -10.916
   84    HZ   PHE  10           HZ       PHE  10  10.592  -9.492 -13.308
   85    H    GLU  11           HN       GLU  11  10.197  -3.539 -11.539
   86    HA   GLU  11           HA       GLU  11  12.257  -4.659 -13.010
   87   1HB   GLU  11          2HB       GLU  11  10.183  -2.650 -13.367
   88   2HB   GLU  11          3HB       GLU  11  11.673  -2.095 -14.105
   89   1HG   GLU  11          2HG       GLU  11  11.656  -4.721 -14.936
   90   2HG   GLU  11          3HG       GLU  11   9.934  -4.407 -14.847
   91    H    LYS  12           HN       LYS  12  12.042  -1.654 -11.041
   92    HA   LYS  12           HA       LYS  12  14.427  -0.498 -11.851
   93   1HB   LYS  12          2HB       LYS  12  12.468   0.382 -10.369
   94   2HB   LYS  12          3HB       LYS  12  13.383  -0.289  -9.034
   95   1HG   LYS  12          2HG       LYS  12  14.832   1.444 -11.042
   96   2HG   LYS  12          3HG       LYS  12  13.791   2.223  -9.866
   97   1HD   LYS  12          2HD       LYS  12  15.135   0.564  -8.184
   98   2HD   LYS  12          3HD       LYS  12  16.355   0.715  -9.434
   99   1HE   LYS  12          2HE       LYS  12  16.949   2.718  -8.553
  100   2HE   LYS  12          3HE       LYS  12  15.389   3.357  -9.031
  101   1HZ   LYS  12          1HZ       LYS  12  14.556   2.346  -6.904
  102   2HZ   LYS  12          2HZ       LYS  12  16.117   2.158  -6.463
  103   3HZ   LYS  12          3HZ       LYS  12  15.524   3.652  -6.750
  104    H    TYR  13           HN       TYR  13  13.768  -3.326  -9.867
  105    HA   TYR  13           HA       TYR  13  16.501  -3.328  -8.849
  106   1HB   TYR  13          2HB       TYR  13  13.814  -4.610  -8.343
  107   2HB   TYR  13          3HB       TYR  13  15.187  -5.656  -8.040
  108    HD1  TYR  13           HD1      TYR  13  13.824  -2.282  -7.169
  109    HD2  TYR  13           HD2      TYR  13  16.323  -5.548  -5.989
  110    HE1  TYR  13           HE1      TYR  13  14.130  -1.229  -4.876
  111    HE2  TYR  13           HE2      TYR  13  16.620  -4.484  -3.700
  112    HH   TYR  13           HH       TYR  13  16.203  -2.781  -2.442
  113    H    ALA  14           HN       ALA  14  14.274  -5.157 -11.012
  114    HA   ALA  14           HA       ALA  14  16.048  -7.280 -11.498
  115   1HB   ALA  14          1HB       ALA  14  13.962  -6.251 -13.440
  116   2HB   ALA  14          2HB       ALA  14  14.470  -7.929 -13.133
  117   3HB   ALA  14          3HB       ALA  14  13.500  -7.058 -11.922
  118    H    ALA  15           HN       ALA  15  15.969  -3.942 -12.527
  119    HA   ALA  15           HA       ALA  15  17.538  -4.442 -14.899
  120   1HB   ALA  15          1HB       ALA  15  16.066  -2.201 -13.645
  121   2HB   ALA  15          2HB       ALA  15  17.575  -1.727 -14.461
  122   3HB   ALA  15          3HB       ALA  15  16.309  -2.591 -15.365
  123    H    LYS  16           HN       LYS  16  17.997  -3.906 -11.477
  124    HA   LYS  16           HA       LYS  16  20.420  -2.587 -11.453
  125   1HB   LYS  16          2HB       LYS  16  18.705  -3.754  -9.598
  126   2HB   LYS  16          3HB       LYS  16  20.187  -4.670  -9.413
  127   1HG   LYS  16          2HG       LYS  16  21.415  -2.383  -9.368
  128   2HG   LYS  16          3HG       LYS  16  19.832  -1.652  -9.191
  129   1HD   LYS  16          2HD       LYS  16  19.512  -2.506  -7.043
  130   2HD   LYS  16          3HD       LYS  16  20.487  -3.931  -7.342
  131   1HE   LYS  16          2HE       LYS  16  21.686  -2.462  -5.790
  132   2HE   LYS  16          3HE       LYS  16  22.558  -2.513  -7.309
  133   1HZ   LYS  16          1HZ       LYS  16  22.248  -0.359  -7.549
  134   2HZ   LYS  16          2HZ       LYS  16  20.632  -0.465  -7.339
  135   3HZ   LYS  16          3HZ       LYS  16  21.614  -0.292  -6.046
  136    H    GLU  17           HN       GLU  17  19.944  -6.183 -11.167
  137    HA   GLU  17           HA       GLU  17  22.497  -6.414 -12.563
  138   1HB   GLU  17          2HB       GLU  17  21.386  -8.021 -10.234
  139   2HB   GLU  17          3HB       GLU  17  22.673  -8.646 -11.246
  140   1HG   GLU  17          2HG       GLU  17  23.506  -6.020 -10.651
  141   2HG   GLU  17          3HG       GLU  17  22.784  -6.577  -9.155
  142    H    GLY  18           HN       GLY  18  22.502  -7.662 -14.410
  143   1HA   GLY  18          1HA       GLY  18  21.788  -9.069 -16.015
  144   2HA   GLY  18          2HA       GLY  18  20.784  -9.869 -14.822
  145    H    ASP  19           HN       ASP  19  19.549  -9.848 -17.131
  146    HA   ASP  19           HA       ASP  19  18.339  -7.550 -17.986
  147   1HB   ASP  19          2HB       ASP  19  18.357 -10.090 -18.853
  148   2HB   ASP  19          3HB       ASP  19  16.824 -10.165 -18.007
  149    HA   PRO  20           HA       PRO  20  15.372  -6.922 -14.803
  150   1HB   PRO  20          2HB       PRO  20  13.758  -5.083 -16.019
  151   2HB   PRO  20          3HB       PRO  20  15.269  -4.664 -15.238
  152   1HG   PRO  20          2HG       PRO  20  14.668  -4.863 -18.126
  153   2HG   PRO  20          3HG       PRO  20  16.007  -4.053 -17.337
  154   1HD   PRO  20          2HD       PRO  20  16.091  -6.575 -18.699
  155   2HD   PRO  20          3HD       PRO  20  17.399  -5.820 -17.811
  156    H    ASN  21           HN       ASN  21  14.829  -8.612 -17.544
  157    HA   ASN  21           HA       ASN  21  12.012  -8.913 -17.021
  158   1HB   ASN  21          2HB       ASN  21  13.907  -9.984 -19.163
  159   2HB   ASN  21          3HB       ASN  21  12.263 -10.576 -19.027
  160   1HD2  ASN  21          1HD2      ASN  21  14.263  -7.714 -19.490
  161   2HD2  ASN  21          2HD2      ASN  21  13.102  -6.749 -20.340
  162    H    GLN  22           HN       GLN  22  14.708  -9.977 -15.529
  163    HA   GLN  22           HA       GLN  22  13.460 -12.436 -14.760
  164   1HB   GLN  22          2HB       GLN  22  15.861 -13.558 -15.049
  165   2HB   GLN  22          3HB       GLN  22  14.702 -13.553 -16.363
  166   1HG   GLN  22          2HG       GLN  22  15.986 -12.168 -17.647
  167   2HG   GLN  22          3HG       GLN  22  16.315 -11.084 -16.309
  168   1HE2  GLN  22          1HE2      GLN  22  18.028 -11.498 -14.894
  169   2HE2  GLN  22          2HE2      GLN  22  19.364 -12.515 -15.320
  170    H    LEU  23           HN       LEU  23  13.692 -12.688 -12.565
  171    HA   LEU  23           HA       LEU  23  15.563 -10.879 -11.256
  172   1HB   LEU  23          2HB       LEU  23  13.107 -12.376 -10.388
  173   2HB   LEU  23          3HB       LEU  23  14.231 -11.729  -9.210
  174    HG   LEU  23           HG       LEU  23  12.129 -10.358  -9.938
  175   1HD1  LEU  23          1HD1      LEU  23  13.092  -8.518  -9.004
  176   2HD1  LEU  23          2HD1      LEU  23  14.313  -9.733  -8.558
  177   3HD1  LEU  23          3HD1      LEU  23  14.587  -8.669  -9.958
  178   1HD2  LEU  23          1HD2      LEU  23  12.541  -8.791 -11.775
  179   2HD2  LEU  23          2HD2      LEU  23  14.068  -9.625 -12.151
  180   3HD2  LEU  23          3HD2      LEU  23  12.517 -10.478 -12.345
  181    H    SER  24           HN       SER  24  17.281 -11.563  -9.992
  182    HA   SER  24           HA       SER  24  17.772 -14.430 -10.157
  183   1HB   SER  24          2HB       SER  24  19.678 -12.062  -9.961
  184   2HB   SER  24          3HB       SER  24  20.207 -13.720  -9.754
  185    HG   SER  24           HG       SER  24  18.661 -13.154 -12.073
  186    H    LYS  25           HN       LYS  25  19.232 -15.245  -8.237
  187    HA   LYS  25           HA       LYS  25  17.815 -14.878  -5.876
  188   1HB   LYS  25          2HB       LYS  25  19.111 -16.892  -6.443
  189   2HB   LYS  25          3HB       LYS  25  20.605 -15.988  -6.305
  190   1HG   LYS  25          2HG       LYS  25  19.776 -15.383  -3.890
  191   2HG   LYS  25          3HG       LYS  25  18.633 -16.693  -4.103
  192   1HD   LYS  25          2HD       LYS  25  20.329 -18.341  -4.233
  193   2HD   LYS  25          3HD       LYS  25  21.559 -17.185  -4.705
  194   1HE   LYS  25          2HE       LYS  25  21.037 -16.132  -2.295
  195   2HE   LYS  25          3HE       LYS  25  20.435 -17.742  -1.955
  196   1HZ   LYS  25          1HZ       LYS  25  23.079 -17.305  -3.138
  197   2HZ   LYS  25          2HZ       LYS  25  22.846 -17.327  -1.522
  198   3HZ   LYS  25          3HZ       LYS  25  22.513 -18.655  -2.413
  199    H    GLU  26           HN       GLU  26  21.183 -13.760  -6.683
  200    HA   GLU  26           HA       GLU  26  21.511 -12.272  -4.418
  201   1HB   GLU  26          2HB       GLU  26  22.775 -12.472  -7.077
  202   2HB   GLU  26          3HB       GLU  26  22.937 -10.875  -6.375
  203   1HG   GLU  26          2HG       GLU  26  24.803 -12.486  -5.759
  204   2HG   GLU  26          3HG       GLU  26  24.004 -11.744  -4.387
  205    H    GLU  27           HN       GLU  27  19.793 -11.512  -7.452
  206    HA   GLU  27           HA       GLU  27  19.612  -8.759  -6.974
  207   1HB   GLU  27          2HB       GLU  27  18.615 -10.706  -8.924
  208   2HB   GLU  27          3HB       GLU  27  17.392  -9.506  -8.553
  209   1HG   GLU  27          2HG       GLU  27  19.903  -8.118  -8.812
  210   2HG   GLU  27          3HG       GLU  27  19.767  -9.209 -10.177
  211    H    LEU  28           HN       LEU  28  17.245 -11.486  -6.532
  212    HA   LEU  28           HA       LEU  28  15.205  -9.978  -5.448
  213   1HB   LEU  28          2HB       LEU  28  15.462 -12.508  -6.186
  214   2HB   LEU  28          3HB       LEU  28  15.717 -12.749  -4.469
  215    HG   LEU  28           HG       LEU  28  13.552 -12.017  -3.910
  216   1HD1  LEU  28          1HD1      LEU  28  12.003 -11.094  -5.752
  217   2HD1  LEU  28          2HD1      LEU  28  13.235 -10.014  -5.056
  218   3HD1  LEU  28          3HD1      LEU  28  13.505 -10.763  -6.648
  219   1HD2  LEU  28          1HD2      LEU  28  12.908 -13.383  -6.502
  220   2HD2  LEU  28          2HD2      LEU  28  13.847 -14.240  -5.256
  221   3HD2  LEU  28          3HD2      LEU  28  12.219 -13.628  -4.879
  222    H    LYS  29           HN       LYS  29  18.053 -11.531  -3.867
  223    HA   LYS  29           HA       LYS  29  17.482 -11.234  -1.267
  224   1HB   LYS  29          2HB       LYS  29  19.557 -12.191  -2.117
  225   2HB   LYS  29          3HB       LYS  29  20.108 -10.615  -2.650
  226   1HG   LYS  29          2HG       LYS  29  20.234  -9.787  -0.367
  227   2HG   LYS  29          3HG       LYS  29  19.389 -11.190   0.257
  228   1HD   LYS  29          2HD       LYS  29  21.436 -12.494  -0.924
  229   2HD   LYS  29          3HD       LYS  29  22.239 -10.954  -0.694
  230   1HE   LYS  29          2HE       LYS  29  20.835 -11.575   1.749
  231   2HE   LYS  29          3HE       LYS  29  21.718 -13.010   1.267
  232   1HZ   LYS  29          1HZ       LYS  29  23.708 -11.775   1.195
  233   2HZ   LYS  29          2HZ       LYS  29  22.942 -10.344   1.374
  234   3HZ   LYS  29          3HZ       LYS  29  22.991 -11.405   2.614
  235    H    LEU  30           HN       LEU  30  18.876  -8.609  -3.357
  236    HA   LEU  30           HA       LEU  30  18.862  -6.638  -1.434
  237   1HB   LEU  30          2HB       LEU  30  18.410  -6.365  -4.410
  238   2HB   LEU  30          3HB       LEU  30  18.879  -5.074  -3.320
  239    HG   LEU  30           HG       LEU  30  20.495  -7.396  -4.324
  240   1HD1  LEU  30          1HD1      LEU  30  21.312  -4.512  -3.948
  241   2HD1  LEU  30          2HD1      LEU  30  22.054  -5.756  -4.983
  242   3HD1  LEU  30          3HD1      LEU  30  20.456  -5.090  -5.398
  243   1HD2  LEU  30          1HD2      LEU  30  20.985  -5.897  -1.742
  244   2HD2  LEU  30          2HD2      LEU  30  20.821  -7.653  -1.984
  245   3HD2  LEU  30          3HD2      LEU  30  22.248  -6.796  -2.617
  246    H    LEU  31           HN       LEU  31  16.302  -7.350  -3.917
  247    HA   LEU  31           HA       LEU  31  14.485  -5.480  -3.108
  248   1HB   LEU  31          2HB       LEU  31  14.514  -7.162  -5.075
  249   2HB   LEU  31          3HB       LEU  31  13.665  -8.235  -3.979
  250    HG   LEU  31           HG       LEU  31  12.452  -5.577  -4.063
  251   1HD1  LEU  31          1HD1      LEU  31  13.351  -5.622  -6.363
  252   2HD1  LEU  31          2HD1      LEU  31  12.489  -7.152  -6.652
  253   3HD1  LEU  31          3HD1      LEU  31  11.572  -5.664  -6.317
  254   1HD2  LEU  31          1HD2      LEU  31  11.210  -8.214  -4.843
  255   2HD2  LEU  31          2HD2      LEU  31  11.532  -7.780  -3.147
  256   3HD2  LEU  31          3HD2      LEU  31  10.438  -6.778  -4.131
  257    H    LEU  32           HN       LEU  32  14.428  -8.974  -2.093
  258    HA   LEU  32           HA       LEU  32  12.518  -8.731  -0.165
  259   1HB   LEU  32          2HB       LEU  32  14.957 -10.513  -0.089
  260   2HB   LEU  32          3HB       LEU  32  13.471 -10.751   0.809
  261    HG   LEU  32           HG       LEU  32  13.625 -10.735  -2.216
  262   1HD1  LEU  32          1HD1      LEU  32  13.574 -13.143  -2.162
  263   2HD1  LEU  32          2HD1      LEU  32  14.973 -12.568  -1.224
  264   3HD1  LEU  32          3HD1      LEU  32  13.515 -13.145  -0.383
  265   1HD2  LEU  32          1HD2      LEU  32  11.422 -12.189  -1.003
  266   2HD2  LEU  32          2HD2      LEU  32  11.431 -10.476  -0.519
  267   3HD2  LEU  32          3HD2      LEU  32  11.409 -10.913  -2.244
  268    H    GLN  33           HN       GLN  33  15.777  -7.453  -0.189
  269    HA   GLN  33           HA       GLN  33  16.071  -7.300   2.598
  270   1HB   GLN  33          2HB       GLN  33  17.710  -6.902   0.408
  271   2HB   GLN  33          3HB       GLN  33  17.468  -5.255   0.956
  272   1HG   GLN  33          2HG       GLN  33  18.001  -6.221   3.352
  273   2HG   GLN  33          3HG       GLN  33  18.668  -7.589   2.482
  274   1HE2  GLN  33          1HE2      GLN  33  20.545  -7.418   1.367
  275   2HE2  GLN  33          2HE2      GLN  33  21.581  -6.030   1.388
  276    H    THR  34           HN       THR  34  15.457  -4.683   0.136
  277    HA   THR  34           HA       THR  34  14.527  -2.922   2.221
  278    HB   THR  34           HB       THR  34  15.359  -2.809  -0.633
  279    HG1  THR  34           HG1      THR  34  15.188  -1.066   1.724
  280   1HG2  THR  34          1HG2      THR  34  13.207  -1.894  -1.151
  281   2HG2  THR  34          2HG2      THR  34  13.047  -1.149   0.458
  282   3HG2  THR  34          3HG2      THR  34  14.182  -0.465  -0.730
  283    H    GLU  35           HN       GLU  35  13.082  -4.608  -0.637
  284    HA   GLU  35           HA       GLU  35  10.582  -3.643  -0.449
  285   1HB   GLU  35          2HB       GLU  35  11.263  -5.143  -2.239
  286   2HB   GLU  35          3HB       GLU  35  11.511  -6.466  -1.116
  287   1HG   GLU  35          2HG       GLU  35   8.904  -5.868  -0.539
  288   2HG   GLU  35          3HG       GLU  35   8.953  -5.360  -2.216
  289    H    PHE  36           HN       PHE  36  11.747  -6.690   1.175
  290    HA   PHE  36           HA       PHE  36  10.098  -6.042   3.456
  291   1HB   PHE  36          2HB       PHE  36   9.755  -8.429   1.560
  292   2HB   PHE  36          3HB       PHE  36   9.202  -8.525   3.221
  293    HD1  PHE  36           HD1      PHE  36   7.810  -6.222   3.876
  294    HD2  PHE  36           HD2      PHE  36   8.083  -8.021   0.043
  295    HE1  PHE  36           HE1      PHE  36   5.640  -5.146   3.217
  296    HE2  PHE  36           HE2      PHE  36   5.913  -6.945  -0.616
  297    HZ   PHE  36           HZ       PHE  36   4.718  -5.521   0.979
  298    HA   PRO  37           HA       PRO  37  13.933  -8.034   4.622
  299   1HB   PRO  37          2HB       PRO  37  14.486  -6.428   6.763
  300   2HB   PRO  37          3HB       PRO  37  15.076  -6.105   5.145
  301   1HG   PRO  37          2HG       PRO  37  12.896  -4.765   6.626
  302   2HG   PRO  37          3HG       PRO  37  13.773  -4.203   5.216
  303   1HD   PRO  37          2HD       PRO  37  11.121  -5.296   5.264
  304   2HD   PRO  37          3HD       PRO  37  12.042  -4.842   3.844
  305    H    SER  38           HN       SER  38  10.897  -7.968   5.749
  306    HA   SER  38           HA       SER  38  11.563  -9.294   8.221
  307   1HB   SER  38          2HB       SER  38   9.309  -7.787   7.194
  308   2HB   SER  38          3HB       SER  38   8.743  -9.359   7.721
  309    HG   SER  38           HG       SER  38   9.583  -7.201   9.233
  310    H    LEU  39           HN       LEU  39  10.339  -9.926   4.933
  311    HA   LEU  39           HA       LEU  39   9.387 -12.535   5.471
  312   1HB   LEU  39          2HB       LEU  39   9.469 -10.699   3.302
  313   2HB   LEU  39          3HB       LEU  39  10.169 -12.206   2.744
  314    HG   LEU  39           HG       LEU  39   7.634 -11.811   2.457
  315   1HD1  LEU  39          1HD1      LEU  39   8.584 -14.402   3.709
  316   2HD1  LEU  39          2HD1      LEU  39   7.164 -14.182   2.659
  317   3HD1  LEU  39          3HD1      LEU  39   8.801 -13.934   2.006
  318   1HD2  LEU  39          1HD2      LEU  39   6.259 -11.729   4.213
  319   2HD2  LEU  39          2HD2      LEU  39   7.088 -13.070   5.040
  320   3HD2  LEU  39          3HD2      LEU  39   7.716 -11.410   5.185
  321    H    LEU  40           HN       LEU  40  12.547 -11.119   5.137
  322    HA   LEU  40           HA       LEU  40  13.830 -13.480   4.184
  323   1HB   LEU  40          2HB       LEU  40  14.854 -10.925   5.421
  324   2HB   LEU  40          3HB       LEU  40  15.895 -12.217   4.858
  325    HG   LEU  40           HG       LEU  40  13.908 -10.788   3.075
  326   1HD1  LEU  40          1HD1      LEU  40  15.240  -9.002   3.270
  327   2HD1  LEU  40          2HD1      LEU  40  16.544  -9.933   4.044
  328   3HD1  LEU  40          3HD1      LEU  40  16.386  -9.928   2.271
  329   1HD2  LEU  40          1HD2      LEU  40  14.370 -12.707   1.929
  330   2HD2  LEU  40          2HD2      LEU  40  15.727 -11.697   1.377
  331   3HD2  LEU  40          3HD2      LEU  40  15.979 -12.900   2.664
  332    H    LYS  41           HN       LYS  41  12.785 -12.195   7.302
  333    HA   LYS  41           HA       LYS  41  14.527 -13.732   8.895
  334   1HB   LYS  41          2HB       LYS  41  13.373 -12.861  10.686
  335   2HB   LYS  41          3HB       LYS  41  13.061 -11.650   9.459
  336   1HG   LYS  41          2HG       LYS  41  10.869 -11.971  10.063
  337   2HG   LYS  41          3HG       LYS  41  10.966 -13.327   8.957
  338   1HD   LYS  41          2HD       LYS  41  11.391 -14.891  10.763
  339   2HD   LYS  41          3HD       LYS  41  11.665 -13.597  11.912
  340   1HE   LYS  41          2HE       LYS  41   9.382 -13.086  12.106
  341   2HE   LYS  41          3HE       LYS  41   9.000 -13.673  10.499
  342   1HZ   LYS  41          1HZ       LYS  41   9.803 -15.902  11.619
  343   2HZ   LYS  41          2HZ       LYS  41   9.254 -15.148  12.960
  344   3HZ   LYS  41          3HZ       LYS  41   8.252 -15.395  11.694
  345    H    GLY  42           HN       GLY  42  11.464 -14.379   7.212
  346   1HA   GLY  42          1HA       GLY  42  10.392 -16.501   8.472
  347   2HA   GLY  42          2HA       GLY  42  10.512 -16.374   6.728
  348    H    MET  43           HN       MET  43  10.534 -18.896   7.928
  349    HA   MET  43           HA       MET  43  13.183 -19.734   8.429
  350   1HB   MET  43          2HB       MET  43  10.626 -21.293   7.752
  351   2HB   MET  43          3HB       MET  43  12.095 -22.032   8.358
  352   1HG   MET  43          2HG       MET  43  11.656 -20.003  10.220
  353   2HG   MET  43          3HG       MET  43  10.021 -20.490   9.819
  354   1HE   MET  43          1HE       MET  43  10.264 -22.493  12.981
  355   2HE   MET  43          2HE       MET  43   9.993 -20.877  12.287
  356   3HE   MET  43          3HE       MET  43   9.037 -22.264  11.712
  357    H    SER  44           HN       SER  44  11.706 -18.752   5.593
  358    HA   SER  44           HA       SER  44  12.864 -20.816   3.955
  359   1HB   SER  44          2HB       SER  44  10.600 -19.806   3.466
  360   2HB   SER  44          3HB       SER  44  11.387 -18.276   3.135
  361    HG   SER  44           HG       SER  44  11.388 -20.684   1.616
  362    H    THR  45           HN       THR  45  15.115 -20.615   3.954
  363    HA   THR  45           HA       THR  45  16.441 -18.127   4.036
  364    HB   THR  45           HB       THR  45  18.428 -19.587   3.537
  365    HG1  THR  45           HG1      THR  45  17.737 -21.218   2.184
  366   1HG2  THR  45          1HG2      THR  45  18.341 -20.368   5.681
  367   2HG2  THR  45          2HG2      THR  45  16.617 -19.931   5.740
  368   3HG2  THR  45          3HG2      THR  45  17.104 -21.559   5.211
  369    H    LEU  46           HN       LEU  46  18.115 -17.519   2.271
  370    HA   LEU  46           HA       LEU  46  16.731 -16.570   0.105
  371   1HB   LEU  46          2HB       LEU  46  19.097 -16.061   1.128
  372   2HB   LEU  46          3HB       LEU  46  19.651 -17.183  -0.099
  373    HG   LEU  46           HG       LEU  46  18.906 -15.799  -1.872
  374   1HD1  LEU  46          1HD1      LEU  46  17.733 -13.550  -1.222
  375   2HD1  LEU  46          2HD1      LEU  46  16.786 -15.048  -1.382
  376   3HD1  LEU  46          3HD1      LEU  46  17.246 -14.454   0.232
  377   1HD2  LEU  46          1HD2      LEU  46  19.810 -13.521  -0.267
  378   2HD2  LEU  46          2HD2      LEU  46  20.821 -14.973  -0.076
  379   3HD2  LEU  46          3HD2      LEU  46  20.542 -14.289  -1.696
  380    H    ASP  47           HN       ASP  47  19.138 -19.298   0.010
  381    HA   ASP  47           HA       ASP  47  18.735 -20.105  -2.488
  382   1HB   ASP  47          2HB       ASP  47  19.556 -21.369   0.038
  383   2HB   ASP  47          3HB       ASP  47  18.805 -22.531  -1.037
  384    H    GLU  48           HN       GLU  48  16.857 -21.172   0.447
  385    HA   GLU  48           HA       GLU  48  15.150 -22.883  -0.824
  386   1HB   GLU  48          2HB       GLU  48  15.344 -21.560   1.756
  387   2HB   GLU  48          3HB       GLU  48  13.669 -21.593   1.246
  388   1HG   GLU  48          2HG       GLU  48  14.306 -24.139   0.597
  389   2HG   GLU  48          3HG       GLU  48  15.523 -23.893   1.833
  390    H    LEU  49           HN       LEU  49  14.862 -19.319  -0.283
  391    HA   LEU  49           HA       LEU  49  12.295 -19.107  -1.410
  392   1HB   LEU  49          2HB       LEU  49  13.961 -17.494   0.014
  393   2HB   LEU  49          3HB       LEU  49  14.103 -16.786  -1.583
  394    HG   LEU  49           HG       LEU  49  11.387 -17.052  -1.373
  395   1HD1  LEU  49          1HD1      LEU  49  10.689 -17.283   0.717
  396   2HD1  LEU  49          2HD1      LEU  49  12.375 -17.386   1.280
  397   3HD1  LEU  49          3HD1      LEU  49  11.565 -15.804   1.182
  398   1HD2  LEU  49          1HD2      LEU  49  13.350 -14.942  -1.336
  399   2HD2  LEU  49          2HD2      LEU  49  11.697 -14.946  -1.996
  400   3HD2  LEU  49          3HD2      LEU  49  11.972 -14.521  -0.289
  401    H    PHE  50           HN       PHE  50  15.632 -18.821  -2.744
  402    HA   PHE  50           HA       PHE  50  14.892 -17.953  -5.275
  403   1HB   PHE  50          2HB       PHE  50  17.209 -18.104  -4.158
  404   2HB   PHE  50          3HB       PHE  50  17.158 -19.841  -4.390
  405    HD1  PHE  50           HD1      PHE  50  16.202 -17.075  -6.705
  406    HD2  PHE  50           HD2      PHE  50  18.800 -20.342  -5.942
  407    HE1  PHE  50           HE1      PHE  50  17.215 -16.801  -8.985
  408    HE2  PHE  50           HE2      PHE  50  19.814 -20.068  -8.222
  409    HZ   PHE  50           HZ       PHE  50  19.009 -18.301  -9.716
  410    H    GLU  51           HN       GLU  51  15.586 -21.320  -4.082
  411    HA   GLU  51           HA       GLU  51  14.909 -22.475  -6.537
  412   1HB   GLU  51          2HB       GLU  51  15.113 -24.596  -5.371
  413   2HB   GLU  51          3HB       GLU  51  16.371 -23.526  -4.786
  414   1HG   GLU  51          2HG       GLU  51  15.500 -24.432  -2.789
  415   2HG   GLU  51          3HG       GLU  51  14.682 -22.886  -2.893
  416    H    GLU  52           HN       GLU  52  13.100 -21.802  -3.501
  417    HA   GLU  52           HA       GLU  52  10.849 -23.277  -4.157
  418   1HB   GLU  52          2HB       GLU  52  11.277 -22.474  -1.883
  419   2HB   GLU  52          3HB       GLU  52  11.181 -20.804  -2.406
  420   1HG   GLU  52          2HG       GLU  52   8.855 -20.851  -2.634
  421   2HG   GLU  52          3HG       GLU  52   8.814 -22.564  -3.004
  422    H    LEU  53           HN       LEU  53  11.498 -19.711  -4.496
  423    HA   LEU  53           HA       LEU  53   9.111 -19.101  -5.763
  424   1HB   LEU  53          2HB       LEU  53  11.812 -17.776  -6.047
  425   2HB   LEU  53          3HB       LEU  53  10.273 -17.074  -6.505
  426    HG   LEU  53           HG       LEU  53  10.664 -17.979  -3.672
  427   1HD1  LEU  53          1HD1      LEU  53  12.244 -16.509  -3.161
  428   2HD1  LEU  53          2HD1      LEU  53  12.460 -16.198  -4.901
  429   3HD1  LEU  53          3HD1      LEU  53  11.344 -15.190  -3.948
  430   1HD2  LEU  53          1HD2      LEU  53   9.293 -15.455  -4.493
  431   2HD2  LEU  53          2HD2      LEU  53   8.503 -17.009  -4.853
  432   3HD2  LEU  53          3HD2      LEU  53   8.920 -16.590  -3.173
  433    H    ASP  54           HN       ASP  54  12.343 -19.963  -7.164
  434    HA   ASP  54           HA       ASP  54  11.370 -19.839  -9.790
  435   1HB   ASP  54          2HB       ASP  54  13.787 -19.636  -9.110
  436   2HB   ASP  54          3HB       ASP  54  13.786 -21.330  -8.660
  437    H    LYS  55           HN       LYS  55   9.703 -21.276 -10.365
  438    HA   LYS  55           HA       LYS  55  10.092 -24.085  -9.592
  439   1HB   LYS  55          2HB       LYS  55   7.690 -24.336  -9.573
  440   2HB   LYS  55          3HB       LYS  55   8.150 -23.029  -8.501
  441   1HG   LYS  55          2HG       LYS  55   7.039 -21.465  -9.740
  442   2HG   LYS  55          3HG       LYS  55   7.676 -22.079 -11.252
  443   1HD   LYS  55          2HD       LYS  55   5.685 -23.869  -9.946
  444   2HD   LYS  55          3HD       LYS  55   5.041 -22.316 -10.440
  445   1HE   LYS  55          2HE       LYS  55   5.002 -22.979 -12.609
  446   2HE   LYS  55          3HE       LYS  55   6.725 -23.295 -12.575
  447   1HZ   LYS  55          1HZ       LYS  55   4.620 -25.158 -11.720
  448   2HZ   LYS  55          2HZ       LYS  55   5.531 -25.281 -13.070
  449   3HZ   LYS  55          3HZ       LYS  55   6.221 -25.455 -11.601
  450    H    ASN  56           HN       ASN  56  10.225 -21.807 -12.108
  451    HA   ASN  56           HA       ASN  56   9.229 -23.590 -14.111
  452   1HB   ASN  56          2HB       ASN  56  10.793 -20.984 -14.477
  453   2HB   ASN  56          3HB       ASN  56   9.794 -21.776 -15.680
  454   1HD2  ASN  56          1HD2      ASN  56   7.493 -22.268 -14.870
  455   2HD2  ASN  56          2HD2      ASN  56   6.656 -20.968 -14.090
  456    H    GLY  57           HN       GLY  57  11.823 -23.850 -12.227
  457   1HA   GLY  57          1HA       GLY  57  14.021 -24.400 -12.432
  458   2HA   GLY  57          2HA       GLY  57  13.362 -25.546 -13.583
  459    H    ASP  58           HN       ASP  58  14.144 -21.989 -13.479
  460    HA   ASP  58           HA       ASP  58  15.536 -22.416 -16.000
  461   1HB   ASP  58          2HB       ASP  58  14.784 -20.031 -16.590
  462   2HB   ASP  58          3HB       ASP  58  13.546 -21.270 -16.657
  463    H    GLY  59           HN       GLY  59  14.878 -20.074 -13.282
  464   1HA   GLY  59          1HA       GLY  59  16.870 -19.698 -11.830
  465   2HA   GLY  59          2HA       GLY  59  17.749 -19.357 -13.307
  466    H    GLU  60           HN       GLU  60  14.631 -18.301 -13.914
  467    HA   GLU  60           HA       GLU  60  15.362 -15.619 -13.041
  468   1HB   GLU  60          2HB       GLU  60  13.405 -16.355 -15.255
  469   2HB   GLU  60          3HB       GLU  60  14.067 -14.768 -14.914
  470   1HG   GLU  60          2HG       GLU  60  15.891 -15.196 -16.190
  471   2HG   GLU  60          3HG       GLU  60  16.266 -16.627 -15.250
  472    H    VAL  61           HN       VAL  61  14.072 -14.583 -11.559
  473    HA   VAL  61           HA       VAL  61  11.602 -15.971 -10.823
  474    HB   VAL  61           HB       VAL  61  13.438 -14.070  -9.365
  475   1HG1  VAL  61          1HG1      VAL  61  10.590 -14.635  -8.917
  476   2HG1  VAL  61          2HG1      VAL  61  11.610 -14.946  -7.492
  477   3HG1  VAL  61          3HG1      VAL  61  11.622 -13.341  -8.262
  478   1HG2  VAL  61          1HG2      VAL  61  14.079 -15.870  -8.060
  479   2HG2  VAL  61          2HG2      VAL  61  12.590 -16.785  -8.394
  480   3HG2  VAL  61          3HG2      VAL  61  13.851 -16.650  -9.643
  481    H    SER  62           HN       SER  62  11.258 -14.706 -13.183
  482    HA   SER  62           HA       SER  62  10.832 -12.066 -13.288
  483   1HB   SER  62          2HB       SER  62   8.588 -13.417 -14.555
  484   2HB   SER  62          3HB       SER  62   9.953 -12.609 -15.300
  485    HG   SER  62           HG       SER  62   9.688 -15.363 -14.525
  486    H    PHE  63           HN       PHE  63   8.631 -10.849 -13.311
  487    HA   PHE  63           HA       PHE  63   7.598 -10.720 -10.800
  488   1HB   PHE  63          2HB       PHE  63   7.372  -9.196 -12.922
  489   2HB   PHE  63          3HB       PHE  63   6.065 -10.252 -13.422
  490    HD1  PHE  63           HD1      PHE  63   4.170  -8.906 -13.293
  491    HD2  PHE  63           HD2      PHE  63   6.853  -9.000 -10.006
  492    HE1  PHE  63           HE1      PHE  63   2.553  -7.550 -11.934
  493    HE2  PHE  63           HE2      PHE  63   5.237  -7.643  -8.648
  494    HZ   PHE  63           HZ       PHE  63   3.106  -6.935  -9.628
  495    H    GLU  64           HN       GLU  64   6.743 -12.950 -13.432
  496    HA   GLU  64           HA       GLU  64   4.236 -13.671 -12.639
  497   1HB   GLU  64          2HB       GLU  64   5.002 -15.995 -13.647
  498   2HB   GLU  64          3HB       GLU  64   4.868 -14.587 -14.682
  499   1HG   GLU  64          2HG       GLU  64   7.095 -14.600 -15.134
  500   2HG   GLU  64          3HG       GLU  64   7.508 -14.659 -13.432
  501    H    GLU  65           HN       GLU  65   7.428 -15.054 -11.605
  502    HA   GLU  65           HA       GLU  65   6.175 -16.825  -9.792
  503   1HB   GLU  65          2HB       GLU  65   9.083 -15.961 -10.102
  504   2HB   GLU  65          3HB       GLU  65   8.551 -17.239  -9.028
  505   1HG   GLU  65          2HG       GLU  65   7.422 -18.288 -11.141
  506   2HG   GLU  65          3HG       GLU  65   8.404 -17.169 -12.066
  507    H    PHE  66           HN       PHE  66   7.430 -13.513  -9.698
  508    HA   PHE  66           HA       PHE  66   7.864 -13.261  -6.974
  509   1HB   PHE  66          2HB       PHE  66   8.468 -11.617  -8.784
  510   2HB   PHE  66          3HB       PHE  66   6.770 -11.336  -9.111
  511    HD1  PHE  66           HD1      PHE  66   9.376 -10.938  -6.502
  512    HD2  PHE  66           HD2      PHE  66   5.578  -9.694  -7.928
  513    HE1  PHE  66           HE1      PHE  66   9.366  -9.060  -4.836
  514    HE2  PHE  66           HE2      PHE  66   5.568  -7.816  -6.262
  515    HZ   PHE  66           HZ       PHE  66   7.462  -7.522  -4.737
  516    H    GLN  67           HN       GLN  67   4.853 -13.100  -8.921
  517    HA   GLN  67           HA       GLN  67   3.262 -11.969  -6.967
  518   1HB   GLN  67          2HB       GLN  67   2.521 -13.919  -9.193
  519   2HB   GLN  67          3HB       GLN  67   1.365 -12.972  -8.278
  520   1HG   GLN  67          2HG       GLN  67   3.072 -10.978  -9.056
  521   2HG   GLN  67          3HG       GLN  67   3.295 -12.091 -10.392
  522   1HE2  GLN  67          1HE2      GLN  67   2.221  -9.661 -10.848
  523   2HE2  GLN  67          2HE2      GLN  67   0.539  -9.767 -11.247
  524    H    VAL  68           HN       VAL  68   4.837 -15.018  -7.041
  525    HA   VAL  68           HA       VAL  68   2.851 -16.470  -5.581
  526    HB   VAL  68           HB       VAL  68   5.787 -17.048  -6.016
  527   1HG1  VAL  68          1HG1      VAL  68   5.108 -18.523  -4.349
  528   2HG1  VAL  68          2HG1      VAL  68   3.459 -18.668  -5.003
  529   3HG1  VAL  68          3HG1      VAL  68   4.818 -19.462  -5.833
  530   1HG2  VAL  68          1HG2      VAL  68   4.025 -16.695  -8.034
  531   2HG2  VAL  68          2HG2      VAL  68   5.363 -17.867  -8.090
  532   3HG2  VAL  68          3HG2      VAL  68   3.723 -18.409  -7.664
  533    H    LEU  69           HN       LEU  69   5.774 -14.520  -4.872
  534    HA   LEU  69           HA       LEU  69   5.820 -15.252  -2.122
  535   1HB   LEU  69          2HB       LEU  69   7.694 -14.369  -3.702
  536   2HB   LEU  69          3HB       LEU  69   7.086 -12.785  -3.263
  537    HG   LEU  69           HG       LEU  69   7.642 -13.081  -0.972
  538   1HD1  LEU  69          1HD1      LEU  69   8.858 -15.441  -0.478
  539   2HD1  LEU  69          2HD1      LEU  69   7.134 -15.125  -0.168
  540   3HD1  LEU  69          3HD1      LEU  69   7.631 -15.960  -1.659
  541   1HD2  LEU  69          1HD2      LEU  69   9.605 -12.404  -1.912
  542   2HD2  LEU  69          2HD2      LEU  69  10.132 -13.965  -1.239
  543   3HD2  LEU  69          3HD2      LEU  69   9.729 -13.832  -2.968
  544    H    VAL  70           HN       VAL  70   4.125 -12.875  -4.114
  545    HA   VAL  70           HA       VAL  70   3.535 -10.959  -2.232
  546    HB   VAL  70           HB       VAL  70   2.228 -12.027  -4.694
  547   1HG1  VAL  70          1HG1      VAL  70   0.398 -10.413  -4.529
  548   2HG1  VAL  70          2HG1      VAL  70   0.339 -11.568  -3.175
  549   3HG1  VAL  70          3HG1      VAL  70   0.958  -9.919  -2.912
  550   1HG2  VAL  70          1HG2      VAL  70   3.822 -10.517  -5.331
  551   2HG2  VAL  70          2HG2      VAL  70   2.460  -9.395  -5.097
  552   3HG2  VAL  70          3HG2      VAL  70   3.694  -9.574  -3.826
  553    H    LYS  71           HN       LYS  71   2.520 -14.308  -2.439
  554    HA   LYS  71           HA       LYS  71   0.143 -14.014  -0.922
  555   1HB   LYS  71          2HB       LYS  71   1.285 -15.996  -2.458
  556   2HB   LYS  71          3HB       LYS  71   1.503 -16.624  -0.837
  557   1HG   LYS  71          2HG       LYS  71  -1.071 -15.753  -0.615
  558   2HG   LYS  71          3HG       LYS  71  -1.037 -16.070  -2.338
  559   1HD   LYS  71          2HD       LYS  71   0.245 -18.318  -1.235
  560   2HD   LYS  71          3HD       LYS  71  -1.034 -17.975  -0.087
  561   1HE   LYS  71          2HE       LYS  71  -2.678 -18.619  -1.543
  562   2HE   LYS  71          3HE       LYS  71  -1.955 -17.757  -2.887
  563   1HZ   LYS  71          1HZ       LYS  71  -1.644 -19.897  -3.506
  564   2HZ   LYS  71          2HZ       LYS  71  -0.233 -19.667  -2.716
  565   3HZ   LYS  71          3HZ       LYS  71  -1.456 -20.468  -1.988
  566    H    LYS  72           HN       LYS  72   3.549 -14.973  -0.147
  567    HA   LYS  72           HA       LYS  72   2.993 -15.273   2.614
  568   1HB   LYS  72          2HB       LYS  72   5.605 -14.964   1.105
  569   2HB   LYS  72          3HB       LYS  72   5.476 -15.377   2.803
  570   1HG   LYS  72          2HG       LYS  72   5.593 -17.511   1.869
  571   2HG   LYS  72          3HG       LYS  72   3.855 -17.295   1.929
  572   1HD   LYS  72          2HD       LYS  72   3.678 -16.904  -0.390
  573   2HD   LYS  72          3HD       LYS  72   5.338 -16.362  -0.534
  574   1HE   LYS  72          2HE       LYS  72   6.010 -18.456  -1.085
  575   2HE   LYS  72          3HE       LYS  72   5.387 -19.083   0.428
  576   1HZ   LYS  72          1HZ       LYS  72   3.798 -18.660  -2.008
  577   2HZ   LYS  72          2HZ       LYS  72   4.323 -20.103  -1.452
  578   3HZ   LYS  72          3HZ       LYS  72   3.222 -19.251  -0.599
  579    H    ILE  73           HN       ILE  73   3.283 -12.551   0.539
  580    HA   ILE  73           HA       ILE  73   4.279 -10.826   2.649
  581    HB   ILE  73           HB       ILE  73   3.666 -10.483  -0.270
  582   1HG1  ILE  73          2HG1      ILE  73   6.211  -9.826   1.213
  583   2HG1  ILE  73          3HG1      ILE  73   5.863 -11.458   0.676
  584   1HG2  ILE  73          1HG2      ILE  73   4.142  -8.313   1.782
  585   2HG2  ILE  73          2HG2      ILE  73   4.408  -8.089   0.036
  586   3HG2  ILE  73          3HG2      ILE  73   2.782  -8.481   0.645
  587   1HD1  ILE  73          1HD1      ILE  73   7.023 -10.609  -1.171
  588   2HD1  ILE  73          2HD1      ILE  73   5.340 -10.285  -1.650
  589   3HD1  ILE  73          3HD1      ILE  73   6.342  -8.976  -0.977
  590    H    SER  74           HN       SER  74   1.323 -12.185   1.606
  591    HA   SER  74           HA       SER  74  -0.213  -9.878   2.375
  592   1HB   SER  74          2HB       SER  74  -0.676 -11.743   0.485
  593   2HB   SER  74          3HB       SER  74  -1.481 -12.549   1.817
  594    HG   SER  74           HG       SER  74  -2.101  -9.814   1.586
  595    H    GLN  75           HN       GLN  75   0.328 -13.315   3.405
  596    HA   GLN  75           HA       GLN  75  -1.321 -13.070   5.662
  597   1HB   GLN  75          2HB       GLN  75  -0.048 -15.148   4.294
  598   2HB   GLN  75          3HB       GLN  75   0.798 -15.118   5.828
  599   1HG   GLN  75          2HG       GLN  75  -1.112 -15.659   7.064
  600   2HG   GLN  75          3HG       GLN  75  -2.204 -14.914   5.913
  601   1HE2  GLN  75          1HE2      GLN  75  -1.824 -15.964   3.581
  602   2HE2  GLN  75          2HE2      GLN  75  -1.997 -17.688   3.544
  Start of MODEL    5
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   1.498  -0.573  -1.973
    3   1HB   LYS   1          2HB       LYS   1   2.759   1.407  -2.730
    4   2HB   LYS   1          3HB       LYS   1   1.215   1.824  -2.014
    5   1HG   LYS   1          2HG       LYS   1   2.737   1.972   0.225
    6   2HG   LYS   1          3HG       LYS   1   3.992   2.294  -0.956
    7   1HD   LYS   1          2HD       LYS   1   2.662   4.159  -1.907
    8   2HD   LYS   1          3HD       LYS   1   1.341   3.808  -0.811
    9   1HE   LYS   1          2HE       LYS   1   2.306   5.048   0.826
   10   2HE   LYS   1          3HE       LYS   1   3.767   4.084   0.749
   11   1HZ   LYS   1          1HZ       LYS   1   3.859   5.636  -1.471
   12   2HZ   LYS   1          2HZ       LYS   1   3.275   6.646  -0.328
   13   3HZ   LYS   1          3HZ       LYS   1   4.699   5.881  -0.092
   14    H    SER   2           HN       SER   2   3.746   0.366   0.700
   15    HA   SER   2           HA       SER   2   6.010  -0.684  -0.464
   16   1HB   SER   2          2HB       SER   2   5.218   0.414   2.083
   17   2HB   SER   2          3HB       SER   2   6.148  -1.040   2.389
   18    HG   SER   2           HG       SER   2   7.636   0.025   0.608
   19    HA   PRO   3           HA       PRO   3   5.782  -4.966   0.335
   20   1HB   PRO   3          2HB       PRO   3   8.172  -5.688   1.446
   21   2HB   PRO   3          3HB       PRO   3   7.967  -5.374  -0.265
   22   1HG   PRO   3          2HG       PRO   3   9.246  -3.677   1.789
   23   2HG   PRO   3          3HG       PRO   3   9.400  -3.594   0.046
   24   1HD   PRO   3          2HD       PRO   3   7.843  -1.858   1.715
   25   2HD   PRO   3          3HD       PRO   3   7.906  -1.849  -0.036
   26    H    GLU   4           HN       GLU   4   6.780  -3.206   3.175
   27    HA   GLU   4           HA       GLU   4   6.359  -5.171   5.015
   28   1HB   GLU   4          2HB       GLU   4   6.887  -2.401   5.026
   29   2HB   GLU   4          3HB       GLU   4   5.414  -2.561   5.962
   30   1HG   GLU   4          2HG       GLU   4   7.585  -4.557   6.534
   31   2HG   GLU   4          3HG       GLU   4   7.893  -2.905   7.032
   32    H    GLU   5           HN       GLU   5   3.993  -2.819   3.608
   33    HA   GLU   5           HA       GLU   5   1.862  -3.730   5.167
   34   1HB   GLU   5          2HB       GLU   5   2.282  -1.882   2.896
   35   2HB   GLU   5          3HB       GLU   5   0.706  -2.649   2.876
   36   1HG   GLU   5          2HG       GLU   5   1.028  -1.963   5.573
   37   2HG   GLU   5          3HG       GLU   5   1.783  -0.620   4.738
   38    H    LEU   6           HN       LEU   6   3.370  -4.849   2.169
   39    HA   LEU   6           HA       LEU   6   1.187  -6.339   1.204
   40   1HB   LEU   6          2HB       LEU   6   4.119  -6.197   0.693
   41   2HB   LEU   6          3HB       LEU   6   3.252  -7.608   0.119
   42    HG   LEU   6           HG       LEU   6   2.515  -4.750  -0.570
   43   1HD1  LEU   6          1HD1      LEU   6   3.663  -6.578  -2.616
   44   2HD1  LEU   6          2HD1      LEU   6   3.803  -4.813  -2.436
   45   3HD1  LEU   6          3HD1      LEU   6   4.782  -5.892  -1.413
   46   1HD2  LEU   6          1HD2      LEU   6   1.556  -6.678  -2.447
   47   2HD2  LEU   6          2HD2      LEU   6   1.065  -7.182  -0.812
   48   3HD2  LEU   6          3HD2      LEU   6   0.633  -5.562  -1.411
   49    H    LYS   7           HN       LYS   7   3.845  -7.007   3.519
   50    HA   LYS   7           HA       LYS   7   3.353  -9.767   3.707
   51   1HB   LYS   7          2HB       LYS   7   5.337  -8.148   4.522
   52   2HB   LYS   7          3HB       LYS   7   4.464  -8.273   6.035
   53   1HG   LYS   7          2HG       LYS   7   4.946 -10.817   4.493
   54   2HG   LYS   7          3HG       LYS   7   6.319 -10.089   5.302
   55   1HD   LYS   7          2HD       LYS   7   3.671 -10.680   6.703
   56   2HD   LYS   7          3HD       LYS   7   5.021 -11.796   6.691
   57   1HE   LYS   7          2HE       LYS   7   6.295  -9.491   7.499
   58   2HE   LYS   7          3HE       LYS   7   4.701  -9.224   8.176
   59   1HZ   LYS   7          1HZ       LYS   7   5.324 -10.578   9.779
   60   2HZ   LYS   7          2HZ       LYS   7   5.280 -11.825   8.726
   61   3HZ   LYS   7          3HZ       LYS   7   6.685 -11.039   9.003
   62    H    GLY   8           HN       GLY   8   2.301  -6.958   5.751
   63   1HA   GLY   8          1HA       GLY   8   0.785  -8.390   7.584
   64   2HA   GLY   8          2HA       GLY   8   0.540  -6.717   7.125
   65    H    ILE   9           HN       ILE   9  -0.351  -6.653   4.589
   66    HA   ILE   9           HA       ILE   9  -2.982  -7.457   4.766
   67    HB   ILE   9           HB       ILE   9  -1.181  -6.511   2.588
   68   1HG1  ILE   9          2HG1      ILE   9  -3.676  -5.495   3.960
   69   2HG1  ILE   9          3HG1      ILE   9  -2.057  -4.829   4.027
   70   1HG2  ILE   9          1HG2      ILE   9  -4.009  -7.491   2.105
   71   2HG2  ILE   9          2HG2      ILE   9  -2.982  -6.617   0.943
   72   3HG2  ILE   9          3HG2      ILE   9  -2.518  -8.246   1.492
   73   1HD1  ILE   9          1HD1      ILE   9  -3.868  -4.929   1.571
   74   2HD1  ILE   9          2HD1      ILE   9  -3.407  -3.480   2.498
   75   3HD1  ILE   9          3HD1      ILE   9  -2.181  -4.359   1.552
   76    H    PHE  10           HN       PHE  10  -0.178  -9.050   3.126
   77    HA   PHE  10           HA       PHE  10  -1.512 -11.102   1.922
   78   1HB   PHE  10          2HB       PHE  10   0.840 -10.893   1.535
   79   2HB   PHE  10          3HB       PHE  10   1.190 -10.648   3.235
   80    HD1  PHE  10           HD1      PHE  10   1.345 -12.574   4.761
   81    HD2  PHE  10           HD2      PHE  10   0.737 -13.105   0.595
   82    HE1  PHE  10           HE1      PHE  10   2.015 -14.984   4.970
   83    HE2  PHE  10           HE2      PHE  10   1.407 -15.515   0.804
   84    HZ   PHE  10           HZ       PHE  10   2.038 -16.425   2.989
   85    H    GLU  11           HN       GLU  11  -0.081 -11.095   5.267
   86    HA   GLU  11           HA       GLU  11  -0.973 -13.641   5.880
   87   1HB   GLU  11          2HB       GLU  11   0.438 -11.513   7.175
   88   2HB   GLU  11          3HB       GLU  11  -0.863 -11.979   8.253
   89   1HG   GLU  11          2HG       GLU  11   0.073 -14.454   7.405
   90   2HG   GLU  11          3HG       GLU  11   1.549 -13.510   7.430
   91    H    LYS  12           HN       LYS  12  -2.473 -10.392   6.291
   92    HA   LYS  12           HA       LYS  12  -4.617 -11.159   7.867
   93   1HB   LYS  12          2HB       LYS  12  -3.711  -8.818   7.000
   94   2HB   LYS  12          3HB       LYS  12  -4.944  -9.041   5.776
   95   1HG   LYS  12          2HG       LYS  12  -6.093  -9.762   8.325
   96   2HG   LYS  12          3HG       LYS  12  -5.281  -8.222   8.521
   97   1HD   LYS  12          2HD       LYS  12  -6.487  -7.446   6.380
   98   2HD   LYS  12          3HD       LYS  12  -7.437  -8.916   6.478
   99   1HE   LYS  12          2HE       LYS  12  -7.857  -8.111   8.994
  100   2HE   LYS  12          3HE       LYS  12  -7.422  -6.540   8.350
  101   1HZ   LYS  12          1HZ       LYS  12  -9.815  -7.935   8.035
  102   2HZ   LYS  12          2HZ       LYS  12  -9.452  -6.418   7.551
  103   3HZ   LYS  12          3HZ       LYS  12  -9.168  -7.682   6.557
  104    H    TYR  13           HN       TYR  13  -3.883 -11.792   4.491
  105    HA   TYR  13           HA       TYR  13  -6.646 -12.562   3.963
  106   1HB   TYR  13          2HB       TYR  13  -4.091 -11.887   2.516
  107   2HB   TYR  13          3HB       TYR  13  -5.027 -13.155   1.751
  108    HD1  TYR  13           HD1      TYR  13  -6.962 -12.650   0.469
  109    HD2  TYR  13           HD2      TYR  13  -5.191  -9.625   2.921
  110    HE1  TYR  13           HE1      TYR  13  -8.444 -10.893  -0.617
  111    HE2  TYR  13           HE2      TYR  13  -6.679  -7.877   1.827
  112    HH   TYR  13           HH       TYR  13  -8.831  -8.759  -0.843
  113    H    ALA  14           HN       ALA  14  -3.329 -13.922   4.286
  114    HA   ALA  14           HA       ALA  14  -4.035 -16.523   3.472
  115   1HB   ALA  14          1HB       ALA  14  -1.833 -17.028   3.977
  116   2HB   ALA  14          2HB       ALA  14  -1.716 -15.260   3.807
  117   3HB   ALA  14          3HB       ALA  14  -1.814 -15.994   5.425
  118    H    ALA  15           HN       ALA  15  -4.532 -14.666   6.409
  119    HA   ALA  15           HA       ALA  15  -4.898 -17.013   8.045
  120   1HB   ALA  15          1HB       ALA  15  -5.826 -14.313   8.921
  121   2HB   ALA  15          2HB       ALA  15  -4.871 -15.534   9.796
  122   3HB   ALA  15          3HB       ALA  15  -4.087 -14.491   8.586
  123    H    LYS  16           HN       LYS  16  -6.738 -15.018   5.847
  124    HA   LYS  16           HA       LYS  16  -9.264 -15.182   6.941
  125   1HB   LYS  16          2HB       LYS  16  -8.102 -14.251   4.584
  126   2HB   LYS  16          3HB       LYS  16  -9.231 -15.473   4.035
  127   1HG   LYS  16          2HG       LYS  16 -10.967 -14.359   5.613
  128   2HG   LYS  16          3HG       LYS  16  -9.832 -13.031   5.754
  129   1HD   LYS  16          2HD       LYS  16 -10.122 -12.351   3.542
  130   2HD   LYS  16          3HD       LYS  16 -10.467 -13.971   2.970
  131   1HE   LYS  16          2HE       LYS  16 -12.580 -12.924   2.843
  132   2HE   LYS  16          3HE       LYS  16 -12.676 -13.784   4.367
  133   1HZ   LYS  16          1HZ       LYS  16 -12.586 -11.877   5.523
  134   2HZ   LYS  16          2HZ       LYS  16 -11.605 -11.107   4.469
  135   3HZ   LYS  16          3HZ       LYS  16 -13.201 -11.237   4.152
  136    H    GLU  17           HN       GLU  17  -7.928 -17.364   4.354
  137    HA   GLU  17           HA       GLU  17  -9.630 -19.428   5.520
  138   1HB   GLU  17          2HB       GLU  17  -8.943 -18.780   2.643
  139   2HB   GLU  17          3HB       GLU  17  -9.406 -20.413   3.082
  140   1HG   GLU  17          2HG       GLU  17 -11.315 -18.774   4.376
  141   2HG   GLU  17          3HG       GLU  17 -11.084 -18.018   2.812
  142    H    GLY  18           HN       GLY  18  -8.640 -21.301   6.211
  143   1HA   GLY  18          1HA       GLY  18  -7.033 -22.831   6.583
  144   2HA   GLY  18          2HA       GLY  18  -6.289 -22.361   5.068
  145    H    ASP  19           HN       ASP  19  -4.419 -22.977   6.785
  146    HA   ASP  19           HA       ASP  19  -3.757 -21.202   8.756
  147   1HB   ASP  19          2HB       ASP  19  -2.694 -23.508   7.858
  148   2HB   ASP  19          3HB       ASP  19  -1.588 -22.420   7.045
  149    HA   PRO  20           HA       PRO  20  -2.423 -17.764   6.360
  150   1HB   PRO  20          2HB       PRO  20  -1.216 -16.284   8.316
  151   2HB   PRO  20          3HB       PRO  20  -2.948 -16.287   8.047
  152   1HG   PRO  20          2HG       PRO  20  -1.404 -17.604  10.196
  153   2HG   PRO  20          3HG       PRO  20  -3.117 -17.238  10.142
  154   1HD   PRO  20          2HD       PRO  20  -1.897 -19.801   9.734
  155   2HD   PRO  20          3HD       PRO  20  -3.597 -19.411   9.566
  156    H    ASN  21           HN       ASN  21  -0.462 -20.104   7.550
  157    HA   ASN  21           HA       ASN  21   1.960 -18.767   6.794
  158   1HB   ASN  21          2HB       ASN  21   1.344 -21.594   7.791
  159   2HB   ASN  21          3HB       ASN  21   2.964 -21.078   7.366
  160   1HD2  ASN  21          1HD2      ASN  21   3.844 -19.187   8.453
  161   2HD2  ASN  21          2HD2      ASN  21   3.432 -18.872  10.106
  162    H    GLN  22           HN       GLN  22  -0.570 -20.063   5.117
  163    HA   GLN  22           HA       GLN  22   1.113 -20.711   2.892
  164   1HB   GLN  22          2HB       GLN  22  -0.316 -22.856   2.490
  165   2HB   GLN  22          3HB       GLN  22   1.002 -22.936   3.642
  166   1HG   GLN  22          2HG       GLN  22  -1.258 -22.015   5.119
  167   2HG   GLN  22          3HG       GLN  22  -1.855 -23.308   4.098
  168   1HE2  GLN  22          1HE2      GLN  22   0.991 -22.509   6.088
  169   2HE2  GLN  22          2HE2      GLN  22   1.174 -24.057   6.842
  170    H    LEU  23           HN       LEU  23   0.198 -19.934   1.012
  171    HA   LEU  23           HA       LEU  23  -2.424 -18.743   1.270
  172   1HB   LEU  23          2HB       LEU  23  -0.128 -18.536  -0.630
  173   2HB   LEU  23          3HB       LEU  23  -1.724 -18.072  -1.185
  174    HG   LEU  23           HG       LEU  23  -0.142 -16.270  -0.217
  175   1HD1  LEU  23          1HD1      LEU  23  -1.953 -14.907   0.278
  176   2HD1  LEU  23          2HD1      LEU  23  -2.679 -16.173  -0.741
  177   3HD1  LEU  23          3HD1      LEU  23  -2.880 -16.229   1.026
  178   1HD2  LEU  23          1HD2      LEU  23  -0.610 -15.967   2.298
  179   2HD2  LEU  23          2HD2      LEU  23  -1.007 -17.702   2.288
  180   3HD2  LEU  23          3HD2      LEU  23   0.616 -17.157   1.801
  181    H    SER  24           HN       SER  24  -4.025 -19.021  -0.572
  182    HA   SER  24           HA       SER  24  -3.811 -21.659  -1.753
  183   1HB   SER  24          2HB       SER  24  -6.273 -20.672  -0.245
  184   2HB   SER  24          3HB       SER  24  -6.160 -22.183  -1.125
  185    HG   SER  24           HG       SER  24  -4.194 -22.555   0.390
  186    H    LYS  25           HN       LYS  25  -5.500 -21.947  -3.550
  187    HA   LYS  25           HA       LYS  25  -5.383 -19.848  -5.323
  188   1HB   LYS  25          2HB       LYS  25  -5.789 -22.236  -5.877
  189   2HB   LYS  25          3HB       LYS  25  -7.416 -22.097  -5.242
  190   1HG   LYS  25          2HG       LYS  25  -7.640 -20.060  -6.904
  191   2HG   LYS  25          3HG       LYS  25  -6.227 -20.742  -7.685
  192   1HD   LYS  25          2HD       LYS  25  -7.858 -22.983  -7.330
  193   2HD   LYS  25          3HD       LYS  25  -9.023 -21.719  -7.669
  194   1HE   LYS  25          2HE       LYS  25  -7.183 -21.132  -9.595
  195   2HE   LYS  25          3HE       LYS  25  -6.878 -22.850  -9.437
  196   1HZ   LYS  25          1HZ       LYS  25  -8.566 -22.805 -10.933
  197   2HZ   LYS  25          2HZ       LYS  25  -9.439 -22.971  -9.562
  198   3HZ   LYS  25          3HZ       LYS  25  -9.312 -21.508 -10.278
  199    H    GLU  26           HN       GLU  26  -8.276 -20.935  -3.403
  200    HA   GLU  26           HA       GLU  26  -9.881 -18.855  -4.155
  201   1HB   GLU  26          2HB       GLU  26  -9.967 -21.027  -2.305
  202   2HB   GLU  26          3HB       GLU  26 -10.415 -19.596  -1.398
  203   1HG   GLU  26          2HG       GLU  26 -11.800 -19.288  -3.826
  204   2HG   GLU  26          3HG       GLU  26 -11.904 -21.009  -3.515
  205    H    GLU  27           HN       GLU  27  -7.515 -19.096  -1.444
  206    HA   GLU  27           HA       GLU  27  -8.196 -16.719  -0.222
  207   1HB   GLU  27          2HB       GLU  27  -5.849 -18.565  -0.225
  208   2HB   GLU  27          3HB       GLU  27  -5.522 -16.936   0.333
  209   1HG   GLU  27          2HG       GLU  27  -7.779 -17.324   1.738
  210   2HG   GLU  27          3HG       GLU  27  -7.367 -19.013   1.514
  211    H    LEU  28           HN       LEU  28  -5.497 -17.407  -2.568
  212    HA   LEU  28           HA       LEU  28  -4.588 -14.828  -2.812
  213   1HB   LEU  28          2HB       LEU  28  -3.697 -17.081  -3.707
  214   2HB   LEU  28          3HB       LEU  28  -4.684 -16.752  -5.117
  215    HG   LEU  28           HG       LEU  28  -3.276 -15.187  -5.918
  216   1HD1  LEU  28          1HD1      LEU  28  -2.586 -14.312  -3.099
  217   2HD1  LEU  28          2HD1      LEU  28  -2.098 -13.503  -4.607
  218   3HD1  LEU  28          3HD1      LEU  28  -3.817 -13.574  -4.151
  219   1HD2  LEU  28          1HD2      LEU  28  -0.973 -15.673  -5.530
  220   2HD2  LEU  28          2HD2      LEU  28  -1.320 -16.340  -3.917
  221   3HD2  LEU  28          3HD2      LEU  28  -1.879 -17.197  -5.373
  222    H    LYS  29           HN       LYS  29  -7.221 -16.506  -4.640
  223    HA   LYS  29           HA       LYS  29  -7.837 -14.691  -6.507
  224   1HB   LYS  29          2HB       LYS  29  -9.005 -16.820  -6.178
  225   2HB   LYS  29          3HB       LYS  29  -9.786 -16.198  -4.737
  226   1HG   LYS  29          2HG       LYS  29 -10.991 -14.508  -6.024
  227   2HG   LYS  29          3HG       LYS  29 -10.064 -14.864  -7.468
  228   1HD   LYS  29          2HD       LYS  29 -11.039 -17.353  -6.998
  229   2HD   LYS  29          3HD       LYS  29 -12.302 -16.430  -6.209
  230   1HE   LYS  29          2HE       LYS  29 -12.176 -14.981  -8.477
  231   2HE   LYS  29          3HE       LYS  29 -11.518 -16.472  -9.122
  232   1HZ   LYS  29          1HZ       LYS  29 -14.143 -16.038  -7.918
  233   2HZ   LYS  29          2HZ       LYS  29 -13.783 -16.676  -9.377
  234   3HZ   LYS  29          3HZ       LYS  29 -13.515 -17.542  -8.018
  235    H    LEU  30           HN       LEU  30  -9.020 -14.558  -3.073
  236    HA   LEU  30           HA       LEU  30 -10.376 -12.173  -3.297
  237   1HB   LEU  30          2HB       LEU  30  -8.882 -13.287  -0.919
  238   2HB   LEU  30          3HB       LEU  30 -10.088 -12.017  -0.860
  239    HG   LEU  30           HG       LEU  30 -10.465 -14.948  -1.447
  240   1HD1  LEU  30          1HD1      LEU  30 -10.525 -13.901   0.903
  241   2HD1  LEU  30          2HD1      LEU  30 -12.085 -13.205   0.401
  242   3HD1  LEU  30          3HD1      LEU  30 -11.863 -14.971   0.420
  243   1HD2  LEU  30          1HD2      LEU  30 -12.881 -14.368  -1.934
  244   2HD2  LEU  30          2HD2      LEU  30 -12.340 -12.688  -2.162
  245   3HD2  LEU  30          3HD2      LEU  30 -11.705 -13.977  -3.212
  246    H    LEU  31           HN       LEU  31  -6.948 -12.699  -2.204
  247    HA   LEU  31           HA       LEU  31  -6.284 -10.059  -1.891
  248   1HB   LEU  31          2HB       LEU  31  -5.022 -12.309  -1.445
  249   2HB   LEU  31          3HB       LEU  31  -4.331 -12.022  -3.030
  250    HG   LEU  31           HG       LEU  31  -4.042  -9.580  -1.673
  251   1HD1  LEU  31          1HD1      LEU  31  -2.570 -10.719   0.279
  252   2HD1  LEU  31          2HD1      LEU  31  -4.244 -10.155   0.500
  253   3HD1  LEU  31          3HD1      LEU  31  -3.917 -11.878   0.193
  254   1HD2  LEU  31          1HD2      LEU  31  -1.856  -9.803  -2.253
  255   2HD2  LEU  31          2HD2      LEU  31  -1.766 -11.501  -1.726
  256   3HD2  LEU  31          3HD2      LEU  31  -2.538 -11.090  -3.276
  257    H    LEU  32           HN       LEU  32  -5.612 -12.074  -4.846
  258    HA   LEU  32           HA       LEU  32  -4.751 -10.035  -6.446
  259   1HB   LEU  32          2HB       LEU  32  -6.357 -12.470  -7.234
  260   2HB   LEU  32          3HB       LEU  32  -5.417 -11.472  -8.325
  261    HG   LEU  32           HG       LEU  32  -4.289 -13.082  -6.017
  262   1HD1  LEU  32          1HD1      LEU  32  -4.966 -14.670  -7.593
  263   2HD1  LEU  32          2HD1      LEU  32  -4.504 -13.642  -8.971
  264   3HD1  LEU  32          3HD1      LEU  32  -3.246 -14.395  -7.960
  265   1HD2  LEU  32          1HD2      LEU  32  -2.761 -11.372  -6.241
  266   2HD2  LEU  32          2HD2      LEU  32  -2.117 -12.576  -7.383
  267   3HD2  LEU  32          3HD2      LEU  32  -3.053 -11.188  -7.987
  268    H    GLN  33           HN       GLN  33  -7.947 -10.615  -5.166
  269    HA   GLN  33           HA       GLN  33  -9.350  -9.278  -7.197
  270   1HB   GLN  33          2HB       GLN  33 -10.036 -10.824  -5.020
  271   2HB   GLN  33          3HB       GLN  33 -10.493  -9.231  -4.450
  272   1HG   GLN  33          2HG       GLN  33 -11.699  -8.933  -6.732
  273   2HG   GLN  33          3HG       GLN  33 -11.467 -10.655  -6.960
  274   1HE2  GLN  33          1HE2      GLN  33 -12.053 -11.997  -4.951
  275   2HE2  GLN  33          2HE2      GLN  33 -13.575 -11.643  -4.204
  276    H    THR  34           HN       THR  34  -8.405  -8.280  -3.823
  277    HA   THR  34           HA       THR  34  -8.956  -5.512  -4.520
  278    HB   THR  34           HB       THR  34  -8.690  -7.200  -2.083
  279    HG1  THR  34           HG1      THR  34 -10.585  -5.997  -3.086
  280   1HG2  THR  34          1HG2      THR  34  -8.069  -5.316  -0.622
  281   2HG2  THR  34          2HG2      THR  34  -6.741  -5.600  -1.773
  282   3HG2  THR  34          3HG2      THR  34  -7.871  -4.249  -2.033
  283    H    GLU  35           HN       GLU  35  -6.153  -7.516  -3.400
  284    HA   GLU  35           HA       GLU  35  -4.289  -5.586  -3.323
  285   1HB   GLU  35          2HB       GLU  35  -3.795  -7.872  -2.673
  286   2HB   GLU  35          3HB       GLU  35  -4.055  -8.460  -4.304
  287   1HG   GLU  35          2HG       GLU  35  -2.119  -6.483  -4.684
  288   2HG   GLU  35          3HG       GLU  35  -1.666  -7.158  -3.132
  289    H    PHE  36           HN       PHE  36  -4.978  -7.645  -6.251
  290    HA   PHE  36           HA       PHE  36  -4.552  -5.325  -7.918
  291   1HB   PHE  36          2HB       PHE  36  -2.814  -7.842  -7.780
  292   2HB   PHE  36          3HB       PHE  36  -2.934  -6.952  -9.285
  293    HD1  PHE  36           HD1      PHE  36  -0.819  -7.439  -6.716
  294    HD2  PHE  36           HD2      PHE  36  -2.762  -4.205  -8.659
  295    HE1  PHE  36           HE1      PHE  36   0.994  -5.885  -5.942
  296    HE2  PHE  36           HE2      PHE  36  -0.949  -2.651  -7.885
  297    HZ   PHE  36           HZ       PHE  36   0.907  -3.509  -6.535
  298    HA   PRO  37           HA       PRO  37  -7.742  -8.012  -9.532
  299   1HB   PRO  37          2HB       PRO  37  -9.471  -6.034 -10.282
  300   2HB   PRO  37          3HB       PRO  37  -9.524  -6.807  -8.711
  301   1HG   PRO  37          2HG       PRO  37  -8.520  -4.119  -9.422
  302   2HG   PRO  37          3HG       PRO  37  -8.972  -4.741  -7.847
  303   1HD   PRO  37          2HD       PRO  37  -6.309  -4.368  -8.844
  304   2HD   PRO  37          3HD       PRO  37  -6.764  -5.097  -7.316
  305    H    SER  38           HN       SER  38  -5.938  -5.442 -10.873
  306    HA   SER  38           HA       SER  38  -6.847  -5.759 -13.493
  307   1HB   SER  38          2HB       SER  38  -4.600  -4.605 -14.035
  308   2HB   SER  38          3HB       SER  38  -5.721  -3.730 -13.012
  309    HG   SER  38           HG       SER  38  -3.767  -5.434 -11.790
  310    H    LEU  39           HN       LEU  39  -4.439  -7.424 -11.472
  311    HA   LEU  39           HA       LEU  39  -3.058  -8.670 -13.600
  312   1HB   LEU  39          2HB       LEU  39  -2.908  -8.503 -10.764
  313   2HB   LEU  39          3HB       LEU  39  -2.935 -10.201 -11.194
  314    HG   LEU  39           HG       LEU  39  -0.665  -8.989 -10.981
  315   1HD1  LEU  39          1HD1      LEU  39  -1.445 -11.255 -12.264
  316   2HD1  LEU  39          2HD1      LEU  39  -0.655 -10.368 -13.589
  317   3HD1  LEU  39          3HD1      LEU  39   0.243 -10.717 -12.093
  318   1HD2  LEU  39          1HD2      LEU  39   0.144  -7.686 -12.725
  319   2HD2  LEU  39          2HD2      LEU  39  -1.120  -8.226 -13.855
  320   3HD2  LEU  39          3HD2      LEU  39  -1.528  -7.105 -12.534
  321    H    LEU  40           HN       LEU  40  -6.171  -9.147 -12.103
  322    HA   LEU  40           HA       LEU  40  -6.361 -11.924 -12.723
  323   1HB   LEU  40          2HB       LEU  40  -8.403  -9.842 -11.943
  324   2HB   LEU  40          3HB       LEU  40  -8.780 -11.535 -12.192
  325    HG   LEU  40           HG       LEU  40  -6.741 -10.581 -10.169
  326   1HD1  LEU  40          1HD1      LEU  40  -9.625 -10.380 -10.074
  327   2HD1  LEU  40          2HD1      LEU  40  -9.019 -11.467  -8.801
  328   3HD1  LEU  40          3HD1      LEU  40  -8.401  -9.802  -8.917
  329   1HD2  LEU  40          1HD2      LEU  40  -6.274 -12.807 -10.471
  330   2HD2  LEU  40          2HD2      LEU  40  -7.501 -12.898  -9.183
  331   3HD2  LEU  40          3HD2      LEU  40  -7.957 -13.225 -10.873
  332    H    LYS  41           HN       LYS  41  -6.885  -8.858 -14.402
  333    HA   LYS  41           HA       LYS  41  -8.563  -9.928 -16.420
  334   1HB   LYS  41          2HB       LYS  41  -6.891  -7.406 -16.259
  335   2HB   LYS  41          3HB       LYS  41  -7.955  -7.783 -17.599
  336   1HG   LYS  41          2HG       LYS  41  -9.643  -8.227 -15.457
  337   2HG   LYS  41          3HG       LYS  41  -8.632  -6.946 -14.819
  338   1HD   LYS  41          2HD       LYS  41  -9.147  -5.501 -16.741
  339   2HD   LYS  41          3HD       LYS  41 -10.012  -6.800 -17.539
  340   1HE   LYS  41          2HE       LYS  41 -11.888  -6.565 -16.205
  341   2HE   LYS  41          3HE       LYS  41 -10.957  -6.162 -14.776
  342   1HZ   LYS  41          1HZ       LYS  41 -11.056  -4.276 -16.994
  343   2HZ   LYS  41          2HZ       LYS  41 -12.310  -4.358 -15.951
  344   3HZ   LYS  41          3HZ       LYS  41 -10.817  -3.983 -15.405
  345    H    GLY  42           HN       GLY  42  -5.048  -9.697 -15.880
  346   1HA   GLY  42          1HA       GLY  42  -3.950 -10.000 -18.322
  347   2HA   GLY  42          2HA       GLY  42  -3.381 -10.841 -16.894
  348    H    MET  43           HN       MET  43  -3.033 -12.046 -19.370
  349    HA   MET  43           HA       MET  43  -5.215 -13.711 -20.013
  350   1HB   MET  43          2HB       MET  43  -2.223 -13.902 -20.678
  351   2HB   MET  43          3HB       MET  43  -3.468 -14.847 -21.469
  352   1HG   MET  43          2HG       MET  43  -3.722 -13.145 -22.953
  353   2HG   MET  43          3HG       MET  43  -4.398 -12.181 -21.656
  354   1HE   MET  43          1HE       MET  43  -1.692 -10.866 -24.219
  355   2HE   MET  43          2HE       MET  43  -3.430 -11.057 -23.886
  356   3HE   MET  43          3HE       MET  43  -2.543  -9.667 -23.216
  357    H    SER  44           HN       SER  44  -3.221 -13.692 -17.326
  358    HA   SER  44           HA       SER  44  -2.957 -16.561 -17.194
  359   1HB   SER  44          2HB       SER  44  -2.042 -14.319 -15.342
  360   2HB   SER  44          3HB       SER  44  -1.791 -16.017 -14.991
  361    HG   SER  44           HG       SER  44  -0.671 -14.438 -17.121
  362    H    THR  45           HN       THR  45  -4.984 -17.471 -16.787
  363    HA   THR  45           HA       THR  45  -6.925 -16.238 -15.150
  364    HB   THR  45           HB       THR  45  -8.049 -18.464 -15.431
  365    HG1  THR  45           HG1      THR  45  -6.708 -20.173 -15.953
  366   1HG2  THR  45          1HG2      THR  45  -8.365 -17.230 -17.441
  367   2HG2  THR  45          2HG2      THR  45  -6.625 -17.226 -17.816
  368   3HG2  THR  45          3HG2      THR  45  -7.576 -18.716 -18.022
  369    H    LEU  46           HN       LEU  46  -7.906 -17.473 -13.199
  370    HA   LEU  46           HA       LEU  46  -6.158 -17.233 -11.102
  371   1HB   LEU  46          2HB       LEU  46  -8.791 -17.507 -11.334
  372   2HB   LEU  46          3HB       LEU  46  -8.418 -19.165 -10.903
  373    HG   LEU  46           HG       LEU  46  -7.519 -18.535  -8.795
  374   1HD1  LEU  46          1HD1      LEU  46  -7.359 -15.810 -10.005
  375   2HD1  LEU  46          2HD1      LEU  46  -7.609 -15.944  -8.247
  376   3HD1  LEU  46          3HD1      LEU  46  -6.184 -16.696  -9.004
  377   1HD2  LEU  46          1HD2      LEU  46 -10.172 -17.882  -9.561
  378   2HD2  LEU  46          2HD2      LEU  46  -9.562 -18.355  -7.957
  379   3HD2  LEU  46          3HD2      LEU  46  -9.625 -16.636  -8.414
  380    H    ASP  47           HN       ASP  47  -7.413 -20.385 -12.419
  381    HA   ASP  47           HA       ASP  47  -5.868 -22.043 -11.031
  382   1HB   ASP  47          2HB       ASP  47  -7.416 -22.165 -13.397
  383   2HB   ASP  47          3HB       ASP  47  -5.860 -22.819 -13.867
  384    H    GLU  48           HN       GLU  48  -5.025 -20.452 -14.199
  385    HA   GLU  48           HA       GLU  48  -2.540 -21.541 -14.497
  386   1HB   GLU  48          2HB       GLU  48  -4.083 -19.360 -15.640
  387   2HB   GLU  48          3HB       GLU  48  -2.410 -18.865 -15.477
  388   1HG   GLU  48          2HG       GLU  48  -1.972 -21.335 -16.484
  389   2HG   GLU  48          3HG       GLU  48  -3.583 -21.093 -17.130
  390    H    LEU  49           HN       LEU  49  -3.541 -18.538 -12.745
  391    HA   LEU  49           HA       LEU  49  -0.931 -17.762 -12.062
  392   1HB   LEU  49          2HB       LEU  49  -3.461 -16.700 -11.892
  393   2HB   LEU  49          3HB       LEU  49  -3.072 -17.001 -10.210
  394    HG   LEU  49           HG       LEU  49  -0.843 -15.730 -11.575
  395   1HD1  LEU  49          1HD1      LEU  49  -3.348 -14.046 -11.481
  396   2HD1  LEU  49          2HD1      LEU  49  -1.766 -13.653 -12.196
  397   3HD1  LEU  49          3HD1      LEU  49  -2.805 -14.883 -12.955
  398   1HD2  LEU  49          1HD2      LEU  49  -2.194 -15.702  -9.033
  399   2HD2  LEU  49          2HD2      LEU  49  -0.555 -15.150  -9.454
  400   3HD2  LEU  49          3HD2      LEU  49  -1.935 -14.037  -9.605
  401    H    PHE  50           HN       PHE  50  -3.403 -19.835 -10.458
  402    HA   PHE  50           HA       PHE  50  -2.102 -20.137  -8.038
  403   1HB   PHE  50          2HB       PHE  50  -4.449 -20.869  -8.741
  404   2HB   PHE  50          3HB       PHE  50  -3.734 -22.135  -9.719
  405    HD1  PHE  50           HD1      PHE  50  -3.901 -24.232  -8.804
  406    HD2  PHE  50           HD2      PHE  50  -3.365 -20.928  -6.194
  407    HE1  PHE  50           HE1      PHE  50  -3.947 -25.783  -6.831
  408    HE2  PHE  50           HE2      PHE  50  -3.412 -22.479  -4.221
  409    HZ   PHE  50           HZ       PHE  50  -3.702 -24.888  -4.563
  410    H    GLU  51           HN       GLU  51  -1.916 -22.190 -11.032
  411    HA   GLU  51           HA       GLU  51   0.001 -23.892  -9.883
  412   1HB   GLU  51          2HB       GLU  51  -1.450 -23.634 -12.413
  413   2HB   GLU  51          3HB       GLU  51   0.218 -24.091 -12.695
  414   1HG   GLU  51          2HG       GLU  51  -0.380 -25.748 -10.588
  415   2HG   GLU  51          3HG       GLU  51  -1.963 -25.613 -11.328
  416    H    GLU  52           HN       GLU  52   0.107 -20.883 -11.794
  417    HA   GLU  52           HA       GLU  52   2.783 -21.089 -12.541
  418   1HB   GLU  52          2HB       GLU  52   1.126 -19.550 -13.594
  419   2HB   GLU  52          3HB       GLU  52   1.069 -18.600 -12.124
  420   1HG   GLU  52          2HG       GLU  52   3.715 -18.484 -12.448
  421   2HG   GLU  52          3HG       GLU  52   3.332 -18.878 -14.112
  422    H    LEU  53           HN       LEU  53   1.166 -19.267  -9.840
  423    HA   LEU  53           HA       LEU  53   3.476 -18.249  -8.716
  424   1HB   LEU  53          2HB       LEU  53   0.913 -19.057  -7.336
  425   2HB   LEU  53          3HB       LEU  53   2.133 -17.974  -6.695
  426    HG   LEU  53           HG       LEU  53   0.885 -17.296  -9.331
  427   1HD1  LEU  53          1HD1      LEU  53  -0.713 -15.976  -7.488
  428   2HD1  LEU  53          2HD1      LEU  53  -1.187 -17.348  -8.518
  429   3HD1  LEU  53          3HD1      LEU  53  -0.616 -17.638  -6.857
  430   1HD2  LEU  53          1HD2      LEU  53   2.240 -15.562  -8.967
  431   2HD2  LEU  53          2HD2      LEU  53   1.040 -15.030  -7.765
  432   3HD2  LEU  53          3HD2      LEU  53   2.457 -15.975  -7.249
  433    H    ASP  54           HN       ASP  54   1.706 -21.323  -7.953
  434    HA   ASP  54           HA       ASP  54   3.524 -22.127  -6.025
  435   1HB   ASP  54          2HB       ASP  54   1.241 -23.089  -6.337
  436   2HB   ASP  54          3HB       ASP  54   1.740 -23.796  -7.861
  437    H    LYS  55           HN       LYS  55   5.727 -22.290  -6.576
  438    HA   LYS  55           HA       LYS  55   6.338 -23.800  -9.022
  439   1HB   LYS  55          2HB       LYS  55   7.006 -21.200  -8.534
  440   2HB   LYS  55          3HB       LYS  55   8.418 -22.020  -7.899
  441   1HG   LYS  55          2HG       LYS  55   7.867 -23.374 -10.317
  442   2HG   LYS  55          3HG       LYS  55   7.559 -21.689 -10.691
  443   1HD   LYS  55          2HD       LYS  55   9.863 -21.855 -11.120
  444   2HD   LYS  55          3HD       LYS  55   9.854 -21.234  -9.481
  445   1HE   LYS  55          2HE       LYS  55  10.448 -23.324  -8.536
  446   2HE   LYS  55          3HE       LYS  55   9.861 -24.232  -9.916
  447   1HZ   LYS  55          1HZ       LYS  55  12.387 -23.717  -9.559
  448   2HZ   LYS  55          2HZ       LYS  55  11.745 -23.842 -11.056
  449   3HZ   LYS  55          3HZ       LYS  55  12.016 -22.370 -10.404
  450    H    ASN  56           HN       ASN  56   5.955 -24.212  -5.816
  451    HA   ASN  56           HA       ASN  56   8.451 -25.651  -5.476
  452   1HB   ASN  56          2HB       ASN  56   7.232 -25.921  -3.060
  453   2HB   ASN  56          3HB       ASN  56   8.186 -24.510  -3.469
  454   1HD2  ASN  56          1HD2      ASN  56   4.922 -25.698  -4.280
  455   2HD2  ASN  56          2HD2      ASN  56   4.053 -24.263  -3.846
  456    H    GLY  57           HN       GLY  57   5.096 -25.989  -6.277
  457   1HA   GLY  57          1HA       GLY  57   3.736 -27.750  -6.581
  458   2HA   GLY  57          2HA       GLY  57   5.182 -28.733  -6.708
  459    H    ASP  58           HN       ASP  58   3.035 -27.142  -4.254
  460    HA   ASP  58           HA       ASP  58   3.300 -29.562  -2.688
  461   1HB   ASP  58          2HB       ASP  58   3.239 -27.804  -0.650
  462   2HB   ASP  58          3HB       ASP  58   4.747 -28.366  -1.343
  463    H    GLY  59           HN       GLY  59   1.924 -26.195  -2.348
  464   1HA   GLY  59          1HA       GLY  59  -0.582 -26.305  -3.070
  465   2HA   GLY  59          2HA       GLY  59  -0.682 -27.357  -1.672
  466    H    GLU  60           HN       GLU  60   1.351 -24.401  -2.208
  467    HA   GLU  60           HA       GLU  60  -0.312 -22.797  -0.609
  468   1HB   GLU  60          2HB       GLU  60   1.251 -22.485   1.309
  469   2HB   GLU  60          3HB       GLU  60   0.600 -24.110   1.240
  470   1HG   GLU  60          2HG       GLU  60   2.695 -24.862   0.043
  471   2HG   GLU  60          3HG       GLU  60   3.347 -23.244   0.218
  472    H    VAL  61           HN       VAL  61  -0.022 -20.762  -1.416
  473    HA   VAL  61           HA       VAL  61   2.434 -20.265  -2.898
  474    HB   VAL  61           HB       VAL  61  -0.269 -18.933  -2.765
  475   1HG1  VAL  61          1HG1      VAL  61   2.266 -17.732  -3.450
  476   2HG1  VAL  61          2HG1      VAL  61   1.221 -17.814  -4.888
  477   3HG1  VAL  61          3HG1      VAL  61   0.643 -17.003  -3.413
  478   1HG2  VAL  61          1HG2      VAL  61  -0.651 -19.786  -4.891
  479   2HG2  VAL  61          2HG2      VAL  61   1.082 -19.997  -5.236
  480   3HG2  VAL  61          3HG2      VAL  61   0.256 -21.107  -4.117
  481    H    SER  62           HN       SER  62   3.375 -20.374  -0.500
  482    HA   SER  62           HA       SER  62   2.933 -18.479   1.340
  483   1HB   SER  62          2HB       SER  62   5.711 -18.681   1.374
  484   2HB   SER  62          3HB       SER  62   4.596 -19.762   2.188
  485    HG   SER  62           HG       SER  62   5.584 -20.111  -0.516
  486    H    PHE  63           HN       PHE  63   4.644 -16.601   1.901
  487    HA   PHE  63           HA       PHE  63   4.240 -14.582   0.062
  488   1HB   PHE  63          2HB       PHE  63   4.898 -14.602   2.602
  489   2HB   PHE  63          3HB       PHE  63   6.548 -14.859   2.070
  490    HD1  PHE  63           HD1      PHE  63   3.832 -12.599   0.850
  491    HD2  PHE  63           HD2      PHE  63   7.768 -12.935   2.399
  492    HE1  PHE  63           HE1      PHE  63   4.140 -10.120   0.607
  493    HE2  PHE  63           HE2      PHE  63   8.076 -10.456   2.156
  494    HZ   PHE  63           HZ       PHE  63   6.258  -9.078   1.262
  495    H    GLU  64           HN       GLU  64   6.523 -17.189  -0.003
  496    HA   GLU  64           HA       GLU  64   8.608 -15.843  -1.299
  497   1HB   GLU  64          2HB       GLU  64   8.124 -18.776  -1.771
  498   2HB   GLU  64          3HB       GLU  64   9.628 -17.939  -1.442
  499   1HG   GLU  64          2HG       GLU  64   7.472 -18.791   0.505
  500   2HG   GLU  64          3HG       GLU  64   9.198 -19.084   0.584
  501    H    GLU  65           HN       GLU  65   6.057 -18.119  -2.556
  502    HA   GLU  65           HA       GLU  65   6.722 -17.760  -5.209
  503   1HB   GLU  65          2HB       GLU  65   4.061 -18.516  -3.926
  504   2HB   GLU  65          3HB       GLU  65   4.392 -18.657  -5.641
  505   1HG   GLU  65          2HG       GLU  65   5.637 -20.553  -5.366
  506   2HG   GLU  65          3HG       GLU  65   6.510 -19.891  -3.999
  507    H    PHE  66           HN       PHE  66   4.859 -15.771  -2.959
  508    HA   PHE  66           HA       PHE  66   3.326 -14.338  -4.776
  509   1HB   PHE  66          2HB       PHE  66   3.218 -14.370  -2.224
  510   2HB   PHE  66          3HB       PHE  66   4.731 -13.488  -2.171
  511    HD1  PHE  66           HD1      PHE  66   1.271 -13.211  -3.527
  512    HD2  PHE  66           HD2      PHE  66   4.696 -11.170  -2.076
  513    HE1  PHE  66           HE1      PHE  66   0.010 -11.042  -3.602
  514    HE2  PHE  66           HE2      PHE  66   3.436  -9.001  -2.151
  515    HZ   PHE  66           HZ       PHE  66   1.108  -8.962  -2.914
  516    H    GLN  67           HN       GLN  67   6.733 -13.944  -3.691
  517    HA   GLN  67           HA       GLN  67   7.119 -11.429  -4.758
  518   1HB   GLN  67          2HB       GLN  67   9.249 -13.596  -4.619
  519   2HB   GLN  67          3HB       GLN  67   9.476 -11.864  -4.484
  520   1HG   GLN  67          2HG       GLN  67   7.834 -12.075  -2.412
  521   2HG   GLN  67          3HG       GLN  67   8.266 -13.772  -2.464
  522   1HE2  GLN  67          1HE2      GLN  67   9.725 -10.531  -2.578
  523   2HE2  GLN  67          2HE2      GLN  67  11.129 -10.885  -1.628
  524    H    VAL  68           HN       VAL  68   6.548 -14.456  -6.316
  525    HA   VAL  68           HA       VAL  68   8.066 -13.929  -8.674
  526    HB   VAL  68           HB       VAL  68   5.769 -15.840  -8.219
  527   1HG1  VAL  68          1HG1      VAL  68   6.046 -16.367 -10.368
  528   2HG1  VAL  68          2HG1      VAL  68   7.404 -15.226 -10.515
  529   3HG1  VAL  68          3HG1      VAL  68   7.701 -16.901  -9.990
  530   1HG2  VAL  68          1HG2      VAL  68   7.999 -15.850  -6.705
  531   2HG2  VAL  68          2HG2      VAL  68   7.145 -17.333  -7.196
  532   3HG2  VAL  68          3HG2      VAL  68   8.584 -16.796  -8.095
  533    H    LEU  69           HN       LEU  69   4.724 -13.359  -7.516
  534    HA   LEU  69           HA       LEU  69   3.813 -12.504 -10.084
  535   1HB   LEU  69          2HB       LEU  69   2.537 -13.521  -8.034
  536   2HB   LEU  69          3HB       LEU  69   2.448 -11.853  -7.501
  537    HG   LEU  69           HG       LEU  69   1.335 -11.251  -9.644
  538   1HD1  LEU  69          1HD1      LEU  69   0.322 -13.555 -10.687
  539   2HD1  LEU  69          2HD1      LEU  69   1.719 -12.667 -11.343
  540   3HD1  LEU  69          3HD1      LEU  69   1.976 -14.060 -10.265
  541   1HD2  LEU  69          1HD2      LEU  69  -0.776 -11.848  -8.928
  542   2HD2  LEU  69          2HD2      LEU  69  -0.263 -13.472  -8.410
  543   3HD2  LEU  69          3HD2      LEU  69   0.184 -12.047  -7.442
  544    H    VAL  70           HN       VAL  70   5.172 -10.998  -7.135
  545    HA   VAL  70           HA       VAL  70   4.527  -8.378  -7.595
  546    HB   VAL  70           HB       VAL  70   6.817  -9.808  -6.309
  547   1HG1  VAL  70          1HG1      VAL  70   7.838  -7.815  -7.340
  548   2HG1  VAL  70          2HG1      VAL  70   6.624  -6.786  -6.543
  549   3HG1  VAL  70          3HG1      VAL  70   7.800  -7.695  -5.564
  550   1HG2  VAL  70          1HG2      VAL  70   5.308  -7.773  -4.818
  551   2HG2  VAL  70          2HG2      VAL  70   4.295  -9.082  -5.472
  552   3HG2  VAL  70          3HG2      VAL  70   5.668  -9.467  -4.407
  553    H    LYS  71           HN       LYS  71   6.626 -10.511  -9.426
  554    HA   LYS  71           HA       LYS  71   8.191  -8.470 -10.617
  555   1HB   LYS  71          2HB       LYS  71   8.337 -11.200 -10.441
  556   2HB   LYS  71          3HB       LYS  71   7.809 -10.996 -12.100
  557   1HG   LYS  71          2HG       LYS  71   9.729  -9.058 -12.015
  558   2HG   LYS  71          3HG       LYS  71  10.377 -10.145 -10.803
  559   1HD   LYS  71          2HD       LYS  71  11.334 -11.114 -12.675
  560   2HD   LYS  71          3HD       LYS  71   9.823 -12.003 -12.667
  561   1HE   LYS  71          2HE       LYS  71   9.205  -9.629 -14.065
  562   2HE   LYS  71          3HE       LYS  71  10.816 -10.039 -14.621
  563   1HZ   LYS  71          1HZ       LYS  71  10.082 -11.936 -15.552
  564   2HZ   LYS  71          2HZ       LYS  71   8.904 -12.200 -14.453
  565   3HZ   LYS  71          3HZ       LYS  71   8.678 -11.108 -15.646
  566    H    LYS  72           HN       LYS  72   5.146 -10.196 -11.479
  567    HA   LYS  72           HA       LYS  72   4.928  -8.931 -14.004
  568   1HB   LYS  72          2HB       LYS  72   2.949 -10.433 -12.271
  569   2HB   LYS  72          3HB       LYS  72   2.569  -9.828 -13.871
  570   1HG   LYS  72          2HG       LYS  72   4.931 -11.676 -13.298
  571   2HG   LYS  72          3HG       LYS  72   3.353 -12.258 -13.788
  572   1HD   LYS  72          2HD       LYS  72   3.814 -10.325 -15.709
  573   2HD   LYS  72          3HD       LYS  72   5.448 -10.878 -15.399
  574   1HE   LYS  72          2HE       LYS  72   3.756 -13.210 -15.543
  575   2HE   LYS  72          3HE       LYS  72   3.370 -12.193 -16.917
  576   1HZ   LYS  72          1HZ       LYS  72   5.905 -12.041 -17.132
  577   2HZ   LYS  72          2HZ       LYS  72   5.928 -13.391 -16.213
  578   3HZ   LYS  72          3HZ       LYS  72   5.149 -13.393 -17.649
  579    H    ILE  73           HN       ILE  73   3.583  -8.306 -10.712
  580    HA   ILE  73           HA       ILE  73   2.099  -6.046 -11.615
  581    HB   ILE  73           HB       ILE  73   2.849  -6.935  -8.828
  582   1HG1  ILE  73          2HG1      ILE  73   0.161  -7.409 -10.065
  583   2HG1  ILE  73          3HG1      ILE  73   1.480  -8.483 -10.487
  584   1HG2  ILE  73          1HG2      ILE  73   1.906  -5.059  -8.119
  585   2HG2  ILE  73          2HG2      ILE  73   1.543  -4.568  -9.791
  586   3HG2  ILE  73          3HG2      ILE  73   0.378  -5.561  -8.882
  587   1HD1  ILE  73          1HD1      ILE  73   0.945  -7.817  -7.577
  588   2HD1  ILE  73          2HD1      ILE  73  -0.007  -9.070  -8.409
  589   3HD1  ILE  73          3HD1      ILE  73   1.759  -9.243  -8.265
  590    H    SER  74           HN       SER  74   5.396  -6.626 -11.271
  591    HA   SER  74           HA       SER  74   5.984  -4.006 -10.239
  592   1HB   SER  74          2HB       SER  74   7.525  -6.507 -10.822
  593   2HB   SER  74          3HB       SER  74   8.413  -5.003 -10.966
  594    HG   SER  74           HG       SER  74   7.336  -6.255  -8.670
  595    H    GLN  75           HN       GLN  75   6.219  -5.930 -13.282
  596    HA   GLN  75           HA       GLN  75   7.525  -3.894 -14.706
  597   1HB   GLN  75          2HB       GLN  75   7.036  -6.560 -15.132
  598   2HB   GLN  75          3HB       GLN  75   5.858  -5.853 -16.220
  599   1HG   GLN  75          2HG       GLN  75   7.471  -4.940 -17.612
  600   2HG   GLN  75          3HG       GLN  75   8.587  -4.624 -16.298
  601   1HE2  GLN  75          1HE2      GLN  75   9.046  -6.901 -15.082
  602   2HE2  GLN  75          2HE2      GLN  75   9.707  -8.115 -16.126
  Start of MODEL    6
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   2.854   0.755  -1.157
    3   1HB   LYS   1          2HB       LYS   1   2.228  -2.126  -0.915
    4   2HB   LYS   1          3HB       LYS   1   2.743  -1.614  -2.509
    5   1HG   LYS   1          2HG       LYS   1   4.431  -0.314  -0.547
    6   2HG   LYS   1          3HG       LYS   1   4.364  -2.024  -0.170
    7   1HD   LYS   1          2HD       LYS   1   6.048  -2.143  -1.736
    8   2HD   LYS   1          3HD       LYS   1   4.703  -2.220  -2.856
    9   1HE   LYS   1          2HE       LYS   1   5.341   0.565  -2.181
   10   2HE   LYS   1          3HE       LYS   1   6.754  -0.267  -2.800
   11   1HZ   LYS   1          1HZ       LYS   1   4.158  -0.431  -4.148
   12   2HZ   LYS   1          2HZ       LYS   1   5.228   0.759  -4.472
   13   3HZ   LYS   1          3HZ       LYS   1   5.630  -0.799  -4.753
   14    H    SER   2           HN       SER   2  -0.052  -1.245  -2.052
   15    HA   SER   2           HA       SER   2  -0.259  -0.128  -4.572
   16   1HB   SER   2          2HB       SER   2  -1.836  -1.898  -2.834
   17   2HB   SER   2          3HB       SER   2  -2.865  -0.889  -3.831
   18    HG   SER   2           HG       SER   2  -1.916  -3.087  -4.666
   19    HA   PRO   3           HA       PRO   3  -2.177   3.686  -3.717
   20   1HB   PRO   3          2HB       PRO   3  -3.301   4.259  -6.142
   21   2HB   PRO   3          3HB       PRO   3  -1.606   4.523  -5.785
   22   1HG   PRO   3          2HG       PRO   3  -2.847   2.389  -7.411
   23   2HG   PRO   3          3HG       PRO   3  -1.177   2.920  -7.388
   24   1HD   PRO   3          2HD       PRO   3  -2.243   0.554  -6.166
   25   2HD   PRO   3          3HD       PRO   3  -0.598   1.146  -6.045
   26    H    GLU   4           HN       GLU   4  -4.217   1.334  -5.343
   27    HA   GLU   4           HA       GLU   4  -6.597   2.564  -4.662
   28   1HB   GLU   4          2HB       GLU   4  -5.796   0.273  -6.065
   29   2HB   GLU   4          3HB       GLU   4  -6.736  -0.378  -4.737
   30   1HG   GLU   4          2HG       GLU   4  -7.954   2.011  -6.030
   31   2HG   GLU   4          3HG       GLU   4  -7.803   0.624  -7.090
   32    H    GLU   5           HN       GLU   5  -4.358   0.524  -2.821
   33    HA   GLU   5           HA       GLU   5  -6.171  -0.280  -0.863
   34   1HB   GLU   5          2HB       GLU   5  -3.247  -0.324  -1.292
   35   2HB   GLU   5          3HB       GLU   5  -3.684  -0.190   0.400
   36   1HG   GLU   5          2HG       GLU   5  -5.475  -2.121  -0.515
   37   2HG   GLU   5          3HG       GLU   5  -4.044  -2.468  -1.465
   38    H    LEU   6           HN       LEU   6  -4.203   2.661  -1.348
   39    HA   LEU   6           HA       LEU   6  -4.352   3.685   1.229
   40   1HB   LEU   6          2HB       LEU   6  -4.196   5.071  -1.450
   41   2HB   LEU   6          3HB       LEU   6  -3.988   5.876   0.093
   42    HG   LEU   6           HG       LEU   6  -2.251   3.557  -0.774
   43   1HD1  LEU   6          1HD1      LEU   6  -2.333   6.148  -1.941
   44   2HD1  LEU   6          2HD1      LEU   6  -0.850   6.036  -0.963
   45   3HD1  LEU   6          3HD1      LEU   6  -1.173   4.830  -2.231
   46   1HD2  LEU   6          1HD2      LEU   6  -2.549   4.740   1.689
   47   2HD2  LEU   6          2HD2      LEU   6  -1.122   3.832   1.135
   48   3HD2  LEU   6          3HD2      LEU   6  -1.150   5.607   1.010
   49    H    LYS   7           HN       LYS   7  -6.653   3.809  -1.533
   50    HA   LYS   7           HA       LYS   7  -8.425   5.593  -0.227
   51   1HB   LYS   7          2HB       LYS   7  -8.090   4.820  -2.784
   52   2HB   LYS   7          3HB       LYS   7  -9.408   3.751  -2.352
   53   1HG   LYS   7          2HG       LYS   7  -9.875   6.460  -1.321
   54   2HG   LYS   7          3HG       LYS   7  -9.602   6.487  -3.052
   55   1HD   LYS   7          2HD       LYS   7 -11.501   4.452  -1.839
   56   2HD   LYS   7          3HD       LYS   7 -12.043   6.091  -2.142
   57   1HE   LYS   7          2HE       LYS   7 -11.882   5.873  -4.469
   58   2HE   LYS   7          3HE       LYS   7 -10.608   4.673  -4.381
   59   1HZ   LYS   7          1HZ       LYS   7 -13.317   4.232  -4.619
   60   2HZ   LYS   7          2HZ       LYS   7 -12.134   3.114  -4.496
   61   3HZ   LYS   7          3HZ       LYS   7 -12.889   3.654  -3.153
   62    H    GLY   8           HN       GLY   8  -8.361   2.002  -0.720
   63   1HA   GLY   8          1HA       GLY   8 -10.727   1.383   0.579
   64   2HA   GLY   8          2HA       GLY   8  -9.325   0.341   0.445
   65    H    ILE   9           HN       ILE   9  -7.362   1.249   1.972
   66    HA   ILE   9           HA       ILE   9  -8.153   0.735   4.561
   67    HB   ILE   9           HB       ILE   9  -5.725   1.894   3.269
   68   1HG1  ILE   9          2HG1      ILE   9  -6.375  -0.609   4.837
   69   2HG1  ILE   9          3HG1      ILE   9  -5.949  -0.478   3.142
   70   1HG2  ILE   9          1HG2      ILE   9  -4.588   2.134   5.391
   71   2HG2  ILE   9          2HG2      ILE   9  -6.018   3.193   5.350
   72   3HG2  ILE   9          3HG2      ILE   9  -6.064   1.671   6.272
   73   1HD1  ILE   9          1HD1      ILE   9  -3.748   0.702   4.188
   74   2HD1  ILE   9          2HD1      ILE   9  -4.187  -0.338   5.564
   75   3HD1  ILE   9          3HD1      ILE   9  -3.871  -1.060   3.968
   76    H    PHE  10           HN       PHE  10  -7.619   3.895   2.886
   77    HA   PHE  10           HA       PHE  10  -7.939   5.564   5.018
   78   1HB   PHE  10          2HB       PHE  10  -7.379   6.510   2.890
   79   2HB   PHE  10          3HB       PHE  10  -8.600   5.574   2.051
   80    HD1  PHE  10           HD1      PHE  10 -10.954   6.302   2.072
   81    HD2  PHE  10           HD2      PHE  10  -7.905   8.643   3.869
   82    HE1  PHE  10           HE1      PHE  10 -12.492   8.285   2.099
   83    HE2  PHE  10           HE2      PHE  10  -9.444  10.626   3.897
   84    HZ   PHE  10           HZ       PHE  10 -11.719  10.423   3.012
   85    H    GLU  11           HN       GLU  11 -10.551   4.349   2.794
   86    HA   GLU  11           HA       GLU  11 -12.596   5.590   4.186
   87   1HB   GLU  11          2HB       GLU  11 -12.307   3.866   1.918
   88   2HB   GLU  11          3HB       GLU  11 -13.522   3.138   2.950
   89   1HG   GLU  11          2HG       GLU  11 -14.230   5.830   3.036
   90   2HG   GLU  11          3HG       GLU  11 -13.635   5.664   1.397
   91    H    LYS  12           HN       LYS  12 -10.950   2.443   4.609
   92    HA   LYS  12           HA       LYS  12 -12.811   1.255   6.301
   93   1HB   LYS  12          2HB       LYS  12 -10.872   0.158   5.138
   94   2HB   LYS  12          3HB       LYS  12  -9.803   0.886   6.320
   95   1HG   LYS  12          2HG       LYS  12 -11.917  -0.315   7.818
   96   2HG   LYS  12          3HG       LYS  12 -11.481  -1.482   6.586
   97   1HD   LYS  12          2HD       LYS  12  -9.154  -1.489   7.286
   98   2HD   LYS  12          3HD       LYS  12  -9.391  -0.092   8.317
   99   1HE   LYS  12          2HE       LYS  12 -10.907  -1.402   9.788
  100   2HE   LYS  12          3HE       LYS  12 -10.759  -2.794   8.734
  101   1HZ   LYS  12          1HZ       LYS  12  -9.051  -3.316  10.014
  102   2HZ   LYS  12          2HZ       LYS  12  -8.205  -2.134   9.268
  103   3HZ   LYS  12          3HZ       LYS  12  -8.946  -1.834  10.693
  104    H    TYR  13           HN       TYR  13 -10.459   3.845   6.803
  105    HA   TYR  13           HA       TYR  13 -10.808   3.663   9.692
  106   1HB   TYR  13          2HB       TYR  13  -9.018   4.984   7.629
  107   2HB   TYR  13          3HB       TYR  13  -9.211   5.850   9.141
  108    HD1  TYR  13           HD1      TYR  13  -8.176   2.556   7.724
  109    HD2  TYR  13           HD2      TYR  13  -7.967   5.235  11.053
  110    HE1  TYR  13           HE1      TYR  13  -6.389   1.099   8.794
  111    HE2  TYR  13           HE2      TYR  13  -6.181   3.768  12.112
  112    HH   TYR  13           HH       TYR  13  -5.537   0.638  11.015
  113    H    ALA  14           HN       ALA  14 -11.504   5.795   6.874
  114    HA   ALA  14           HA       ALA  14 -12.509   7.931   8.408
  115   1HB   ALA  14          1HB       ALA  14 -11.757   7.654   5.858
  116   2HB   ALA  14          2HB       ALA  14 -13.500   7.369   5.632
  117   3HB   ALA  14          3HB       ALA  14 -12.933   8.895   6.354
  118    H    ALA  15           HN       ALA  15 -13.777   4.791   7.460
  119    HA   ALA  15           HA       ALA  15 -16.521   5.580   7.859
  120   1HB   ALA  15          1HB       ALA  15 -16.767   2.995   7.622
  121   2HB   ALA  15          2HB       ALA  15 -16.241   3.933   6.204
  122   3HB   ALA  15          3HB       ALA  15 -15.047   3.031   7.167
  123    H    LYS  16           HN       LYS  16 -13.791   4.501   9.751
  124    HA   LYS  16           HA       LYS  16 -15.039   3.073  11.753
  125   1HB   LYS  16          2HB       LYS  16 -12.485   4.039  11.212
  126   2HB   LYS  16          3HB       LYS  16 -12.913   4.836  12.712
  127   1HG   LYS  16          2HG       LYS  16 -13.690   2.507  13.553
  128   2HG   LYS  16          3HG       LYS  16 -12.880   1.843  12.147
  129   1HD   LYS  16          2HD       LYS  16 -10.752   2.365  12.940
  130   2HD   LYS  16          3HD       LYS  16 -11.301   3.782  13.813
  131   1HE   LYS  16          2HE       LYS  16 -12.208   2.445  15.615
  132   2HE   LYS  16          3HE       LYS  16 -12.074   0.966  14.685
  133   1HZ   LYS  16          1HZ       LYS  16  -9.561   1.986  14.721
  134   2HZ   LYS  16          2HZ       LYS  16 -10.109   2.268  16.233
  135   3HZ   LYS  16          3HZ       LYS  16 -10.111   0.749  15.634
  136    H    GLU  17           HN       GLU  17 -14.170   6.605  11.883
  137    HA   GLU  17           HA       GLU  17 -16.514   6.896  13.597
  138   1HB   GLU  17          2HB       GLU  17 -13.783   8.200  13.683
  139   2HB   GLU  17          3HB       GLU  17 -15.164   9.027  14.375
  140   1HG   GLU  17          2HG       GLU  17 -15.381   6.372  15.333
  141   2HG   GLU  17          3HG       GLU  17 -13.667   6.727  15.416
  142    H    GLY  18           HN       GLY  18 -18.100   8.315  12.935
  143   1HA   GLY  18          1HA       GLY  18 -19.175   9.857  11.703
  144   2HA   GLY  18          2HA       GLY  18 -17.631  10.632  11.413
  145    H    ASP  19           HN       ASP  19 -19.138  10.889   9.291
  146    HA   ASP  19           HA       ASP  19 -19.463   8.768   7.601
  147   1HB   ASP  19          2HB       ASP  19 -20.158  11.338   7.476
  148   2HB   ASP  19          3HB       ASP  19 -18.680  11.499   6.550
  149    HA   PRO  20           HA       PRO  20 -15.306   8.067   6.344
  150   1HB   PRO  20          2HB       PRO  20 -15.745   6.367   4.250
  151   2HB   PRO  20          3HB       PRO  20 -15.727   5.843   5.922
  152   1HG   PRO  20          2HG       PRO  20 -18.043   6.233   4.126
  153   2HG   PRO  20          3HG       PRO  20 -17.955   5.325   5.622
  154   1HD   PRO  20          2HD       PRO  20 -19.127   7.917   5.253
  155   2HD   PRO  20          3HD       PRO  20 -18.935   7.059   6.769
  156    H    ASN  21           HN       ASN  21 -17.425   9.985   4.812
  157    HA   ASN  21           HA       ASN  21 -15.817  10.311   2.460
  158   1HB   ASN  21          2HB       ASN  21 -18.348  11.664   3.510
  159   2HB   ASN  21          3HB       ASN  21 -17.539  12.230   2.062
  160   1HD2  ASN  21          1HD2      ASN  21 -20.034  11.476   1.751
  161   2HD2  ASN  21          2HD2      ASN  21 -20.193   9.947   0.955
  162    H    GLN  22           HN       GLN  22 -15.705  11.282   5.697
  163    HA   GLN  22           HA       GLN  22 -14.052  13.544   4.987
  164   1HB   GLN  22          2HB       GLN  22 -15.131  14.769   7.036
  165   2HB   GLN  22          3HB       GLN  22 -15.965  14.799   5.495
  166   1HG   GLN  22          2HG       GLN  22 -16.783  12.401   6.863
  167   2HG   GLN  22          3HG       GLN  22 -16.883  13.717   8.016
  168   1HE2  GLN  22          1HE2      GLN  22 -17.545  13.096   4.568
  169   2HE2  GLN  22          2HE2      GLN  22 -19.085  13.887   4.494
  170    H    LEU  23           HN       LEU  23 -12.155  13.551   6.158
  171    HA   LEU  23           HA       LEU  23 -11.889  11.481   8.166
  172   1HB   LEU  23          2HB       LEU  23 -10.036  13.145   6.518
  173   2HB   LEU  23          3HB       LEU  23  -9.443  12.464   8.019
  174    HG   LEU  23           HG       LEU  23  -9.098  11.178   5.791
  175   1HD1  LEU  23          1HD1      LEU  23  -9.285   8.998   6.985
  176   2HD1  LEU  23          2HD1      LEU  23  -8.431  10.260   7.905
  177   3HD1  LEU  23          3HD1      LEU  23 -10.113   9.845   8.314
  178   1HD2  LEU  23          1HD2      LEU  23 -11.003   9.477   5.484
  179   2HD2  LEU  23          2HD2      LEU  23 -12.015  10.662   6.345
  180   3HD2  LEU  23          3HD2      LEU  23 -11.219  11.114   4.818
  181    H    SER  24           HN       SER  24 -10.808  11.963  10.266
  182    HA   SER  24           HA       SER  24 -11.284  14.707  11.097
  183   1HB   SER  24          2HB       SER  24 -12.138  12.239  12.677
  184   2HB   SER  24          3HB       SER  24 -12.291  13.899  13.220
  185    HG   SER  24           HG       SER  24 -13.729  12.536  11.144
  186    H    LYS  25           HN       LYS  25 -10.220  15.068  13.385
  187    HA   LYS  25           HA       LYS  25  -7.521  14.472  13.173
  188   1HB   LYS  25          2HB       LYS  25  -8.538  16.386  14.407
  189   2HB   LYS  25          3HB       LYS  25  -9.068  15.277  15.655
  190   1HG   LYS  25          2HG       LYS  25  -6.448  14.553  15.545
  191   2HG   LYS  25          3HG       LYS  25  -6.289  16.208  14.992
  192   1HD   LYS  25          2HD       LYS  25  -8.089  16.255  17.228
  193   2HD   LYS  25          3HD       LYS  25  -6.742  15.234  17.689
  194   1HE   LYS  25          2HE       LYS  25  -5.131  17.011  17.116
  195   2HE   LYS  25          3HE       LYS  25  -6.414  18.020  16.478
  196   1HZ   LYS  25          1HZ       LYS  25  -6.729  17.091  19.194
  197   2HZ   LYS  25          2HZ       LYS  25  -5.570  18.213  18.936
  198   3HZ   LYS  25          3HZ       LYS  25  -7.120  18.533  18.534
  199    H    GLU  26           HN       GLU  26  -9.967  13.105  15.493
  200    HA   GLU  26           HA       GLU  26  -8.251  11.245  16.562
  201   1HB   GLU  26          2HB       GLU  26 -11.017  11.940  16.763
  202   2HB   GLU  26          3HB       GLU  26 -10.960  10.209  16.494
  203   1HG   GLU  26          2HG       GLU  26  -8.891  10.662  18.352
  204   2HG   GLU  26          3HG       GLU  26 -10.159  11.756  18.870
  205    H    GLU  27           HN       GLU  27 -10.447  11.065  13.708
  206    HA   GLU  27           HA       GLU  27 -10.140   8.360  13.250
  207   1HB   GLU  27          2HB       GLU  27 -11.057  10.737  11.705
  208   2HB   GLU  27          3HB       GLU  27 -10.534   9.380  10.728
  209   1HG   GLU  27          2HG       GLU  27 -12.042   8.011  12.513
  210   2HG   GLU  27          3HG       GLU  27 -12.843   9.563  12.649
  211    H    LEU  28           HN       LEU  28  -8.422  11.177  11.712
  212    HA   LEU  28           HA       LEU  28  -6.685   9.678  10.174
  213   1HB   LEU  28          2HB       LEU  28  -7.222  12.211  10.245
  214   2HB   LEU  28          3HB       LEU  28  -5.929  12.301  11.425
  215    HG   LEU  28           HG       LEU  28  -4.306  12.059   9.880
  216   1HD1  LEU  28          1HD1      LEU  28  -6.085  10.213   8.263
  217   2HD1  LEU  28          2HD1      LEU  28  -4.369  10.567   7.947
  218   3HD1  LEU  28          3HD1      LEU  28  -4.843   9.713   9.435
  219   1HD2  LEU  28          1HD2      LEU  28  -4.898  12.986   7.669
  220   2HD2  LEU  28          2HD2      LEU  28  -6.622  12.795   8.069
  221   3HD2  LEU  28          3HD2      LEU  28  -5.607  13.909   9.016
  222    H    LYS  29           HN       LYS  29  -6.412  10.810  13.590
  223    HA   LYS  29           HA       LYS  29  -3.855  10.190  14.154
  224   1HB   LYS  29          2HB       LYS  29  -5.446  11.174  15.737
  225   2HB   LYS  29          3HB       LYS  29  -6.294   9.647  15.873
  226   1HG   LYS  29          2HG       LYS  29  -4.518   8.601  17.033
  227   2HG   LYS  29          3HG       LYS  29  -3.317   9.717  16.414
  228   1HD   LYS  29          2HD       LYS  29  -3.895  11.415  17.940
  229   2HD   LYS  29          3HD       LYS  29  -5.530  10.819  18.150
  230   1HE   LYS  29          2HE       LYS  29  -3.635   8.773  19.000
  231   2HE   LYS  29          3HE       LYS  29  -3.260  10.287  19.800
  232   1HZ   LYS  29          1HZ       LYS  29  -4.902   9.706  21.146
  233   2HZ   LYS  29          2HZ       LYS  29  -5.929  10.174  19.966
  234   3HZ   LYS  29          3HZ       LYS  29  -5.528   8.599  20.122
  235    H    LEU  30           HN       LEU  30  -6.626   7.842  14.223
  236    HA   LEU  30           HA       LEU  30  -5.142   5.614  14.862
  237   1HB   LEU  30          2HB       LEU  30  -7.600   5.809  13.115
  238   2HB   LEU  30          3HB       LEU  30  -6.991   4.345  13.861
  239    HG   LEU  30           HG       LEU  30  -8.310   6.719  15.152
  240   1HD1  LEU  30          1HD1      LEU  30  -9.841   5.032  14.541
  241   2HD1  LEU  30          2HD1      LEU  30  -8.777   3.735  15.136
  242   3HD1  LEU  30          3HD1      LEU  30  -9.574   4.832  16.290
  243   1HD2  LEU  30          1HD2      LEU  30  -6.472   4.734  16.500
  244   2HD2  LEU  30          2HD2      LEU  30  -6.391   6.512  16.523
  245   3HD2  LEU  30          3HD2      LEU  30  -7.708   5.669  17.374
  246    H    LEU  31           HN       LEU  31  -6.099   6.770  11.549
  247    HA   LEU  31           HA       LEU  31  -4.742   4.876  10.117
  248   1HB   LEU  31          2HB       LEU  31  -6.348   6.780   9.420
  249   2HB   LEU  31          3HB       LEU  31  -4.897   7.747   9.249
  250    HG   LEU  31           HG       LEU  31  -4.578   5.210   7.885
  251   1HD1  LEU  31          1HD1      LEU  31  -6.253   5.675   6.073
  252   2HD1  LEU  31          2HD1      LEU  31  -6.944   5.116   7.615
  253   3HD1  LEU  31          3HD1      LEU  31  -7.027   6.839   7.174
  254   1HD2  LEU  31          1HD2      LEU  31  -3.853   6.573   6.081
  255   2HD2  LEU  31          2HD2      LEU  31  -4.713   7.996   6.715
  256   3HD2  LEU  31          3HD2      LEU  31  -3.292   7.358   7.577
  257    H    LEU  32           HN       LEU  32  -3.497   8.215  10.856
  258    HA   LEU  32           HA       LEU  32  -0.955   7.851   9.969
  259   1HB   LEU  32          2HB       LEU  32  -1.808   9.426  12.401
  260   2HB   LEU  32          3HB       LEU  32  -0.328   9.649  11.489
  261    HG   LEU  32           HG       LEU  32  -3.084  10.006  10.288
  262   1HD1  LEU  32          1HD1      LEU  32  -2.369  12.513  10.480
  263   2HD1  LEU  32          2HD1      LEU  32  -3.121  11.686  11.864
  264   3HD1  LEU  32          3HD1      LEU  32  -1.358  11.922  11.820
  265   1HD2  LEU  32          1HD2      LEU  32  -1.716   9.766   8.471
  266   2HD2  LEU  32          2HD2      LEU  32  -1.550  11.515   8.753
  267   3HD2  LEU  32          3HD2      LEU  32  -0.284  10.399   9.318
  268    H    GLN  33           HN       GLN  33  -2.528   6.371  12.728
  269    HA   GLN  33           HA       GLN  33  -0.183   5.822  14.166
  270   1HB   GLN  33          2HB       GLN  33  -2.887   5.619  14.658
  271   2HB   GLN  33          3HB       GLN  33  -2.465   3.931  14.448
  272   1HG   GLN  33          2HG       GLN  33  -0.607   4.213  16.128
  273   2HG   GLN  33          3HG       GLN  33  -1.100   5.877  16.368
  274   1HE2  GLN  33          1HE2      GLN  33  -2.607   6.335  17.804
  275   2HE2  GLN  33          2HE2      GLN  33  -3.638   5.205  18.617
  276    H    THR  34           HN       THR  34  -2.346   3.601  12.247
  277    HA   THR  34           HA       THR  34  -0.223   1.653  12.091
  278    HB   THR  34           HB       THR  34  -3.153   1.850  11.620
  279    HG1  THR  34           HG1      THR  34  -2.853  -0.246  12.587
  280   1HG2  THR  34          1HG2      THR  34  -3.254  -0.033  10.062
  281   2HG2  THR  34          2HG2      THR  34  -2.288   1.246   9.287
  282   3HG2  THR  34          3HG2      THR  34  -1.478  -0.157  10.026
  283    H    GLU  35           HN       GLU  35  -2.002   3.804   9.788
  284    HA   GLU  35           HA       GLU  35  -0.836   2.999   7.505
  285   1HB   GLU  35          2HB       GLU  35  -2.589   4.667   7.503
  286   2HB   GLU  35          3HB       GLU  35  -1.609   5.797   8.417
  287   1HG   GLU  35          2HG       GLU  35  -0.039   5.145   6.143
  288   2HG   GLU  35          3HG       GLU  35  -1.671   5.324   5.528
  289    H    PHE  36           HN       PHE  36   0.398   5.693   9.624
  290    HA   PHE  36           HA       PHE  36   3.096   4.865   9.014
  291   1HB   PHE  36          2HB       PHE  36   1.792   7.542   8.261
  292   2HB   PHE  36          3HB       PHE  36   3.532   7.386   8.407
  293    HD1  PHE  36           HD1      PHE  36   1.359   7.849   6.007
  294    HD2  PHE  36           HD2      PHE  36   4.052   4.782   7.169
  295    HE1  PHE  36           HE1      PHE  36   1.487   7.060   3.628
  296    HE2  PHE  36           HE2      PHE  36   4.180   3.993   4.790
  297    HZ   PHE  36           HZ       PHE  36   2.896   5.141   3.048
  298    HA   PRO  37           HA       PRO  37   2.668   6.365  13.210
  299   1HB   PRO  37          2HB       PRO  37   4.196   4.434  14.395
  300   2HB   PRO  37          3HB       PRO  37   2.460   4.298  14.202
  301   1HG   PRO  37          2HG       PRO  37   4.604   2.936  12.691
  302   2HG   PRO  37          3HG       PRO  37   2.908   2.512  12.813
  303   1HD   PRO  37          2HD       PRO  37   4.203   3.791  10.595
  304   2HD   PRO  37          3HD       PRO  37   2.488   3.473  10.766
  305    H    SER  38           HN       SER  38   4.996   6.361  10.950
  306    HA   SER  38           HA       SER  38   7.052   7.259  12.754
  307   1HB   SER  38          2HB       SER  38   7.326   5.773  10.591
  308   2HB   SER  38          3HB       SER  38   7.251   7.298   9.732
  309    HG   SER  38           HG       SER  38   9.350   7.399  10.153
  310    H    LEU  39           HN       LEU  39   4.661   8.478  10.417
  311    HA   LEU  39           HA       LEU  39   5.804  11.046  10.118
  312   1HB   LEU  39          2HB       LEU  39   3.606   9.557   9.102
  313   2HB   LEU  39          3HB       LEU  39   2.974  11.067   9.727
  314    HG   LEU  39           HG       LEU  39   3.694  10.929   7.251
  315   1HD1  LEU  39          1HD1      LEU  39   5.028  13.311   8.327
  316   2HD1  LEU  39          2HD1      LEU  39   3.612  13.163   7.257
  317   3HD1  LEU  39          3HD1      LEU  39   3.416  13.010   9.020
  318   1HD2  LEU  39          1HD2      LEU  39   5.862  10.839   6.649
  319   2HD2  LEU  39          2HD2      LEU  39   6.410  11.779   8.057
  320   3HD2  LEU  39          3HD2      LEU  39   6.057  10.043   8.229
  321    H    LEU  40           HN       LEU  40   4.068   9.445  12.675
  322    HA   LEU  40           HA       LEU  40   2.943  11.815  13.792
  323   1HB   LEU  40          2HB       LEU  40   3.366   9.024  14.859
  324   2HB   LEU  40          3HB       LEU  40   2.575  10.300  15.763
  325    HG   LEU  40           HG       LEU  40   1.601   9.371  13.053
  326   1HD1  LEU  40          1HD1      LEU  40   1.129   7.422  14.062
  327   2HD1  LEU  40          2HD1      LEU  40   1.320   8.098  15.697
  328   3HD1  LEU  40          3HD1      LEU  40  -0.204   8.336  14.809
  329   1HD2  LEU  40          1HD2      LEU  40   0.535  11.191  15.190
  330   2HD2  LEU  40          2HD2      LEU  40   0.627  11.432  13.429
  331   3HD2  LEU  40          3HD2      LEU  40  -0.582  10.319  14.113
  332    H    LYS  41           HN       LYS  41   6.052  10.140  13.890
  333    HA   LYS  41           HA       LYS  41   6.946  11.315  16.302
  334   1HB   LYS  41          2HB       LYS  41   8.781  10.046  15.986
  335   2HB   LYS  41          3HB       LYS  41   7.788   9.254  14.780
  336   1HG   LYS  41          2HG       LYS  41   8.707  10.827  13.033
  337   2HG   LYS  41          3HG       LYS  41   9.747  11.538  14.251
  338   1HD   LYS  41          2HD       LYS  41  10.347   8.876  14.593
  339   2HD   LYS  41          3HD       LYS  41   9.960   8.889  12.884
  340   1HE   LYS  41          2HE       LYS  41  11.872  10.016  12.345
  341   2HE   LYS  41          3HE       LYS  41  11.649  11.185  13.632
  342   1HZ   LYS  41          1HZ       LYS  41  12.277   8.803  14.843
  343   2HZ   LYS  41          2HZ       LYS  41  13.316   8.943  13.591
  344   3HZ   LYS  41          3HZ       LYS  41  13.226  10.126  14.714
  345    H    GLY  42           HN       GLY  42   6.839  12.310  12.886
  346   1HA   GLY  42          1HA       GLY  42   8.689  14.230  12.622
  347   2HA   GLY  42          2HA       GLY  42   7.048  14.399  12.030
  348    H    MET  43           HN       MET  43   8.574  16.647  12.827
  349    HA   MET  43           HA       MET  43   8.035  17.309  15.506
  350   1HB   MET  43          2HB       MET  43   8.702  19.049  13.066
  351   2HB   MET  43          3HB       MET  43   8.768  19.612  14.724
  352   1HG   MET  43          2HG       MET  43  10.353  17.437  15.007
  353   2HG   MET  43          3HG       MET  43  10.606  17.701  13.293
  354   1HE   MET  43          1HE       MET  43  11.443  20.787  16.611
  355   2HE   MET  43          2HE       MET  43   9.888  19.962  16.347
  356   3HE   MET  43          3HE       MET  43  11.299  19.040  16.920
  357    H    SER  44           HN       SER  44   5.940  16.903  12.928
  358    HA   SER  44           HA       SER  44   4.299  19.183  13.567
  359   1HB   SER  44          2HB       SER  44   4.018  16.942  11.520
  360   2HB   SER  44          3HB       SER  44   2.817  18.200  11.733
  361    HG   SER  44           HG       SER  44   5.603  18.651  11.073
  362    H    THR  45           HN       THR  45   3.332  18.870  15.585
  363    HA   THR  45           HA       THR  45   2.518  16.367  16.557
  364    HB   THR  45           HB       THR  45   1.472  17.749  18.318
  365    HG1  THR  45           HG1      THR  45   2.125  19.997  16.576
  366   1HG2  THR  45          1HG2      THR  45   4.167  18.388  17.269
  367   2HG2  THR  45          2HG2      THR  45   3.429  19.750  18.145
  368   3HG2  THR  45          3HG2      THR  45   3.638  18.179  18.955
  369    H    LEU  46           HN       LEU  46   0.140  15.961  17.260
  370    HA   LEU  46           HA       LEU  46  -1.297  15.357  15.010
  371   1HB   LEU  46          2HB       LEU  46  -1.476  14.712  17.577
  372   2HB   LEU  46          3HB       LEU  46  -2.739  15.927  17.555
  373    HG   LEU  46           HG       LEU  46  -3.521  14.505  15.415
  374   1HD1  LEU  46          1HD1      LEU  46  -2.308  12.382  17.198
  375   2HD1  LEU  46          2HD1      LEU  46  -3.163  12.161  15.653
  376   3HD1  LEU  46          3HD1      LEU  46  -1.568  12.950  15.682
  377   1HD2  LEU  46          1HD2      LEU  46  -4.171  13.548  18.206
  378   2HD2  LEU  46          2HD2      LEU  46  -4.753  15.098  17.554
  379   3HD2  LEU  46          3HD2      LEU  46  -5.216  13.571  16.765
  380    H    ASP  47           HN       ASP  47  -2.067  18.046  17.339
  381    HA   ASP  47           HA       ASP  47  -4.050  19.197  15.999
  382   1HB   ASP  47          2HB       ASP  47  -2.399  19.906  18.107
  383   2HB   ASP  47          3HB       ASP  47  -2.000  21.148  16.936
  384    H    GLU  48           HN       GLU  48  -0.493  19.853  15.558
  385    HA   GLU  48           HA       GLU  48  -0.725  21.729  13.583
  386   1HB   GLU  48          2HB       GLU  48   1.364  20.070  14.743
  387   2HB   GLU  48          3HB       GLU  48   1.607  20.193  13.012
  388   1HG   GLU  48          2HG       GLU  48   1.054  22.794  13.494
  389   2HG   GLU  48          3HG       GLU  48   1.629  22.370  15.095
  390    H    LEU  49           HN       LEU  49  -0.541  18.126  13.340
  391    HA   LEU  49           HA       LEU  49  -0.505  18.069  10.530
  392   1HB   LEU  49          2HB       LEU  49  -0.107  16.280  12.531
  393   2HB   LEU  49          3HB       LEU  49  -1.701  15.797  11.987
  394    HG   LEU  49           HG       LEU  49  -0.564  15.878   9.595
  395   1HD1  LEU  49          1HD1      LEU  49   1.867  14.776  10.656
  396   2HD1  LEU  49          2HD1      LEU  49   1.638  16.117   9.509
  397   3HD1  LEU  49          3HD1      LEU  49   1.649  16.436  11.260
  398   1HD2  LEU  49          1HD2      LEU  49  -1.232  13.878  11.445
  399   2HD2  LEU  49          2HD2      LEU  49  -0.965  13.697   9.694
  400   3HD2  LEU  49          3HD2      LEU  49   0.381  13.442  10.831
  401    H    PHE  50           HN       PHE  50  -3.164  17.797  12.972
  402    HA   PHE  50           HA       PHE  50  -5.221  17.329  11.208
  403   1HB   PHE  50          2HB       PHE  50  -5.179  17.340  13.781
  404   2HB   PHE  50          3HB       PHE  50  -5.152  19.092  13.732
  405    HD1  PHE  50           HD1      PHE  50  -7.176  19.807  14.596
  406    HD2  PHE  50           HD2      PHE  50  -7.172  16.653  11.757
  407    HE1  PHE  50           HE1      PHE  50  -9.685  19.844  14.551
  408    HE2  PHE  50           HE2      PHE  50  -9.681  16.690  11.712
  409    HZ   PHE  50           HZ       PHE  50 -10.908  18.285  13.110
  410    H    GLU  51           HN       GLU  51  -4.088  20.527  12.527
  411    HA   GLU  51           HA       GLU  51  -5.868  21.973  10.935
  412   1HB   GLU  51          2HB       GLU  51  -4.657  23.937  11.713
  413   2HB   GLU  51          3HB       GLU  51  -4.812  22.811  13.046
  414   1HG   GLU  51          2HG       GLU  51  -2.540  23.444  13.168
  415   2HG   GLU  51          3HG       GLU  51  -2.466  21.915  12.314
  416    H    GLU  52           HN       GLU  52  -2.454  20.922  10.533
  417    HA   GLU  52           HA       GLU  52  -1.868  22.473   8.335
  418   1HB   GLU  52          2HB       GLU  52  -0.108  21.318   9.515
  419   2HB   GLU  52          3HB       GLU  52  -0.851  19.754   9.245
  420   1HG   GLU  52          2HG       GLU  52  -0.476  19.988   6.788
  421   2HG   GLU  52          3HG       GLU  52   0.242  21.567   7.041
  422    H    LEU  53           HN       LEU  53  -3.071  19.043   8.487
  423    HA   LEU  53           HA       LEU  53  -3.238  18.592   5.788
  424   1HB   LEU  53          2HB       LEU  53  -5.037  17.587   7.997
  425   2HB   LEU  53          3HB       LEU  53  -4.947  16.911   6.383
  426    HG   LEU  53           HG       LEU  53  -2.436  17.096   8.012
  427   1HD1  LEU  53          1HD1      LEU  53  -2.985  15.563   9.536
  428   2HD1  LEU  53          2HD1      LEU  53  -4.677  15.913   9.109
  429   3HD1  LEU  53          3HD1      LEU  53  -3.830  14.548   8.342
  430   1HD2  LEU  53          1HD2      LEU  53  -1.812  16.240   6.016
  431   2HD2  LEU  53          2HD2      LEU  53  -2.353  14.717   6.760
  432   3HD2  LEU  53          3HD2      LEU  53  -3.432  15.599   5.653
  433    H    ASP  54           HN       ASP  54  -5.887  19.797   7.969
  434    HA   ASP  54           HA       ASP  54  -7.645  20.261   5.890
  435   1HB   ASP  54          2HB       ASP  54  -8.302  20.150   8.280
  436   2HB   ASP  54          3HB       ASP  54  -7.398  21.612   8.618
  437    H    LYS  55           HN       LYS  55  -8.448  22.543   5.220
  438    HA   LYS  55           HA       LYS  55  -6.777  24.775   5.627
  439   1HB   LYS  55          2HB       LYS  55  -5.661  24.991   3.562
  440   2HB   LYS  55          3HB       LYS  55  -5.332  23.359   4.105
  441   1HG   LYS  55          2HG       LYS  55  -7.330  22.597   2.672
  442   2HG   LYS  55          3HG       LYS  55  -7.369  24.216   2.003
  443   1HD   LYS  55          2HD       LYS  55  -4.818  23.836   1.494
  444   2HD   LYS  55          3HD       LYS  55  -5.165  22.139   1.761
  445   1HE   LYS  55          2HE       LYS  55  -6.699  22.035  -0.074
  446   2HE   LYS  55          3HE       LYS  55  -6.882  23.777  -0.138
  447   1HZ   LYS  55          1HZ       LYS  55  -5.123  22.276  -1.571
  448   2HZ   LYS  55          2HZ       LYS  55  -5.147  23.906  -1.468
  449   3HZ   LYS  55          3HZ       LYS  55  -4.186  23.039  -0.472
  450    H    ASN  56           HN       ASN  56  -9.148  23.052   3.534
  451    HA   ASN  56           HA       ASN  56 -10.303  25.207   2.366
  452   1HB   ASN  56          2HB       ASN  56 -12.483  23.687   2.592
  453   2HB   ASN  56          3HB       ASN  56 -11.141  23.143   1.605
  454   1HD2  ASN  56          1HD2      ASN  56 -11.359  21.002   1.819
  455   2HD2  ASN  56          2HD2      ASN  56 -11.199  20.116   3.299
  456    H    GLY  57           HN       GLY  57 -10.579  23.919   5.687
  457   1HA   GLY  57          1HA       GLY  57 -11.251  25.085   7.547
  458   2HA   GLY  57          2HA       GLY  57 -11.957  26.332   6.537
  459    H    ASP  58           HN       ASP  58 -12.392  22.769   7.158
  460    HA   ASP  58           HA       ASP  58 -15.220  23.347   7.473
  461   1HB   ASP  58          2HB       ASP  58 -15.461  20.935   6.348
  462   2HB   ASP  58          3HB       ASP  58 -15.403  22.387   5.369
  463    H    GLY  59           HN       GLY  59 -12.593  20.825   7.628
  464   1HA   GLY  59          1HA       GLY  59 -12.045  20.126   9.948
  465   2HA   GLY  59          2HA       GLY  59 -13.764  19.871  10.174
  466    H    GLU  60           HN       GLU  60 -13.137  19.148   6.944
  467    HA   GLU  60           HA       GLU  60 -12.912  16.330   7.636
  468   1HB   GLU  60          2HB       GLU  60 -13.850  17.450   4.970
  469   2HB   GLU  60          3HB       GLU  60 -14.099  15.835   5.604
  470   1HG   GLU  60          2HG       GLU  60 -16.030  16.491   6.588
  471   2HG   GLU  60          3HG       GLU  60 -15.166  17.685   7.536
  472    H    VAL  61           HN       VAL  61 -11.015  15.297   7.186
  473    HA   VAL  61           HA       VAL  61  -9.137  16.687   5.437
  474    HB   VAL  61           HB       VAL  61  -8.866  14.525   7.525
  475   1HG1  VAL  61          1HG1      VAL  61  -7.099  13.753   6.381
  476   2HG1  VAL  61          2HG1      VAL  61  -7.119  15.132   5.255
  477   3HG1  VAL  61          3HG1      VAL  61  -6.289  15.275   6.823
  478   1HG2  VAL  61          1HG2      VAL  61  -7.383  17.141   7.483
  479   2HG2  VAL  61          2HG2      VAL  61  -9.074  17.089   8.035
  480   3HG2  VAL  61          3HG2      VAL  61  -7.837  16.114   8.864
  481    H    SER  62           HN       SER  62 -11.130  15.766   3.895
  482    HA   SER  62           HA       SER  62 -11.251  13.180   3.189
  483   1HB   SER  62          2HB       SER  62 -11.192  14.851   0.792
  484   2HB   SER  62          3HB       SER  62 -12.542  14.000   1.517
  485    HG   SER  62           HG       SER  62 -11.702  16.688   1.852
  486    H    PHE  63           HN       PHE  63 -10.353  12.141   1.064
  487    HA   PHE  63           HA       PHE  63  -7.680  11.720   1.296
  488   1HB   PHE  63          2HB       PHE  63  -9.637  10.619  -0.125
  489   2HB   PHE  63          3HB       PHE  63  -9.200  11.777  -1.365
  490    HD1  PHE  63           HD1      PHE  63  -7.402   9.390   0.888
  491    HD2  PHE  63           HD2      PHE  63  -7.850  10.958  -3.030
  492    HE1  PHE  63           HE1      PHE  63  -5.617   7.831   0.060
  493    HE2  PHE  63           HE2      PHE  63  -6.065   9.399  -3.858
  494    HZ   PHE  63           HZ       PHE  63  -4.970   7.854  -2.303
  495    H    GLU  64           HN       GLU  64  -9.370  14.336  -0.447
  496    HA   GLU  64           HA       GLU  64  -7.429  15.136  -2.152
  497   1HB   GLU  64          2HB       GLU  64  -8.422  17.531  -1.570
  498   2HB   GLU  64          3HB       GLU  64  -9.402  16.332  -2.391
  499   1HG   GLU  64          2HG       GLU  64 -10.857  16.198  -0.649
  500   2HG   GLU  64          3HG       GLU  64  -9.561  15.955   0.505
  501    H    GLU  65           HN       GLU  65  -7.887  16.229   1.288
  502    HA   GLU  65           HA       GLU  65  -5.515  17.732   1.249
  503   1HB   GLU  65          2HB       GLU  65  -7.161  16.689   3.597
  504   2HB   GLU  65          3HB       GLU  65  -5.896  17.896   3.721
  505   1HG   GLU  65          2HG       GLU  65  -7.878  18.546   1.625
  506   2HG   GLU  65          3HG       GLU  65  -8.605  18.399   3.213
  507    H    PHE  66           HN       PHE  66  -6.333  14.355   1.924
  508    HA   PHE  66           HA       PHE  66  -4.161  13.657   3.495
  509   1HB   PHE  66          2HB       PHE  66  -6.336  12.387   2.706
  510   2HB   PHE  66          3HB       PHE  66  -5.442  12.004   1.248
  511    HD1  PHE  66           HD1      PHE  66  -4.824   9.789   1.260
  512    HD2  PHE  66           HD2      PHE  66  -4.521  11.994   4.873
  513    HE1  PHE  66           HE1      PHE  66  -3.826   7.787   2.398
  514    HE2  PHE  66           HE2      PHE  66  -3.524   9.991   6.011
  515    HZ   PHE  66           HZ       PHE  66  -3.188   7.912   4.760
  516    H    GLN  67           HN       GLN  67  -4.499  14.014  -0.064
  517    HA   GLN  67           HA       GLN  67  -2.146  12.746  -0.745
  518   1HB   GLN  67          2HB       GLN  67  -3.524  15.082  -2.145
  519   2HB   GLN  67          3HB       GLN  67  -2.336  14.022  -2.878
  520   1HG   GLN  67          2HG       GLN  67  -4.054  12.123  -1.994
  521   2HG   GLN  67          3HG       GLN  67  -5.194  13.447  -2.130
  522   1HE2  GLN  67          1HE2      GLN  67  -4.900  10.956  -3.660
  523   2HE2  GLN  67          2HE2      GLN  67  -4.764  11.399  -5.329
  524    H    VAL  68           HN       VAL  68  -2.658  15.647   1.025
  525    HA   VAL  68           HA       VAL  68  -0.317  17.023   0.134
  526    HB   VAL  68           HB       VAL  68  -1.978  17.410   2.630
  527   1HG1  VAL  68          1HG1      VAL  68   0.330  18.522   2.409
  528   2HG1  VAL  68          2HG1      VAL  68  -0.408  19.510   1.125
  529   3HG1  VAL  68          3HG1      VAL  68  -1.058  19.573   2.781
  530   1HG2  VAL  68          1HG2      VAL  68  -2.949  17.525   0.065
  531   2HG2  VAL  68          2HG2      VAL  68  -3.604  18.428   1.452
  532   3HG2  VAL  68          3HG2      VAL  68  -2.450  19.210   0.346
  533    H    LEU  69           HN       LEU  69  -1.209  14.738   2.746
  534    HA   LEU  69           HA       LEU  69   1.274  15.051   4.107
  535   1HB   LEU  69          2HB       LEU  69  -1.111  14.219   4.886
  536   2HB   LEU  69          3HB       LEU  69  -0.474  12.653   4.424
  537    HG   LEU  69           HG       LEU  69   1.370  12.880   5.996
  538   1HD1  LEU  69          1HD1      LEU  69   0.538  15.686   6.013
  539   2HD1  LEU  69          2HD1      LEU  69   0.814  15.019   7.640
  540   3HD1  LEU  69          3HD1      LEU  69   2.105  14.945   6.417
  541   1HD2  LEU  69          1HD2      LEU  69  -0.941  13.665   7.701
  542   2HD2  LEU  69          2HD2      LEU  69  -1.144  12.253   6.637
  543   3HD2  LEU  69          3HD2      LEU  69   0.174  12.284   7.833
  544    H    VAL  70           HN       VAL  70  -0.030  12.986   1.510
  545    HA   VAL  70           HA       VAL  70   1.828  10.957   1.555
  546    HB   VAL  70           HB       VAL  70   0.144  12.276  -0.532
  547   1HG1  VAL  70          1HG1      VAL  70   0.910  10.700  -2.243
  548   2HG1  VAL  70          2HG1      VAL  70   2.244  11.749  -1.706
  549   3HG1  VAL  70          3HG1      VAL  70   2.145  10.069  -1.127
  550   1HG2  VAL  70          1HG2      VAL  70  -0.554  10.486   1.250
  551   2HG2  VAL  70          2HG2      VAL  70  -1.139  10.349  -0.425
  552   3HG2  VAL  70          3HG2      VAL  70   0.222   9.343   0.128
  553    H    LYS  71           HN       LYS  71   2.185  14.356   0.721
  554    HA   LYS  71           HA       LYS  71   4.516  14.037  -0.861
  555   1HB   LYS  71          2HB       LYS  71   2.745  16.047  -0.465
  556   2HB   LYS  71          3HB       LYS  71   4.040  16.589   0.583
  557   1HG   LYS  71          2HG       LYS  71   4.962  15.579  -2.061
  558   2HG   LYS  71          3HG       LYS  71   3.941  17.001  -2.156
  559   1HD   LYS  71          2HD       LYS  71   5.722  17.522  -0.006
  560   2HD   LYS  71          3HD       LYS  71   6.715  16.777  -1.243
  561   1HE   LYS  71          2HE       LYS  71   4.796  18.839  -2.242
  562   2HE   LYS  71          3HE       LYS  71   6.059  19.451  -1.192
  563   1HZ   LYS  71          1HZ       LYS  71   7.462  17.876  -2.767
  564   2HZ   LYS  71          2HZ       LYS  71   6.280  18.295  -3.814
  565   3HZ   LYS  71          3HZ       LYS  71   7.189  19.451  -3.104
  566    H    LYS  72           HN       LYS  72   3.848  14.656   2.626
  567    HA   LYS  72           HA       LYS  72   6.585  14.976   3.283
  568   1HB   LYS  72          2HB       LYS  72   4.096  14.458   4.927
  569   2HB   LYS  72          3HB       LYS  72   5.685  14.656   5.639
  570   1HG   LYS  72          2HG       LYS  72   4.441  16.706   3.750
  571   2HG   LYS  72          3HG       LYS  72   4.270  16.785   5.492
  572   1HD   LYS  72          2HD       LYS  72   6.983  16.486   5.323
  573   2HD   LYS  72          3HD       LYS  72   6.687  17.291   3.795
  574   1HE   LYS  72          2HE       LYS  72   5.233  18.966   5.233
  575   2HE   LYS  72          3HE       LYS  72   6.108  18.302   6.598
  576   1HZ   LYS  72          1HZ       LYS  72   6.986  20.210   4.839
  577   2HZ   LYS  72          2HZ       LYS  72   7.845  19.506   6.037
  578   3HZ   LYS  72          3HZ       LYS  72   7.894  18.889   4.525
  579    H    ILE  73           HN       ILE  73   4.309  12.222   3.082
  580    HA   ILE  73           HA       ILE  73   6.119  10.416   4.345
  581    HB   ILE  73           HB       ILE  73   3.629   9.959   2.697
  582   1HG1  ILE  73          2HG1      ILE  73   3.704   9.612   5.658
  583   2HG1  ILE  73          3HG1      ILE  73   3.708  11.254   5.047
  584   1HG2  ILE  73          1HG2      ILE  73   4.026   7.819   4.462
  585   2HG2  ILE  73          2HG2      ILE  73   4.184   7.809   2.689
  586   3HG2  ILE  73          3HG2      ILE  73   5.612   8.111   3.707
  587   1HD1  ILE  73          1HD1      ILE  73   1.650   9.085   4.450
  588   2HD1  ILE  73          2HD1      ILE  73   1.395  10.597   5.353
  589   3HD1  ILE  73          3HD1      ILE  73   1.702  10.648   3.601
  590    H    SER  74           HN       SER  74   6.145  12.021   1.372
  591    HA   SER  74           HA       SER  74   7.243   9.788  -0.071
  592   1HB   SER  74          2HB       SER  74   5.686  11.578  -1.071
  593   2HB   SER  74          3HB       SER  74   7.042  12.684  -0.989
  594    HG   SER  74           HG       SER  74   8.261  11.182  -2.342
  595    H    GLN  75           HN       GLN  75   8.227  12.991   1.284
  596    HA   GLN  75           HA       GLN  75  10.866  12.789   0.353
  597   1HB   GLN  75          2HB       GLN  75   9.288  14.776   1.483
  598   2HB   GLN  75          3HB       GLN  75  10.426  14.441   2.773
  599   1HG   GLN  75          2HG       GLN  75  11.603  16.047   1.538
  600   2HG   GLN  75          3HG       GLN  75  12.252  14.564   0.867
  601   1HE2  GLN  75          1HE2      GLN  75   9.261  16.460   0.443
  602   2HE2  GLN  75          2HE2      GLN  75   9.320  16.578  -1.284
  Start of MODEL    7
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   1.431   0.433  -2.012
    3   1HB   LYS   1          2HB       LYS   1   3.849   0.660  -0.214
    4   2HB   LYS   1          3HB       LYS   1   3.984   0.700  -1.960
    5   1HG   LYS   1          2HG       LYS   1   2.358   2.609  -2.035
    6   2HG   LYS   1          3HG       LYS   1   2.246   2.576  -0.286
    7   1HD   LYS   1          2HD       LYS   1   4.948   2.742  -0.516
    8   2HD   LYS   1          3HD       LYS   1   4.510   3.507  -2.031
    9   1HE   LYS   1          2HE       LYS   1   3.126   5.168  -0.864
   10   2HE   LYS   1          3HE       LYS   1   3.338   4.338   0.665
   11   1HZ   LYS   1          1HZ       LYS   1   4.876   6.064   0.635
   12   2HZ   LYS   1          2HZ       LYS   1   5.771   4.734   0.323
   13   3HZ   LYS   1          3HZ       LYS   1   5.376   5.755  -0.889
   14    H    SER   2           HN       SER   2   3.168  -1.829   0.228
   15    HA   SER   2           HA       SER   2   4.024  -3.537  -1.756
   16   1HB   SER   2          2HB       SER   2   3.948  -3.462   1.135
   17   2HB   SER   2          3HB       SER   2   3.471  -5.064   0.609
   18    HG   SER   2           HG       SER   2   5.684  -5.181   0.698
   19    HA   PRO   3           HA       PRO   3   0.571  -6.059  -2.611
   20   1HB   PRO   3          2HB       PRO   3   1.448  -8.645  -2.501
   21   2HB   PRO   3          3HB       PRO   3   1.772  -7.580  -3.855
   22   1HG   PRO   3          2HG       PRO   3   3.604  -8.458  -1.708
   23   2HG   PRO   3          3HG       PRO   3   3.995  -7.762  -3.268
   24   1HD   PRO   3          2HD       PRO   3   4.054  -6.428  -0.730
   25   2HD   PRO   3          3HD       PRO   3   4.332  -5.704  -2.302
   26    H    GLU   4           HN       GLU   4   2.165  -7.049   0.329
   27    HA   GLU   4           HA       GLU   4   0.180  -8.627   1.329
   28   1HB   GLU   4          2HB       GLU   4   2.600  -7.550   2.243
   29   2HB   GLU   4          3HB       GLU   4   1.425  -6.907   3.373
   30   1HG   GLU   4          2HG       GLU   4   0.812  -9.702   2.866
   31   2HG   GLU   4          3HG       GLU   4   2.508  -9.559   3.283
   32    H    GLU   5           HN       GLU   5   0.584  -5.036   1.573
   33    HA   GLU   5           HA       GLU   5  -1.695  -4.696   3.157
   34   1HB   GLU   5          2HB       GLU   5   0.263  -2.987   1.736
   35   2HB   GLU   5          3HB       GLU   5  -1.332  -2.270   1.848
   36   1HG   GLU   5          2HG       GLU   5  -0.926  -3.349   4.412
   37   2HG   GLU   5          3HG       GLU   5   0.659  -2.745   3.974
   38    H    LEU   6           HN       LEU   6  -1.143  -5.073  -0.315
   39    HA   LEU   6           HA       LEU   6  -3.546  -3.889  -1.185
   40   1HB   LEU   6          2HB       LEU   6  -1.486  -5.714  -2.347
   41   2HB   LEU   6          3HB       LEU   6  -3.015  -5.528  -3.182
   42    HG   LEU   6           HG       LEU   6  -1.304  -3.161  -2.400
   43   1HD1  LEU   6          1HD1      LEU   6  -1.107  -4.954  -4.808
   44   2HD1  LEU   6          2HD1      LEU   6  -0.667  -3.232  -4.907
   45   3HD1  LEU   6          3HD1      LEU   6   0.184  -4.304  -3.770
   46   1HD2  LEU   6          1HD2      LEU   6  -3.659  -2.689  -2.897
   47   2HD2  LEU   6          2HD2      LEU   6  -2.571  -1.991  -4.121
   48   3HD2  LEU   6          3HD2      LEU   6  -3.482  -3.476  -4.484
   49    H    LYS   7           HN       LYS   7  -2.606  -7.220  -0.189
   50    HA   LYS   7           HA       LYS   7  -4.982  -8.461  -0.934
   51   1HB   LYS   7          2HB       LYS   7  -2.645  -9.366  -0.085
   52   2HB   LYS   7          3HB       LYS   7  -3.438  -9.353   1.477
   53   1HG   LYS   7          2HG       LYS   7  -3.765 -11.546   0.432
   54   2HG   LYS   7          3HG       LYS   7  -5.310 -10.726   0.536
   55   1HD   LYS   7          2HD       LYS   7  -4.109  -9.953  -1.961
   56   2HD   LYS   7          3HD       LYS   7  -3.939 -11.692  -1.823
   57   1HE   LYS   7          2HE       LYS   7  -6.612 -10.749  -0.979
   58   2HE   LYS   7          3HE       LYS   7  -6.247 -10.327  -2.640
   59   1HZ   LYS   7          1HZ       LYS   7  -6.889 -12.406  -3.019
   60   2HZ   LYS   7          2HZ       LYS   7  -5.399 -12.845  -2.514
   61   3HZ   LYS   7          3HZ       LYS   7  -6.662 -12.906  -1.481
   62    H    GLY   8           HN       GLY   8  -3.969  -7.195   2.322
   63   1HA   GLY   8          1HA       GLY   8  -6.310  -7.650   3.683
   64   2HA   GLY   8          2HA       GLY   8  -5.194  -6.337   4.002
   65    H    ILE   9           HN       ILE   9  -5.355  -4.547   2.027
   66    HA   ILE   9           HA       ILE   9  -7.749  -3.249   2.445
   67    HB   ILE   9           HB       ILE   9  -5.457  -2.986   0.580
   68   1HG1  ILE   9          2HG1      ILE   9  -6.812  -1.269   2.664
   69   2HG1  ILE   9          3HG1      ILE   9  -5.208  -1.974   2.710
   70   1HG2  ILE   9          1HG2      ILE   9  -8.018  -1.411   0.197
   71   2HG2  ILE   9          2HG2      ILE   9  -6.473  -1.153  -0.649
   72   3HG2  ILE   9          3HG2      ILE   9  -7.390  -2.657  -0.908
   73   1HD1  ILE   9          1HD1      ILE   9  -5.042   0.417   2.175
   74   2HD1  ILE   9          2HD1      ILE   9  -4.537  -0.539   0.762
   75   3HD1  ILE   9          3HD1      ILE   9  -6.150   0.212   0.797
   76    H    PHE  10           HN       PHE  10  -6.700  -5.283  -0.365
   77    HA   PHE  10           HA       PHE  10  -8.918  -4.982  -1.925
   78   1HB   PHE  10          2HB       PHE  10  -7.055  -6.239  -2.769
   79   2HB   PHE  10          3HB       PHE  10  -6.912  -7.183  -1.300
   80    HD1  PHE  10           HD1      PHE  10  -8.541  -6.912  -4.539
   81    HD2  PHE  10           HD2      PHE  10  -8.400  -9.104  -0.908
   82    HE1  PHE  10           HE1      PHE  10  -9.809  -8.787  -5.622
   83    HE2  PHE  10           HE2      PHE  10  -9.668 -10.979  -1.991
   84    HZ   PHE  10           HZ       PHE  10 -10.358 -10.799  -4.335
   85    H    GLU  11           HN       GLU  11  -8.353  -7.574   0.569
   86    HA   GLU  11           HA       GLU  11 -10.872  -8.683   0.269
   87   1HB   GLU  11          2HB       GLU  11  -8.544  -9.044   1.950
   88   2HB   GLU  11          3HB       GLU  11  -9.976  -9.102   2.958
   89   1HG   GLU  11          2HG       GLU  11 -10.815 -10.630   0.829
   90   2HG   GLU  11          3HG       GLU  11  -9.096 -10.973   0.801
   91    H    LYS  12           HN       LYS  12  -9.597  -6.126   2.468
   92    HA   LYS  12           HA       LYS  12 -11.875  -5.899   4.060
   93   1HB   LYS  12          2HB       LYS  12  -9.583  -4.987   4.532
   94   2HB   LYS  12          3HB       LYS  12  -9.881  -3.727   3.352
   95   1HG   LYS  12          2HG       LYS  12 -12.134  -3.398   4.789
   96   2HG   LYS  12          3HG       LYS  12 -11.173  -4.153   6.045
   97   1HD   LYS  12          2HD       LYS  12  -9.493  -2.196   4.784
   98   2HD   LYS  12          3HD       LYS  12 -11.044  -1.428   5.058
   99   1HE   LYS  12          2HE       LYS  12 -10.006  -3.072   7.334
  100   2HE   LYS  12          3HE       LYS  12  -9.085  -1.627   6.968
  101   1HZ   LYS  12          1HZ       LYS  12 -11.892  -1.180   6.954
  102   2HZ   LYS  12          2HZ       LYS  12 -11.351  -1.705   8.403
  103   3HZ   LYS  12          3HZ       LYS  12 -10.713  -0.360   7.732
  104    H    TYR  13           HN       TYR  13 -11.330  -5.147   0.725
  105    HA   TYR  13           HA       TYR  13 -13.490  -3.187   0.689
  106   1HB   TYR  13          2HB       TYR  13 -11.130  -4.063  -0.913
  107   2HB   TYR  13          3HB       TYR  13 -12.544  -3.825  -1.921
  108    HD1  TYR  13           HD1      TYR  13 -10.411  -2.116   0.625
  109    HD2  TYR  13           HD2      TYR  13 -13.176  -1.661  -2.608
  110    HE1  TYR  13           HE1      TYR  13  -9.975   0.389   0.595
  111    HE2  TYR  13           HE2      TYR  13 -12.731   0.842  -2.627
  112    HH   TYR  13           HH       TYR  13 -11.791   2.508  -1.588
  113    H    ALA  14           HN       ALA  14 -12.590  -6.430  -0.641
  114    HA   ALA  14           HA       ALA  14 -14.976  -6.761  -2.090
  115   1HB   ALA  14          1HB       ALA  14 -12.802  -7.991  -2.418
  116   2HB   ALA  14          2HB       ALA  14 -13.144  -8.890  -0.920
  117   3HB   ALA  14          3HB       ALA  14 -14.227  -9.052  -2.323
  118    H    ALA  15           HN       ALA  15 -14.357  -6.614   1.272
  119    HA   ALA  15           HA       ALA  15 -16.402  -8.511   2.010
  120   1HB   ALA  15          1HB       ALA  15 -14.203  -7.923   3.268
  121   2HB   ALA  15          2HB       ALA  15 -15.080  -6.475   3.819
  122   3HB   ALA  15          3HB       ALA  15 -15.697  -8.096   4.220
  123    H    LYS  16           HN       LYS  16 -16.054  -5.076   1.273
  124    HA   LYS  16           HA       LYS  16 -18.177  -4.038   2.692
  125   1HB   LYS  16          2HB       LYS  16 -16.456  -3.251   0.498
  126   2HB   LYS  16          3HB       LYS  16 -18.095  -2.703   0.210
  127   1HG   LYS  16          2HG       LYS  16 -17.169  -0.948   1.496
  128   2HG   LYS  16          3HG       LYS  16 -18.066  -1.874   2.683
  129   1HD   LYS  16          2HD       LYS  16 -15.849  -3.163   3.117
  130   2HD   LYS  16          3HD       LYS  16 -15.061  -1.902   2.189
  131   1HE   LYS  16          2HE       LYS  16 -16.725  -0.505   4.006
  132   2HE   LYS  16          3HE       LYS  16 -16.059  -1.823   4.949
  133   1HZ   LYS  16          1HZ       LYS  16 -13.946  -0.933   3.544
  134   2HZ   LYS  16          2HZ       LYS  16 -14.744   0.452   3.877
  135   3HZ   LYS  16          3HZ       LYS  16 -14.282  -0.537   5.092
  136    H    GLU  17           HN       GLU  17 -18.248  -5.035  -0.807
  137    HA   GLU  17           HA       GLU  17 -21.046  -5.715  -0.332
  138   1HB   GLU  17          2HB       GLU  17 -19.680  -4.477  -2.744
  139   2HB   GLU  17          3HB       GLU  17 -21.224  -5.290  -2.902
  140   1HG   GLU  17          2HG       GLU  17 -21.556  -3.621  -0.648
  141   2HG   GLU  17          3HG       GLU  17 -20.623  -2.646  -1.766
  142    H    GLY  18           HN       GLY  18 -21.659  -7.813  -0.748
  143   1HA   GLY  18          1HA       GLY  18 -21.561  -9.947  -1.456
  144   2HA   GLY  18          2HA       GLY  18 -20.480  -9.434  -2.737
  145    H    ASP  19           HN       ASP  19 -19.891 -11.865  -1.783
  146    HA   ASP  19           HA       ASP  19 -18.474 -12.097   0.518
  147   1HB   ASP  19          2HB       ASP  19 -19.147 -13.815  -1.405
  148   2HB   ASP  19          3HB       ASP  19 -17.534 -13.485  -2.005
  149    HA   PRO  20           HA       PRO  20 -14.773  -9.913  -0.386
  150   1HB   PRO  20          2HB       PRO  20 -13.118 -10.911   1.546
  151   2HB   PRO  20          3HB       PRO  20 -14.291  -9.646   1.850
  152   1HG   PRO  20          2HG       PRO  20 -14.407 -12.503   2.604
  153   2HG   PRO  20          3HG       PRO  20 -15.331 -11.159   3.247
  154   1HD   PRO  20          2HD       PRO  20 -16.253 -13.146   1.395
  155   2HD   PRO  20          3HD       PRO  20 -17.138 -11.738   1.948
  156    H    ASN  21           HN       ASN  21 -15.251 -13.042  -1.113
  157    HA   ASN  21           HA       ASN  21 -12.511 -13.451  -1.927
  158   1HB   ASN  21          2HB       ASN  21 -14.998 -15.227  -1.916
  159   2HB   ASN  21          3HB       ASN  21 -13.507 -15.735  -2.685
  160   1HD2  ASN  21          1HD2      ASN  21 -14.555 -17.198  -0.668
  161   2HD2  ASN  21          2HD2      ASN  21 -13.586 -17.095   0.764
  162    H    GLN  22           HN       GLN  22 -15.083 -11.754  -3.073
  163    HA   GLN  22           HA       GLN  22 -14.260 -12.155  -5.795
  164   1HB   GLN  22          2HB       GLN  22 -16.792 -12.175  -6.464
  165   2HB   GLN  22          3HB       GLN  22 -16.040 -13.672  -5.951
  166   1HG   GLN  22          2HG       GLN  22 -16.945 -12.388  -3.563
  167   2HG   GLN  22          3HG       GLN  22 -18.248 -12.223  -4.723
  168   1HE2  GLN  22          1HE2      GLN  22 -15.851 -14.626  -3.639
  169   2HE2  GLN  22          2HE2      GLN  22 -16.908 -15.998  -3.618
  170    H    LEU  23           HN       LEU  23 -14.140 -10.193  -6.844
  171    HA   LEU  23           HA       LEU  23 -15.160  -7.902  -5.366
  172   1HB   LEU  23          2HB       LEU  23 -13.117  -8.269  -7.544
  173   2HB   LEU  23          3HB       LEU  23 -13.750  -6.686  -7.138
  174    HG   LEU  23           HG       LEU  23 -11.522  -7.506  -6.081
  175   1HD1  LEU  23          1HD1      LEU  23 -11.730  -5.847  -4.557
  176   2HD1  LEU  23          2HD1      LEU  23 -13.227  -5.524  -5.464
  177   3HD1  LEU  23          3HD1      LEU  23 -13.289  -6.447  -3.943
  178   1HD2  LEU  23          1HD2      LEU  23 -13.501  -8.850  -4.220
  179   2HD2  LEU  23          2HD2      LEU  23 -12.350  -9.673  -5.299
  180   3HD2  LEU  23          3HD2      LEU  23 -11.750  -8.678  -3.951
  181    H    SER  24           HN       SER  24 -16.231  -6.117  -6.603
  182    HA   SER  24           HA       SER  24 -17.714  -7.209  -8.860
  183   1HB   SER  24          2HB       SER  24 -18.943  -5.336  -6.804
  184   2HB   SER  24          3HB       SER  24 -19.770  -6.246  -8.053
  185    HG   SER  24           HG       SER  24 -19.653  -8.088  -6.877
  186    H    LYS  25           HN       LYS  25 -18.629  -5.457 -10.314
  187    HA   LYS  25           HA       LYS  25 -16.688  -3.647 -11.041
  188   1HB   LYS  25          2HB       LYS  25 -18.475  -4.470 -12.513
  189   2HB   LYS  25          3HB       LYS  25 -19.669  -3.576 -11.596
  190   1HG   LYS  25          2HG       LYS  25 -18.091  -1.494 -12.103
  191   2HG   LYS  25          3HG       LYS  25 -17.478  -2.509 -13.393
  192   1HD   LYS  25          2HD       LYS  25 -20.250  -2.804 -13.645
  193   2HD   LYS  25          3HD       LYS  25 -20.084  -1.126 -13.168
  194   1HE   LYS  25          2HE       LYS  25 -18.098  -1.235 -15.034
  195   2HE   LYS  25          3HE       LYS  25 -19.139  -2.494 -15.668
  196   1HZ   LYS  25          1HZ       LYS  25 -20.893  -0.582 -15.111
  197   2HZ   LYS  25          2HZ       LYS  25 -19.598   0.326 -15.518
  198   3HZ   LYS  25          3HZ       LYS  25 -20.190  -0.772 -16.573
  199    H    GLU  26           HN       GLU  26 -19.812  -2.953  -9.310
  200    HA   GLU  26           HA       GLU  26 -19.290  -0.308  -8.872
  201   1HB   GLU  26          2HB       GLU  26 -21.229  -2.254  -8.050
  202   2HB   GLU  26          3HB       GLU  26 -20.720  -1.401  -6.606
  203   1HG   GLU  26          2HG       GLU  26 -20.987   0.675  -8.449
  204   2HG   GLU  26          3HG       GLU  26 -22.275  -0.412  -8.930
  205    H    GLU  27           HN       GLU  27 -18.252  -3.212  -7.039
  206    HA   GLU  27           HA       GLU  27 -17.313  -1.819  -4.818
  207   1HB   GLU  27          2HB       GLU  27 -17.158  -4.564  -5.907
  208   2HB   GLU  27          3HB       GLU  27 -15.746  -4.117  -4.970
  209   1HG   GLU  27          2HG       GLU  27 -18.303  -3.285  -3.714
  210   2HG   GLU  27          3HG       GLU  27 -18.159  -5.020  -3.914
  211    H    LEU  28           HN       LEU  28 -15.474  -3.318  -7.584
  212    HA   LEU  28           HA       LEU  28 -13.002  -2.359  -6.947
  213   1HB   LEU  28          2HB       LEU  28 -13.836  -3.951  -8.807
  214   2HB   LEU  28          3HB       LEU  28 -13.979  -2.503  -9.784
  215    HG   LEU  28           HG       LEU  28 -11.728  -2.240 -10.007
  216   1HD1  LEU  28          1HD1      LEU  28 -11.401  -3.527  -7.288
  217   2HD1  LEU  28          2HD1      LEU  28 -10.040  -3.069  -8.340
  218   3HD1  LEU  28          3HD1      LEU  28 -11.155  -1.821  -7.733
  219   1HD2  LEU  28          1HD2      LEU  28 -10.605  -4.417 -10.267
  220   2HD2  LEU  28          2HD2      LEU  28 -11.937  -5.198  -9.382
  221   3HD2  LEU  28          3HD2      LEU  28 -12.250  -4.415 -10.949
  222    H    LYS  29           HN       LYS  29 -15.716  -0.687  -8.607
  223    HA   LYS  29           HA       LYS  29 -14.447   1.523  -9.542
  224   1HB   LYS  29          2HB       LYS  29 -16.824   0.990  -9.883
  225   2HB   LYS  29          3HB       LYS  29 -17.167   1.372  -8.208
  226   1HG   LYS  29          2HG       LYS  29 -16.607   3.701  -8.513
  227   2HG   LYS  29          3HG       LYS  29 -15.844   3.395 -10.061
  228   1HD   LYS  29          2HD       LYS  29 -17.919   3.053 -11.169
  229   2HD   LYS  29          3HD       LYS  29 -18.774   2.716  -9.676
  230   1HE   LYS  29          2HE       LYS  29 -18.020   5.239  -9.092
  231   2HE   LYS  29          3HE       LYS  29 -17.958   5.376 -10.838
  232   1HZ   LYS  29          1HZ       LYS  29 -20.300   4.113  -9.710
  233   2HZ   LYS  29          2HZ       LYS  29 -20.157   5.726  -9.496
  234   3HZ   LYS  29          3HZ       LYS  29 -20.172   5.101 -11.005
  235    H    LEU  30           HN       LEU  30 -15.806   1.093  -6.199
  236    HA   LEU  30           HA       LEU  30 -14.962   3.521  -5.208
  237   1HB   LEU  30          2HB       LEU  30 -15.230   0.879  -3.767
  238   2HB   LEU  30          3HB       LEU  30 -15.150   2.455  -3.004
  239    HG   LEU  30           HG       LEU  30 -17.374   1.266  -4.650
  240   1HD1  LEU  30          1HD1      LEU  30 -18.577   2.409  -2.557
  241   2HD1  LEU  30          2HD1      LEU  30 -17.883   0.771  -2.494
  242   3HD1  LEU  30          3HD1      LEU  30 -16.969   2.149  -1.837
  243   1HD2  LEU  30          1HD2      LEU  30 -17.369   3.318  -5.693
  244   2HD2  LEU  30          2HD2      LEU  30 -18.434   3.635  -4.302
  245   3HD2  LEU  30          3HD2      LEU  30 -16.736   4.170  -4.264
  246    H    LEU  31           HN       LEU  31 -13.270   0.310  -4.988
  247    HA   LEU  31           HA       LEU  31 -11.003   1.169  -3.742
  248   1HB   LEU  31          2HB       LEU  31 -11.816  -1.173  -4.477
  249   2HB   LEU  31          3HB       LEU  31 -10.936  -0.856  -5.959
  250    HG   LEU  31           HG       LEU  31  -9.331  -0.324  -3.567
  251   1HD1  LEU  31          1HD1      LEU  31  -9.238  -3.129  -3.655
  252   2HD1  LEU  31          2HD1      LEU  31  -9.830  -2.097  -2.330
  253   3HD1  LEU  31          3HD1      LEU  31 -10.964  -2.704  -3.561
  254   1HD2  LEU  31          1HD2      LEU  31  -8.341  -2.402  -5.304
  255   2HD2  LEU  31          2HD2      LEU  31  -8.957  -1.034  -6.262
  256   3HD2  LEU  31          3HD2      LEU  31  -7.712  -0.762  -5.019
  257    H    LEU  32           HN       LEU  32 -11.307   0.747  -7.344
  258    HA   LEU  32           HA       LEU  32  -8.971   1.982  -8.016
  259   1HB   LEU  32          2HB       LEU  32 -11.583   2.081  -9.533
  260   2HB   LEU  32          3HB       LEU  32  -9.986   2.356 -10.201
  261    HG   LEU  32           HG       LEU  32 -10.855  -0.259  -8.944
  262   1HD1  LEU  32          1HD1      LEU  32 -12.261  -0.034 -10.816
  263   2HD1  LEU  32          2HD1      LEU  32 -10.968   0.677 -11.812
  264   3HD1  LEU  32          3HD1      LEU  32 -10.905  -1.046 -11.369
  265   1HD2  LEU  32          1HD2      LEU  32  -8.873  -1.203  -9.804
  266   2HD2  LEU  32          2HD2      LEU  32  -8.528   0.226 -10.808
  267   3HD2  LEU  32          3HD2      LEU  32  -8.384   0.327  -9.036
  268    H    GLN  33           HN       GLN  33 -11.872   3.382  -6.650
  269    HA   GLN  33           HA       GLN  33 -11.454   5.978  -7.634
  270   1HB   GLN  33          2HB       GLN  33 -13.485   4.674  -6.288
  271   2HB   GLN  33          3HB       GLN  33 -12.846   5.705  -5.023
  272   1HG   GLN  33          2HG       GLN  33 -13.046   7.686  -6.562
  273   2HG   GLN  33          3HG       GLN  33 -13.732   6.644  -7.793
  274   1HE2  GLN  33          1HE2      GLN  33 -15.583   5.217  -6.958
  275   2HE2  GLN  33          2HE2      GLN  33 -16.807   6.006  -6.021
  276    H    THR  34           HN       THR  34 -11.024   4.611  -4.282
  277    HA   THR  34           HA       THR  34  -9.341   6.843  -3.571
  278    HB   THR  34           HB       THR  34 -10.795   4.597  -2.267
  279    HG1  THR  34           HG1      THR  34 -11.491   6.522  -1.433
  280   1HG2  THR  34          1HG2      THR  34  -9.358   4.887  -0.171
  281   2HG2  THR  34          2HG2      THR  34  -8.580   3.935  -1.459
  282   3HG2  THR  34          3HG2      THR  34  -8.117   5.635  -1.205
  283    H    GLU  35           HN       GLU  35  -8.920   3.279  -4.044
  284    HA   GLU  35           HA       GLU  35  -6.320   3.095  -3.388
  285   1HB   GLU  35          2HB       GLU  35  -7.626   1.140  -3.984
  286   2HB   GLU  35          3HB       GLU  35  -7.859   1.715  -5.623
  287   1HG   GLU  35          2HG       GLU  35  -5.997   0.572  -6.224
  288   2HG   GLU  35          3HG       GLU  35  -5.053   1.709  -5.282
  289    H    PHE  36           HN       PHE  36  -7.570   3.744  -6.748
  290    HA   PHE  36           HA       PHE  36  -5.334   5.520  -7.179
  291   1HB   PHE  36          2HB       PHE  36  -5.800   2.797  -8.461
  292   2HB   PHE  36          3HB       PHE  36  -5.131   4.064  -9.469
  293    HD1  PHE  36           HD1      PHE  36  -4.383   1.500  -7.153
  294    HD2  PHE  36           HD2      PHE  36  -3.014   5.268  -8.546
  295    HE1  PHE  36           HE1      PHE  36  -2.090   0.995  -6.265
  296    HE2  PHE  36           HE2      PHE  36  -0.721   4.763  -7.658
  297    HZ   PHE  36           HZ       PHE  36  -0.287   2.633  -6.528
  298    HA   PRO  37           HA       PRO  37  -9.064   6.923  -9.219
  299   1HB   PRO  37          2HB       PRO  37  -8.806   9.565  -8.570
  300   2HB   PRO  37          3HB       PRO  37  -9.701   8.421  -7.590
  301   1HG   PRO  37          2HG       PRO  37  -7.034   9.596  -7.095
  302   2HG   PRO  37          3HG       PRO  37  -8.113   8.806  -5.962
  303   1HD   PRO  37          2HD       PRO  37  -5.755   7.688  -7.152
  304   2HD   PRO  37          3HD       PRO  37  -6.896   6.861  -6.110
  305    H    SER  38           HN       SER  38  -5.879   7.081  -9.799
  306    HA   SER  38           HA       SER  38  -6.125   8.994 -11.932
  307   1HB   SER  38          2HB       SER  38  -3.649   8.331 -12.280
  308   2HB   SER  38          3HB       SER  38  -4.055   9.175 -10.799
  309    HG   SER  38           HG       SER  38  -3.227   6.496 -11.189
  310    H    LEU  39           HN       LEU  39  -5.931   5.478 -11.353
  311    HA   LEU  39           HA       LEU  39  -5.429   4.785 -14.056
  312   1HB   LEU  39          2HB       LEU  39  -5.662   3.495 -11.519
  313   2HB   LEU  39          3HB       LEU  39  -6.724   2.679 -12.649
  314    HG   LEU  39           HG       LEU  39  -4.282   1.863 -12.372
  315   1HD1  LEU  39          1HD1      LEU  39  -5.891   2.165 -14.861
  316   2HD1  LEU  39          2HD1      LEU  39  -4.220   1.573 -15.020
  317   3HD1  LEU  39          3HD1      LEU  39  -5.378   0.700 -13.989
  318   1HD2  LEU  39          1HD2      LEU  39  -3.542   4.367 -12.848
  319   2HD2  LEU  39          2HD2      LEU  39  -2.546   2.976 -13.340
  320   3HD2  LEU  39          3HD2      LEU  39  -3.581   3.796 -14.534
  321    H    LEU  40           HN       LEU  40  -8.221   5.867 -12.271
  322    HA   LEU  40           HA       LEU  40 -10.144   4.601 -13.953
  323   1HB   LEU  40          2HB       LEU  40 -10.318   6.846 -11.943
  324   2HB   LEU  40          3HB       LEU  40 -11.701   6.199 -12.804
  325    HG   LEU  40           HG       LEU  40  -9.903   4.608 -10.953
  326   1HD1  LEU  40          1HD1      LEU  40 -11.826   4.633  -9.404
  327   2HD1  LEU  40          2HD1      LEU  40 -11.154   6.256  -9.695
  328   3HD1  LEU  40          3HD1      LEU  40 -12.667   5.763 -10.493
  329   1HD2  LEU  40          1HD2      LEU  40 -12.132   3.865 -12.770
  330   2HD2  LEU  40          2HD2      LEU  40 -10.725   2.923 -12.220
  331   3HD2  LEU  40          3HD2      LEU  40 -12.133   3.127 -11.150
  332    H    LYS  41           HN       LYS  41  -8.119   7.466 -14.096
  333    HA   LYS  41           HA       LYS  41  -9.758   8.913 -15.900
  334   1HB   LYS  41          2HB       LYS  41  -6.820   9.114 -15.181
  335   2HB   LYS  41          3HB       LYS  41  -7.641  10.232 -16.251
  336   1HG   LYS  41          2HG       LYS  41  -8.582   9.641 -13.408
  337   2HG   LYS  41          3HG       LYS  41  -7.509  10.967 -13.809
  338   1HD   LYS  41          2HD       LYS  41  -9.585  11.272 -15.662
  339   2HD   LYS  41          3HD       LYS  41 -10.427  10.719 -14.228
  340   1HE   LYS  41          2HE       LYS  41  -9.649  12.561 -12.911
  341   2HE   LYS  41          3HE       LYS  41  -8.366  12.945 -14.040
  342   1HZ   LYS  41          1HZ       LYS  41 -11.159  13.610 -14.172
  343   2HZ   LYS  41          2HZ       LYS  41  -9.862  14.441 -14.714
  344   3HZ   LYS  41          3HZ       LYS  41 -10.469  13.209 -15.598
  345    H    GLY  42           HN       GLY  42  -7.314   6.342 -16.180
  346   1HA   GLY  42          1HA       GLY  42  -6.435   6.476 -18.720
  347   2HA   GLY  42          2HA       GLY  42  -6.892   4.977 -17.935
  348    H    MET  43           HN       MET  43  -7.156   5.193 -20.700
  349    HA   MET  43           HA       MET  43  -9.730   6.095 -21.408
  350   1HB   MET  43          2HB       MET  43  -7.771   4.187 -22.804
  351   2HB   MET  43          3HB       MET  43  -9.171   4.900 -23.580
  352   1HG   MET  43          2HG       MET  43  -7.213   6.758 -22.227
  353   2HG   MET  43          3HG       MET  43  -6.737   6.035 -23.751
  354   1HE   MET  43          1HE       MET  43  -6.496   8.581 -23.940
  355   2HE   MET  43          2HE       MET  43  -7.688   9.510 -24.879
  356   3HE   MET  43          3HE       MET  43  -7.757   9.515 -23.101
  357    H    SER  44           HN       SER  44  -8.781   3.486 -19.533
  358    HA   SER  44           HA       SER  44 -10.675   1.636 -20.656
  359   1HB   SER  44          2HB       SER  44  -8.957   1.399 -18.146
  360   2HB   SER  44          3HB       SER  44  -9.858   0.097 -18.896
  361    HG   SER  44           HG       SER  44  -8.179  -0.238 -20.165
  362    H    THR  45           HN       THR  45 -12.781   2.361 -20.274
  363    HA   THR  45           HA       THR  45 -13.534   3.696 -17.898
  364    HB   THR  45           HB       THR  45 -15.820   3.388 -18.881
  365    HG1  THR  45           HG1      THR  45 -15.992   1.577 -20.138
  366   1HG2  THR  45          1HG2      THR  45 -13.702   4.755 -20.124
  367   2HG2  THR  45          2HG2      THR  45 -14.352   3.729 -21.424
  368   3HG2  THR  45          3HG2      THR  45 -15.418   4.877 -20.580
  369    H    LEU  46           HN       LEU  46 -15.437   2.839 -16.516
  370    HA   LEU  46           HA       LEU  46 -14.481   0.794 -14.958
  371   1HB   LEU  46          2HB       LEU  46 -16.409   2.616 -14.714
  372   2HB   LEU  46          3HB       LEU  46 -17.420   1.242 -15.114
  373    HG   LEU  46           HG       LEU  46 -15.876   0.133 -13.175
  374   1HD1  LEU  46          1HD1      LEU  46 -16.253   2.999 -12.273
  375   2HD1  LEU  46          2HD1      LEU  46 -15.502   1.661 -11.370
  376   3HD1  LEU  46          3HD1      LEU  46 -14.706   2.313 -12.822
  377   1HD2  LEU  46          1HD2      LEU  46 -18.324   0.071 -13.334
  378   2HD2  LEU  46          2HD2      LEU  46 -17.776   0.434 -11.680
  379   3HD2  LEU  46          3HD2      LEU  46 -18.407   1.737 -12.715
  380    H    ASP  47           HN       ASP  47 -17.332   0.560 -17.209
  381    HA   ASP  47           HA       ASP  47 -17.762  -2.056 -17.049
  382   1HB   ASP  47          2HB       ASP  47 -18.559  -0.017 -18.737
  383   2HB   ASP  47          3HB       ASP  47 -17.691  -1.047 -19.857
  384    H    GLU  48           HN       GLU  48 -15.459  -0.404 -19.344
  385    HA   GLU  48           HA       GLU  48 -14.512  -2.651 -20.570
  386   1HB   GLU  48          2HB       GLU  48 -13.778   0.152 -20.353
  387   2HB   GLU  48          3HB       GLU  48 -12.326  -0.830 -20.338
  388   1HG   GLU  48          2HG       GLU  48 -13.609  -2.092 -22.355
  389   2HG   GLU  48          3HG       GLU  48 -14.401  -0.536 -22.502
  390    H    LEU  49           HN       LEU  49 -13.348  -1.011 -17.561
  391    HA   LEU  49           HA       LEU  49 -11.164  -2.725 -17.161
  392   1HB   LEU  49          2HB       LEU  49 -12.067  -0.402 -16.078
  393   2HB   LEU  49          3HB       LEU  49 -12.469  -1.532 -14.799
  394    HG   LEU  49           HG       LEU  49  -9.942  -2.315 -15.216
  395   1HD1  LEU  49          1HD1      LEU  49  -9.340  -0.883 -16.992
  396   2HD1  LEU  49          2HD1      LEU  49 -10.038   0.543 -16.188
  397   3HD1  LEU  49          3HD1      LEU  49  -8.561  -0.210 -15.541
  398   1HD2  LEU  49          1HD2      LEU  49 -11.335  -0.775 -13.301
  399   2HD2  LEU  49          2HD2      LEU  49  -9.810  -1.670 -13.099
  400   3HD2  LEU  49          3HD2      LEU  49  -9.779   0.042 -13.583
  401    H    PHE  50           HN       PHE  50 -14.603  -2.812 -16.080
  402    HA   PHE  50           HA       PHE  50 -14.349  -4.985 -14.373
  403   1HB   PHE  50          2HB       PHE  50 -16.303  -3.332 -14.772
  404   2HB   PHE  50          3HB       PHE  50 -16.664  -4.210 -16.246
  405    HD1  PHE  50           HD1      PHE  50 -15.711  -5.529 -12.894
  406    HD2  PHE  50           HD2      PHE  50 -18.725  -5.207 -15.864
  407    HE1  PHE  50           HE1      PHE  50 -17.159  -7.116 -11.596
  408    HE2  PHE  50           HE2      PHE  50 -20.174  -6.794 -14.566
  409    HZ   PHE  50           HZ       PHE  50 -19.373  -7.729 -12.447
  410    H    GLU  51           HN       GLU  51 -15.333  -4.869 -17.872
  411    HA   GLU  51           HA       GLU  51 -15.519  -7.661 -18.039
  412   1HB   GLU  51          2HB       GLU  51 -15.924  -5.352 -19.767
  413   2HB   GLU  51          3HB       GLU  51 -15.071  -6.607 -20.643
  414   1HG   GLU  51          2HG       GLU  51 -16.840  -8.262 -19.789
  415   2HG   GLU  51          3HG       GLU  51 -17.734  -6.884 -19.179
  416    H    GLU  52           HN       GLU  52 -12.945  -5.253 -18.731
  417    HA   GLU  52           HA       GLU  52 -11.248  -7.006 -20.054
  418   1HB   GLU  52          2HB       GLU  52 -10.972  -4.570 -20.156
  419   2HB   GLU  52          3HB       GLU  52 -10.658  -4.492 -18.433
  420   1HG   GLU  52          2HG       GLU  52  -8.578  -5.759 -18.682
  421   2HG   GLU  52          3HG       GLU  52  -8.927  -6.101 -20.365
  422    H    LEU  53           HN       LEU  53 -11.231  -5.866 -16.597
  423    HA   LEU  53           HA       LEU  53  -9.140  -7.459 -15.754
  424   1HB   LEU  53          2HB       LEU  53 -11.552  -6.515 -14.199
  425   2HB   LEU  53          3HB       LEU  53 -10.059  -7.113 -13.505
  426    HG   LEU  53           HG       LEU  53  -9.945  -4.773 -15.377
  427   1HD1  LEU  53          1HD1      LEU  53 -11.176  -3.434 -14.112
  428   2HD1  LEU  53          2HD1      LEU  53 -11.562  -4.793 -13.029
  429   3HD1  LEU  53          3HD1      LEU  53 -10.131  -3.783 -12.714
  430   1HD2  LEU  53          1HD2      LEU  53  -7.960  -6.076 -14.266
  431   2HD2  LEU  53          2HD2      LEU  53  -7.929  -4.300 -14.379
  432   3HD2  LEU  53          3HD2      LEU  53  -8.373  -5.087 -12.845
  433    H    ASP  54           HN       ASP  54 -12.704  -8.132 -15.727
  434    HA   ASP  54           HA       ASP  54 -12.363 -10.697 -14.679
  435   1HB   ASP  54          2HB       ASP  54 -14.501  -9.441 -14.583
  436   2HB   ASP  54          3HB       ASP  54 -14.626  -9.480 -16.330
  437    H    LYS  55           HN       LYS  55 -11.226 -12.281 -15.825
  438    HA   LYS  55           HA       LYS  55 -11.783 -12.465 -18.704
  439   1HB   LYS  55          2HB       LYS  55  -9.233 -12.456 -17.195
  440   2HB   LYS  55          3HB       LYS  55  -9.365 -13.685 -18.437
  441   1HG   LYS  55          2HG       LYS  55 -10.357 -11.576 -19.839
  442   2HG   LYS  55          3HG       LYS  55  -9.344 -10.693 -18.715
  443   1HD   LYS  55          2HD       LYS  55  -7.390 -12.130 -19.358
  444   2HD   LYS  55          3HD       LYS  55  -8.406 -12.994 -20.495
  445   1HE   LYS  55          2HE       LYS  55  -8.811 -10.905 -21.772
  446   2HE   LYS  55          3HE       LYS  55  -7.888  -9.983 -20.602
  447   1HZ   LYS  55          1HZ       LYS  55  -6.808 -10.953 -22.752
  448   2HZ   LYS  55          2HZ       LYS  55  -5.957 -10.823 -21.364
  449   3HZ   LYS  55          3HZ       LYS  55  -6.582 -12.265 -21.807
  450    H    ASN  56           HN       ASN  56 -12.365 -13.791 -15.685
  451    HA   ASN  56           HA       ASN  56 -12.135 -16.517 -16.583
  452   1HB   ASN  56          2HB       ASN  56 -13.324 -15.509 -13.952
  453   2HB   ASN  56          3HB       ASN  56 -12.703 -17.114 -14.284
  454   1HD2  ASN  56          1HD2      ASN  56 -10.427 -17.351 -14.765
  455   2HD2  ASN  56          2HD2      ASN  56  -9.265 -16.295 -14.035
  456    H    GLY  57           HN       GLY  57 -14.171 -14.155 -17.385
  457   1HA   GLY  57          1HA       GLY  57 -16.408 -13.875 -17.686
  458   2HA   GLY  57          2HA       GLY  57 -16.266 -15.495 -18.338
  459    H    ASP  58           HN       ASP  58 -16.429 -13.889 -15.072
  460    HA   ASP  58           HA       ASP  58 -18.438 -15.887 -14.403
  461   1HB   ASP  58          2HB       ASP  58 -17.480 -15.693 -12.002
  462   2HB   ASP  58          3HB       ASP  58 -16.564 -16.638 -13.160
  463    H    GLY  59           HN       GLY  59 -16.781 -12.822 -13.313
  464   1HA   GLY  59          1HA       GLY  59 -18.323 -10.839 -13.477
  465   2HA   GLY  59          2HA       GLY  59 -19.416 -11.775 -12.477
  466    H    GLU  60           HN       GLU  60 -16.441 -12.809 -11.451
  467    HA   GLU  60           HA       GLU  60 -16.397 -10.749  -9.391
  468   1HB   GLU  60          2HB       GLU  60 -15.321 -13.596  -9.216
  469   2HB   GLU  60          3HB       GLU  60 -15.446 -12.448  -7.898
  470   1HG   GLU  60          2HG       GLU  60 -17.641 -13.965  -9.309
  471   2HG   GLU  60          3HG       GLU  60 -17.382 -13.745  -7.590
  472    H    VAL  61           HN       VAL  61 -14.534  -9.554  -9.054
  473    HA   VAL  61           HA       VAL  61 -12.297 -10.210 -10.831
  474    HB   VAL  61           HB       VAL  61 -13.253  -7.648  -9.555
  475   1HG1  VAL  61          1HG1      VAL  61 -10.560  -8.392 -10.494
  476   2HG1  VAL  61          2HG1      VAL  61 -11.202  -6.896 -11.214
  477   3HG1  VAL  61          3HG1      VAL  61 -11.084  -7.052  -9.445
  478   1HG2  VAL  61          1HG2      VAL  61 -13.864  -6.954 -11.671
  479   2HG2  VAL  61          2HG2      VAL  61 -12.712  -8.043 -12.482
  480   3HG2  VAL  61          3HG2      VAL  61 -14.208  -8.698 -11.774
  481    H    SER  62           HN       SER  62 -12.155 -11.972  -8.918
  482    HA   SER  62           HA       SER  62 -11.328 -11.259  -6.434
  483   1HB   SER  62          2HB       SER  62  -9.794 -13.547  -7.377
  484   2HB   SER  62          3HB       SER  62 -11.107 -13.500  -6.217
  485    HG   SER  62           HG       SER  62 -11.289 -13.731  -9.091
  486    H    PHE  63           HN       PHE  63  -9.001 -11.558  -5.510
  487    HA   PHE  63           HA       PHE  63  -7.363  -9.603  -6.444
  488   1HB   PHE  63          2HB       PHE  63  -7.314 -10.939  -4.245
  489   2HB   PHE  63          3HB       PHE  63  -6.596 -12.275  -5.122
  490    HD1  PHE  63           HD1      PHE  63  -6.007  -8.643  -4.485
  491    HD2  PHE  63           HD2      PHE  63  -4.296 -12.473  -5.125
  492    HE1  PHE  63           HE1      PHE  63  -3.722  -7.694  -4.061
  493    HE2  PHE  63           HE2      PHE  63  -2.011 -11.524  -4.701
  494    HZ   PHE  63           HZ       PHE  63  -1.752  -9.145  -4.174
  495    H    GLU  64           HN       GLU  64  -7.615 -12.992  -7.530
  496    HA   GLU  64           HA       GLU  64  -5.211 -13.274  -8.763
  497   1HB   GLU  64          2HB       GLU  64  -6.675 -14.724 -10.439
  498   2HB   GLU  64          3HB       GLU  64  -6.474 -15.221  -8.770
  499   1HG   GLU  64          2HG       GLU  64  -8.686 -14.934  -8.312
  500   2HG   GLU  64          3HG       GLU  64  -8.711 -13.340  -9.040
  501    H    GLU  65           HN       GLU  65  -8.274 -11.883 -10.127
  502    HA   GLU  65           HA       GLU  65  -7.030 -11.261 -12.579
  503   1HB   GLU  65          2HB       GLU  65  -9.631 -10.220 -11.369
  504   2HB   GLU  65          3HB       GLU  65  -9.152 -10.032 -13.045
  505   1HG   GLU  65          2HG       GLU  65  -9.593 -12.240 -13.570
  506   2HG   GLU  65          3HG       GLU  65  -9.056 -12.834 -12.011
  507    H    PHE  66           HN       PHE  66  -7.513  -9.607  -9.467
  508    HA   PHE  66           HA       PHE  66  -7.115  -6.992 -10.288
  509   1HB   PHE  66          2HB       PHE  66  -7.856  -7.841  -8.016
  510   2HB   PHE  66          3HB       PHE  66  -6.260  -8.517  -7.753
  511    HD1  PHE  66           HD1      PHE  66  -4.456  -7.156  -6.999
  512    HD2  PHE  66           HD2      PHE  66  -8.150  -5.366  -8.077
  513    HE1  PHE  66           HE1      PHE  66  -3.712  -4.995  -5.961
  514    HE2  PHE  66           HE2      PHE  66  -7.406  -3.206  -7.038
  515    HZ   PHE  66           HZ       PHE  66  -5.196  -3.046  -5.993
  516    H    GLN  67           HN       GLN  67  -4.818  -9.669  -9.747
  517    HA   GLN  67           HA       GLN  67  -2.534  -8.140  -9.497
  518   1HB   GLN  67          2HB       GLN  67  -2.646 -10.860 -10.851
  519   2HB   GLN  67          3HB       GLN  67  -1.328 -10.182  -9.916
  520   1HG   GLN  67          2HG       GLN  67  -3.354 -10.063  -8.059
  521   2HG   GLN  67          3HG       GLN  67  -3.856 -11.469  -8.977
  522   1HE2  GLN  67          1HE2      GLN  67  -1.517 -10.091  -6.843
  523   2HE2  GLN  67          2HE2      GLN  67  -0.594 -11.517  -6.503
  524    H    VAL  68           HN       VAL  68  -4.637  -8.620 -12.201
  525    HA   VAL  68           HA       VAL  68  -2.630  -8.283 -14.217
  526    HB   VAL  68           HB       VAL  68  -5.641  -8.044 -14.372
  527   1HG1  VAL  68          1HG1      VAL  68  -3.460  -8.318 -16.446
  528   2HG1  VAL  68          2HG1      VAL  68  -5.140  -8.802 -16.780
  529   3HG1  VAL  68          3HG1      VAL  68  -4.769  -7.116 -16.349
  530   1HG2  VAL  68          1HG2      VAL  68  -4.467 -10.256 -13.478
  531   2HG2  VAL  68          2HG2      VAL  68  -5.843 -10.317 -14.605
  532   3HG2  VAL  68          3HG2      VAL  68  -4.183 -10.518 -15.216
  533    H    LEU  69           HN       LEU  69  -4.868  -6.244 -12.319
  534    HA   LEU  69           HA       LEU  69  -4.350  -3.933 -13.937
  535   1HB   LEU  69          2HB       LEU  69  -6.461  -4.575 -12.571
  536   2HB   LEU  69          3HB       LEU  69  -5.585  -3.921 -11.201
  537    HG   LEU  69           HG       LEU  69  -5.471  -1.737 -12.210
  538   1HD1  LEU  69          1HD1      LEU  69  -7.029  -1.729 -14.484
  539   2HD1  LEU  69          2HD1      LEU  69  -5.252  -1.642 -14.429
  540   3HD1  LEU  69          3HD1      LEU  69  -6.059  -3.210 -14.669
  541   1HD2  LEU  69          1HD2      LEU  69  -8.212  -3.007 -12.298
  542   2HD2  LEU  69          2HD2      LEU  69  -7.467  -2.060 -10.988
  543   3HD2  LEU  69          3HD2      LEU  69  -7.944  -1.260 -12.504
  544    H    VAL  70           HN       VAL  70  -2.928  -5.561 -11.157
  545    HA   VAL  70           HA       VAL  70  -1.666  -3.444  -9.919
  546    HB   VAL  70           HB       VAL  70  -1.170  -6.372 -10.221
  547   1HG1  VAL  70          1HG1      VAL  70   0.764  -6.053  -8.550
  548   2HG1  VAL  70          2HG1      VAL  70   1.087  -5.717 -10.267
  549   3HG1  VAL  70          3HG1      VAL  70   0.817  -4.372  -9.132
  550   1HG2  VAL  70          1HG2      VAL  70  -2.840  -5.390  -8.614
  551   2HG2  VAL  70          2HG2      VAL  70  -1.597  -6.418  -7.861
  552   3HG2  VAL  70          3HG2      VAL  70  -1.477  -4.646  -7.745
  553    H    LYS  71           HN       LYS  71  -1.060  -4.993 -13.035
  554    HA   LYS  71           HA       LYS  71   1.608  -4.061 -13.292
  555   1HB   LYS  71          2HB       LYS  71   0.201  -5.969 -14.530
  556   2HB   LYS  71          3HB       LYS  71  -0.075  -4.677 -15.681
  557   1HG   LYS  71          2HG       LYS  71   2.745  -5.044 -14.702
  558   2HG   LYS  71          3HG       LYS  71   2.114  -6.276 -15.776
  559   1HD   LYS  71          2HD       LYS  71   1.311  -3.830 -16.957
  560   2HD   LYS  71          3HD       LYS  71   2.942  -3.528 -16.391
  561   1HE   LYS  71          2HE       LYS  71   3.889  -5.033 -17.870
  562   2HE   LYS  71          3HE       LYS  71   2.551  -6.159 -17.754
  563   1HZ   LYS  71          1HZ       LYS  71   1.905  -5.340 -19.680
  564   2HZ   LYS  71          2HZ       LYS  71   1.505  -3.944 -18.933
  565   3HZ   LYS  71          3HZ       LYS  71   2.972  -4.104 -19.633
  566    H    LYS  72           HN       LYS  72  -1.630  -2.899 -14.407
  567    HA   LYS  72           HA       LYS  72  -0.481  -0.598 -15.650
  568   1HB   LYS  72          2HB       LYS  72  -3.376  -1.199 -14.977
  569   2HB   LYS  72          3HB       LYS  72  -2.795   0.030 -16.082
  570   1HG   LYS  72          2HG       LYS  72  -3.021  -1.567 -17.696
  571   2HG   LYS  72          3HG       LYS  72  -1.517  -2.214 -17.073
  572   1HD   LYS  72          2HD       LYS  72  -2.595  -3.907 -15.827
  573   2HD   LYS  72          3HD       LYS  72  -4.109  -3.028 -15.743
  574   1HE   LYS  72          2HE       LYS  72  -4.646  -4.634 -17.354
  575   2HE   LYS  72          3HE       LYS  72  -4.112  -3.322 -18.386
  576   1HZ   LYS  72          1HZ       LYS  72  -3.093  -5.465 -18.907
  577   2HZ   LYS  72          2HZ       LYS  72  -1.979  -4.328 -18.543
  578   3HZ   LYS  72          3HZ       LYS  72  -2.354  -5.483 -17.451
  579    H    ILE  73           HN       ILE  73  -1.017  -1.537 -12.427
  580    HA   ILE  73           HA       ILE  73  -1.833   1.004 -11.421
  581    HB   ILE  73           HB       ILE  73  -0.981  -1.619 -10.276
  582   1HG1  ILE  73          2HG1      ILE  73  -3.408   0.110  -9.728
  583   2HG1  ILE  73          3HG1      ILE  73  -3.342  -1.090 -11.003
  584   1HG2  ILE  73          1HG2      ILE  73  -1.016  -0.745  -8.017
  585   2HG2  ILE  73          2HG2      ILE  73   0.246   0.076  -8.967
  586   3HG2  ILE  73          3HG2      ILE  73  -1.293   0.905  -8.627
  587   1HD1  ILE  73          1HD1      ILE  73  -4.097  -1.582  -8.375
  588   2HD1  ILE  73          2HD1      ILE  73  -3.586  -2.824  -9.544
  589   3HD1  ILE  73          3HD1      ILE  73  -2.406  -2.138  -8.401
  590    H    SER  74           HN       SER  74   1.279  -0.856 -11.524
  591    HA   SER  74           HA       SER  74   2.714   1.254 -10.356
  592   1HB   SER  74          2HB       SER  74   3.195  -1.449 -11.159
  593   2HB   SER  74          3HB       SER  74   4.399  -0.469 -11.973
  594    HG   SER  74           HG       SER  74   4.449  -1.280  -9.437
  595    H    GLN  75           HN       GLN  75   2.040   0.171 -13.720
  596    HA   GLN  75           HA       GLN  75   3.851   1.966 -14.893
  597   1HB   GLN  75          2HB       GLN  75   2.458  -0.207 -15.777
  598   2HB   GLN  75          3HB       GLN  75   1.463   1.066 -16.453
  599   1HG   GLN  75          2HG       GLN  75   3.265   0.356 -18.029
  600   2HG   GLN  75          3HG       GLN  75   3.398   2.051 -17.605
  601   1HE2  GLN  75          1HE2      GLN  75   4.333  -1.042 -16.095
  602   2HE2  GLN  75          2HE2      GLN  75   5.992  -0.645 -15.791
  Start of MODEL    8
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   1.899  -0.960  -1.731
    3   1HB   LYS   1          2HB       LYS   1   1.282   1.973  -1.613
    4   2HB   LYS   1          3HB       LYS   1   2.331   1.379  -2.884
    5   1HG   LYS   1          2HG       LYS   1   0.452  -0.462  -3.217
    6   2HG   LYS   1          3HG       LYS   1  -0.563   0.663  -2.337
    7   1HD   LYS   1          2HD       LYS   1  -0.632   2.175  -4.072
    8   2HD   LYS   1          3HD       LYS   1   1.047   1.920  -4.502
    9   1HE   LYS   1          2HE       LYS   1   0.537  -0.081  -5.751
   10   2HE   LYS   1          3HE       LYS   1  -1.071  -0.196  -5.062
   11   1HZ   LYS   1          1HZ       LYS   1  -0.150   1.971  -6.821
   12   2HZ   LYS   1          2HZ       LYS   1  -1.099   0.723  -7.277
   13   3HZ   LYS   1          3HZ       LYS   1  -1.655   1.823  -6.205
   14    H    SER   2           HN       SER   2   3.187   1.438   0.601
   15    HA   SER   2           HA       SER   2   5.814   1.193  -0.459
   16   1HB   SER   2          2HB       SER   2   4.425   2.951   1.318
   17   2HB   SER   2          3HB       SER   2   5.755   2.272   2.236
   18    HG   SER   2           HG       SER   2   5.925   4.282   0.555
   19    HA   PRO   3           HA       PRO   3   7.234  -2.006   2.132
   20   1HB   PRO   3          2HB       PRO   3   9.764  -1.259   2.848
   21   2HB   PRO   3          3HB       PRO   3   9.371  -1.932   1.278
   22   1HG   PRO   3          2HG       PRO   3   9.968   0.873   1.996
   23   2HG   PRO   3          3HG       PRO   3   9.994   0.115   0.416
   24   1HD   PRO   3          2HD       PRO   3   7.956   1.846   1.455
   25   2HD   PRO   3          3HD       PRO   3   7.928   0.996  -0.077
   26    H    GLU   4           HN       GLU   4   7.897   1.111   3.625
   27    HA   GLU   4           HA       GLU   4   8.152   0.162   6.182
   28   1HB   GLU   4          2HB       GLU   4   7.992   2.688   4.880
   29   2HB   GLU   4          3HB       GLU   4   6.792   2.736   6.156
   30   1HG   GLU   4          2HG       GLU   4   9.377   1.522   6.985
   31   2HG   GLU   4          3HG       GLU   4   9.508   3.201   6.501
   32    H    GLU   5           HN       GLU   5   5.249   0.801   4.209
   33    HA   GLU   5           HA       GLU   5   3.441   0.762   6.336
   34   1HB   GLU   5          2HB       GLU   5   3.368   0.887   3.421
   35   2HB   GLU   5          3HB       GLU   5   2.105  -0.175   4.013
   36   1HG   GLU   5          2HG       GLU   5   1.966   1.975   5.793
   37   2HG   GLU   5          3HG       GLU   5   2.373   2.763   4.281
   38    H    LEU   6           HN       LEU   6   4.888  -1.770   4.251
   39    HA   LEU   6           HA       LEU   6   3.184  -3.855   4.900
   40   1HB   LEU   6          2HB       LEU   6   5.992  -3.604   3.929
   41   2HB   LEU   6          3HB       LEU   6   5.446  -5.173   4.487
   42    HG   LEU   6           HG       LEU   6   4.205  -3.532   2.262
   43   1HD1  LEU   6          1HD1      LEU   6   6.360  -5.458   2.324
   44   2HD1  LEU   6          2HD1      LEU   6   5.014  -6.045   1.318
   45   3HD1  LEU   6          3HD1      LEU   6   5.756  -4.464   0.976
   46   1HD2  LEU   6          1HD2      LEU   6   3.235  -5.910   3.751
   47   2HD2  LEU   6          2HD2      LEU   6   2.334  -4.621   2.916
   48   3HD2  LEU   6          3HD2      LEU   6   3.064  -5.947   1.979
   49    H    LYS   7           HN       LYS   7   6.011  -2.471   6.629
   50    HA   LYS   7           HA       LYS   7   6.124  -4.511   8.572
   51   1HB   LYS   7          2HB       LYS   7   7.859  -2.678   7.842
   52   2HB   LYS   7          3HB       LYS   7   7.070  -1.701   9.064
   53   1HG   LYS   7          2HG       LYS   7   8.700  -2.744  10.365
   54   2HG   LYS   7          3HG       LYS   7   7.369  -3.862  10.586
   55   1HD   LYS   7          2HD       LYS   7   8.259  -5.288   8.729
   56   2HD   LYS   7          3HD       LYS   7   9.592  -4.171   8.511
   57   1HE   LYS   7          2HE       LYS   7   9.604  -4.767  11.284
   58   2HE   LYS   7          3HE       LYS   7   9.268  -6.300  10.503
   59   1HZ   LYS   7          1HZ       LYS   7  11.594  -5.994  10.630
   60   2HZ   LYS   7          2HZ       LYS   7  11.186  -5.847   9.056
   61   3HZ   LYS   7          3HZ       LYS   7  11.531  -4.516   9.938
   62    H    GLY   8           HN       GLY   8   4.850  -1.107   8.745
   63   1HA   GLY   8          1HA       GLY   8   3.730  -1.217  11.245
   64   2HA   GLY   8          2HA       GLY   8   3.129  -0.249   9.914
   65    H    ILE   9           HN       ILE   9   2.030  -1.893   8.093
   66    HA   ILE   9           HA       ILE   9  -0.371  -2.650   9.211
   67    HB   ILE   9           HB       ILE   9   1.027  -3.124   6.625
   68   1HG1  ILE   9          2HG1      ILE   9  -1.573  -1.811   7.460
   69   2HG1  ILE   9          3HG1      ILE   9  -0.095  -1.011   6.962
   70   1HG2  ILE   9          1HG2      ILE   9   0.073  -5.274   6.862
   71   2HG2  ILE   9          2HG2      ILE   9  -1.436  -4.617   7.541
   72   3HG2  ILE   9          3HG2      ILE   9  -1.041  -4.349   5.826
   73   1HD1  ILE   9          1HD1      ILE   9  -2.198  -2.289   5.309
   74   2HD1  ILE   9          2HD1      ILE   9  -1.049  -0.997   4.887
   75   3HD1  ILE   9          3HD1      ILE   9  -0.538  -2.701   4.816
   76    H    PHE  10           HN       PHE  10   2.476  -4.704   8.299
   77    HA   PHE  10           HA       PHE  10   1.437  -7.135   8.973
   78   1HB   PHE  10          2HB       PHE  10   3.614  -6.994   7.949
   79   2HB   PHE  10          3HB       PHE  10   4.166  -5.780   9.085
   80    HD1  PHE  10           HD1      PHE  10   4.889  -6.438  11.350
   81    HD2  PHE  10           HD2      PHE  10   3.802  -9.336   8.448
   82    HE1  PHE  10           HE1      PHE  10   6.020  -8.221  12.707
   83    HE2  PHE  10           HE2      PHE  10   4.934 -11.119   9.804
   84    HZ   PHE  10           HZ       PHE  10   6.029 -10.541  11.918
   85    H    GLU  11           HN       GLU  11   3.347  -4.913  11.133
   86    HA   GLU  11           HA       GLU  11   3.067  -6.528  13.366
   87   1HB   GLU  11          2HB       GLU  11   4.349  -4.105  12.703
   88   2HB   GLU  11          3HB       GLU  11   3.263  -3.673  14.009
   89   1HG   GLU  11          2HG       GLU  11   4.336  -6.091  14.902
   90   2HG   GLU  11          3HG       GLU  11   5.694  -5.367  14.064
   91    H    LYS  12           HN       LYS  12   1.095  -3.797  12.085
   92    HA   LYS  12           HA       LYS  12  -0.586  -3.539  14.294
   93   1HB   LYS  12          2HB       LYS  12  -0.283  -1.939  12.360
   94   2HB   LYS  12          3HB       LYS  12  -1.287  -3.003  11.396
   95   1HG   LYS  12          2HG       LYS  12  -2.875  -2.768  13.613
   96   2HG   LYS  12          3HG       LYS  12  -2.050  -1.223  13.681
   97   1HD   LYS  12          2HD       LYS  12  -2.653  -1.076  11.106
   98   2HD   LYS  12          3HD       LYS  12  -3.833  -2.315  11.484
   99   1HE   LYS  12          2HE       LYS  12  -3.707   0.129  13.258
  100   2HE   LYS  12          3HE       LYS  12  -4.445   0.288  11.677
  101   1HZ   LYS  12          1HZ       LYS  12  -6.160  -0.983  12.287
  102   2HZ   LYS  12          2HZ       LYS  12  -5.268  -2.011  13.190
  103   3HZ   LYS  12          3HZ       LYS  12  -5.731  -0.573  13.809
  104    H    TYR  13           HN       TYR  13  -0.249  -6.064  11.928
  105    HA   TYR  13           HA       TYR  13  -2.952  -7.038  12.428
  106   1HB   TYR  13          2HB       TYR  13  -0.691  -7.334  10.472
  107   2HB   TYR  13          3HB       TYR  13  -1.501  -8.848  10.826
  108    HD1  TYR  13           HD1      TYR  13  -2.319  -5.307   9.886
  109    HD2  TYR  13           HD2      TYR  13  -3.357  -9.444   9.555
  110    HE1  TYR  13           HE1      TYR  13  -4.152  -4.721   8.224
  111    HE2  TYR  13           HE2      TYR  13  -5.186  -8.844   7.894
  112    HH   TYR  13           HH       TYR  13  -5.574  -5.518   6.763
  113    H    ALA  14           HN       ALA  14   0.517  -7.980  12.837
  114    HA   ALA  14           HA       ALA  14  -0.049 -10.476  14.001
  115   1HB   ALA  14          1HB       ALA  14   2.122  -9.627  12.942
  116   2HB   ALA  14          2HB       ALA  14   2.411  -8.757  14.468
  117   3HB   ALA  14          3HB       ALA  14   2.292 -10.533  14.465
  118    H    ALA  15           HN       ALA  15  -0.499  -7.249  15.112
  119    HA   ALA  15           HA       ALA  15  -0.104  -7.904  17.899
  120   1HB   ALA  15          1HB       ALA  15  -1.347  -5.446  17.797
  121   2HB   ALA  15          2HB       ALA  15   0.413  -5.702  17.734
  122   3HB   ALA  15          3HB       ALA  15  -0.511  -5.502  16.226
  123    H    LYS  16           HN       LYS  16  -2.649  -7.869  15.458
  124    HA   LYS  16           HA       LYS  16  -4.876  -7.538  17.049
  125   1HB   LYS  16          2HB       LYS  16  -4.252  -8.449  14.377
  126   2HB   LYS  16          3HB       LYS  16  -5.511  -9.453  15.068
  127   1HG   LYS  16          2HG       LYS  16  -6.722  -7.655  14.118
  128   2HG   LYS  16          3HG       LYS  16  -6.639  -7.223  15.814
  129   1HD   LYS  16          2HD       LYS  16  -4.492  -5.892  15.213
  130   2HD   LYS  16          3HD       LYS  16  -4.942  -6.123  13.536
  131   1HE   LYS  16          2HE       LYS  16  -6.109  -4.168  13.837
  132   2HE   LYS  16          3HE       LYS  16  -7.331  -5.223  14.518
  133   1HZ   LYS  16          1HZ       LYS  16  -5.521  -3.434  15.864
  134   2HZ   LYS  16          2HZ       LYS  16  -7.056  -3.844  16.243
  135   3HZ   LYS  16          3HZ       LYS  16  -5.824  -4.844  16.630
  136    H    GLU  17           HN       GLU  17  -3.517 -10.728  15.944
  137    HA   GLU  17           HA       GLU  17  -4.496 -11.778  18.485
  138   1HB   GLU  17          2HB       GLU  17  -4.477 -13.005  15.709
  139   2HB   GLU  17          3HB       GLU  17  -4.576 -14.015  17.138
  140   1HG   GLU  17          2HG       GLU  17  -6.477 -11.981  17.608
  141   2HG   GLU  17          3HG       GLU  17  -6.648 -12.335  15.900
  142    H    GLY  18           HN       GLY  18  -3.007 -12.797  19.796
  143   1HA   GLY  18          1HA       GLY  18  -1.070 -13.718  20.480
  144   2HA   GLY  18          2HA       GLY  18  -0.721 -14.148  18.818
  145    H    ASP  19           HN       ASP  19   1.483 -13.471  20.122
  146    HA   ASP  19           HA       ASP  19   2.045 -10.825  20.494
  147   1HB   ASP  19          2HB       ASP  19   3.419 -13.098  20.871
  148   2HB   ASP  19          3HB       ASP  19   4.135 -12.672  19.330
  149    HA   PRO  20           HA       PRO  20   2.343  -9.393  16.351
  150   1HB   PRO  20          2HB       PRO  20   3.661  -7.032  16.746
  151   2HB   PRO  20          3HB       PRO  20   1.936  -7.219  16.992
  152   1HG   PRO  20          2HG       PRO  20   4.084  -7.013  19.012
  153   2HG   PRO  20          3HG       PRO  20   2.360  -6.774  19.215
  154   1HD   PRO  20          2HD       PRO  20   3.879  -9.075  20.006
  155   2HD   PRO  20          3HD       PRO  20   2.140  -8.884  20.102
  156    H    ASN  21           HN       ASN  21   4.860 -10.581  18.074
  157    HA   ASN  21           HA       ASN  21   6.787  -9.931  16.032
  158   1HB   ASN  21          2HB       ASN  21   6.912 -11.340  18.732
  159   2HB   ASN  21          3HB       ASN  21   8.260 -11.448  17.617
  160   1HD2  ASN  21          1HD2      ASN  21   7.078  -9.825  20.181
  161   2HD2  ASN  21          2HD2      ASN  21   7.869  -8.292  20.024
  162    H    GLN  22           HN       GLN  22   4.271 -12.045  16.307
  163    HA   GLN  22           HA       GLN  22   5.566 -13.953  14.600
  164   1HB   GLN  22          2HB       GLN  22   4.257 -15.765  16.143
  165   2HB   GLN  22          3HB       GLN  22   5.948 -15.364  16.361
  166   1HG   GLN  22          2HG       GLN  22   5.338 -13.656  18.072
  167   2HG   GLN  22          3HG       GLN  22   3.639 -14.012  17.836
  168   1HE2  GLN  22          1HE2      GLN  22   3.151 -14.777  19.802
  169   2HE2  GLN  22          2HE2      GLN  22   3.799 -16.219  20.509
  170    H    LEU  23           HN       LEU  23   4.194 -14.460  12.932
  171    HA   LEU  23           HA       LEU  23   1.471 -13.496  13.152
  172   1HB   LEU  23          2HB       LEU  23   3.235 -14.405  10.895
  173   2HB   LEU  23          3HB       LEU  23   1.505 -14.229  10.677
  174    HG   LEU  23           HG       LEU  23   3.067 -12.279  10.019
  175   1HD1  LEU  23          1HD1      LEU  23   0.933 -11.185  11.755
  176   2HD1  LEU  23          2HD1      LEU  23   1.258 -10.934  10.023
  177   3HD1  LEU  23          3HD1      LEU  23   0.427 -12.411  10.568
  178   1HD2  LEU  23          1HD2      LEU  23   3.002 -11.930  13.026
  179   2HD2  LEU  23          2HD2      LEU  23   4.429 -12.121  11.979
  180   3HD2  LEU  23          3HD2      LEU  23   3.440 -10.644  11.876
  181    H    SER  24           HN       SER  24  -0.347 -14.896  12.333
  182    HA   SER  24           HA       SER  24   0.208 -17.697  12.898
  183   1HB   SER  24          2HB       SER  24  -2.198 -16.107  13.896
  184   2HB   SER  24          3HB       SER  24  -1.989 -17.836  14.090
  185    HG   SER  24           HG       SER  24  -1.030 -17.284  15.928
  186    H    LYS  25           HN       LYS  25  -1.575 -19.168  11.993
  187    HA   LYS  25           HA       LYS  25  -1.973 -18.649   9.315
  188   1HB   LYS  25          2HB       LYS  25  -2.002 -20.878  10.422
  189   2HB   LYS  25          3HB       LYS  25  -3.571 -20.504  11.105
  190   1HG   LYS  25          2HG       LYS  25  -4.116 -19.927   8.508
  191   2HG   LYS  25          3HG       LYS  25  -2.829 -21.088   8.251
  192   1HD   LYS  25          2HD       LYS  25  -4.528 -22.624   8.409
  193   2HD   LYS  25          3HD       LYS  25  -4.270 -22.443  10.133
  194   1HE   LYS  25          2HE       LYS  25  -6.014 -20.585  10.133
  195   2HE   LYS  25          3HE       LYS  25  -6.336 -20.949   8.449
  196   1HZ   LYS  25          1HZ       LYS  25  -6.464 -23.031  10.502
  197   2HZ   LYS  25          2HZ       LYS  25  -7.750 -22.081  10.168
  198   3HZ   LYS  25          3HZ       LYS  25  -7.122 -23.043   9.007
  199    H    GLU  26           HN       GLU  26  -4.430 -18.497  11.995
  200    HA   GLU  26           HA       GLU  26  -6.445 -17.500  10.434
  201   1HB   GLU  26          2HB       GLU  26  -5.949 -17.978  13.222
  202   2HB   GLU  26          3HB       GLU  26  -6.629 -16.369  13.087
  203   1HG   GLU  26          2HG       GLU  26  -8.220 -17.815  11.317
  204   2HG   GLU  26          3HG       GLU  26  -7.897 -19.002  12.566
  205    H    GLU  27           HN       GLU  27  -3.744 -15.831  12.107
  206    HA   GLU  27           HA       GLU  27  -4.742 -13.259  11.775
  207   1HB   GLU  27          2HB       GLU  27  -2.229 -14.535  12.611
  208   2HB   GLU  27          3HB       GLU  27  -1.941 -13.037  11.748
  209   1HG   GLU  27          2HG       GLU  27  -4.123 -12.478  13.479
  210   2HG   GLU  27          3HG       GLU  27  -3.018 -13.439  14.441
  211    H    LEU  28           HN       LEU  28  -2.156 -15.016   9.903
  212    HA   LEU  28           HA       LEU  28  -1.797 -13.123   7.955
  213   1HB   LEU  28          2HB       LEU  28  -0.555 -15.318   8.489
  214   2HB   LEU  28          3HB       LEU  28  -1.704 -16.076   7.404
  215    HG   LEU  28           HG       LEU  28  -0.744 -15.220   5.542
  216   1HD1  LEU  28          1HD1      LEU  28   0.058 -12.748   7.101
  217   2HD1  LEU  28          2HD1      LEU  28   0.322 -13.009   5.360
  218   3HD1  LEU  28          3HD1      LEU  28  -1.334 -12.910   6.004
  219   1HD2  LEU  28          1HD2      LEU  28   1.054 -16.407   6.643
  220   2HD2  LEU  28          2HD2      LEU  28   1.708 -15.010   5.755
  221   3HD2  LEU  28          3HD2      LEU  28   1.530 -14.935   7.525
  222    H    LYS  29           HN       LYS  29  -4.243 -15.770   8.143
  223    HA   LYS  29           HA       LYS  29  -5.337 -15.656   5.686
  224   1HB   LYS  29          2HB       LYS  29  -6.028 -17.174   7.499
  225   2HB   LYS  29          3HB       LYS  29  -6.825 -15.848   8.322
  226   1HG   LYS  29          2HG       LYS  29  -8.506 -15.646   6.659
  227   2HG   LYS  29          3HG       LYS  29  -7.538 -16.447   5.438
  228   1HD   LYS  29          2HD       LYS  29  -7.857 -18.615   6.457
  229   2HD   LYS  29          3HD       LYS  29  -8.488 -17.913   7.933
  230   1HE   LYS  29          2HE       LYS  29 -10.600 -17.876   7.095
  231   2HE   LYS  29          3HE       LYS  29 -10.080 -16.992   5.675
  232   1HZ   LYS  29          1HZ       LYS  29  -9.687 -19.884   5.967
  233   2HZ   LYS  29          2HZ       LYS  29 -11.006 -19.234   5.258
  234   3HZ   LYS  29          3HZ       LYS  29  -9.528 -18.993   4.607
  235    H    LEU  30           HN       LEU  30  -6.199 -13.468   8.455
  236    HA   LEU  30           HA       LEU  30  -8.014 -11.918   7.078
  237   1HB   LEU  30          2HB       LEU  30  -6.123 -11.098   9.288
  238   2HB   LEU  30          3HB       LEU  30  -7.557 -10.222   8.791
  239    HG   LEU  30           HG       LEU  30  -7.367 -12.868  10.218
  240   1HD1  LEU  30          1HD1      LEU  30  -7.596 -10.353  11.188
  241   2HD1  LEU  30          2HD1      LEU  30  -9.313 -10.788  11.014
  242   3HD1  LEU  30          3HD1      LEU  30  -8.233 -11.801  12.002
  243   1HD2  LEU  30          1HD2      LEU  30  -9.820 -13.110   9.954
  244   2HD2  LEU  30          2HD2      LEU  30  -9.796 -11.778   8.773
  245   3HD2  LEU  30          3HD2      LEU  30  -8.925 -13.291   8.426
  246    H    LEU  31           HN       LEU  31  -4.469 -11.289   7.586
  247    HA   LEU  31           HA       LEU  31  -4.296  -9.014   6.079
  248   1HB   LEU  31          2HB       LEU  31  -2.584 -10.334   7.544
  249   2HB   LEU  31          3HB       LEU  31  -2.129 -11.083   6.026
  250    HG   LEU  31           HG       LEU  31  -2.149  -8.354   5.439
  251   1HD1  LEU  31          1HD1      LEU  31  -1.427  -8.812   8.291
  252   2HD1  LEU  31          2HD1      LEU  31  -0.398  -7.709   7.346
  253   3HD1  LEU  31          3HD1      LEU  31  -2.143  -7.390   7.496
  254   1HD2  LEU  31          1HD2      LEU  31  -0.500 -10.455   5.052
  255   2HD2  LEU  31          2HD2      LEU  31  -0.046  -8.764   4.732
  256   3HD2  LEU  31          3HD2      LEU  31   0.438  -9.542   6.258
  257    H    LEU  32           HN       LEU  32  -3.514 -12.365   4.894
  258    HA   LEU  32           HA       LEU  32  -3.256 -11.708   2.250
  259   1HB   LEU  32          2HB       LEU  32  -4.361 -14.264   3.424
  260   2HB   LEU  32          3HB       LEU  32  -3.723 -14.069   1.804
  261    HG   LEU  32           HG       LEU  32  -2.121 -13.696   4.350
  262   1HD1  LEU  32          1HD1      LEU  32  -1.020 -15.837   3.662
  263   2HD1  LEU  32          2HD1      LEU  32  -2.713 -16.005   4.185
  264   3HD1  LEU  32          3HD1      LEU  32  -2.309 -16.047   2.452
  265   1HD2  LEU  32          1HD2      LEU  32  -0.173 -13.576   2.949
  266   2HD2  LEU  32          2HD2      LEU  32  -1.146 -13.873   1.488
  267   3HD2  LEU  32          3HD2      LEU  32  -1.349 -12.358   2.399
  268    H    GLN  33           HN       GLN  33  -6.115 -11.704   4.248
  269    HA   GLN  33           HA       GLN  33  -7.958 -12.140   2.175
  270   1HB   GLN  33          2HB       GLN  33  -8.083 -12.000   4.928
  271   2HB   GLN  33          3HB       GLN  33  -8.835 -10.481   4.483
  272   1HG   GLN  33          2HG       GLN  33 -10.257 -11.879   2.802
  273   2HG   GLN  33          3HG       GLN  33  -9.683 -13.289   3.670
  274   1HE2  GLN  33          1HE2      GLN  33 -10.472 -13.799   5.631
  275   2HE2  GLN  33          2HE2      GLN  33 -11.735 -12.945   6.452
  276    H    THR  34           HN       THR  34  -6.844  -9.136   3.900
  277    HA   THR  34           HA       THR  34  -8.084  -7.529   1.805
  278    HB   THR  34           HB       THR  34  -7.247  -7.220   4.647
  279    HG1  THR  34           HG1      THR  34  -9.060  -5.971   2.704
  280   1HG2  THR  34          1HG2      THR  34  -5.716  -5.525   3.878
  281   2HG2  THR  34          2HG2      THR  34  -6.805  -5.040   2.556
  282   3HG2  THR  34          3HG2      THR  34  -7.221  -4.648   4.242
  283    H    GLU  35           HN       GLU  35  -4.834  -8.033   3.323
  284    HA   GLU  35           HA       GLU  35  -3.425  -6.308   1.821
  285   1HB   GLU  35          2HB       GLU  35  -2.386  -7.552   3.617
  286   2HB   GLU  35          3HB       GLU  35  -2.677  -9.084   2.819
  287   1HG   GLU  35          2HG       GLU  35  -0.631  -8.907   1.860
  288   2HG   GLU  35          3HG       GLU  35  -1.240  -7.565   0.913
  289    H    PHE  36           HN       PHE  36  -3.975  -9.813   0.993
  290    HA   PHE  36           HA       PHE  36  -4.137  -9.072  -1.794
  291   1HB   PHE  36          2HB       PHE  36  -2.012 -10.882  -0.509
  292   2HB   PHE  36          3HB       PHE  36  -2.373 -10.964  -2.222
  293    HD1  PHE  36           HD1      PHE  36  -2.406  -8.471  -3.345
  294    HD2  PHE  36           HD2      PHE  36  -0.152  -9.657   0.049
  295    HE1  PHE  36           HE1      PHE  36  -0.776  -6.613  -3.779
  296    HE2  PHE  36           HE2      PHE  36   1.478  -7.798  -0.385
  297    HZ   PHE  36           HZ       PHE  36   1.147  -6.299  -2.294
  298    HA   PRO  37           HA       PRO  37  -6.925 -12.413  -0.758
  299   1HB   PRO  37          2HB       PRO  37  -9.050 -11.517  -2.225
  300   2HB   PRO  37          3HB       PRO  37  -8.809 -11.107  -0.538
  301   1HG   PRO  37          2HG       PRO  37  -8.384  -9.426  -2.932
  302   2HG   PRO  37          3HG       PRO  37  -8.563  -8.931  -1.260
  303   1HD   PRO  37          2HD       PRO  37  -6.120  -9.071  -2.757
  304   2HD   PRO  37          3HD       PRO  37  -6.286  -8.688  -1.055
  305    H    SER  38           HN       SER  38  -5.627 -11.221  -3.649
  306    HA   SER  38           HA       SER  38  -6.757 -13.154  -5.330
  307   1HB   SER  38          2HB       SER  38  -5.042 -10.905  -5.577
  308   2HB   SER  38          3HB       SER  38  -4.119 -12.256  -6.202
  309    HG   SER  38           HG       SER  38  -5.477 -12.481  -7.879
  310    H    LEU  39           HN       LEU  39  -3.923 -13.035  -3.170
  311    HA   LEU  39           HA       LEU  39  -2.636 -15.310  -4.251
  312   1HB   LEU  39          2HB       LEU  39  -2.152 -13.333  -2.279
  313   2HB   LEU  39          3HB       LEU  39  -2.016 -14.890  -1.486
  314    HG   LEU  39           HG       LEU  39  -0.471 -13.962  -3.922
  315   1HD1  LEU  39          1HD1      LEU  39   1.486 -14.280  -2.354
  316   2HD1  LEU  39          2HD1      LEU  39   0.410 -12.910  -1.992
  317   3HD1  LEU  39          3HD1      LEU  39   0.300 -14.405  -1.033
  318   1HD2  LEU  39          1HD2      LEU  39  -1.204 -16.552  -3.457
  319   2HD2  LEU  39          2HD2      LEU  39   0.256 -16.041  -4.337
  320   3HD2  LEU  39          3HD2      LEU  39   0.359 -16.463  -2.611
  321    H    LEU  40           HN       LEU  40  -5.451 -14.820  -2.265
  322    HA   LEU  40           HA       LEU  40  -5.300 -17.329  -0.918
  323   1HB   LEU  40          2HB       LEU  40  -7.525 -15.327  -1.311
  324   2HB   LEU  40          3HB       LEU  40  -7.684 -16.787  -0.354
  325    HG   LEU  40           HG       LEU  40  -5.686 -14.573   0.189
  326   1HD1  LEU  40          1HD1      LEU  40  -7.664 -13.537   0.730
  327   2HD1  LEU  40          2HD1      LEU  40  -8.475 -15.060   1.167
  328   3HD1  LEU  40          3HD1      LEU  40  -7.275 -14.343   2.268
  329   1HD2  LEU  40          1HD2      LEU  40  -6.443 -16.989   1.857
  330   2HD2  LEU  40          2HD2      LEU  40  -4.920 -16.766   0.961
  331   3HD2  LEU  40          3HD2      LEU  40  -5.315 -15.694   2.327
  332    H    LYS  41           HN       LYS  41  -6.442 -16.141  -4.047
  333    HA   LYS  41           HA       LYS  41  -8.148 -18.340  -4.575
  334   1HB   LYS  41          2HB       LYS  41  -8.582 -17.289  -6.550
  335   2HB   LYS  41          3HB       LYS  41  -7.963 -15.925  -5.642
  336   1HG   LYS  41          2HG       LYS  41  -6.646 -15.720  -7.540
  337   2HG   LYS  41          3HG       LYS  41  -5.606 -16.772  -6.602
  338   1HD   LYS  41          2HD       LYS  41  -7.178 -18.658  -7.805
  339   2HD   LYS  41          3HD       LYS  41  -7.259 -17.399  -9.022
  340   1HE   LYS  41          2HE       LYS  41  -4.524 -17.901  -7.942
  341   2HE   LYS  41          3HE       LYS  41  -5.217 -19.248  -8.822
  342   1HZ   LYS  41          1HZ       LYS  41  -5.544 -16.674 -10.057
  343   2HZ   LYS  41          2HZ       LYS  41  -4.006 -17.217  -9.982
  344   3HZ   LYS  41          3HZ       LYS  41  -5.152 -18.111 -10.728
  345    H    GLY  42           HN       GLY  42  -4.667 -17.664  -4.945
  346   1HA   GLY  42          1HA       GLY  42  -3.794 -19.443  -6.762
  347   2HA   GLY  42          2HA       GLY  42  -2.969 -19.131  -5.248
  348    H    MET  43           HN       MET  43  -2.765 -21.648  -6.463
  349    HA   MET  43           HA       MET  43  -4.733 -23.400  -5.459
  350   1HB   MET  43          2HB       MET  43  -1.872 -23.881  -6.466
  351   2HB   MET  43          3HB       MET  43  -3.047 -25.155  -6.204
  352   1HG   MET  43          2HG       MET  43  -4.442 -24.414  -7.995
  353   2HG   MET  43          3HG       MET  43  -3.728 -22.814  -8.017
  354   1HE   MET  43          1HE       MET  43  -4.231 -25.738  -9.650
  355   2HE   MET  43          2HE       MET  43  -2.855 -26.077 -10.726
  356   3HE   MET  43          3HE       MET  43  -2.873 -26.732  -9.071
  357    H    SER  44           HN       SER  44  -2.424 -21.597  -3.853
  358    HA   SER  44           HA       SER  44  -1.692 -23.701  -2.022
  359   1HB   SER  44          2HB       SER  44  -0.856 -20.803  -2.367
  360   2HB   SER  44          3HB       SER  44  -0.434 -21.690  -0.916
  361    HG   SER  44           HG       SER  44   1.084 -22.758  -1.990
  362    H    THR  45           HN       THR  45  -3.475 -24.209  -0.731
  363    HA   THR  45           HA       THR  45  -5.362 -22.303   0.126
  364    HB   THR  45           HB       THR  45  -6.142 -24.207   1.527
  365    HG1  THR  45           HG1      THR  45  -3.790 -25.596   0.532
  366   1HG2  THR  45          1HG2      THR  45  -6.396 -24.352  -1.049
  367   2HG2  THR  45          2HG2      THR  45  -4.952 -25.392  -1.025
  368   3HG2  THR  45          3HG2      THR  45  -6.430 -25.902  -0.175
  369    H    LEU  46           HN       LEU  46  -5.855 -22.015   2.577
  370    HA   LEU  46           HA       LEU  46  -3.949 -20.348   3.612
  371   1HB   LEU  46          2HB       LEU  46  -6.486 -20.913   4.193
  372   2HB   LEU  46          3HB       LEU  46  -5.730 -21.828   5.483
  373    HG   LEU  46           HG       LEU  46  -6.085 -19.825   6.532
  374   1HD1  LEU  46          1HD1      LEU  46  -3.405 -19.217   5.263
  375   2HD1  LEU  46          2HD1      LEU  46  -4.005 -18.699   6.857
  376   3HD1  LEU  46          3HD1      LEU  46  -3.651 -20.417   6.555
  377   1HD2  LEU  46          1HD2      LEU  46  -7.055 -18.663   4.627
  378   2HD2  LEU  46          2HD2      LEU  46  -5.912 -17.607   5.491
  379   3HD2  LEU  46          3HD2      LEU  46  -5.433 -18.368   3.955
  380    H    ASP  47           HN       ASP  47  -4.697 -23.688   4.851
  381    HA   ASP  47           HA       ASP  47  -2.678 -23.899   6.589
  382   1HB   ASP  47          2HB       ASP  47  -4.107 -25.846   4.800
  383   2HB   ASP  47          3HB       ASP  47  -2.666 -26.437   5.603
  384    H    GLU  48           HN       GLU  48  -2.634 -24.633   3.029
  385    HA   GLU  48           HA       GLU  48  -0.079 -25.584   2.870
  386   1HB   GLU  48          2HB       GLU  48  -2.138 -24.630   1.051
  387   2HB   GLU  48          3HB       GLU  48  -0.567 -24.091   0.491
  388   1HG   GLU  48          2HG       GLU  48   0.107 -26.638   1.090
  389   2HG   GLU  48          3HG       GLU  48  -1.606 -26.899   0.828
  390    H    LEU  49           HN       LEU  49  -1.288 -22.181   2.661
  391    HA   LEU  49           HA       LEU  49   1.233 -21.059   2.125
  392   1HB   LEU  49          2HB       LEU  49  -1.368 -20.207   2.145
  393   2HB   LEU  49          3HB       LEU  49  -0.722 -19.400   3.560
  394    HG   LEU  49           HG       LEU  49   1.148 -19.078   1.410
  395   1HD1  LEU  49          1HD1      LEU  49  -0.837 -19.559  -0.028
  396   2HD1  LEU  49          2HD1      LEU  49  -1.638 -18.138   0.686
  397   3HD1  LEU  49          3HD1      LEU  49  -0.141 -17.936  -0.255
  398   1HD2  LEU  49          1HD2      LEU  49  -0.067 -17.574   3.497
  399   2HD2  LEU  49          2HD2      LEU  49   1.358 -17.167   2.511
  400   3HD2  LEU  49          3HD2      LEU  49  -0.264 -16.665   1.980
  401    H    PHE  50           HN       PHE  50  -0.572 -21.810   5.144
  402    HA   PHE  50           HA       PHE  50   1.112 -20.474   6.896
  403   1HB   PHE  50          2HB       PHE  50  -1.185 -21.612   7.258
  404   2HB   PHE  50          3HB       PHE  50  -0.358 -23.157   7.232
  405    HD1  PHE  50           HD1      PHE  50  -0.220 -24.077   9.331
  406    HD2  PHE  50           HD2      PHE  50   0.304 -19.885   8.924
  407    HE1  PHE  50           HE1      PHE  50   0.207 -23.890  11.797
  408    HE2  PHE  50           HE2      PHE  50   0.730 -19.699  11.391
  409    HZ   PHE  50           HZ       PHE  50   0.676 -21.704  12.798
  410    H    GLU  51           HN       GLU  51   1.155 -23.942   5.808
  411    HA   GLU  51           HA       GLU  51   3.455 -24.525   7.292
  412   1HB   GLU  51          2HB       GLU  51   1.644 -25.898   5.451
  413   2HB   GLU  51          3HB       GLU  51   3.305 -26.367   5.149
  414   1HG   GLU  51          2HG       GLU  51   3.381 -26.532   7.835
  415   2HG   GLU  51          3HG       GLU  51   1.651 -26.736   7.644
  416    H    GLU  52           HN       GLU  52   2.846 -23.369   3.958
  417    HA   GLU  52           HA       GLU  52   5.410 -23.850   2.998
  418   1HB   GLU  52          2HB       GLU  52   3.392 -23.367   1.592
  419   2HB   GLU  52          3HB       GLU  52   3.417 -21.703   2.143
  420   1HG   GLU  52          2HG       GLU  52   6.070 -22.387   1.209
  421   2HG   GLU  52          3HG       GLU  52   4.916 -22.884  -0.012
  422    H    LEU  53           HN       LEU  53   3.873 -20.817   4.292
  423    HA   LEU  53           HA       LEU  53   6.158 -19.248   4.118
  424   1HB   LEU  53          2HB       LEU  53   3.887 -19.030   6.097
  425   2HB   LEU  53          3HB       LEU  53   5.011 -17.761   5.656
  426    HG   LEU  53           HG       LEU  53   3.415 -19.007   3.461
  427   1HD1  LEU  53          1HD1      LEU  53   1.426 -18.578   4.341
  428   2HD1  LEU  53          2HD1      LEU  53   2.176 -17.913   5.812
  429   3HD1  LEU  53          3HD1      LEU  53   1.860 -16.854   4.417
  430   1HD2  LEU  53          1HD2      LEU  53   3.322 -16.420   2.944
  431   2HD2  LEU  53          2HD2      LEU  53   4.709 -16.379   4.058
  432   3HD2  LEU  53          3HD2      LEU  53   4.775 -17.386   2.592
  433    H    ASP  54           HN       ASP  54   4.829 -21.136   6.920
  434    HA   ASP  54           HA       ASP  54   6.959 -20.501   8.585
  435   1HB   ASP  54          2HB       ASP  54   4.694 -21.443   9.257
  436   2HB   ASP  54          3HB       ASP  54   5.203 -23.000   8.633
  437    H    LYS  55           HN       LYS  55   9.077 -21.043   7.975
  438    HA   LYS  55           HA       LYS  55   9.486 -23.791   7.016
  439   1HB   LYS  55          2HB       LYS  55   9.856 -21.770   5.402
  440   2HB   LYS  55          3HB       LYS  55  11.325 -21.511   6.320
  441   1HG   LYS  55          2HG       LYS  55  12.282 -23.058   4.950
  442   2HG   LYS  55          3HG       LYS  55  11.403 -24.259   5.876
  443   1HD   LYS  55          2HD       LYS  55   9.624 -23.075   3.898
  444   2HD   LYS  55          3HD       LYS  55  11.091 -23.619   3.108
  445   1HE   LYS  55          2HE       LYS  55  10.607 -25.765   4.759
  446   2HE   LYS  55          3HE       LYS  55   8.967 -25.218   4.477
  447   1HZ   LYS  55          1HZ       LYS  55   9.688 -25.161   2.051
  448   2HZ   LYS  55          2HZ       LYS  55  10.933 -26.111   2.515
  449   3HZ   LYS  55          3HZ       LYS  55   9.395 -26.618   2.728
  450    H    ASN  56           HN       ASN  56   9.780 -21.695   9.614
  451    HA   ASN  56           HA       ASN  56  12.369 -22.692  10.400
  452   1HB   ASN  56          2HB       ASN  56  10.461 -20.857  11.940
  453   2HB   ASN  56          3HB       ASN  56  12.160 -21.110  12.285
  454   1HD2  ASN  56          1HD2      ASN  56  13.746 -20.290  10.906
  455   2HD2  ASN  56          2HD2      ASN  56  13.438 -19.003   9.788
  456    H    GLY  57           HN       GLY  57   9.300 -23.898  10.331
  457   1HA   GLY  57          1HA       GLY  57   8.007 -25.221  11.645
  458   2HA   GLY  57          2HA       GLY  57   9.536 -26.028  11.933
  459    H    ASP  58           HN       ASP  58   7.667 -23.120  13.063
  460    HA   ASP  58           HA       ASP  58   8.444 -23.896  15.755
  461   1HB   ASP  58          2HB       ASP  58   8.303 -21.229  16.091
  462   2HB   ASP  58          3HB       ASP  58   9.799 -22.029  15.649
  463    H    GLY  59           HN       GLY  59   6.446 -21.525  13.823
  464   1HA   GLY  59          1HA       GLY  59   3.992 -22.100  13.919
  465   2HA   GLY  59          2HA       GLY  59   4.189 -22.040  15.659
  466    H    GLU  60           HN       GLU  60   5.719 -19.934  13.143
  467    HA   GLU  60           HA       GLU  60   3.943 -17.804  13.698
  468   1HB   GLU  60          2HB       GLU  60   5.781 -16.260  14.575
  469   2HB   GLU  60          3HB       GLU  60   5.200 -17.467  15.705
  470   1HG   GLU  60          2HG       GLU  60   7.404 -18.525  14.079
  471   2HG   GLU  60          3HG       GLU  60   7.880 -17.051  14.898
  472    H    VAL  61           HN       VAL  61   3.796 -16.630  11.827
  473    HA   VAL  61           HA       VAL  61   5.928 -17.030   9.872
  474    HB   VAL  61           HB       VAL  61   3.064 -16.090   9.677
  475   1HG1  VAL  61          1HG1      VAL  61   3.507 -15.100   7.730
  476   2HG1  VAL  61          2HG1      VAL  61   5.239 -15.448   7.943
  477   3HG1  VAL  61          3HG1      VAL  61   4.193 -16.618   7.103
  478   1HG2  VAL  61          1HG2      VAL  61   4.222 -18.453   8.230
  479   2HG2  VAL  61          2HG2      VAL  61   3.801 -18.602   9.953
  480   3HG2  VAL  61          3HG2      VAL  61   2.552 -18.152   8.767
  481    H    SER  62           HN       SER  62   7.041 -15.506  11.686
  482    HA   SER  62           HA       SER  62   6.417 -12.897  11.921
  483   1HB   SER  62          2HB       SER  62   9.298 -13.179  11.583
  484   2HB   SER  62          3HB       SER  62   8.383 -12.850  13.041
  485    HG   SER  62           HG       SER  62   9.007 -15.426  11.890
  486    H    PHE  63           HN       PHE  63   7.705 -10.955  10.921
  487    HA   PHE  63           HA       PHE  63   7.033 -10.652   8.308
  488   1HB   PHE  63          2HB       PHE  63   7.828  -8.942  10.062
  489   2HB   PHE  63          3HB       PHE  63   9.468  -9.501   9.799
  490    HD1  PHE  63           HD1      PHE  63  10.644  -8.974   7.720
  491    HD2  PHE  63           HD2      PHE  63   6.711  -7.547   8.429
  492    HE1  PHE  63           HE1      PHE  63  10.908  -7.319   5.852
  493    HE2  PHE  63           HE2      PHE  63   6.975  -5.892   6.560
  494    HZ   PHE  63           HZ       PHE  63   9.070  -5.797   5.294
  495    H    GLU  64           HN       GLU  64   9.941 -12.188   9.680
  496    HA   GLU  64           HA       GLU  64  11.592 -12.048   7.514
  497   1HB   GLU  64          2HB       GLU  64  12.390 -14.393   8.472
  498   2HB   GLU  64          3HB       GLU  64  12.631 -12.923   9.396
  499   1HG   GLU  64          2HG       GLU  64  11.220 -13.610  11.046
  500   2HG   GLU  64          3HG       GLU  64   9.968 -14.047   9.901
  501    H    GLU  65           HN       GLU  65   9.183 -14.643   8.340
  502    HA   GLU  65           HA       GLU  65   9.661 -16.054   5.973
  503   1HB   GLU  65          2HB       GLU  65   7.257 -16.094   7.851
  504   2HB   GLU  65          3HB       GLU  65   7.558 -17.280   6.597
  505   1HG   GLU  65          2HG       GLU  65   9.247 -18.313   7.780
  506   2HG   GLU  65          3HG       GLU  65   9.863 -16.805   8.427
  507    H    PHE  66           HN       PHE  66   7.605 -13.305   6.840
  508    HA   PHE  66           HA       PHE  66   5.706 -13.489   4.835
  509   1HB   PHE  66          2HB       PHE  66   6.063 -11.887   6.916
  510   2HB   PHE  66          3HB       PHE  66   7.066 -10.932   5.842
  511    HD1  PHE  66           HD1      PHE  66   3.756 -12.629   5.445
  512    HD2  PHE  66           HD2      PHE  66   5.976  -9.022   5.177
  513    HE1  PHE  66           HE1      PHE  66   1.715 -11.436   4.600
  514    HE2  PHE  66           HE2      PHE  66   3.935  -7.829   4.333
  515    HZ   PHE  66           HZ       PHE  66   1.830  -9.050   4.054
  516    H    GLN  67           HN       GLN  67   9.072 -12.248   4.800
  517    HA   GLN  67           HA       GLN  67   8.907 -10.908   2.393
  518   1HB   GLN  67          2HB       GLN  67  11.338 -12.362   3.523
  519   2HB   GLN  67          3HB       GLN  67  11.362 -11.036   2.377
  520   1HG   GLN  67          2HG       GLN  67   9.988  -9.747   4.249
  521   2HG   GLN  67          3HG       GLN  67  10.629 -10.979   5.318
  522   1HE2  GLN  67          1HE2      GLN  67  11.149  -8.010   3.925
  523   2HE2  GLN  67          2HE2      GLN  67  12.850  -7.822   4.189
  524    H    VAL  68           HN       VAL  68   8.626 -14.262   3.075
  525    HA   VAL  68           HA       VAL  68   9.794 -15.204   0.636
  526    HB   VAL  68           HB       VAL  68   7.941 -16.580   2.590
  527   1HG1  VAL  68          1HG1      VAL  68   9.805 -17.611   0.433
  528   2HG1  VAL  68          2HG1      VAL  68   9.129 -18.638   1.720
  529   3HG1  VAL  68          3HG1      VAL  68   8.044 -17.833   0.561
  530   1HG2  VAL  68          1HG2      VAL  68  10.370 -15.518   3.243
  531   2HG2  VAL  68          2HG2      VAL  68   9.651 -16.950   4.017
  532   3HG2  VAL  68          3HG2      VAL  68  10.840 -17.149   2.707
  533    H    LEU  69           HN       LEU  69   6.558 -14.270   1.852
  534    HA   LEU  69           HA       LEU  69   5.228 -15.253  -0.478
  535   1HB   LEU  69          2HB       LEU  69   4.417 -14.811   2.006
  536   2HB   LEU  69          3HB       LEU  69   4.022 -13.233   1.354
  537    HG   LEU  69           HG       LEU  69   2.610 -14.304  -0.374
  538   1HD1  LEU  69          1HD1      LEU  69   3.383 -16.418  -0.809
  539   2HD1  LEU  69          2HD1      LEU  69   3.650 -16.800   0.909
  540   3HD1  LEU  69          3HD1      LEU  69   1.998 -16.787   0.246
  541   1HD2  LEU  69          1HD2      LEU  69   0.754 -14.773   1.039
  542   2HD2  LEU  69          2HD2      LEU  69   1.814 -15.226   2.395
  543   3HD2  LEU  69          3HD2      LEU  69   1.735 -13.532   1.854
  544    H    VAL  70           HN       VAL  70   6.769 -12.231   0.581
  545    HA   VAL  70           HA       VAL  70   5.601 -10.426  -1.107
  546    HB   VAL  70           HB       VAL  70   8.302 -10.762   0.118
  547   1HG1  VAL  70          1HG1      VAL  70   8.639  -8.298  -0.848
  548   2HG1  VAL  70          2HG1      VAL  70   9.190  -9.743  -1.730
  549   3HG1  VAL  70          3HG1      VAL  70   7.656  -8.959  -2.177
  550   1HG2  VAL  70          1HG2      VAL  70   6.159  -9.864   1.255
  551   2HG2  VAL  70          2HG2      VAL  70   7.673  -8.953   1.466
  552   3HG2  VAL  70          3HG2      VAL  70   6.448  -8.387   0.305
  553    H    LYS  71           HN       LYS  71   7.615 -13.197  -1.866
  554    HA   LYS  71           HA       LYS  71   8.518 -12.255  -4.381
  555   1HB   LYS  71          2HB       LYS  71   9.138 -14.355  -2.711
  556   2HB   LYS  71          3HB       LYS  71   8.290 -15.168  -4.011
  557   1HG   LYS  71          2HG       LYS  71   9.858 -13.499  -5.495
  558   2HG   LYS  71          3HG       LYS  71  10.882 -13.660  -4.082
  559   1HD   LYS  71          2HD       LYS  71   9.677 -16.170  -5.247
  560   2HD   LYS  71          3HD       LYS  71  11.002 -15.417  -6.112
  561   1HE   LYS  71          2HE       LYS  71  11.657 -15.490  -3.283
  562   2HE   LYS  71          3HE       LYS  71  11.146 -17.090  -3.786
  563   1HZ   LYS  71          1HZ       LYS  71  13.174 -17.272  -4.603
  564   2HZ   LYS  71          2HZ       LYS  71  12.742 -16.245  -5.797
  565   3HZ   LYS  71          3HZ       LYS  71  13.501 -15.678  -4.466
  566    H    LYS  72           HN       LYS  72   5.702 -14.186  -3.231
  567    HA   LYS  72           HA       LYS  72   4.749 -14.700  -5.848
  568   1HB   LYS  72          2HB       LYS  72   3.461 -14.870  -3.112
  569   2HB   LYS  72          3HB       LYS  72   2.654 -15.352  -4.591
  570   1HG   LYS  72          2HG       LYS  72   5.359 -16.467  -3.716
  571   2HG   LYS  72          3HG       LYS  72   3.832 -17.239  -3.338
  572   1HD   LYS  72          2HD       LYS  72   3.625 -16.775  -6.093
  573   2HD   LYS  72          3HD       LYS  72   5.320 -17.172  -5.894
  574   1HE   LYS  72          2HE       LYS  72   4.883 -19.351  -5.218
  575   2HE   LYS  72          3HE       LYS  72   3.386 -18.922  -4.415
  576   1HZ   LYS  72          1HZ       LYS  72   2.383 -18.648  -6.593
  577   2HZ   LYS  72          2HZ       LYS  72   3.775 -19.091  -7.323
  578   3HZ   LYS  72          3HZ       LYS  72   2.961 -20.163  -6.398
  579    H    ILE  73           HN       ILE  73   4.353 -12.080  -3.459
  580    HA   ILE  73           HA       ILE  73   2.169 -10.889  -4.854
  581    HB   ILE  73           HB       ILE  73   3.985  -9.986  -2.626
  582   1HG1  ILE  73          2HG1      ILE  73   1.052 -10.328  -2.290
  583   2HG1  ILE  73          3HG1      ILE  73   1.974 -11.795  -2.550
  584   1HG2  ILE  73          1HG2      ILE  73   2.579  -8.035  -2.340
  585   2HG2  ILE  73          2HG2      ILE  73   3.296  -8.034  -3.969
  586   3HG2  ILE  73          3HG2      ILE  73   1.593  -8.501  -3.746
  587   1HD1  ILE  73          1HD1      ILE  73   2.671 -11.742  -0.401
  588   2HD1  ILE  73          2HD1      ILE  73   3.456 -10.171  -0.693
  589   3HD1  ILE  73          3HD1      ILE  73   1.763 -10.232  -0.146
  590    H    SER  74           HN       SER  74   5.544 -11.149  -5.411
  591    HA   SER  74           HA       SER  74   5.768  -8.582  -6.648
  592   1HB   SER  74          2HB       SER  74   7.562 -10.776  -5.864
  593   2HB   SER  74          3HB       SER  74   7.961 -10.152  -7.452
  594    HG   SER  74           HG       SER  74   8.713  -9.093  -5.184
  595    H    GLN  75           HN       GLN  75   5.527 -12.057  -7.611
  596    HA   GLN  75           HA       GLN  75   5.776 -11.514 -10.352
  597   1HB   GLN  75          2HB       GLN  75   5.782 -13.784  -8.742
  598   2HB   GLN  75          3HB       GLN  75   4.276 -13.958  -9.622
  599   1HG   GLN  75          2HG       GLN  75   5.337 -14.113 -11.703
  600   2HG   GLN  75          3HG       GLN  75   6.710 -13.148 -11.200
  601   1HE2  GLN  75          1HE2      GLN  75   7.801 -14.213  -9.125
  602   2HE2  GLN  75          2HE2      GLN  75   8.268 -15.868  -9.334
  Start of MODEL    9
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   2.719  -0.878  -1.239
    3   1HB   LYS   1          2HB       LYS   1   0.156   0.287  -2.192
    4   2HB   LYS   1          3HB       LYS   1   1.518   0.420  -3.287
    5   1HG   LYS   1          2HG       LYS   1   1.179  -1.739  -3.890
    6   2HG   LYS   1          3HG       LYS   1   1.669  -2.225  -2.279
    7   1HD   LYS   1          2HD       LYS   1  -1.006  -1.333  -1.978
    8   2HD   LYS   1          3HD       LYS   1  -1.005  -2.233  -3.481
    9   1HE   LYS   1          2HE       LYS   1  -1.381  -3.953  -1.935
   10   2HE   LYS   1          3HE       LYS   1   0.361  -4.039  -2.108
   11   1HZ   LYS   1          1HZ       LYS   1   0.359  -2.401  -0.175
   12   2HZ   LYS   1          2HZ       LYS   1  -1.181  -2.879   0.079
   13   3HZ   LYS   1          3HZ       LYS   1   0.033  -3.968   0.146
   14    H    SER   2           HN       SER   2   3.411   0.887  -3.280
   15    HA   SER   2           HA       SER   2   5.199   2.510  -1.956
   16   1HB   SER   2          2HB       SER   2   4.538   1.818  -4.673
   17   2HB   SER   2          3HB       SER   2   4.704   3.561  -4.595
   18    HG   SER   2           HG       SER   2   6.681   1.850  -4.796
   19    HA   PRO   3           HA       PRO   3   3.110   6.311  -1.487
   20   1HB   PRO   3          2HB       PRO   3   4.770   8.252  -2.457
   21   2HB   PRO   3          3HB       PRO   3   5.002   7.484  -0.899
   22   1HG   PRO   3          2HG       PRO   3   6.500   7.065  -3.413
   23   2HG   PRO   3          3HG       PRO   3   6.965   6.647  -1.776
   24   1HD   PRO   3          2HD       PRO   3   6.000   4.855  -3.797
   25   2HD   PRO   3          3HD       PRO   3   6.354   4.459  -2.127
   26    H    GLU   4           HN       GLU   4   4.283   5.957  -4.759
   27    HA   GLU   4           HA       GLU   4   2.785   7.891  -5.934
   28   1HB   GLU   4          2HB       GLU   4   4.422   5.794  -6.777
   29   2HB   GLU   4          3HB       GLU   4   2.878   5.385  -7.496
   30   1HG   GLU   4          2HG       GLU   4   3.657   8.262  -7.720
   31   2HG   GLU   4          3HG       GLU   4   4.677   7.145  -8.605
   32    H    GLU   5           HN       GLU   5   1.846   4.493  -5.120
   33    HA   GLU   5           HA       GLU   5  -0.700   4.726  -6.260
   34   1HB   GLU   5          2HB       GLU   5   0.817   2.753  -4.669
   35   2HB   GLU   5          3HB       GLU   5  -0.899   2.732  -4.315
   36   1HG   GLU   5          2HG       GLU   5  -0.769   2.945  -7.133
   37   2HG   GLU   5          3HG       GLU   5   0.511   1.820  -6.724
   38    H    LEU   6           HN       LEU   6   0.699   5.539  -3.096
   39    HA   LEU   6           HA       LEU   6  -1.690   5.665  -1.645
   40   1HB   LEU   6          2HB       LEU   6   1.068   6.775  -1.358
   41   2HB   LEU   6          3HB       LEU   6  -0.202   7.397  -0.322
   42    HG   LEU   6           HG       LEU   6   0.493   4.457  -0.554
   43   1HD1  LEU   6          1HD1      LEU   6   1.591   6.614   1.221
   44   2HD1  LEU   6          2HD1      LEU   6   1.439   4.948   1.830
   45   3HD1  LEU   6          3HD1      LEU   6   2.429   5.281   0.390
   46   1HD2  LEU   6          1HD2      LEU   6  -0.685   4.725   1.852
   47   2HD2  LEU   6          2HD2      LEU   6  -1.531   6.010   0.957
   48   3HD2  LEU   6          3HD2      LEU   6  -1.570   4.335   0.358
   49    H    LYS   7           HN       LYS   7   0.042   8.035  -3.727
   50    HA   LYS   7           HA       LYS   7  -1.556  10.230  -3.094
   51   1HB   LYS   7          2HB       LYS   7   0.697   9.861  -4.525
   52   2HB   LYS   7          3HB       LYS   7  -0.447   9.978  -5.846
   53   1HG   LYS   7          2HG       LYS   7  -0.783  12.011  -3.677
   54   2HG   LYS   7          3HG       LYS   7   0.692  12.150  -4.614
   55   1HD   LYS   7          2HD       LYS   7  -1.454  11.651  -6.468
   56   2HD   LYS   7          3HD       LYS   7  -1.998  12.903  -5.370
   57   1HE   LYS   7          2HE       LYS   7   0.453  13.903  -5.817
   58   2HE   LYS   7          3HE       LYS   7   0.345  12.938  -7.276
   59   1HZ   LYS   7          1HZ       LYS   7  -1.725  14.049  -7.786
   60   2HZ   LYS   7          2HZ       LYS   7  -1.624  14.948  -6.426
   61   3HZ   LYS   7          3HZ       LYS   7  -0.520  15.138  -7.615
   62    H    GLY   8           HN       GLY   8  -1.800   7.821  -5.800
   63   1HA   GLY   8          1HA       GLY   8  -4.097   8.843  -6.983
   64   2HA   GLY   8          2HA       GLY   8  -3.557   7.177  -7.043
   65    H    ILE   9           HN       ILE   9  -3.798   6.144  -4.553
   66    HA   ILE   9           HA       ILE   9  -6.502   5.689  -4.278
   67    HB   ILE   9           HB       ILE   9  -4.123   5.270  -2.498
   68   1HG1  ILE   9          2HG1      ILE   9  -5.941   3.418  -4.066
   69   2HG1  ILE   9          3HG1      ILE   9  -4.295   3.862  -4.474
   70   1HG2  ILE   9          1HG2      ILE   9  -6.183   3.709  -1.448
   71   2HG2  ILE   9          2HG2      ILE   9  -5.417   5.128  -0.696
   72   3HG2  ILE   9          3HG2      ILE   9  -6.901   5.324  -1.659
   73   1HD1  ILE   9          1HD1      ILE   9  -5.134   1.702  -2.833
   74   2HD1  ILE   9          2HD1      ILE   9  -3.465   2.250  -3.119
   75   3HD1  ILE   9          3HD1      ILE   9  -4.384   2.884  -1.733
   76    H    PHE  10           HN       PHE  10  -4.343   7.950  -2.452
   77    HA   PHE  10           HA       PHE  10  -6.147   8.858  -0.620
   78   1HB   PHE  10          2HB       PHE  10  -3.871   9.616  -0.505
   79   2HB   PHE  10          3HB       PHE  10  -3.821  10.006  -2.213
   80    HD1  PHE  10           HD1      PHE  10  -4.809  12.109  -3.036
   81    HD2  PHE  10           HD2      PHE  10  -4.657  11.214   1.109
   82    HE1  PHE  10           HE1      PHE  10  -5.247  14.522  -2.499
   83    HE2  PHE  10           HE2      PHE  10  -5.095  13.627   1.646
   84    HZ   PHE  10           HZ       PHE  10  -5.384  15.252  -0.165
   85    H    GLU  11           HN       GLU  11  -5.495  10.273  -3.909
   86    HA   GLU  11           HA       GLU  11  -7.473  12.198  -3.693
   87   1HB   GLU  11          2HB       GLU  11  -5.610  11.230  -5.696
   88   2HB   GLU  11          3HB       GLU  11  -7.169  11.501  -6.449
   89   1HG   GLU  11          2HG       GLU  11  -6.960  13.754  -4.862
   90   2HG   GLU  11          3HG       GLU  11  -5.275  13.467  -5.250
   91    H    LYS  12           HN       LYS  12  -7.524   8.788  -4.783
   92    HA   LYS  12           HA       LYS  12 -10.000   8.809  -6.039
   93   1HB   LYS  12          2HB       LYS  12  -8.067   6.995  -5.779
   94   2HB   LYS  12          3HB       LYS  12  -9.104   6.409  -4.494
   95   1HG   LYS  12          2HG       LYS  12 -10.998   6.181  -6.028
   96   2HG   LYS  12          3HG       LYS  12 -10.119   6.985  -7.314
   97   1HD   LYS  12          2HD       LYS  12  -8.343   5.020  -6.882
   98   2HD   LYS  12          3HD       LYS  12  -9.737   4.201  -6.206
   99   1HE   LYS  12          2HE       LYS  12 -10.968   4.373  -8.292
  100   2HE   LYS  12          3HE       LYS  12  -9.803   5.495  -8.967
  101   1HZ   LYS  12          1HZ       LYS  12  -9.260   2.691  -8.271
  102   2HZ   LYS  12          2HZ       LYS  12  -9.441   3.286  -9.781
  103   3HZ   LYS  12          3HZ       LYS  12  -8.159   3.735  -8.876
  104    H    TYR  13           HN       TYR  13  -9.087   8.974  -2.636
  105    HA   TYR  13           HA       TYR  13 -11.825   8.385  -1.821
  106   1HB   TYR  13          2HB       TYR  13  -9.037   8.644  -0.647
  107   2HB   TYR  13          3HB       TYR  13 -10.364   9.018   0.436
  108    HD1  TYR  13           HD1      TYR  13  -9.155   6.337  -1.883
  109    HD2  TYR  13           HD2      TYR  13 -11.430   7.296   1.611
  110    HE1  TYR  13           HE1      TYR  13  -9.463   3.861  -1.395
  111    HE2  TYR  13           HE2      TYR  13 -11.730   4.817   2.087
  112    HH   TYR  13           HH       TYR  13 -10.004   2.406   0.242
  113    H    ALA  14           HN       ALA  14  -9.328  11.006  -1.633
  114    HA   ALA  14           HA       ALA  14 -10.905  12.825  -0.241
  115   1HB   ALA  14          1HB       ALA  14  -8.361  12.790  -0.853
  116   2HB   ALA  14          2HB       ALA  14  -8.879  13.634  -2.332
  117   3HB   ALA  14          3HB       ALA  14  -9.200  14.356  -0.737
  118    H    ALA  15           HN       ALA  15 -11.058  11.651  -3.536
  119    HA   ALA  15           HA       ALA  15 -12.503  13.961  -4.487
  120   1HB   ALA  15          1HB       ALA  15 -10.881  12.550  -5.852
  121   2HB   ALA  15          2HB       ALA  15 -12.109  11.261  -5.826
  122   3HB   ALA  15          3HB       ALA  15 -12.474  12.823  -6.598
  123    H    LYS  16           HN       LYS  16 -13.121  10.901  -2.888
  124    HA   LYS  16           HA       LYS  16 -15.657  10.325  -3.806
  125   1HB   LYS  16          2HB       LYS  16 -13.906   9.323  -1.906
  126   2HB   LYS  16          3HB       LYS  16 -15.268   9.851  -0.939
  127   1HG   LYS  16          2HG       LYS  16 -16.774   8.621  -2.658
  128   2HG   LYS  16          3HG       LYS  16 -15.302   7.899  -3.278
  129   1HD   LYS  16          2HD       LYS  16 -14.955   6.604  -1.372
  130   2HD   LYS  16          3HD       LYS  16 -15.711   7.770  -0.304
  131   1HE   LYS  16          2HE       LYS  16 -17.430   6.365  -2.360
  132   2HE   LYS  16          3HE       LYS  16 -16.945   5.481  -0.926
  133   1HZ   LYS  16          1HZ       LYS  16 -17.753   7.878   0.023
  134   2HZ   LYS  16          2HZ       LYS  16 -18.825   7.581  -1.173
  135   3HZ   LYS  16          3HZ       LYS  16 -18.632   6.502   0.038
  136    H    GLU  17           HN       GLU  17 -14.849  12.122  -0.747
  137    HA   GLU  17           HA       GLU  17 -17.333  13.584  -1.207
  138   1HB   GLU  17          2HB       GLU  17 -16.107  12.549   1.373
  139   2HB   GLU  17          3HB       GLU  17 -17.291  13.841   1.382
  140   1HG   GLU  17          2HG       GLU  17 -18.422  11.901  -0.326
  141   2HG   GLU  17          3HG       GLU  17 -17.685  10.956   0.953
  142    H    GLY  18           HN       GLY  18 -17.177  15.806  -1.296
  143   1HA   GLY  18          1HA       GLY  18 -16.297  17.873  -1.163
  144   2HA   GLY  18          2HA       GLY  18 -15.241  17.305   0.115
  145    H    ASP  19           HN       ASP  19 -13.968  19.062  -1.346
  146    HA   ASP  19           HA       ASP  19 -12.974  18.307  -3.783
  147   1HB   ASP  19          2HB       ASP  19 -12.734  20.506  -2.254
  148   2HB   ASP  19          3HB       ASP  19 -11.209  19.765  -1.813
  149    HA   PRO  20           HA       PRO  20 -10.131  15.175  -2.586
  150   1HB   PRO  20          2HB       PRO  20  -8.679  14.951  -4.891
  151   2HB   PRO  20          3HB       PRO  20 -10.236  14.180  -4.660
  152   1HG   PRO  20          2HG       PRO  20  -9.573  16.575  -6.261
  153   2HG   PRO  20          3HG       PRO  20 -10.994  15.554  -6.350
  154   1HD   PRO  20          2HD       PRO  20 -10.817  18.147  -5.138
  155   2HD   PRO  20          3HD       PRO  20 -12.205  17.077  -5.126
  156    H    ASN  21           HN       ASN  21  -9.379  18.340  -2.925
  157    HA   ASN  21           HA       ASN  21  -6.557  17.925  -2.595
  158   1HB   ASN  21          2HB       ASN  21  -8.383  20.329  -2.912
  159   2HB   ASN  21          3HB       ASN  21  -6.780  20.577  -2.250
  160   1HD2  ASN  21          1HD2      ASN  21  -8.660  20.101  -5.026
  161   2HD2  ASN  21          2HD2      ASN  21  -7.407  19.986  -6.215
  162    H    GLN  22           HN       GLN  22  -9.242  17.637  -0.652
  163    HA   GLN  22           HA       GLN  22  -7.691  18.202   1.698
  164   1HB   GLN  22          2HB       GLN  22  -9.895  19.341   2.657
  165   2HB   GLN  22          3HB       GLN  22  -8.704  20.286   1.785
  166   1HG   GLN  22          2HG       GLN  22 -10.621  19.029  -0.055
  167   2HG   GLN  22          3HG       GLN  22 -11.442  20.011   1.142
  168   1HE2  GLN  22          1HE2      GLN  22 -12.045  21.518  -0.395
  169   2HE2  GLN  22          2HE2      GLN  22 -10.948  22.672  -1.077
  170    H    LEU  23           HN       LEU  23  -8.037  16.629   3.243
  171    HA   LEU  23           HA       LEU  23 -10.112  14.686   2.618
  172   1HB   LEU  23          2HB       LEU  23  -7.688  14.625   4.412
  173   2HB   LEU  23          3HB       LEU  23  -8.883  13.344   4.368
  174    HG   LEU  23           HG       LEU  23  -6.625  13.356   2.897
  175   1HD1  LEU  23          1HD1      LEU  23  -9.194  11.963   2.799
  176   2HD1  LEU  23          2HD1      LEU  23  -8.321  11.936   1.248
  177   3HD1  LEU  23          3HD1      LEU  23  -7.533  11.326   2.723
  178   1HD2  LEU  23          1HD2      LEU  23  -7.072  15.240   1.532
  179   2HD2  LEU  23          2HD2      LEU  23  -7.323  13.805   0.509
  180   3HD2  LEU  23          3HD2      LEU  23  -8.723  14.683   1.171
  181    H    SER  24           HN       SER  24 -11.502  13.831   4.364
  182    HA   SER  24           HA       SER  24 -11.906  15.841   6.436
  183   1HB   SER  24          2HB       SER  24 -14.105  14.320   4.967
  184   2HB   SER  24          3HB       SER  24 -14.345  15.517   6.224
  185    HG   SER  24           HG       SER  24 -14.260  15.994   3.638
  186    H    LYS  25           HN       LYS  25 -13.197  14.909   8.361
  187    HA   LYS  25           HA       LYS  25 -11.910  12.704   9.377
  188   1HB   LYS  25          2HB       LYS  25 -13.075  14.405  10.715
  189   2HB   LYS  25          3HB       LYS  25 -14.623  13.836  10.125
  190   1HG   LYS  25          2HG       LYS  25 -13.653  11.468  11.020
  191   2HG   LYS  25          3HG       LYS  25 -12.729  12.530  12.064
  192   1HD   LYS  25          2HD       LYS  25 -15.377  13.569  12.102
  193   2HD   LYS  25          3HD       LYS  25 -15.566  11.829  12.196
  194   1HE   LYS  25          2HE       LYS  25 -13.443  12.301  13.955
  195   2HE   LYS  25          3HE       LYS  25 -14.458  13.709  14.199
  196   1HZ   LYS  25          1HZ       LYS  25 -16.112  11.498  14.064
  197   2HZ   LYS  25          2HZ       LYS  25 -14.892  11.111  15.078
  198   3HZ   LYS  25          3HZ       LYS  25 -15.801  12.438  15.363
  199    H    GLU  26           HN       GLU  26 -15.316  12.847   8.104
  200    HA   GLU  26           HA       GLU  26 -15.743  10.144   8.270
  201   1HB   GLU  26          2HB       GLU  26 -17.097  12.448   7.241
  202   2HB   GLU  26          3HB       GLU  26 -17.139  11.234   5.978
  203   1HG   GLU  26          2HG       GLU  26 -17.700   9.751   8.290
  204   2HG   GLU  26          3HG       GLU  26 -18.519  11.271   8.592
  205    H    GLU  27           HN       GLU  27 -14.271  12.131   5.657
  206    HA   GLU  27           HA       GLU  27 -14.213  10.129   3.746
  207   1HB   GLU  27          2HB       GLU  27 -13.104  12.807   4.124
  208   2HB   GLU  27          3HB       GLU  27 -11.944  11.769   3.318
  209   1HG   GLU  27          2HG       GLU  27 -14.507  11.222   2.142
  210   2HG   GLU  27          3HG       GLU  27 -14.354  12.965   2.239
  211    H    LEU  28           HN       LEU  28 -11.532  11.319   5.908
  212    HA   LEU  28           HA       LEU  28  -9.664   9.442   5.224
  213   1HB   LEU  28          2HB       LEU  28  -9.555  11.530   6.735
  214   2HB   LEU  28          3HB       LEU  28 -10.006  10.447   8.036
  215    HG   LEU  28           HG       LEU  28  -7.973   9.440   8.112
  216   1HD1  LEU  28          1HD1      LEU  28  -7.703   9.912   5.133
  217   2HD1  LEU  28          2HD1      LEU  28  -6.454   9.156   6.151
  218   3HD1  LEU  28          3HD1      LEU  28  -8.043   8.376   5.966
  219   1HD2  LEU  28          1HD2      LEU  28  -6.797  11.747   6.627
  220   2HD2  LEU  28          2HD2      LEU  28  -7.796  12.086   8.061
  221   3HD2  LEU  28          3HD2      LEU  28  -6.358  11.048   8.204
  222    H    LYS  29           HN       LYS  29 -12.339   9.209   7.634
  223    HA   LYS  29           HA       LYS  29 -11.737   6.891   8.867
  224   1HB   LYS  29          2HB       LYS  29 -13.695   8.289   9.355
  225   2HB   LYS  29          3HB       LYS  29 -14.459   7.776   7.864
  226   1HG   LYS  29          2HG       LYS  29 -14.874   5.607   8.648
  227   2HG   LYS  29          3HG       LYS  29 -13.512   5.625   9.751
  228   1HD   LYS  29          2HD       LYS  29 -14.951   7.593  10.913
  229   2HD   LYS  29          3HD       LYS  29 -16.277   6.762  10.126
  230   1HE   LYS  29          2HE       LYS  29 -14.522   4.807  11.389
  231   2HE   LYS  29          3HE       LYS  29 -14.966   6.034  12.559
  232   1HZ   LYS  29          1HZ       LYS  29 -16.912   4.642  10.856
  233   2HZ   LYS  29          2HZ       LYS  29 -16.550   4.191  12.383
  234   3HZ   LYS  29          3HZ       LYS  29 -17.244   5.643  12.104
  235    H    LEU  30           HN       LEU  30 -13.461   7.180   5.682
  236    HA   LEU  30           HA       LEU  30 -13.693   4.477   5.203
  237   1HB   LEU  30          2HB       LEU  30 -13.300   6.728   3.226
  238   2HB   LEU  30          3HB       LEU  30 -13.892   5.124   2.840
  239    HG   LEU  30           HG       LEU  30 -15.258   7.329   4.362
  240   1HD1  LEU  30          1HD1      LEU  30 -15.800   5.711   1.893
  241   2HD1  LEU  30          2HD1      LEU  30 -17.147   6.458   2.786
  242   3HD1  LEU  30          3HD1      LEU  30 -15.839   7.474   2.134
  243   1HD2  LEU  30          1HD2      LEU  30 -15.524   5.463   5.840
  244   2HD2  LEU  30          2HD2      LEU  30 -17.053   5.699   4.959
  245   3HD2  LEU  30          3HD2      LEU  30 -15.949   4.384   4.489
  246    H    LEU  31           HN       LEU  31 -11.067   6.732   4.090
  247    HA   LEU  31           HA       LEU  31  -9.498   4.857   2.860
  248   1HB   LEU  31          2HB       LEU  31  -9.341   7.449   3.092
  249   2HB   LEU  31          3HB       LEU  31  -8.306   7.093   4.461
  250    HG   LEU  31           HG       LEU  31  -7.366   5.491   2.319
  251   1HD1  LEU  31          1HD1      LEU  31  -8.509   8.026   1.392
  252   2HD1  LEU  31          2HD1      LEU  31  -6.796   7.811   0.958
  253   3HD1  LEU  31          3HD1      LEU  31  -7.996   6.588   0.478
  254   1HD2  LEU  31          1HD2      LEU  31  -6.245   8.039   3.521
  255   2HD2  LEU  31          2HD2      LEU  31  -6.018   6.388   4.148
  256   3HD2  LEU  31          3HD2      LEU  31  -5.338   6.841   2.566
  257    H    LEU  32           HN       LEU  32  -9.052   6.062   6.264
  258    HA   LEU  32           HA       LEU  32  -7.144   4.279   7.023
  259   1HB   LEU  32          2HB       LEU  32  -9.416   5.308   8.727
  260   2HB   LEU  32          3HB       LEU  32  -7.882   4.686   9.302
  261    HG   LEU  32           HG       LEU  32  -8.073   7.112   7.508
  262   1HD1  LEU  32          1HD1      LEU  32  -9.265   7.952   9.271
  263   2HD1  LEU  32          2HD1      LEU  32  -8.489   6.879  10.460
  264   3HD1  LEU  32          3HD1      LEU  32  -7.607   8.288   9.824
  265   1HD2  LEU  32          1HD2      LEU  32  -5.856   7.386   9.101
  266   2HD2  LEU  32          2HD2      LEU  32  -5.904   5.630   8.816
  267   3HD2  LEU  32          3HD2      LEU  32  -5.866   6.754   7.437
  268    H    GLN  33           HN       GLN  33 -10.504   3.674   6.245
  269    HA   GLN  33           HA       GLN  33 -10.749   1.316   7.747
  270   1HB   GLN  33          2HB       GLN  33 -12.471   2.933   6.326
  271   2HB   GLN  33          3HB       GLN  33 -12.357   1.551   5.255
  272   1HG   GLN  33          2HG       GLN  33 -12.786   0.089   7.366
  273   2HG   GLN  33          3HG       GLN  33 -13.247   1.578   8.166
  274   1HE2  GLN  33          1HE2      GLN  33 -14.750   3.002   6.769
  275   2HE2  GLN  33          2HE2      GLN  33 -16.116   2.205   6.061
  276    H    THR  34           HN       THR  34 -10.439   1.803   4.148
  277    HA   THR  34           HA       THR  34  -9.621  -0.943   3.833
  278    HB   THR  34           HB       THR  34 -10.533   1.351   2.175
  279    HG1  THR  34           HG1      THR  34 -11.595  -0.771   2.724
  280   1HG2  THR  34          1HG2      THR  34  -8.319   1.077   1.103
  281   2HG2  THR  34          2HG2      THR  34  -8.510  -0.692   1.114
  282   3HG2  THR  34          3HG2      THR  34  -9.561   0.311   0.085
  283    H    GLU  35           HN       GLU  35  -8.096   2.315   3.428
  284    HA   GLU  35           HA       GLU  35  -5.690   1.523   2.534
  285   1HB   GLU  35          2HB       GLU  35  -6.234   3.868   2.765
  286   2HB   GLU  35          3HB       GLU  35  -6.410   3.729   4.503
  287   1HG   GLU  35          2HG       GLU  35  -4.227   4.760   3.875
  288   2HG   GLU  35          3HG       GLU  35  -4.007   3.267   4.766
  289    H    PHE  36           HN       PHE  36  -6.511   2.010   6.052
  290    HA   PHE  36           HA       PHE  36  -4.896  -0.297   6.695
  291   1HB   PHE  36          2HB       PHE  36  -4.338   2.615   7.470
  292   2HB   PHE  36          3HB       PHE  36  -3.768   1.308   8.489
  293    HD1  PHE  36           HD1      PHE  36  -2.616   3.530   6.256
  294    HD2  PHE  36           HD2      PHE  36  -2.709  -0.681   6.773
  295    HE1  PHE  36           HE1      PHE  36  -0.565   3.309   4.826
  296    HE2  PHE  36           HE2      PHE  36  -0.657  -0.902   5.344
  297    HZ   PHE  36           HZ       PHE  36   0.390   1.096   4.388
  298    HA   PRO  37           HA       PRO  37  -8.483   0.082   9.346
  299   1HB   PRO  37          2HB       PRO  37  -9.171  -2.563   9.332
  300   2HB   PRO  37          3HB       PRO  37  -9.816  -1.399   8.192
  301   1HG   PRO  37          2HG       PRO  37  -7.768  -3.484   7.751
  302   2HG   PRO  37          3HG       PRO  37  -8.722  -2.614   6.566
  303   1HD   PRO  37          2HD       PRO  37  -5.969  -2.153   7.227
  304   2HD   PRO  37          3HD       PRO  37  -6.955  -1.210   6.127
  305    H    SER  38           HN       SER  38  -5.456  -1.047   9.646
  306    HA   SER  38           HA       SER  38  -5.926  -2.291  12.195
  307   1HB   SER  38          2HB       SER  38  -3.834  -2.325  10.183
  308   2HB   SER  38          3HB       SER  38  -3.130  -1.909  11.733
  309    HG   SER  38           HG       SER  38  -4.678  -3.866  12.418
  310    H    LEU  39           HN       LEU  39  -4.731   0.749  10.757
  311    HA   LEU  39           HA       LEU  39  -3.555   1.754  13.122
  312   1HB   LEU  39          2HB       LEU  39  -3.895   2.530  10.396
  313   2HB   LEU  39          3HB       LEU  39  -4.428   3.854  11.412
  314    HG   LEU  39           HG       LEU  39  -1.974   3.796  10.653
  315   1HD1  LEU  39          1HD1      LEU  39  -2.968   4.332  13.431
  316   2HD1  LEU  39          2HD1      LEU  39  -1.238   4.523  13.056
  317   3HD1  LEU  39          3HD1      LEU  39  -2.453   5.468  12.161
  318   1HD2  LEU  39          1HD2      LEU  39  -1.571   1.968  13.013
  319   2HD2  LEU  39          2HD2      LEU  39  -1.774   1.328  11.365
  320   3HD2  LEU  39          3HD2      LEU  39  -0.424   2.429  11.732
  321    H    LEU  40           HN       LEU  40  -6.840   1.355  12.006
  322    HA   LEU  40           HA       LEU  40  -7.924   3.476  13.576
  323   1HB   LEU  40          2HB       LEU  40  -9.156   1.105  12.173
  324   2HB   LEU  40          3HB       LEU  40 -10.084   2.319  13.032
  325    HG   LEU  40           HG       LEU  40  -8.241   2.954  10.714
  326   1HD1  LEU  40          1HD1      LEU  40  -9.967   1.465   9.907
  327   2HD1  LEU  40          2HD1      LEU  40 -11.228   2.444  10.693
  328   3HD1  LEU  40          3HD1      LEU  40 -10.290   3.121   9.340
  329   1HD2  LEU  40          1HD2      LEU  40 -10.124   4.547  12.410
  330   2HD2  LEU  40          2HD2      LEU  40  -8.513   4.965  11.780
  331   3HD2  LEU  40          3HD2      LEU  40  -9.924   4.981  10.695
  332    H    LYS  41           HN       LYS  41  -6.933   0.135  14.098
  333    HA   LYS  41           HA       LYS  41  -8.526  -0.268  16.413
  334   1HB   LYS  41          2HB       LYS  41  -7.610  -2.358  16.458
  335   2HB   LYS  41          3HB       LYS  41  -7.329  -1.958  14.776
  336   1HG   LYS  41          2HG       LYS  41  -5.168  -2.565  15.273
  337   2HG   LYS  41          3HG       LYS  41  -5.053  -0.910  15.838
  338   1HD   LYS  41          2HD       LYS  41  -6.132  -2.220  18.054
  339   2HD   LYS  41          3HD       LYS  41  -5.055  -3.433  17.392
  340   1HE   LYS  41          2HE       LYS  41  -3.737  -0.833  17.343
  341   2HE   LYS  41          3HE       LYS  41  -4.349  -1.148  18.955
  342   1HZ   LYS  41          1HZ       LYS  41  -2.094  -2.174  17.899
  343   2HZ   LYS  41          2HZ       LYS  41  -2.843  -2.720  19.243
  344   3HZ   LYS  41          3HZ       LYS  41  -3.130  -3.433  17.802
  345    H    GLY  42           HN       GLY  42  -5.386   1.224  15.696
  346   1HA   GLY  42          1HA       GLY  42  -4.013   1.171  18.008
  347   2HA   GLY  42          2HA       GLY  42  -4.147   2.599  17.001
  348    H    MET  43           HN       MET  43  -3.794   2.884  19.758
  349    HA   MET  43           HA       MET  43  -6.242   3.065  21.113
  350   1HB   MET  43          2HB       MET  43  -3.537   4.432  21.606
  351   2HB   MET  43          3HB       MET  43  -4.834   4.362  22.782
  352   1HG   MET  43          2HG       MET  43  -4.672   1.719  22.290
  353   2HG   MET  43          3HG       MET  43  -3.046   2.140  21.794
  354   1HE   MET  43          1HE       MET  43  -1.067   2.257  23.649
  355   2HE   MET  43          2HE       MET  43  -1.586   1.281  25.044
  356   3HE   MET  43          3HE       MET  43  -1.989   0.757  23.391
  357    H    SER  44           HN       SER  44  -5.083   4.858  18.522
  358    HA   SER  44           HA       SER  44  -6.097   7.374  19.499
  359   1HB   SER  44          2HB       SER  44  -3.978   7.246  18.147
  360   2HB   SER  44          3HB       SER  44  -4.907   6.657  16.782
  361    HG   SER  44           HG       SER  44  -6.180   8.685  16.930
  362    H    THR  45           HN       THR  45  -8.352   7.291  19.582
  363    HA   THR  45           HA       THR  45  -9.942   5.853  17.783
  364    HB   THR  45           HB       THR  45 -11.765   7.192  18.855
  365    HG1  THR  45           HG1      THR  45 -10.993   9.249  19.215
  366   1HG2  THR  45          1HG2      THR  45 -11.499   6.234  20.936
  367   2HG2  THR  45          2HG2      THR  45 -10.039   5.501  20.230
  368   3HG2  THR  45          3HG2      THR  45  -9.912   7.002  21.179
  369    H    LEU  46           HN       LEU  46 -11.707   6.946  16.394
  370    HA   LEU  46           HA       LEU  46 -10.489   8.051  14.201
  371   1HB   LEU  46          2HB       LEU  46 -12.830   6.983  14.589
  372   2HB   LEU  46          3HB       LEU  46 -13.351   8.630  14.886
  373    HG   LEU  46           HG       LEU  46 -13.617   7.638  12.520
  374   1HD1  LEU  46          1HD1      LEU  46 -12.287  10.163  12.014
  375   2HD1  LEU  46          2HD1      LEU  46 -14.015   9.745  11.937
  376   3HD1  LEU  46          3HD1      LEU  46 -13.288  10.241  13.484
  377   1HD2  LEU  46          1HD2      LEU  46 -11.786   7.657  11.039
  378   2HD2  LEU  46          2HD2      LEU  46 -10.740   8.501  12.207
  379   3HD2  LEU  46          3HD2      LEU  46 -11.212   6.809  12.495
  380    H    ASP  47           HN       ASP  47 -12.628   9.849  16.533
  381    HA   ASP  47           HA       ASP  47 -12.234  12.314  15.622
  382   1HB   ASP  47          2HB       ASP  47 -13.324  11.211  17.895
  383   2HB   ASP  47          3HB       ASP  47 -11.958  12.062  18.590
  384    H    GLU  48           HN       GLU  48 -10.149  10.528  18.013
  385    HA   GLU  48           HA       GLU  48  -8.339  12.518  18.479
  386   1HB   GLU  48          2HB       GLU  48  -8.550   9.654  18.928
  387   2HB   GLU  48          3HB       GLU  48  -6.901  10.055  18.489
  388   1HG   GLU  48          2HG       GLU  48  -7.321  12.075  20.234
  389   2HG   GLU  48          3HG       GLU  48  -8.506  10.954  20.875
  390    H    LEU  49           HN       LEU  49  -8.379  10.000  15.885
  391    HA   LEU  49           HA       LEU  49  -5.893  10.707  14.795
  392   1HB   LEU  49          2HB       LEU  49  -7.720   8.704  14.455
  393   2HB   LEU  49          3HB       LEU  49  -7.925   9.614  12.972
  394    HG   LEU  49           HG       LEU  49  -5.237   9.457  12.990
  395   1HD1  LEU  49          1HD1      LEU  49  -4.650   7.095  13.666
  396   2HD1  LEU  49          2HD1      LEU  49  -4.943   8.237  15.000
  397   3HD1  LEU  49          3HD1      LEU  49  -6.194   7.052  14.552
  398   1HD2  LEU  49          1HD2      LEU  49  -6.007   8.698  11.028
  399   2HD2  LEU  49          2HD2      LEU  49  -5.837   7.087  11.766
  400   3HD2  LEU  49          3HD2      LEU  49  -7.418   7.905  11.770
  401    H    PHE  50           HN       PHE  50  -9.264  11.819  14.197
  402    HA   PHE  50           HA       PHE  50  -8.730  13.342  11.945
  403   1HB   PHE  50          2HB       PHE  50 -10.972  12.689  12.996
  404   2HB   PHE  50          3HB       PHE  50 -10.656  13.818  14.299
  405    HD1  PHE  50           HD1      PHE  50 -12.400  15.358  14.037
  406    HD2  PHE  50           HD2      PHE  50 -10.012  14.343  10.679
  407    HE1  PHE  50           HE1      PHE  50 -13.486  17.192  12.711
  408    HE2  PHE  50           HE2      PHE  50 -11.098  16.177   9.353
  409    HZ   PHE  50           HZ       PHE  50 -12.822  17.579  10.385
  410    H    GLU  51           HN       GLU  51  -8.824  14.325  15.444
  411    HA   GLU  51           HA       GLU  51  -8.064  16.956  14.866
  412   1HB   GLU  51          2HB       GLU  51  -8.789  15.386  17.179
  413   2HB   GLU  51          3HB       GLU  51  -7.322  16.268  17.554
  414   1HG   GLU  51          2HG       GLU  51  -8.708  18.264  16.325
  415   2HG   GLU  51          3HG       GLU  51 -10.061  17.318  16.914
  416    H    GLU  52           HN       GLU  52  -6.278  13.985  15.852
  417    HA   GLU  52           HA       GLU  52  -3.847  15.222  16.294
  418   1HB   GLU  52          2HB       GLU  52  -4.501  12.866  16.942
  419   2HB   GLU  52          3HB       GLU  52  -4.324  12.391  15.264
  420   1HG   GLU  52          2HG       GLU  52  -1.946  12.984  15.275
  421   2HG   GLU  52          3HG       GLU  52  -2.081  13.700  16.869
  422    H    LEU  53           HN       LEU  53  -5.053  13.458  13.346
  423    HA   LEU  53           HA       LEU  53  -2.846  13.976  11.762
  424   1HB   LEU  53          2HB       LEU  53  -5.734  13.640  10.940
  425   2HB   LEU  53          3HB       LEU  53  -4.344  13.494   9.884
  426    HG   LEU  53           HG       LEU  53  -4.516  11.741  12.314
  427   1HD1  LEU  53          1HD1      LEU  53  -6.580  11.836  10.392
  428   2HD1  LEU  53          2HD1      LEU  53  -5.617  10.383  10.030
  429   3HD1  LEU  53          3HD1      LEU  53  -6.307  10.612  11.655
  430   1HD2  LEU  53          1HD2      LEU  53  -2.497  11.912  10.753
  431   2HD2  LEU  53          2HD2      LEU  53  -3.121  10.285  11.116
  432   3HD2  LEU  53          3HD2      LEU  53  -3.499  11.056   9.557
  433    H    ASP  54           HN       ASP  54  -5.970  15.814  12.008
  434    HA   ASP  54           HA       ASP  54  -4.993  17.843  10.318
  435   1HB   ASP  54          2HB       ASP  54  -7.464  17.105  11.012
  436   2HB   ASP  54          3HB       ASP  54  -7.237  18.264  12.306
  437    H    LYS  55           HN       LYS  55  -2.931  18.383  11.466
  438    HA   LYS  55           HA       LYS  55  -3.327  19.725  14.037
  439   1HB   LYS  55          2HB       LYS  55  -1.611  17.809  13.628
  440   2HB   LYS  55          3HB       LYS  55  -0.657  19.038  12.822
  441   1HG   LYS  55          2HG       LYS  55   0.111  19.160  15.053
  442   2HG   LYS  55          3HG       LYS  55  -1.039  20.480  14.968
  443   1HD   LYS  55          2HD       LYS  55  -2.323  17.921  15.696
  444   2HD   LYS  55          3HD       LYS  55  -1.069  18.380  16.830
  445   1HE   LYS  55          2HE       LYS  55  -3.135  20.416  15.926
  446   2HE   LYS  55          3HE       LYS  55  -3.516  19.277  17.202
  447   1HZ   LYS  55          1HZ       LYS  55  -1.555  21.414  17.198
  448   2HZ   LYS  55          2HZ       LYS  55  -2.606  20.974  18.368
  449   3HZ   LYS  55          3HZ       LYS  55  -1.251  20.099  18.116
  450    H    ASN  56           HN       ASN  56  -3.488  20.435  10.816
  451    HA   ASN  56           HA       ASN  56  -1.846  22.775  10.892
  452   1HB   ASN  56          2HB       ASN  56  -2.675  23.124   8.574
  453   2HB   ASN  56          3HB       ASN  56  -2.136  21.470   8.780
  454   1HD2  ASN  56          1HD2      ASN  56  -3.574  21.465   6.780
  455   2HD2  ASN  56          2HD2      ASN  56  -5.234  21.027   7.006
  456    H    GLY  57           HN       GLY  57  -4.548  22.079  12.510
  457   1HA   GLY  57          1HA       GLY  57  -6.503  23.103  13.060
  458   2HA   GLY  57          2HA       GLY  57  -5.443  24.492  13.201
  459    H    ASP  58           HN       ASP  58  -6.941  22.595  10.473
  460    HA   ASP  58           HA       ASP  58  -7.897  25.158   9.472
  461   1HB   ASP  58          2HB       ASP  58  -6.274  24.720   7.861
  462   2HB   ASP  58          3HB       ASP  58  -6.343  22.986   8.108
  463    H    GLY  59           HN       GLY  59  -8.100  21.535   9.071
  464   1HA   GLY  59          1HA       GLY  59 -10.320  20.644   9.851
  465   2HA   GLY  59          2HA       GLY  59 -11.026  21.806   8.746
  466    H    GLU  60           HN       GLU  60  -8.189  21.041   7.231
  467    HA   GLU  60           HA       GLU  60  -9.439  18.784   5.868
  468   1HB   GLU  60          2HB       GLU  60  -7.661  20.964   4.688
  469   2HB   GLU  60          3HB       GLU  60  -8.277  19.586   3.799
  470   1HG   GLU  60          2HG       GLU  60  -9.872  21.230   3.282
  471   2HG   GLU  60          3HG       GLU  60 -10.645  20.399   4.618
  472    H    VAL  61           HN       VAL  61  -8.209  16.925   5.583
  473    HA   VAL  61           HA       VAL  61  -5.518  17.042   6.735
  474    HB   VAL  61           HB       VAL  61  -7.542  14.832   6.387
  475   1HG1  VAL  61          1HG1      VAL  61  -4.592  14.683   6.803
  476   2HG1  VAL  61          2HG1      VAL  61  -5.610  13.600   7.783
  477   3HG1  VAL  61          3HG1      VAL  61  -5.700  13.540   6.006
  478   1HG2  VAL  61          1HG2      VAL  61  -7.461  16.612   8.358
  479   2HG2  VAL  61          2HG2      VAL  61  -7.841  14.899   8.662
  480   3HG2  VAL  61          3HG2      VAL  61  -6.201  15.517   8.975
  481    H    SER  62           HN       SER  62  -5.152  18.174   4.469
  482    HA   SER  62           HA       SER  62  -5.292  16.834   2.135
  483   1HB   SER  62          2HB       SER  62  -2.744  18.287   2.412
  484   2HB   SER  62          3HB       SER  62  -4.093  18.598   1.338
  485    HG   SER  62           HG       SER  62  -3.500  19.709   3.849
  486    H    PHE  63           HN       PHE  63  -2.975  16.250   0.890
  487    HA   PHE  63           HA       PHE  63  -2.263  13.765   1.950
  488   1HB   PHE  63          2HB       PHE  63  -2.195  14.646  -0.476
  489   2HB   PHE  63          3HB       PHE  63  -0.795  15.603  -0.034
  490    HD1  PHE  63           HD1      PHE  63  -1.741  12.056   0.671
  491    HD2  PHE  63           HD2      PHE  63   1.078  14.724  -1.044
  492    HE1  PHE  63           HE1      PHE  63  -0.243  10.118   0.119
  493    HE2  PHE  63           HE2      PHE  63   2.576  12.786  -1.597
  494    HZ   PHE  63           HZ       PHE  63   1.897  10.507  -1.008
  495    H    GLU  64           HN       GLU  64  -1.088  17.008   2.572
  496    HA   GLU  64           HA       GLU  64   1.527  16.371   3.247
  497   1HB   GLU  64          2HB       GLU  64   0.042  18.571   4.680
  498   2HB   GLU  64          3HB       GLU  64   1.673  18.574   4.038
  499   1HG   GLU  64          2HG       GLU  64  -0.943  18.953   2.572
  500   2HG   GLU  64          3HG       GLU  64   0.519  19.916   2.481
  501    H    GLU  65           HN       GLU  65  -1.409  16.837   5.347
  502    HA   GLU  65           HA       GLU  65  -0.110  16.118   7.685
  503   1HB   GLU  65          2HB       GLU  65  -3.064  15.955   6.944
  504   2HB   GLU  65          3HB       GLU  65  -2.448  15.797   8.577
  505   1HG   GLU  65          2HG       GLU  65  -1.352  18.188   7.279
  506   2HG   GLU  65          3HG       GLU  65  -3.103  18.202   7.230
  507    H    PHE  66           HN       PHE  66  -1.452  14.222   5.031
  508    HA   PHE  66           HA       PHE  66  -1.948  11.836   6.352
  509   1HB   PHE  66          2HB       PHE  66  -2.350  12.698   3.884
  510   2HB   PHE  66          3HB       PHE  66  -0.703  12.188   3.570
  511    HD1  PHE  66           HD1      PHE  66  -0.723  10.273   2.293
  512    HD2  PHE  66           HD2      PHE  66  -3.509  10.614   5.475
  513    HE1  PHE  66           HE1      PHE  66  -1.532   7.942   1.834
  514    HE2  PHE  66           HE2      PHE  66  -4.318   8.283   5.016
  515    HZ   PHE  66           HZ       PHE  66  -3.320   6.974   3.201
  516    H    GLN  67           HN       GLN  67   1.093  13.221   5.008
  517    HA   GLN  67           HA       GLN  67   2.600  10.917   5.237
  518   1HB   GLN  67          2HB       GLN  67   3.517  13.817   5.480
  519   2HB   GLN  67          3HB       GLN  67   4.556  12.450   5.131
  520   1HG   GLN  67          2HG       GLN  67   2.619  12.123   3.194
  521   2HG   GLN  67          3HG       GLN  67   2.626  13.868   3.351
  522   1HE2  GLN  67          1HE2      GLN  67   3.371  12.859   1.016
  523   2HE2  GLN  67          2HE2      GLN  67   5.077  12.994   0.743
  524    H    VAL  68           HN       VAL  68   1.154  12.849   7.669
  525    HA   VAL  68           HA       VAL  68   3.187  12.496   9.653
  526    HB   VAL  68           HB       VAL  68   0.280  13.254   9.981
  527   1HG1  VAL  68          1HG1      VAL  68   2.746  13.645  11.700
  528   2HG1  VAL  68          2HG1      VAL  68   1.221  14.525  11.957
  529   3HG1  VAL  68          3HG1      VAL  68   1.259  12.751  12.099
  530   1HG2  VAL  68          1HG2      VAL  68   1.456  14.660   8.273
  531   2HG2  VAL  68          2HG2      VAL  68   0.909  15.563   9.707
  532   3HG2  VAL  68          3HG2      VAL  68   2.626  15.127   9.531
  533    H    LEU  69           HN       LEU  69   0.163  10.863   8.621
  534    HA   LEU  69           HA       LEU  69   0.186   9.082  10.852
  535   1HB   LEU  69          2HB       LEU  69  -1.771   9.936   9.348
  536   2HB   LEU  69          3HB       LEU  69  -1.311   8.609   8.299
  537    HG   LEU  69           HG       LEU  69  -1.797   6.980   9.980
  538   1HD1  LEU  69          1HD1      LEU  69  -1.229   7.538  12.075
  539   2HD1  LEU  69          2HD1      LEU  69  -1.550   9.269  11.812
  540   3HD1  LEU  69          3HD1      LEU  69  -2.893   8.161  12.187
  541   1HD2  LEU  69          1HD2      LEU  69  -3.908   9.107   9.653
  542   2HD2  LEU  69          2HD2      LEU  69  -3.757   7.534   8.833
  543   3HD2  LEU  69          3HD2      LEU  69  -4.222   7.601  10.550
  544    H    VAL  70           HN       VAL  70   1.534   9.174   7.564
  545    HA   VAL  70           HA       VAL  70   2.010   6.484   7.184
  546    HB   VAL  70           HB       VAL  70   3.268   9.039   6.278
  547   1HG1  VAL  70          1HG1      VAL  70   4.654   7.474   4.695
  548   2HG1  VAL  70          2HG1      VAL  70   5.264   7.860   6.322
  549   3HG1  VAL  70          3HG1      VAL  70   4.472   6.295   6.017
  550   1HG2  VAL  70          1HG2      VAL  70   1.759   6.761   4.975
  551   2HG2  VAL  70          2HG2      VAL  70   1.273   8.466   5.136
  552   3HG2  VAL  70          3HG2      VAL  70   2.599   8.019   4.036
  553    H    LYS  71           HN       LYS  71   3.454   8.776   9.431
  554    HA   LYS  71           HA       LYS  71   5.853   7.322   9.841
  555   1HB   LYS  71          2HB       LYS  71   4.967   9.833  10.460
  556   2HB   LYS  71          3HB       LYS  71   4.848   9.047  12.021
  557   1HG   LYS  71          2HG       LYS  71   7.298   8.115  11.221
  558   2HG   LYS  71          3HG       LYS  71   7.276   9.652  10.378
  559   1HD   LYS  71          2HD       LYS  71   7.485  10.859  12.312
  560   2HD   LYS  71          3HD       LYS  71   6.318   9.872  13.169
  561   1HE   LYS  71          2HE       LYS  71   8.048   8.922  14.291
  562   2HE   LYS  71          3HE       LYS  71   8.531   8.153  12.792
  563   1HZ   LYS  71          1HZ       LYS  71   9.509  10.601  12.480
  564   2HZ   LYS  71          2HZ       LYS  71   9.657  10.435  14.098
  565   3HZ   LYS  71          3HZ       LYS  71  10.362   9.353  13.098
  566    H    LYS  72           HN       LYS  72   2.590   7.373  11.354
  567    HA   LYS  72           HA       LYS  72   3.312   5.598  13.439
  568   1HB   LYS  72          2HB       LYS  72   0.654   6.502  12.307
  569   2HB   LYS  72          3HB       LYS  72   0.789   5.407  13.668
  570   1HG   LYS  72          2HG       LYS  72   2.136   8.145  13.582
  571   2HG   LYS  72          3HG       LYS  72   0.552   7.875  14.281
  572   1HD   LYS  72          2HD       LYS  72   2.296   5.875  15.380
  573   2HD   LYS  72          3HD       LYS  72   3.156   7.399  15.465
  574   1HE   LYS  72          2HE       LYS  72   0.269   7.459  16.286
  575   2HE   LYS  72          3HE       LYS  72   1.360   6.598  17.353
  576   1HZ   LYS  72          1HZ       LYS  72   1.201   8.930  17.901
  577   2HZ   LYS  72          2HZ       LYS  72   2.729   8.555  17.462
  578   3HZ   LYS  72          3HZ       LYS  72   1.756   9.359  16.426
  579    H    ILE  73           HN       ILE  73   2.045   5.246  10.107
  580    HA   ILE  73           HA       ILE  73   1.541   2.456  10.418
  581    HB   ILE  73           HB       ILE  73   1.702   4.268   8.011
  582   1HG1  ILE  73          2HG1      ILE  73  -0.836   3.030   8.957
  583   2HG1  ILE  73          3HG1      ILE  73  -0.170   4.317   9.942
  584   1HG2  ILE  73          1HG2      ILE  73   1.977   2.364   6.853
  585   2HG2  ILE  73          2HG2      ILE  73   1.474   1.335   8.216
  586   3HG2  ILE  73          3HG2      ILE  73   0.247   2.120   7.192
  587   1HD1  ILE  73          1HD1      ILE  73   0.080   5.656   7.724
  588   2HD1  ILE  73          2HD1      ILE  73  -1.002   4.428   7.023
  589   3HD1  ILE  73          3HD1      ILE  73  -1.563   5.440   8.376
  590    H    SER  74           HN       SER  74   4.370   4.294  10.317
  591    HA   SER  74           HA       SER  74   5.833   2.360   8.769
  592   1HB   SER  74          2HB       SER  74   6.129   5.073   9.138
  593   2HB   SER  74          3HB       SER  74   7.312   4.461  10.277
  594    HG   SER  74           HG       SER  74   8.602   4.053   8.630
  595    H    GLN  75           HN       GLN  75   5.549   3.588  12.156
  596    HA   GLN  75           HA       GLN  75   7.568   1.905  13.139
  597   1HB   GLN  75          2HB       GLN  75   6.140   4.072  14.105
  598   2HB   GLN  75          3HB       GLN  75   5.462   2.760  15.048
  599   1HG   GLN  75          2HG       GLN  75   7.304   3.363  16.366
  600   2HG   GLN  75          3HG       GLN  75   7.976   2.047  15.424
  601   1HE2  GLN  75          1HE2      GLN  75   7.281   5.494  14.830
  602   2HE2  GLN  75          2HE2      GLN  75   8.854   5.938  14.256
  Start of MODEL   10
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   2.143  -1.033  -1.585
    3   1HB   LYS   1          2HB       LYS   1   0.313   1.012  -1.974
    4   2HB   LYS   1          3HB       LYS   1   1.819   1.731  -2.507
    5   1HG   LYS   1          2HG       LYS   1   0.898   0.627  -4.434
    6   2HG   LYS   1          3HG       LYS   1   2.234  -0.373  -3.900
    7   1HD   LYS   1          2HD       LYS   1   0.606  -1.831  -2.642
    8   2HD   LYS   1          3HD       LYS   1  -0.713  -0.855  -3.255
    9   1HE   LYS   1          2HE       LYS   1  -0.123  -1.453  -5.586
   10   2HE   LYS   1          3HE       LYS   1   1.279  -2.345  -5.030
   11   1HZ   LYS   1          1HZ       LYS   1  -0.116  -3.887  -3.950
   12   2HZ   LYS   1          2HZ       LYS   1  -1.458  -2.988  -4.188
   13   3HZ   LYS   1          3HZ       LYS   1  -0.718  -3.701  -5.457
   14    H    SER   2           HN       SER   2   4.004   0.236  -2.958
   15    HA   SER   2           HA       SER   2   6.019   0.632  -0.990
   16   1HB   SER   2          2HB       SER   2   5.911  -0.227  -3.692
   17   2HB   SER   2          3HB       SER   2   6.845   1.255  -3.723
   18    HG   SER   2           HG       SER   2   7.447  -1.241  -2.529
   19    HA   PRO   3           HA       PRO   3   6.156   4.978  -1.142
   20   1HB   PRO   3          2HB       PRO   3   8.810   5.557  -0.848
   21   2HB   PRO   3          3HB       PRO   3   7.776   5.098   0.490
   22   1HG   PRO   3          2HG       PRO   3   9.831   3.491  -0.902
   23   2HG   PRO   3          3HG       PRO   3   9.103   3.219   0.668
   24   1HD   PRO   3          2HD       PRO   3   8.500   1.828  -1.766
   25   2HD   PRO   3          3HD       PRO   3   7.692   1.637  -0.223
   26    H    GLU   4           HN       GLU   4   8.542   3.532  -3.274
   27    HA   GLU   4           HA       GLU   4   8.953   5.753  -4.824
   28   1HB   GLU   4          2HB       GLU   4   9.747   3.059  -4.831
   29   2HB   GLU   4          3HB       GLU   4   8.932   3.250  -6.371
   30   1HG   GLU   4          2HG       GLU   4  10.685   5.542  -5.764
   31   2HG   GLU   4          3HG       GLU   4  11.569   4.029  -5.774
   32    H    GLU   5           HN       GLU   5   6.298   3.361  -4.824
   33    HA   GLU   5           HA       GLU   5   5.259   4.155  -7.307
   34   1HB   GLU   5          2HB       GLU   5   4.594   2.280  -5.169
   35   2HB   GLU   5          3HB       GLU   5   3.147   3.084  -5.746
   36   1HG   GLU   5          2HG       GLU   5   4.451   2.522  -8.130
   37   2HG   GLU   5          3HG       GLU   5   4.921   1.151  -7.146
   38    H    LEU   6           HN       LEU   6   4.844   5.240  -3.930
   39    HA   LEU   6           HA       LEU   6   2.504   6.700  -4.256
   40   1HB   LEU   6          2HB       LEU   6   4.787   6.666  -2.354
   41   2HB   LEU   6          3HB       LEU   6   3.764   8.089  -2.348
   42    HG   LEU   6           HG       LEU   6   2.613   5.308  -2.106
   43   1HD1  LEU   6          1HD1      LEU   6   3.287   5.066  -0.004
   44   2HD1  LEU   6          2HD1      LEU   6   4.386   6.443  -0.262
   45   3HD1  LEU   6          3HD1      LEU   6   2.764   6.714   0.419
   46   1HD2  LEU   6          1HD2      LEU   6   0.646   6.318  -1.426
   47   2HD2  LEU   6          2HD2      LEU   6   1.458   7.829  -0.950
   48   3HD2  LEU   6          3HD2      LEU   6   1.238   7.441  -2.673
   49    H    LYS   7           HN       LYS   7   5.964   7.586  -4.791
   50    HA   LYS   7           HA       LYS   7   5.400  10.269  -5.434
   51   1HB   LYS   7          2HB       LYS   7   7.638   8.908  -4.818
   52   2HB   LYS   7          3HB       LYS   7   7.808   8.923  -6.561
   53   1HG   LYS   7          2HG       LYS   7   7.162  11.456  -4.999
   54   2HG   LYS   7          3HG       LYS   7   8.814  10.925  -5.246
   55   1HD   LYS   7          2HD       LYS   7   7.057  11.029  -7.682
   56   2HD   LYS   7          3HD       LYS   7   7.517  12.568  -6.982
   57   1HE   LYS   7          2HE       LYS   7   9.830  12.203  -7.351
   58   2HE   LYS   7          3HE       LYS   7   9.647  10.463  -7.437
   59   1HZ   LYS   7          1HZ       LYS   7   8.096  11.592  -9.438
   60   2HZ   LYS   7          2HZ       LYS   7   9.573  12.285  -9.519
   61   3HZ   LYS   7          3HZ       LYS   7   9.428  10.661  -9.602
   62    H    GLY   8           HN       GLY   8   6.027   7.330  -7.470
   63   1HA   GLY   8          1HA       GLY   8   5.771   8.507  -9.957
   64   2HA   GLY   8          2HA       GLY   8   5.398   6.839  -9.570
   65    H    ILE   9           HN       ILE   9   3.187   6.780  -8.053
   66    HA   ILE   9           HA       ILE   9   1.129   7.314  -9.805
   67    HB   ILE   9           HB       ILE   9   1.346   6.632  -6.913
   68   1HG1  ILE   9          2HG1      ILE   9   0.093   5.317  -9.338
   69   2HG1  ILE   9          3HG1      ILE   9   1.592   4.864  -8.551
   70   1HG2  ILE   9          1HG2      ILE   9  -1.092   6.610  -6.668
   71   2HG2  ILE   9          2HG2      ILE   9  -0.472   8.257  -6.937
   72   3HG2  ILE   9          3HG2      ILE   9  -1.262   7.375  -8.267
   73   1HD1  ILE   9          1HD1      ILE   9  -1.207   4.727  -7.343
   74   2HD1  ILE   9          2HD1      ILE   9  -0.163   3.356  -7.786
   75   3HD1  ILE   9          3HD1      ILE   9   0.287   4.415  -6.428
   76    H    PHE  10           HN       PHE  10   2.288   9.226  -6.957
   77    HA   PHE  10           HA       PHE  10   0.390  11.185  -6.979
   78   1HB   PHE  10          2HB       PHE  10   2.031  11.210  -5.239
   79   2HB   PHE  10          3HB       PHE  10   3.353  10.942  -6.357
   80    HD1  PHE  10           HD1      PHE  10   1.252  13.435  -4.746
   81    HD2  PHE  10           HD2      PHE  10   4.302  12.821  -7.632
   82    HE1  PHE  10           HE1      PHE  10   1.778  15.889  -4.712
   83    HE2  PHE  10           HE2      PHE  10   4.829  15.275  -7.598
   84    HZ   PHE  10           HZ       PHE  10   3.560  16.779  -6.139
   85    H    GLU  11           HN       GLU  11   3.564  11.213  -8.759
   86    HA   GLU  11           HA       GLU  11   3.072  13.632 -10.009
   87   1HB   GLU  11          2HB       GLU  11   5.168  11.779  -9.881
   88   2HB   GLU  11          3HB       GLU  11   4.726  11.764 -11.577
   89   1HG   GLU  11          2HG       GLU  11   4.678  14.494 -10.944
   90   2HG   GLU  11          3HG       GLU  11   6.026  13.897  -9.996
   91    H    LYS  12           HN       LYS  12   2.355  10.233 -10.951
   92    HA   LYS  12           HA       LYS  12   1.600  10.703 -13.570
   93   1HB   LYS  12          2HB       LYS  12   1.893   8.511 -12.086
   94   2HB   LYS  12          3HB       LYS  12   0.154   8.656 -11.936
   95   1HG   LYS  12          2HG       LYS  12   0.872   9.135 -14.701
   96   2HG   LYS  12          3HG       LYS  12   1.662   7.662 -14.173
   97   1HD   LYS  12          2HD       LYS  12  -0.632   6.950 -13.200
   98   2HD   LYS  12          3HD       LYS  12  -1.318   8.295 -14.090
   99   1HE   LYS  12          2HE       LYS  12  -0.684   7.363 -16.214
  100   2HE   LYS  12          3HE       LYS  12   0.437   6.234 -15.480
  101   1HZ   LYS  12          1HZ       LYS  12  -1.300   4.871 -15.699
  102   2HZ   LYS  12          2HZ       LYS  12  -1.810   5.533 -14.296
  103   3HZ   LYS  12          3HZ       LYS  12  -2.419   6.059 -15.716
  104    H    TYR  13           HN       TYR  13   0.078  11.606 -10.548
  105    HA   TYR  13           HA       TYR  13  -2.474  12.071 -11.882
  106   1HB   TYR  13          2HB       TYR  13  -1.289  11.843  -9.111
  107   2HB   TYR  13          3HB       TYR  13  -2.619  12.976  -9.250
  108    HD1  TYR  13           HD1      TYR  13  -4.802  12.199  -8.999
  109    HD2  TYR  13           HD2      TYR  13  -1.736   9.440 -10.136
  110    HE1  TYR  13           HE1      TYR  13  -6.453  10.275  -8.809
  111    HE2  TYR  13           HE2      TYR  13  -3.397   7.525  -9.942
  112    HH   TYR  13           HH       TYR  13  -6.717   8.124  -8.841
  113    H    ALA  14           HN       ALA  14   0.184  13.820 -10.162
  114    HA   ALA  14           HA       ALA  14  -1.002  16.350 -10.325
  115   1HB   ALA  14          1HB       ALA  14   1.004  15.467  -8.925
  116   2HB   ALA  14          2HB       ALA  14   1.981  15.835 -10.367
  117   3HB   ALA  14          3HB       ALA  14   1.080  17.133  -9.547
  118    H    ALA  15           HN       ALA  15   0.465  14.268 -12.715
  119    HA   ALA  15           HA       ALA  15   1.139  16.442 -14.487
  120   1HB   ALA  15          1HB       ALA  15   0.988  13.578 -15.367
  121   2HB   ALA  15          2HB       ALA  15   2.206  14.822 -15.737
  122   3HB   ALA  15          3HB       ALA  15   2.210  14.016 -14.150
  123    H    LYS  16           HN       LYS  16  -1.609  14.414 -13.688
  124    HA   LYS  16           HA       LYS  16  -2.930  14.342 -16.110
  125   1HB   LYS  16          2HB       LYS  16  -3.430  13.592 -13.469
  126   2HB   LYS  16          3HB       LYS  16  -4.706  14.737 -13.827
  127   1HG   LYS  16          2HG       LYS  16  -5.054  13.431 -16.042
  128   2HG   LYS  16          3HG       LYS  16  -4.014  12.196 -15.359
  129   1HD   LYS  16          2HD       LYS  16  -5.571  11.566 -13.742
  130   2HD   LYS  16          3HD       LYS  16  -6.267  13.170 -13.624
  131   1HE   LYS  16          2HE       LYS  16  -7.985  12.148 -14.792
  132   2HE   LYS  16          3HE       LYS  16  -7.013  12.647 -16.162
  133   1HZ   LYS  16          1HZ       LYS  16  -6.044  10.213 -15.244
  134   2HZ   LYS  16          2HZ       LYS  16  -7.664  10.073 -15.394
  135   3HZ   LYS  16          3HZ       LYS  16  -6.764  10.538 -16.674
  136    H    GLU  17           HN       GLU  17  -3.521  16.720 -13.419
  137    HA   GLU  17           HA       GLU  17  -4.195  18.615 -15.534
  138   1HB   GLU  17          2HB       GLU  17  -5.469  18.167 -12.813
  139   2HB   GLU  17          3HB       GLU  17  -5.668  19.682 -13.671
  140   1HG   GLU  17          2HG       GLU  17  -6.190  17.722 -15.632
  141   2HG   GLU  17          3HG       GLU  17  -6.928  17.071 -14.182
  142    H    GLY  18           HN       GLY  18  -3.068  20.539 -15.544
  143   1HA   GLY  18          1HA       GLY  18  -1.673  22.178 -14.884
  144   2HA   GLY  18          2HA       GLY  18  -2.032  21.768 -13.218
  145    H    ASP  19           HN       ASP  19   0.475  22.496 -13.417
  146    HA   ASP  19           HA       ASP  19   2.305  20.739 -14.438
  147   1HB   ASP  19          2HB       ASP  19   2.472  23.131 -13.222
  148   2HB   ASP  19          3HB       ASP  19   2.857  22.148 -11.823
  149    HA   PRO  20           HA       PRO  20   2.024  17.450 -11.535
  150   1HB   PRO  20          2HB       PRO  20   4.299  16.072 -12.164
  151   2HB   PRO  20          3HB       PRO  20   2.807  15.924 -13.071
  152   1HG   PRO  20          2HG       PRO  20   5.285  17.361 -13.801
  153   2HG   PRO  20          3HG       PRO  20   3.969  16.846 -14.838
  154   1HD   PRO  20          2HD       PRO  20   4.472  19.509 -13.898
  155   2HD   PRO  20          3HD       PRO  20   3.093  18.972 -14.838
  156    H    ASN  21           HN       ASN  21   4.108  19.959 -11.311
  157    HA   ASN  21           HA       ASN  21   5.504  18.829  -9.058
  158   1HB   ASN  21          2HB       ASN  21   5.693  21.452 -10.601
  159   2HB   ASN  21          3HB       ASN  21   6.515  21.265  -9.065
  160   1HD2  ASN  21          1HD2      ASN  21   5.996  19.506 -12.118
  161   2HD2  ASN  21          2HD2      ASN  21   7.616  18.928 -12.318
  162    H    GLN  22           HN       GLN  22   2.467  19.906  -9.507
  163    HA   GLN  22           HA       GLN  22   2.279  20.894  -6.835
  164   1HB   GLN  22          2HB       GLN  22   0.748  22.848  -7.934
  165   2HB   GLN  22          3HB       GLN  22   2.433  23.077  -7.511
  166   1HG   GLN  22          2HG       GLN  22   3.081  22.404  -9.857
  167   2HG   GLN  22          3HG       GLN  22   1.382  22.273 -10.265
  168   1HE2  GLN  22          1HE2      GLN  22   4.056  24.353  -9.682
  169   2HE2  GLN  22          2HE2      GLN  22   3.309  25.870 -10.061
  170    H    LEU  23           HN       LEU  23   0.454  20.024  -5.924
  171    HA   LEU  23           HA       LEU  23  -1.401  18.714  -7.728
  172   1HB   LEU  23          2HB       LEU  23  -0.905  18.593  -4.760
  173   2HB   LEU  23          3HB       LEU  23  -2.305  17.844  -5.503
  174    HG   LEU  23           HG       LEU  23  -0.099  16.484  -5.029
  175   1HD1  LEU  23          1HD1      LEU  23  -0.814  15.482  -7.563
  176   2HD1  LEU  23          2HD1      LEU  23  -1.422  14.973  -5.969
  177   3HD1  LEU  23          3HD1      LEU  23  -2.282  16.230  -6.889
  178   1HD2  LEU  23          1HD2      LEU  23   1.274  16.316  -7.137
  179   2HD2  LEU  23          2HD2      LEU  23   0.501  17.828  -7.672
  180   3HD2  LEU  23          3HD2      LEU  23   1.491  17.809  -6.193
  181    H    SER  24           HN       SER  24  -3.743  18.996  -7.517
  182    HA   SER  24           HA       SER  24  -4.388  21.619  -6.419
  183   1HB   SER  24          2HB       SER  24  -5.350  20.375  -9.031
  184   2HB   SER  24          3HB       SER  24  -6.077  21.803  -8.319
  185    HG   SER  24           HG       SER  24  -3.699  22.620  -8.325
  186    H    LYS  25           HN       LYS  25  -6.849  21.836  -5.993
  187    HA   LYS  25           HA       LYS  25  -7.666  19.829  -4.285
  188   1HB   LYS  25          2HB       LYS  25  -8.426  22.195  -4.258
  189   2HB   LYS  25          3HB       LYS  25  -9.381  21.895  -5.695
  190   1HG   LYS  25          2HG       LYS  25 -10.439  19.921  -4.312
  191   2HG   LYS  25          3HG       LYS  25  -9.752  20.726  -2.916
  192   1HD   LYS  25          2HD       LYS  25 -11.734  21.884  -2.918
  193   2HD   LYS  25          3HD       LYS  25 -10.937  22.871  -4.127
  194   1HE   LYS  25          2HE       LYS  25 -12.227  20.410  -5.208
  195   2HE   LYS  25          3HE       LYS  25 -13.345  21.563  -4.506
  196   1HZ   LYS  25          1HZ       LYS  25 -12.916  22.000  -6.829
  197   2HZ   LYS  25          2HZ       LYS  25 -12.418  23.256  -5.913
  198   3HZ   LYS  25          3HZ       LYS  25 -11.324  22.217  -6.537
  199    H    GLU  26           HN       GLU  26  -8.971  20.592  -7.595
  200    HA   GLU  26           HA       GLU  26 -10.613  18.407  -7.725
  201   1HB   GLU  26          2HB       GLU  26  -9.714  20.494  -9.470
  202   2HB   GLU  26          3HB       GLU  26  -9.542  18.989 -10.351
  203   1HG   GLU  26          2HG       GLU  26 -12.030  18.688  -9.107
  204   2HG   GLU  26          3HG       GLU  26 -12.002  20.396  -9.497
  205    H    GLU  27           HN       GLU  27  -7.124  18.754  -8.515
  206    HA   GLU  27           HA       GLU  27  -6.855  16.293  -9.765
  207   1HB   GLU  27          2HB       GLU  27  -5.113  18.422  -8.745
  208   2HB   GLU  27          3HB       GLU  27  -4.389  16.843  -8.517
  209   1HG   GLU  27          2HG       GLU  27  -5.546  16.825 -11.137
  210   2HG   GLU  27          3HG       GLU  27  -4.712  18.358 -10.978
  211    H    LEU  28           HN       LEU  28  -6.097  17.294  -6.349
  212    HA   LEU  28           HA       LEU  28  -5.348  14.808  -5.432
  213   1HB   LEU  28          2HB       LEU  28  -5.345  17.216  -4.383
  214   2HB   LEU  28          3HB       LEU  28  -6.874  16.707  -3.696
  215    HG   LEU  28           HG       LEU  28  -5.907  15.114  -2.327
  216   1HD1  LEU  28          1HD1      LEU  28  -4.737  13.741  -3.832
  217   2HD1  LEU  28          2HD1      LEU  28  -3.617  15.046  -4.293
  218   3HD1  LEU  28          3HD1      LEU  28  -3.510  14.310  -2.676
  219   1HD2  LEU  28          1HD2      LEU  28  -5.248  17.321  -1.578
  220   2HD2  LEU  28          2HD2      LEU  28  -3.950  16.152  -1.237
  221   3HD2  LEU  28          3HD2      LEU  28  -3.799  17.274  -2.611
  222    H    LYS  29           HN       LYS  29  -8.631  16.302  -5.649
  223    HA   LYS  29           HA       LYS  29 -10.127  14.508  -4.325
  224   1HB   LYS  29          2HB       LYS  29 -11.010  16.505  -5.415
  225   2HB   LYS  29          3HB       LYS  29 -10.740  15.803  -6.998
  226   1HG   LYS  29          2HG       LYS  29 -12.379  14.051  -6.599
  227   2HG   LYS  29          3HG       LYS  29 -12.496  14.459  -4.898
  228   1HD   LYS  29          2HD       LYS  29 -14.220  15.838  -5.418
  229   2HD   LYS  29          3HD       LYS  29 -13.070  16.885  -6.226
  230   1HE   LYS  29          2HE       LYS  29 -14.234  16.462  -8.137
  231   2HE   LYS  29          3HE       LYS  29 -13.479  14.881  -8.126
  232   1HZ   LYS  29          1HZ       LYS  29 -16.117  15.349  -7.952
  233   2HZ   LYS  29          2HZ       LYS  29 -15.386  13.942  -7.560
  234   3HZ   LYS  29          3HZ       LYS  29 -15.728  15.037  -6.397
  235    H    LEU  30           HN       LEU  30  -9.076  14.160  -7.786
  236    HA   LEU  30           HA       LEU  30 -10.184  11.675  -8.206
  237   1HB   LEU  30          2HB       LEU  30  -7.635  12.819  -9.357
  238   2HB   LEU  30          3HB       LEU  30  -8.537  11.466 -10.011
  239    HG   LEU  30           HG       LEU  30  -9.246  14.387  -9.995
  240   1HD1  LEU  30          1HD1      LEU  30  -9.035  14.271 -12.227
  241   2HD1  LEU  30          2HD1      LEU  30  -8.097  12.798 -11.881
  242   3HD1  LEU  30          3HD1      LEU  30  -9.816  12.675 -12.328
  243   1HD2  LEU  30          1HD2      LEU  30 -11.199  13.237  -9.046
  244   2HD2  LEU  30          2HD2      LEU  30 -11.528  13.883 -10.671
  245   3HD2  LEU  30          3HD2      LEU  30 -11.231  12.142 -10.448
  246    H    LEU  31           HN       LEU  31  -6.791  12.454  -7.157
  247    HA   LEU  31           HA       LEU  31  -5.936   9.874  -6.820
  248   1HB   LEU  31          2HB       LEU  31  -4.751  12.187  -6.638
  249   2HB   LEU  31          3HB       LEU  31  -5.131  12.060  -4.932
  250    HG   LEU  31           HG       LEU  31  -3.981   9.581  -5.627
  251   1HD1  LEU  31          1HD1      LEU  31  -2.725   9.977  -7.428
  252   2HD1  LEU  31          2HD1      LEU  31  -2.949  11.738  -7.310
  253   3HD1  LEU  31          3HD1      LEU  31  -1.687  10.936  -6.345
  254   1HD2  LEU  31          1HD2      LEU  31  -2.595  10.012  -3.870
  255   2HD2  LEU  31          2HD2      LEU  31  -2.321  11.705  -4.348
  256   3HD2  LEU  31          3HD2      LEU  31  -3.846  11.239  -3.557
  257    H    LEU  32           HN       LEU  32  -7.177  12.029  -4.163
  258    HA   LEU  32           HA       LEU  32  -7.330  10.100  -2.234
  259   1HB   LEU  32          2HB       LEU  32  -9.221  12.422  -2.629
  260   2HB   LEU  32          3HB       LEU  32  -8.932  11.557  -1.133
  261    HG   LEU  32           HG       LEU  32  -6.772  13.083  -2.605
  262   1HD1  LEU  32          1HD1      LEU  32  -8.362  14.741  -2.066
  263   2HD1  LEU  32          2HD1      LEU  32  -8.696  14.020  -0.473
  264   3HD1  LEU  32          3HD1      LEU  32  -7.132  14.812  -0.782
  265   1HD2  LEU  32          1HD2      LEU  32  -5.422  12.073  -1.161
  266   2HD2  LEU  32          2HD2      LEU  32  -6.239  12.967   0.143
  267   3HD2  LEU  32          3HD2      LEU  32  -6.795  11.336  -0.301
  268    H    GLN  33           HN       GLN  33  -9.222  10.443  -5.146
  269    HA   GLN  33           HA       GLN  33 -11.507   9.113  -4.218
  270   1HB   GLN  33          2HB       GLN  33 -10.815  10.494  -6.507
  271   2HB   GLN  33          3HB       GLN  33 -10.836   8.846  -7.103
  272   1HG   GLN  33          2HG       GLN  33 -13.144   8.802  -5.655
  273   2HG   GLN  33          3HG       GLN  33 -13.094  10.512  -6.034
  274   1HE2  GLN  33          1HE2      GLN  33 -12.800  11.139  -8.282
  275   2HE2  GLN  33          2HE2      GLN  33 -13.487  10.172  -9.545
  276    H    THR  34           HN       THR  34  -8.543   8.047  -6.005
  277    HA   THR  34           HA       THR  34  -9.392   5.267  -5.603
  278    HB   THR  34           HB       THR  34  -7.847   6.801  -7.643
  279    HG1  THR  34           HG1      THR  34  -8.756   4.769  -8.753
  280   1HG2  THR  34          1HG2      THR  34  -6.080   5.250  -6.591
  281   2HG2  THR  34          2HG2      THR  34  -7.139   3.889  -7.033
  282   3HG2  THR  34          3HG2      THR  34  -6.445   4.926  -8.303
  283    H    GLU  35           HN       GLU  35  -6.489   7.408  -5.242
  284    HA   GLU  35           HA       GLU  35  -4.859   5.647  -4.038
  285   1HB   GLU  35          2HB       GLU  35  -4.067   7.849  -4.585
  286   2HB   GLU  35          3HB       GLU  35  -5.255   8.621  -3.553
  287   1HG   GLU  35          2HG       GLU  35  -3.840   8.520  -1.787
  288   2HG   GLU  35          3HG       GLU  35  -3.745   6.776  -1.926
  289    H    PHE  36           HN       PHE  36  -7.190   7.857  -2.323
  290    HA   PHE  36           HA       PHE  36  -7.611   5.786  -0.354
  291   1HB   PHE  36          2HB       PHE  36  -6.471   8.591   0.190
  292   2HB   PHE  36          3HB       PHE  36  -7.121   7.574   1.461
  293    HD1  PHE  36           HD1      PHE  36  -4.186   8.727   0.469
  294    HD2  PHE  36           HD2      PHE  36  -6.063   4.945   0.894
  295    HE1  PHE  36           HE1      PHE  36  -1.939   7.644   0.750
  296    HE2  PHE  36           HE2      PHE  36  -3.816   3.862   1.176
  297    HZ   PHE  36           HZ       PHE  36  -1.782   5.224   1.100
  298    HA   PRO  37           HA       PRO  37 -11.341   8.099  -1.244
  299   1HB   PRO  37          2HB       PRO  37 -13.030   5.953  -1.340
  300   2HB   PRO  37          3HB       PRO  37 -12.222   6.601  -2.754
  301   1HG   PRO  37          2HG       PRO  37 -11.615   4.136  -1.238
  302   2HG   PRO  37          3HG       PRO  37 -11.119   4.578  -2.860
  303   1HD   PRO  37          2HD       PRO  37  -9.504   4.653  -0.491
  304   2HD   PRO  37          3HD       PRO  37  -9.045   5.204  -2.090
  305    H    SER  38           HN       SER  38 -10.727   5.636   1.130
  306    HA   SER  38           HA       SER  38 -12.910   6.091   2.715
  307   1HB   SER  38          2HB       SER  38 -10.737   4.445   2.825
  308   2HB   SER  38          3HB       SER  38 -10.302   5.578   4.089
  309    HG   SER  38           HG       SER  38 -12.830   5.082   4.606
  310    H    LEU  39           HN       LEU  39  -9.991   8.013   2.181
  311    HA   LEU  39           HA       LEU  39 -10.161   9.525   4.571
  312   1HB   LEU  39          2HB       LEU  39  -8.410   9.241   2.371
  313   2HB   LEU  39          3HB       LEU  39  -8.876  10.929   2.419
  314    HG   LEU  39           HG       LEU  39  -7.598   9.338   4.657
  315   1HD1  LEU  39          1HD1      LEU  39  -6.022   9.917   2.921
  316   2HD1  LEU  39          2HD1      LEU  39  -6.567  11.611   2.939
  317   3HD1  LEU  39          3HD1      LEU  39  -5.728  10.931   4.353
  318   1HD2  LEU  39          1HD2      LEU  39  -7.517  11.518   5.873
  319   2HD2  LEU  39          2HD2      LEU  39  -8.613  12.191   4.642
  320   3HD2  LEU  39          3HD2      LEU  39  -9.154  10.847   5.677
  321    H    LEU  40           HN       LEU  40 -11.955   9.455   1.591
  322    HA   LEU  40           HA       LEU  40 -12.728  12.199   1.647
  323   1HB   LEU  40          2HB       LEU  40 -13.900   9.821   0.199
  324   2HB   LEU  40          3HB       LEU  40 -14.341  11.495  -0.075
  325    HG   LEU  40           HG       LEU  40 -11.554  10.382  -0.493
  326   1HD1  LEU  40          1HD1      LEU  40 -13.792  10.832  -2.482
  327   2HD1  LEU  40          2HD1      LEU  40 -12.091  10.549  -2.923
  328   3HD1  LEU  40          3HD1      LEU  40 -13.007   9.292  -2.057
  329   1HD2  LEU  40          1HD2      LEU  40 -10.924  12.504  -0.620
  330   2HD2  LEU  40          2HD2      LEU  40 -11.994  12.705  -2.028
  331   3HD2  LEU  40          3HD2      LEU  40 -12.599  13.062  -0.392
  332    H    LYS  41           HN       LYS  41 -13.751   9.207   3.208
  333    HA   LYS  41           HA       LYS  41 -16.365  10.114   3.847
  334   1HB   LYS  41          2HB       LYS  41 -16.640   8.067   4.826
  335   2HB   LYS  41          3HB       LYS  41 -15.323   7.696   3.733
  336   1HG   LYS  41          2HG       LYS  41 -14.378   6.850   5.663
  337   2HG   LYS  41          3HG       LYS  41 -13.837   8.507   5.839
  338   1HD   LYS  41          2HD       LYS  41 -14.997   8.689   7.776
  339   2HD   LYS  41          3HD       LYS  41 -16.494   8.391   6.917
  340   1HE   LYS  41          2HE       LYS  41 -15.639   5.835   7.045
  341   2HE   LYS  41          3HE       LYS  41 -14.750   6.449   8.425
  342   1HZ   LYS  41          1HZ       LYS  41 -17.410   5.787   8.324
  343   2HZ   LYS  41          2HZ       LYS  41 -16.607   6.457   9.578
  344   3HZ   LYS  41          3HZ       LYS  41 -17.374   7.410   8.497
  345    H    GLY  42           HN       GLY  42 -13.121  10.372   5.307
  346   1HA   GLY  42          1HA       GLY  42 -13.558  10.979   7.889
  347   2HA   GLY  42          2HA       GLY  42 -12.397  11.825   6.886
  348    H    MET  43           HN       MET  43 -13.636  13.149   9.025
  349    HA   MET  43           HA       MET  43 -15.934  14.524   8.118
  350   1HB   MET  43          2HB       MET  43 -13.954  15.101  10.393
  351   2HB   MET  43          3HB       MET  43 -15.502  15.902  10.210
  352   1HG   MET  43          2HG       MET  43 -16.734  13.942  10.724
  353   2HG   MET  43          3HG       MET  43 -15.414  12.874  10.290
  354   1HE   MET  43          1HE       MET  43 -17.075  13.063  13.596
  355   2HE   MET  43          2HE       MET  43 -16.571  11.925  12.324
  356   3HE   MET  43          3HE       MET  43 -15.698  11.970  13.875
  357    H    SER  44           HN       SER  44 -12.739  14.695   7.135
  358    HA   SER  44           HA       SER  44 -12.701  17.570   6.918
  359   1HB   SER  44          2HB       SER  44 -10.432  16.893   5.683
  360   2HB   SER  44          3HB       SER  44 -10.546  16.907   7.432
  361    HG   SER  44           HG       SER  44 -11.160  14.524   5.932
  362    H    THR  45           HN       THR  45 -14.161  18.210   5.316
  363    HA   THR  45           HA       THR  45 -14.663  16.716   2.986
  364    HB   THR  45           HB       THR  45 -15.854  18.826   2.324
  365    HG1  THR  45           HG1      THR  45 -14.993  20.653   3.227
  366   1HG2  THR  45          1HG2      THR  45 -16.075  17.765   5.150
  367   2HG2  THR  45          2HG2      THR  45 -16.957  19.255   4.736
  368   3HG2  THR  45          3HG2      THR  45 -17.289  17.749   3.848
  369    H    LEU  46           HN       LEU  46 -14.367  17.732   0.714
  370    HA   LEU  46           HA       LEU  46 -11.704  17.579   0.077
  371   1HB   LEU  46          2HB       LEU  46 -13.944  17.528  -1.317
  372   2HB   LEU  46          3HB       LEU  46 -13.561  19.214  -1.597
  373    HG   LEU  46           HG       LEU  46 -11.558  18.699  -2.741
  374   1HD1  LEU  46          1HD1      LEU  46 -11.771  16.066  -1.351
  375   2HD1  LEU  46          2HD1      LEU  46 -10.969  16.121  -2.940
  376   3HD1  LEU  46          3HD1      LEU  46 -10.363  17.126  -1.601
  377   1HD2  LEU  46          1HD2      LEU  46 -12.566  18.031  -4.609
  378   2HD2  LEU  46          2HD2      LEU  46 -12.906  16.416  -3.943
  379   3HD2  LEU  46          3HD2      LEU  46 -14.022  17.764  -3.621
  380    H    ASP  47           HN       ASP  47 -13.689  20.630   0.072
  381    HA   ASP  47           HA       ASP  47 -11.738  22.384  -0.333
  382   1HB   ASP  47          2HB       ASP  47 -14.343  22.389   1.009
  383   2HB   ASP  47          3HB       ASP  47 -13.265  23.545   1.765
  384    H    GLU  48           HN       GLU  48 -12.809  21.073   2.895
  385    HA   GLU  48           HA       GLU  48 -11.027  22.444   4.445
  386   1HB   GLU  48          2HB       GLU  48 -12.826  20.179   4.727
  387   2HB   GLU  48          3HB       GLU  48 -11.347  19.859   5.610
  388   1HG   GLU  48          2HG       GLU  48 -11.709  22.417   6.405
  389   2HG   GLU  48          3HG       GLU  48 -13.380  22.041   6.033
  390    H    LEU  49           HN       LEU  49 -10.656  19.241   2.799
  391    HA   LEU  49           HA       LEU  49  -8.138  18.654   3.830
  392   1HB   LEU  49          2HB       LEU  49  -9.970  17.373   2.315
  393   2HB   LEU  49          3HB       LEU  49  -8.788  17.768   1.083
  394    HG   LEU  49           HG       LEU  49  -7.090  16.741   2.847
  395   1HD1  LEU  49          1HD1      LEU  49  -8.511  14.631   3.728
  396   2HD1  LEU  49          2HD1      LEU  49  -8.218  16.097   4.695
  397   3HD1  LEU  49          3HD1      LEU  49  -9.759  15.897   3.826
  398   1HD2  LEU  49          1HD2      LEU  49  -8.224  15.913   0.470
  399   2HD2  LEU  49          2HD2      LEU  49  -6.861  15.138   1.313
  400   3HD2  LEU  49          3HD2      LEU  49  -8.518  14.537   1.561
  401    H    PHE  50           HN       PHE  50  -9.164  20.462   0.877
  402    HA   PHE  50           HA       PHE  50  -6.619  20.833  -0.163
  403   1HB   PHE  50          2HB       PHE  50  -8.962  21.284  -1.166
  404   2HB   PHE  50          3HB       PHE  50  -9.048  22.722  -0.168
  405    HD1  PHE  50           HD1      PHE  50  -6.530  21.203  -2.484
  406    HD2  PHE  50           HD2      PHE  50  -8.664  24.676  -1.307
  407    HE1  PHE  50           HE1      PHE  50  -5.379  22.520  -4.284
  408    HE2  PHE  50           HE2      PHE  50  -7.513  25.994  -3.107
  409    HZ   PHE  50           HZ       PHE  50  -5.884  24.900  -4.574
  410    H    GLU  51           HN       GLU  51  -8.595  22.975   2.007
  411    HA   GLU  51           HA       GLU  51  -6.632  24.938   2.171
  412   1HB   GLU  51          2HB       GLU  51  -9.222  24.327   3.428
  413   2HB   GLU  51          3HB       GLU  51  -8.121  25.110   4.544
  414   1HG   GLU  51          2HG       GLU  51  -7.663  26.816   2.627
  415   2HG   GLU  51          3HG       GLU  51  -9.075  26.136   1.842
  416    H    GLU  52           HN       GLU  52  -7.444  22.105   4.268
  417    HA   GLU  52           HA       GLU  52  -5.614  22.697   6.255
  418   1HB   GLU  52          2HB       GLU  52  -7.559  20.944   6.158
  419   2HB   GLU  52          3HB       GLU  52  -6.363  19.864   5.468
  420   1HG   GLU  52          2HG       GLU  52  -4.909  20.133   7.443
  421   2HG   GLU  52          3HG       GLU  52  -5.986  21.340   8.116
  422    H    LEU  53           HN       LEU  53  -5.347  20.393   3.450
  423    HA   LEU  53           HA       LEU  53  -2.713  19.670   3.921
  424   1HB   LEU  53          2HB       LEU  53  -4.200  19.827   1.296
  425   2HB   LEU  53          3HB       LEU  53  -2.721  18.933   1.587
  426    HG   LEU  53           HG       LEU  53  -5.148  18.335   3.251
  427   1HD1  LEU  53          1HD1      LEU  53  -5.366  16.468   1.293
  428   2HD1  LEU  53          2HD1      LEU  53  -6.332  17.961   1.376
  429   3HD1  LEU  53          3HD1      LEU  53  -4.884  17.895   0.343
  430   1HD2  LEU  53          1HD2      LEU  53  -2.629  17.373   3.352
  431   2HD2  LEU  53          2HD2      LEU  53  -4.068  16.443   3.834
  432   3HD2  LEU  53          3HD2      LEU  53  -3.359  16.213   2.217
  433    H    ASP  54           HN       ASP  54  -4.073  22.273   1.791
  434    HA   ASP  54           HA       ASP  54  -1.501  23.173   1.094
  435   1HB   ASP  54          2HB       ASP  54  -3.848  23.498  -0.078
  436   2HB   ASP  54          3HB       ASP  54  -4.012  24.877   0.991
  437    H    LYS  55           HN       LYS  55  -0.310  23.750   3.000
  438    HA   LYS  55           HA       LYS  55  -1.541  25.846   4.650
  439   1HB   LYS  55          2HB       LYS  55  -0.050  23.406   5.312
  440   2HB   LYS  55          3HB       LYS  55   0.587  24.834   6.101
  441   1HG   LYS  55          2HG       LYS  55  -2.061  25.288   6.513
  442   2HG   LYS  55          3HG       LYS  55  -2.108  23.540   6.398
  443   1HD   LYS  55          2HD       LYS  55  -0.003  23.725   8.067
  444   2HD   LYS  55          3HD       LYS  55  -0.728  25.275   8.444
  445   1HE   LYS  55          2HE       LYS  55  -2.852  24.206   9.057
  446   2HE   LYS  55          3HE       LYS  55  -2.282  22.646   8.496
  447   1HZ   LYS  55          1HZ       LYS  55  -2.118  23.179  10.953
  448   2HZ   LYS  55          2HZ       LYS  55  -0.815  22.492  10.247
  449   3HZ   LYS  55          3HZ       LYS  55  -0.820  24.093  10.570
  450    H    ASN  56           HN       ASN  56   0.607  25.282   2.131
  451    HA   ASN  56           HA       ASN  56   2.619  27.094   3.045
  452   1HB   ASN  56          2HB       ASN  56   2.108  25.685   0.378
  453   2HB   ASN  56          3HB       ASN  56   3.453  26.783   0.614
  454   1HD2  ASN  56          1HD2      ASN  56   4.682  26.348   2.752
  455   2HD2  ASN  56          2HD2      ASN  56   5.142  24.703   3.044
  456    H    GLY  57           HN       GLY  57  -0.480  27.627   2.327
  457   1HA   GLY  57          1HA       GLY  57  -1.713  29.154   1.177
  458   2HA   GLY  57          2HA       GLY  57  -0.522  30.247   1.853
  459    H    ASP  58           HN       ASP  58  -0.690  27.835  -0.874
  460    HA   ASP  58           HA       ASP  58   0.340  29.961  -2.571
  461   1HB   ASP  58          2HB       ASP  58   1.160  27.021  -2.691
  462   2HB   ASP  58          3HB       ASP  58   1.729  28.281  -3.768
  463    H    GLY  59           HN       GLY  59  -1.146  26.651  -2.334
  464   1HA   GLY  59          1HA       GLY  59  -3.373  26.408  -3.290
  465   2HA   GLY  59          2HA       GLY  59  -2.820  27.319  -4.681
  466    H    GLU  60           HN       GLU  60  -0.436  25.190  -3.267
  467    HA   GLU  60           HA       GLU  60  -1.127  23.143  -5.217
  468   1HB   GLU  60          2HB       GLU  60   1.703  24.167  -4.720
  469   2HB   GLU  60          3HB       GLU  60   1.235  22.928  -5.868
  470   1HG   GLU  60          2HG       GLU  60   1.204  24.698  -7.339
  471   2HG   GLU  60          3HG       GLU  60  -0.418  24.914  -6.714
  472    H    VAL  61           HN       VAL  61  -1.112  21.088  -4.368
  473    HA   VAL  61           HA       VAL  61  -0.060  20.838  -1.650
  474    HB   VAL  61           HB       VAL  61  -2.099  19.291  -3.251
  475   1HG1  VAL  61          1HG1      VAL  61  -0.611  18.539  -0.770
  476   2HG1  VAL  61          2HG1      VAL  61  -2.350  18.165  -0.844
  477   3HG1  VAL  61          3HG1      VAL  61  -1.246  17.517  -2.082
  478   1HG2  VAL  61          1HG2      VAL  61  -2.560  20.546  -0.558
  479   2HG2  VAL  61          2HG2      VAL  61  -2.565  21.563  -2.020
  480   3HG2  VAL  61          3HG2      VAL  61  -3.714  20.212  -1.871
  481    H    SER  62           HN       SER  62   2.086  20.964  -3.111
  482    HA   SER  62           HA       SER  62   2.855  18.931  -4.701
  483   1HB   SER  62          2HB       SER  62   5.144  19.492  -3.158
  484   2HB   SER  62          3HB       SER  62   4.669  20.275  -4.651
  485    HG   SER  62           HG       SER  62   3.871  21.098  -1.988
  486    H    PHE  63           HN       PHE  63   4.737  17.258  -4.002
  487    HA   PHE  63           HA       PHE  63   3.514  15.307  -2.472
  488   1HB   PHE  63          2HB       PHE  63   5.455  15.236  -4.220
  489   2HB   PHE  63          3HB       PHE  63   6.518  15.768  -2.932
  490    HD1  PHE  63           HD1      PHE  63   7.872  14.035  -2.259
  491    HD2  PHE  63           HD2      PHE  63   3.791  13.214  -3.085
  492    HE1  PHE  63           HE1      PHE  63   8.209  11.651  -1.551
  493    HE2  PHE  63           HE2      PHE  63   4.128  10.829  -2.377
  494    HZ   PHE  63           HZ       PHE  63   6.333  10.076  -1.619
  495    H    GLU  64           HN       GLU  64   5.232  18.161  -1.479
  496    HA   GLU  64           HA       GLU  64   6.296  17.144   0.904
  497   1HB   GLU  64          2HB       GLU  64   5.504  20.037   0.681
  498   2HB   GLU  64          3HB       GLU  64   6.977  19.335   1.320
  499   1HG   GLU  64          2HG       GLU  64   6.211  19.822  -1.568
  500   2HG   GLU  64          3HG       GLU  64   7.682  20.279  -0.732
  501    H    GLU  65           HN       GLU  65   3.321  19.108   0.181
  502    HA   GLU  65           HA       GLU  65   2.426  18.985   2.833
  503   1HB   GLU  65          2HB       GLU  65   1.064  19.674   0.202
  504   2HB   GLU  65          3HB       GLU  65   0.208  19.733   1.730
  505   1HG   GLU  65          2HG       GLU  65   2.022  21.292   2.608
  506   2HG   GLU  65          3HG       GLU  65   2.715  21.318   0.999
  507    H    PHE  66           HN       PHE  66   2.323  16.767   0.129
  508    HA   PHE  66           HA       PHE  66  -0.014  15.376   0.799
  509   1HB   PHE  66          2HB       PHE  66   1.128  15.173  -1.382
  510   2HB   PHE  66          3HB       PHE  66   2.632  14.711  -0.610
  511    HD1  PHE  66           HD1      PHE  66   3.200  12.480  -0.647
  512    HD2  PHE  66           HD2      PHE  66  -0.909  13.528  -0.802
  513    HE1  PHE  66           HE1      PHE  66   2.593  10.059  -0.913
  514    HE2  PHE  66           HE2      PHE  66  -1.516  11.107  -1.067
  515    HZ   PHE  66           HZ       PHE  66   0.242   9.402  -1.119
  516    H    GLN  67           HN       GLN  67   3.396  15.133   1.893
  517    HA   GLN  67           HA       GLN  67   3.174  12.666   3.111
  518   1HB   GLN  67          2HB       GLN  67   4.936  15.039   3.867
  519   2HB   GLN  67          3HB       GLN  67   5.182  13.395   4.420
  520   1HG   GLN  67          2HG       GLN  67   4.960  13.088   1.645
  521   2HG   GLN  67          3HG       GLN  67   5.817  14.609   1.799
  522   1HE2  GLN  67          1HE2      GLN  67   7.157  12.672   0.651
  523   2HE2  GLN  67          2HE2      GLN  67   8.376  11.982   1.670
  524    H    VAL  68           HN       VAL  68   1.651  15.650   3.869
  525    HA   VAL  68           HA       VAL  68   1.562  15.284   6.705
  526    HB   VAL  68           HB       VAL  68  -0.043  17.055   4.851
  527   1HG1  VAL  68          1HG1      VAL  68  -1.199  17.728   6.634
  528   2HG1  VAL  68          2HG1      VAL  68  -0.376  16.494   7.617
  529   3HG1  VAL  68          3HG1      VAL  68   0.309  18.132   7.489
  530   1HG2  VAL  68          1HG2      VAL  68   1.930  18.080   4.526
  531   2HG2  VAL  68          2HG2      VAL  68   1.745  18.666   6.196
  532   3HG2  VAL  68          3HG2      VAL  68   2.711  17.208   5.867
  533    H    LEU  69           HN       LEU  69  -0.459  14.477   3.860
  534    HA   LEU  69           HA       LEU  69  -2.672  13.644   5.453
  535   1HB   LEU  69          2HB       LEU  69  -2.568  14.498   3.003
  536   2HB   LEU  69          3HB       LEU  69  -2.179  12.836   2.606
  537    HG   LEU  69           HG       LEU  69  -4.278  12.041   3.416
  538   1HD1  LEU  69          1HD1      LEU  69  -4.321  14.599   4.880
  539   2HD1  LEU  69          2HD1      LEU  69  -5.886  14.093   4.199
  540   3HD1  LEU  69          3HD1      LEU  69  -5.004  13.011   5.305
  541   1HD2  LEU  69          1HD2      LEU  69  -4.429  14.488   1.672
  542   2HD2  LEU  69          2HD2      LEU  69  -4.577  12.769   1.232
  543   3HD2  LEU  69          3HD2      LEU  69  -5.898  13.580   2.107
  544    H    VAL  70           HN       VAL  70   0.310  12.195   4.194
  545    HA   VAL  70           HA       VAL  70  -0.391   9.526   4.291
  546    HB   VAL  70           HB       VAL  70   2.127  11.109   4.549
  547   1HG1  VAL  70          1HG1      VAL  70   3.251   8.708   4.512
  548   2HG1  VAL  70          2HG1      VAL  70   2.854   9.522   6.044
  549   3HG1  VAL  70          3HG1      VAL  70   1.777   8.258   5.402
  550   1HG2  VAL  70          1HG2      VAL  70   2.000  10.781   2.340
  551   2HG2  VAL  70          2HG2      VAL  70   2.407   9.077   2.655
  552   3HG2  VAL  70          3HG2      VAL  70   0.704   9.575   2.520
  553    H    LYS  71           HN       LYS  71  -0.057  11.876   6.852
  554    HA   LYS  71           HA       LYS  71   0.590  10.056   8.919
  555   1HB   LYS  71          2HB       LYS  71   0.501  12.792   8.643
  556   2HB   LYS  71          3HB       LYS  71  -0.897  12.490   9.656
  557   1HG   LYS  71          2HG       LYS  71   0.965  10.822  10.833
  558   2HG   LYS  71          3HG       LYS  71   1.999  12.116  10.261
  559   1HD   LYS  71          2HD       LYS  71   0.610  13.797  11.437
  560   2HD   LYS  71          3HD       LYS  71  -0.517  12.552  11.939
  561   1HE   LYS  71          2HE       LYS  71   0.809  12.675  13.851
  562   2HE   LYS  71          3HE       LYS  71   1.664  11.416  12.981
  563   1HZ   LYS  71          1HZ       LYS  71   3.117  13.139  12.091
  564   2HZ   LYS  71          2HZ       LYS  71   2.347  14.274  12.978
  565   3HZ   LYS  71          3HZ       LYS  71   3.178  13.081  13.722
  566    H    LYS  72           HN       LYS  72  -2.493  11.449   7.644
  567    HA   LYS  72           HA       LYS  72  -4.088  10.077   9.539
  568   1HB   LYS  72          2HB       LYS  72  -4.775  11.397   6.897
  569   2HB   LYS  72          3HB       LYS  72  -5.954  10.790   8.041
  570   1HG   LYS  72          2HG       LYS  72  -5.818  13.026   8.709
  571   2HG   LYS  72          3HG       LYS  72  -4.649  12.295   9.790
  572   1HD   LYS  72          2HD       LYS  72  -2.878  13.364   8.804
  573   2HD   LYS  72          3HD       LYS  72  -3.475  13.067   7.184
  574   1HE   LYS  72          2HE       LYS  72  -3.898  15.317   7.157
  575   2HE   LYS  72          3HE       LYS  72  -5.337  14.894   8.063
  576   1HZ   LYS  72          1HZ       LYS  72  -3.749  15.073  10.057
  577   2HZ   LYS  72          2HZ       LYS  72  -2.820  15.965   9.053
  578   3HZ   LYS  72          3HZ       LYS  72  -4.347  16.439   9.390
  579    H    ILE  73           HN       ILE  73  -2.966   9.414   6.186
  580    HA   ILE  73           HA       ILE  73  -4.528   7.037   5.984
  581    HB   ILE  73           HB       ILE  73  -2.207   8.041   4.331
  582   1HG1  ILE  73          2HG1      ILE  73  -5.025   8.231   3.388
  583   2HG1  ILE  73          3HG1      ILE  73  -4.540   9.350   4.646
  584   1HG2  ILE  73          1HG2      ILE  73  -3.996   6.444   2.822
  585   2HG2  ILE  73          2HG2      ILE  73  -2.297   6.115   3.240
  586   3HG2  ILE  73          3HG2      ILE  73  -3.603   5.540   4.304
  587   1HD1  ILE  73          1HD1      ILE  73  -4.179  10.053   2.156
  588   2HD1  ILE  73          2HD1      ILE  73  -2.851  10.338   3.307
  589   3HD1  ILE  73          3HD1      ILE  73  -2.787   8.944   2.202
  590    H    SER  74           HN       SER  74  -1.753   7.898   7.753
  591    HA   SER  74           HA       SER  74  -0.552   5.295   7.506
  592   1HB   SER  74          2HB       SER  74   0.193   7.915   8.782
  593   2HB   SER  74          3HB       SER  74   0.907   6.463   9.454
  594    HG   SER  74           HG       SER  74   1.649   5.919   7.265
  595    H    GLN  75           HN       GLN  75  -2.401   7.315   9.839
  596    HA   GLN  75           HA       GLN  75  -2.138   5.492  11.958
  597   1HB   GLN  75          2HB       GLN  75  -3.160   8.097  11.582
  598   2HB   GLN  75          3HB       GLN  75  -4.549   7.153  12.083
  599   1HG   GLN  75          2HG       GLN  75  -3.723   7.648  14.183
  600   2HG   GLN  75          3HG       GLN  75  -2.788   6.195  13.890
  601   1HE2  GLN  75          1HE2      GLN  75  -2.653   9.620  12.900
  602   2HE2  GLN  75          2HE2      GLN  75  -0.985   9.891  13.280
  Start of MODEL   11
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   1.675  -0.803  -1.866
    3   1HB   LYS   1          2HB       LYS   1   1.851   2.145  -1.303
    4   2HB   LYS   1          3HB       LYS   1   2.676   1.478  -2.697
    5   1HG   LYS   1          2HG       LYS   1   0.651   0.705  -3.690
    6   2HG   LYS   1          3HG       LYS   1  -0.231   0.776  -2.178
    7   1HD   LYS   1          2HD       LYS   1  -1.028   2.731  -3.128
    8   2HD   LYS   1          3HD       LYS   1   0.390   3.389  -2.337
    9   1HE   LYS   1          2HE       LYS   1   0.564   2.320  -5.178
   10   2HE   LYS   1          3HE       LYS   1  -0.010   3.947  -4.872
   11   1HZ   LYS   1          1HZ       LYS   1   2.592   3.109  -4.969
   12   2HZ   LYS   1          2HZ       LYS   1   2.054   4.591  -4.543
   13   3HZ   LYS   1          3HZ       LYS   1   2.322   3.459  -3.397
   14    H    SER   2           HN       SER   2   3.708   1.403   0.195
   15    HA   SER   2           HA       SER   2   6.042   0.059  -0.716
   16   1HB   SER   2          2HB       SER   2   6.120   1.893   1.661
   17   2HB   SER   2          3HB       SER   2   7.227   1.782   0.307
   18    HG   SER   2           HG       SER   2   5.275   2.636  -0.991
   19    HA   PRO   3           HA       PRO   3   6.448  -2.736   2.594
   20   1HB   PRO   3          2HB       PRO   3   9.151  -2.913   2.960
   21   2HB   PRO   3          3HB       PRO   3   8.303  -3.737   1.667
   22   1HG   PRO   3          2HG       PRO   3  10.003  -1.323   1.525
   23   2HG   PRO   3          3HG       PRO   3   9.505  -2.393   0.229
   24   1HD   PRO   3          2HD       PRO   3   8.443   0.207   0.812
   25   2HD   PRO   3          3HD       PRO   3   7.868  -0.910  -0.409
   26    H    GLU   4           HN       GLU   4   8.306   0.197   3.072
   27    HA   GLU   4           HA       GLU   4   8.650  -0.121   5.785
   28   1HB   GLU   4          2HB       GLU   4   9.106   1.901   3.803
   29   2HB   GLU   4          3HB       GLU   4   8.284   2.676   5.143
   30   1HG   GLU   4          2HG       GLU   4  10.433   0.788   5.966
   31   2HG   GLU   4          3HG       GLU   4  11.004   2.161   5.039
   32    H    GLU   5           HN       GLU   5   5.860   0.984   3.867
   33    HA   GLU   5           HA       GLU   5   4.499   2.181   5.992
   34   1HB   GLU   5          2HB       GLU   5   3.911   1.361   3.198
   35   2HB   GLU   5          3HB       GLU   5   2.510   1.378   4.249
   36   1HG   GLU   5          2HG       GLU   5   3.997   3.752   4.849
   37   2HG   GLU   5          3HG       GLU   5   3.949   3.627   3.101
   38    H    LEU   6           HN       LEU   6   4.760  -1.165   4.772
   39    HA   LEU   6           HA       LEU   6   2.551  -2.229   6.097
   40   1HB   LEU   6          2HB       LEU   6   5.140  -3.365   5.079
   41   2HB   LEU   6          3HB       LEU   6   3.987  -4.369   5.935
   42    HG   LEU   6           HG       LEU   6   3.389  -2.812   3.404
   43   1HD1  LEU   6          1HD1      LEU   6   3.369  -5.024   2.299
   44   2HD1  LEU   6          2HD1      LEU   6   4.973  -4.577   2.931
   45   3HD1  LEU   6          3HD1      LEU   6   3.970  -5.759   3.806
   46   1HD2  LEU   6          1HD2      LEU   6   1.460  -4.717   3.585
   47   2HD2  LEU   6          2HD2      LEU   6   1.705  -4.318   5.303
   48   3HD2  LEU   6          3HD2      LEU   6   1.279  -3.036   4.144
   49    H    LYS   7           HN       LYS   7   5.950  -1.650   7.136
   50    HA   LYS   7           HA       LYS   7   5.635  -2.945   9.625
   51   1HB   LYS   7          2HB       LYS   7   7.754  -2.107   8.177
   52   2HB   LYS   7          3HB       LYS   7   7.650  -0.779   9.315
   53   1HG   LYS   7          2HG       LYS   7   8.128  -2.123  11.160
   54   2HG   LYS   7          3HG       LYS   7   7.402  -3.551  10.450
   55   1HD   LYS   7          2HD       LYS   7   9.317  -4.080   9.193
   56   2HD   LYS   7          3HD       LYS   7   9.872  -2.419   9.136
   57   1HE   LYS   7          2HE       LYS   7   9.849  -3.068  11.896
   58   2HE   LYS   7          3HE       LYS   7  10.475  -4.504  11.110
   59   1HZ   LYS   7          1HZ       LYS   7  12.012  -3.006   9.910
   60   2HZ   LYS   7          2HZ       LYS   7  11.510  -1.770  10.853
   61   3HZ   LYS   7          3HZ       LYS   7  12.263  -3.055  11.523
   62    H    GLY   8           HN       GLY   8   5.594   0.547   8.631
   63   1HA   GLY   8          1HA       GLY   8   5.062   1.638  11.123
   64   2HA   GLY   8          2HA       GLY   8   4.613   2.333   9.578
   65    H    ILE   9           HN       ILE   9   2.678   0.836   8.484
   66    HA   ILE   9           HA       ILE   9   0.420   1.447   9.940
   67    HB   ILE   9           HB       ILE   9   0.979  -0.381   7.627
   68   1HG1  ILE   9          2HG1      ILE   9  -0.407   2.293   7.949
   69   2HG1  ILE   9          3HG1      ILE   9   1.122   1.977   7.155
   70   1HG2  ILE   9          1HG2      ILE   9  -0.892  -1.521   7.999
   71   2HG2  ILE   9          2HG2      ILE   9  -1.350  -0.467   9.358
   72   3HG2  ILE   9          3HG2      ILE   9  -1.784  -0.012   7.692
   73   1HD1  ILE   9          1HD1      ILE   9  -0.527   0.227   5.804
   74   2HD1  ILE   9          2HD1      ILE   9  -1.645   1.565   6.159
   75   3HD1  ILE   9          3HD1      ILE   9  -0.144   1.876   5.253
   76    H    PHE  10           HN       PHE  10   2.208  -1.684   9.652
   77    HA   PHE  10           HA       PHE  10   0.509  -3.269  11.078
   78   1HB   PHE  10          2HB       PHE  10   2.431  -4.285  10.087
   79   2HB   PHE  10          3HB       PHE  10   3.502  -3.013  10.641
   80    HD1  PHE  10           HD1      PHE  10   1.947  -6.194  11.475
   81    HD2  PHE  10           HD2      PHE  10   4.380  -3.040  12.936
   82    HE1  PHE  10           HE1      PHE  10   2.688  -7.649  13.381
   83    HE2  PHE  10           HE2      PHE  10   5.122  -4.495  14.842
   84    HZ   PHE  10           HZ       PHE  10   4.267  -6.782  15.042
   85    H    GLU  11           HN       GLU  11   3.306  -1.351  12.400
   86    HA   GLU  11           HA       GLU  11   2.781  -2.030  15.032
   87   1HB   GLU  11          2HB       GLU  11   4.641  -0.396  13.580
   88   2HB   GLU  11          3HB       GLU  11   3.999   0.586  14.882
   89   1HG   GLU  11          2HG       GLU  11   4.421  -1.690  16.289
   90   2HG   GLU  11          3HG       GLU  11   5.613  -1.950  15.030
   91    H    LYS  12           HN       LYS  12   1.578   0.605  12.922
   92    HA   LYS  12           HA       LYS  12   0.452   2.205  14.892
   93   1HB   LYS  12          2HB       LYS  12   0.817   2.812  12.500
   94   2HB   LYS  12          3HB       LYS  12  -0.519   1.771  12.052
   95   1HG   LYS  12          2HG       LYS  12  -2.069   3.103  13.460
   96   2HG   LYS  12          3HG       LYS  12  -0.743   4.110  14.006
   97   1HD   LYS  12          2HD       LYS  12  -0.443   4.332  11.277
   98   2HD   LYS  12          3HD       LYS  12  -2.179   4.118  11.387
   99   1HE   LYS  12          2HE       LYS  12  -2.505   6.170  12.370
  100   2HE   LYS  12          3HE       LYS  12  -1.090   6.021  13.393
  101   1HZ   LYS  12          1HZ       LYS  12  -1.171   7.658  11.381
  102   2HZ   LYS  12          2HZ       LYS  12   0.223   6.929  11.822
  103   3HZ   LYS  12          3HZ       LYS  12  -0.635   6.355  10.556
  104    H    TYR  13           HN       TYR  13  -0.544  -0.900  13.513
  105    HA   TYR  13           HA       TYR  13  -3.163  -0.665  14.775
  106   1HB   TYR  13          2HB       TYR  13  -1.674  -2.439  12.793
  107   2HB   TYR  13          3HB       TYR  13  -3.044  -3.143  13.630
  108    HD1  TYR  13           HD1      TYR  13  -5.085  -3.057  12.540
  109    HD2  TYR  13           HD2      TYR  13  -2.224   0.035  11.793
  110    HE1  TYR  13           HE1      TYR  13  -6.656  -2.004  10.840
  111    HE2  TYR  13           HE2      TYR  13  -3.804   1.077  10.096
  112    HH   TYR  13           HH       TYR  13  -5.832  -0.092   8.571
  113    H    ALA  14           HN       ALA  14  -0.071  -2.491  14.967
  114    HA   ALA  14           HA       ALA  14  -0.980  -4.351  16.875
  115   1HB   ALA  14          1HB       ALA  14   1.890  -3.478  16.722
  116   2HB   ALA  14          2HB       ALA  14   1.203  -5.116  16.827
  117   3HB   ALA  14          3HB       ALA  14   1.153  -4.227  15.286
  118    H    ALA  15           HN       ALA  15   0.019  -0.976  17.013
  119    HA   ALA  15           HA       ALA  15   0.556  -1.072  19.844
  120   1HB   ALA  15          1HB       ALA  15   1.890   0.494  18.743
  121   2HB   ALA  15          2HB       ALA  15   0.574   1.008  17.660
  122   3HB   ALA  15          3HB       ALA  15   0.573   1.517  19.366
  123    H    LYS  16           HN       LYS  16  -2.177  -0.729  17.700
  124    HA   LYS  16           HA       LYS  16  -3.817   0.939  19.160
  125   1HB   LYS  16          2HB       LYS  16  -4.005  -0.650  16.871
  126   2HB   LYS  16          3HB       LYS  16  -5.240  -1.292  17.935
  127   1HG   LYS  16          2HG       LYS  16  -5.960   1.169  18.339
  128   2HG   LYS  16          3HG       LYS  16  -4.924   1.586  16.988
  129   1HD   LYS  16          2HD       LYS  16  -6.291   0.530  15.418
  130   2HD   LYS  16          3HD       LYS  16  -6.869  -0.668  16.560
  131   1HE   LYS  16          2HE       LYS  16  -7.615   2.234  16.993
  132   2HE   LYS  16          3HE       LYS  16  -8.455   1.323  15.754
  133   1HZ   LYS  16          1HZ       LYS  16  -9.371  -0.048  17.289
  134   2HZ   LYS  16          2HZ       LYS  16  -8.164   0.116  18.377
  135   3HZ   LYS  16          3HZ       LYS  16  -9.266   1.307  18.195
  136    H    GLU  17           HN       GLU  17  -3.894  -2.698  19.217
  137    HA   GLU  17           HA       GLU  17  -4.759  -2.421  21.990
  138   1HB   GLU  17          2HB       GLU  17  -5.572  -4.360  19.811
  139   2HB   GLU  17          3HB       GLU  17  -5.725  -4.827  21.493
  140   1HG   GLU  17          2HG       GLU  17  -6.802  -2.213  21.392
  141   2HG   GLU  17          3HG       GLU  17  -7.379  -2.977  19.924
  142    H    GLY  18           HN       GLY  18  -3.515  -3.399  23.559
  143   1HA   GLY  18          1HA       GLY  18  -1.879  -4.618  24.502
  144   2HA   GLY  18          2HA       GLY  18  -2.009  -5.742  23.164
  145    H    ASP  19           HN       ASP  19   0.487  -5.597  23.926
  146    HA   ASP  19           HA       ASP  19   1.998  -3.438  23.209
  147   1HB   ASP  19          2HB       ASP  19   2.531  -5.821  24.344
  148   2HB   ASP  19          3HB       ASP  19   3.046  -6.227  22.719
  149    HA   PRO  20           HA       PRO  20   1.844  -3.732  18.823
  150   1HB   PRO  20          2HB       PRO  20   3.820  -1.959  18.177
  151   2HB   PRO  20          3HB       PRO  20   2.188  -1.468  18.582
  152   1HG   PRO  20          2HG       PRO  20   4.640  -1.283  20.222
  153   2HG   PRO  20          3HG       PRO  20   3.119  -0.435  20.422
  154   1HD   PRO  20          2HD       PRO  20   4.050  -2.672  21.956
  155   2HD   PRO  20          3HD       PRO  20   2.483  -1.897  22.077
  156    H    ASN  21           HN       ASN  21   4.172  -5.022  20.712
  157    HA   ASN  21           HA       ASN  21   5.879  -5.738  18.522
  158   1HB   ASN  21          2HB       ASN  21   5.873  -6.414  21.505
  159   2HB   ASN  21          3HB       ASN  21   7.043  -7.104  20.398
  160   1HD2  ASN  21          1HD2      ASN  21   8.266  -5.562  19.031
  161   2HD2  ASN  21          2HD2      ASN  21   8.792  -4.067  19.730
  162    H    GLN  22           HN       GLN  22   2.875  -6.696  19.589
  163    HA   GLN  22           HA       GLN  22   3.246  -9.326  18.481
  164   1HB   GLN  22          2HB       GLN  22   1.773 -10.242  20.439
  165   2HB   GLN  22          3HB       GLN  22   3.491 -10.027  20.706
  166   1HG   GLN  22          2HG       GLN  22   2.258  -7.512  21.309
  167   2HG   GLN  22          3HG       GLN  22   1.266  -8.743  22.065
  168   1HE2  GLN  22          1HE2      GLN  22   4.719  -8.068  21.486
  169   2HE2  GLN  22          2HE2      GLN  22   5.285  -8.439  23.080
  170    H    LEU  23           HN       LEU  23   1.547  -9.837  17.134
  171    HA   LEU  23           HA       LEU  23  -0.650  -7.941  17.080
  172   1HB   LEU  23          2HB       LEU  23   0.477  -9.972  15.188
  173   2HB   LEU  23          3HB       LEU  23  -1.165  -9.399  14.974
  174    HG   LEU  23           HG       LEU  23   0.822  -8.263  13.710
  175   1HD1  LEU  23          1HD1      LEU  23  -1.133  -7.260  13.182
  176   2HD1  LEU  23          2HD1      LEU  23  -1.653  -7.121  14.879
  177   3HD1  LEU  23          3HD1      LEU  23  -0.480  -5.961  14.210
  178   1HD2  LEU  23          1HD2      LEU  23   1.046  -7.070  16.469
  179   2HD2  LEU  23          2HD2      LEU  23   2.325  -7.720  15.417
  180   3HD2  LEU  23          3HD2      LEU  23   1.541  -6.174  15.014
  181    H    SER  24           HN       SER  24  -2.910  -8.719  16.904
  182    HA   SER  24           HA       SER  24  -3.255 -11.325  18.137
  183   1HB   SER  24          2HB       SER  24  -4.636  -8.755  19.032
  184   2HB   SER  24          3HB       SER  24  -5.050 -10.358  19.607
  185    HG   SER  24           HG       SER  24  -2.857 -10.560  20.441
  186    H    LYS  25           HN       LYS  25  -5.752 -11.928  18.040
  187    HA   LYS  25           HA       LYS  25  -6.496 -11.926  15.366
  188   1HB   LYS  25          2HB       LYS  25  -7.148 -13.589  17.120
  189   2HB   LYS  25          3HB       LYS  25  -8.261 -12.411  17.783
  190   1HG   LYS  25          2HG       LYS  25  -9.271 -12.256  15.391
  191   2HG   LYS  25          3HG       LYS  25  -8.345 -13.698  15.025
  192   1HD   LYS  25          2HD       LYS  25 -10.131 -14.860  15.835
  193   2HD   LYS  25          3HD       LYS  25  -9.549 -14.407  17.425
  194   1HE   LYS  25          2HE       LYS  25 -10.995 -12.141  16.508
  195   2HE   LYS  25          3HE       LYS  25 -11.963 -13.519  16.021
  196   1HZ   LYS  25          1HZ       LYS  25 -10.879 -13.592  18.694
  197   2HZ   LYS  25          2HZ       LYS  25 -12.066 -12.504  18.422
  198   3HZ   LYS  25          3HZ       LYS  25 -12.334 -14.091  18.146
  199    H    GLU  26           HN       GLU  26  -7.981 -10.103  18.143
  200    HA   GLU  26           HA       GLU  26  -9.741  -8.681  16.610
  201   1HB   GLU  26          2HB       GLU  26  -8.880  -8.734  19.321
  202   2HB   GLU  26          3HB       GLU  26  -8.739  -7.062  18.815
  203   1HG   GLU  26          2HG       GLU  26 -11.239  -8.372  17.890
  204   2HG   GLU  26          3HG       GLU  26 -11.093  -8.298  19.635
  205    H    GLU  27           HN       GLU  27  -6.325  -7.928  17.513
  206    HA   GLU  27           HA       GLU  27  -6.281  -5.388  16.440
  207   1HB   GLU  27          2HB       GLU  27  -4.272  -7.441  17.246
  208   2HB   GLU  27          3HB       GLU  27  -3.689  -6.230  16.122
  209   1HG   GLU  27          2HG       GLU  27  -4.947  -4.555  17.812
  210   2HG   GLU  27          3HG       GLU  27  -4.704  -5.874  18.940
  211    H    LEU  28           HN       LEU  28  -5.220  -8.547  14.982
  212    HA   LEU  28           HA       LEU  28  -4.501  -7.532  12.515
  213   1HB   LEU  28          2HB       LEU  28  -4.256  -9.882  13.648
  214   2HB   LEU  28          3HB       LEU  28  -5.751 -10.237  12.806
  215    HG   LEU  28           HG       LEU  28  -4.777 -10.139  10.712
  216   1HD1  LEU  28          1HD1      LEU  28  -3.845  -7.975  10.670
  217   2HD1  LEU  28          2HD1      LEU  28  -2.663  -8.367  11.942
  218   3HD1  LEU  28          3HD1      LEU  28  -2.497  -9.083  10.320
  219   1HD2  LEU  28          1HD2      LEU  28  -3.906 -12.063  11.863
  220   2HD2  LEU  28          2HD2      LEU  28  -2.631 -11.388  10.820
  221   3HD2  LEU  28          3HD2      LEU  28  -2.591 -11.099  12.576
  222    H    LYS  29           HN       LYS  29  -7.701  -8.704  13.721
  223    HA   LYS  29           HA       LYS  29  -9.174  -8.702  11.489
  224   1HB   LYS  29          2HB       LYS  29 -10.036  -9.222  13.714
  225   2HB   LYS  29          3HB       LYS  29  -9.942  -7.536  14.181
  226   1HG   LYS  29          2HG       LYS  29 -11.614  -6.907  12.503
  227   2HG   LYS  29          3HG       LYS  29 -11.601  -8.518  11.814
  228   1HD   LYS  29          2HD       LYS  29 -12.674  -9.477  13.730
  229   2HD   LYS  29          3HD       LYS  29 -12.308  -8.092  14.740
  230   1HE   LYS  29          2HE       LYS  29 -13.971  -6.734  13.710
  231   2HE   LYS  29          3HE       LYS  29 -14.043  -7.737  12.275
  232   1HZ   LYS  29          1HZ       LYS  29 -14.887  -9.516  13.811
  233   2HZ   LYS  29          2HZ       LYS  29 -15.094  -8.351  14.937
  234   3HZ   LYS  29          3HZ       LYS  29 -15.906  -8.273  13.522
  235    H    LEU  30           HN       LEU  30  -8.451  -5.725  13.444
  236    HA   LEU  30           HA       LEU  30  -9.716  -3.939  11.773
  237   1HB   LEU  30          2HB       LEU  30  -7.233  -3.522  13.443
  238   2HB   LEU  30          3HB       LEU  30  -8.257  -2.256  12.797
  239    HG   LEU  30           HG       LEU  30  -8.822  -4.199  15.020
  240   1HD1  LEU  30          1HD1      LEU  30  -9.020  -2.358  16.363
  241   2HD1  LEU  30          2HD1      LEU  30  -7.841  -1.752  15.175
  242   3HD1  LEU  30          3HD1      LEU  30  -9.557  -1.301  15.035
  243   1HD2  LEU  30          1HD2      LEU  30 -11.200  -3.320  14.988
  244   2HD2  LEU  30          2HD2      LEU  30 -10.876  -2.766  13.328
  245   3HD2  LEU  30          3HD2      LEU  30 -10.775  -4.499  13.724
  246    H    LEU  31           HN       LEU  31  -6.193  -4.844  11.794
  247    HA   LEU  31           HA       LEU  31  -5.447  -3.390   9.603
  248   1HB   LEU  31          2HB       LEU  31  -4.146  -4.890  11.307
  249   2HB   LEU  31          3HB       LEU  31  -4.340  -6.131  10.084
  250    HG   LEU  31           HG       LEU  31  -3.393  -3.939   8.646
  251   1HD1  LEU  31          1HD1      LEU  31  -2.341  -3.896  11.437
  252   2HD1  LEU  31          2HD1      LEU  31  -1.197  -3.610  10.103
  253   3HD1  LEU  31          3HD1      LEU  31  -2.624  -2.563  10.291
  254   1HD2  LEU  31          1HD2      LEU  31  -1.422  -5.268   8.312
  255   2HD2  LEU  31          2HD2      LEU  31  -1.744  -6.206   9.791
  256   3HD2  LEU  31          3HD2      LEU  31  -2.832  -6.352   8.390
  257    H    LEU  32           HN       LEU  32  -6.289  -6.930   9.543
  258    HA   LEU  32           HA       LEU  32  -6.344  -7.227   6.841
  259   1HB   LEU  32          2HB       LEU  32  -8.199  -8.535   8.834
  260   2HB   LEU  32          3HB       LEU  32  -7.812  -9.129   7.232
  261    HG   LEU  32           HG       LEU  32  -5.726  -8.753   9.392
  262   1HD1  LEU  32          1HD1      LEU  32  -5.929 -11.345   9.490
  263   2HD1  LEU  32          2HD1      LEU  32  -7.076 -10.336  10.404
  264   3HD1  LEU  32          3HD1      LEU  32  -7.569 -11.065   8.857
  265   1HD2  LEU  32          1HD2      LEU  32  -4.245  -9.349   7.853
  266   2HD2  LEU  32          2HD2      LEU  32  -5.173 -10.817   7.465
  267   3HD2  LEU  32          3HD2      LEU  32  -5.537  -9.288   6.629
  268    H    GLN  33           HN       GLN  33  -8.527  -5.393   8.876
  269    HA   GLN  33           HA       GLN  33 -10.719  -5.462   7.129
  270   1HB   GLN  33          2HB       GLN  33 -10.275  -4.567   9.698
  271   2HB   GLN  33          3HB       GLN  33 -10.376  -3.046   8.832
  272   1HG   GLN  33          2HG       GLN  33 -12.546  -3.904   7.769
  273   2HG   GLN  33          3HG       GLN  33 -12.465  -5.270   8.864
  274   1HE2  GLN  33          1HE2      GLN  33 -13.397  -5.098  10.757
  275   2HE2  GLN  33          2HE2      GLN  33 -13.869  -3.639  11.562
  276    H    THR  34           HN       THR  34  -8.379  -2.767   7.870
  277    HA   THR  34           HA       THR  34  -9.132  -1.427   5.429
  278    HB   THR  34           HB       THR  34  -7.654  -0.874   7.952
  279    HG1  THR  34           HG1      THR  34  -9.678   0.114   7.439
  280   1HG2  THR  34          1HG2      THR  34  -6.455   1.082   6.941
  281   2HG2  THR  34          2HG2      THR  34  -5.789  -0.458   6.347
  282   3HG2  THR  34          3HG2      THR  34  -6.887   0.493   5.318
  283    H    GLU  35           HN       GLU  35  -6.174  -3.053   6.735
  284    HA   GLU  35           HA       GLU  35  -4.515  -2.585   4.674
  285   1HB   GLU  35          2HB       GLU  35  -3.743  -3.742   6.645
  286   2HB   GLU  35          3HB       GLU  35  -4.856  -5.072   6.392
  287   1HG   GLU  35          2HG       GLU  35  -2.615  -5.761   5.680
  288   2HG   GLU  35          3HG       GLU  35  -3.656  -5.667   4.274
  289    H    PHE  36           HN       PHE  36  -6.654  -5.521   4.969
  290    HA   PHE  36           HA       PHE  36  -7.113  -5.408   2.120
  291   1HB   PHE  36          2HB       PHE  36  -5.601  -7.582   3.659
  292   2HB   PHE  36          3HB       PHE  36  -6.466  -7.997   2.193
  293    HD1  PHE  36           HD1      PHE  36  -5.942  -5.970   0.299
  294    HD2  PHE  36           HD2      PHE  36  -3.337  -7.460   3.299
  295    HE1  PHE  36           HE1      PHE  36  -3.960  -5.264  -1.070
  296    HE2  PHE  36           HE2      PHE  36  -1.355  -6.753   1.930
  297    HZ   PHE  36           HZ       PHE  36  -1.691  -5.663  -0.238
  298    HA   PRO  37           HA       PRO  37 -10.716  -6.793   4.388
  299   1HB   PRO  37          2HB       PRO  37 -12.553  -5.328   2.993
  300   2HB   PRO  37          3HB       PRO  37 -11.779  -4.752   4.456
  301   1HG   PRO  37          2HG       PRO  37 -11.263  -3.965   1.654
  302   2HG   PRO  37          3HG       PRO  37 -10.826  -3.125   3.128
  303   1HD   PRO  37          2HD       PRO  37  -9.083  -4.667   1.451
  304   2HD   PRO  37          3HD       PRO  37  -8.675  -3.924   2.985
  305    H    SER  38           HN       SER  38  -9.423  -7.366   1.472
  306    HA   SER  38           HA       SER  38 -11.730  -8.759   0.467
  307   1HB   SER  38          2HB       SER  38 -10.119  -9.328  -1.440
  308   2HB   SER  38          3HB       SER  38 -10.480  -7.627  -1.222
  309    HG   SER  38           HG       SER  38  -8.452  -7.225  -0.490
  310    H    LEU  39           HN       LEU  39  -8.587  -9.349   2.052
  311    HA   LEU  39           HA       LEU  39  -8.519 -12.129   1.551
  312   1HB   LEU  39          2HB       LEU  39  -6.910 -10.133   2.809
  313   2HB   LEU  39          3HB       LEU  39  -7.111 -11.463   3.931
  314    HG   LEU  39           HG       LEU  39  -5.086 -11.534   2.401
  315   1HD1  LEU  39          1HD1      LEU  39  -5.274 -13.983   2.027
  316   2HD1  LEU  39          2HD1      LEU  39  -5.745 -13.473   3.666
  317   3HD1  LEU  39          3HD1      LEU  39  -6.996 -13.884   2.468
  318   1HD2  LEU  39          1HD2      LEU  39  -5.346 -11.348   0.209
  319   2HD2  LEU  39          2HD2      LEU  39  -6.288 -12.858   0.195
  320   3HD2  LEU  39          3HD2      LEU  39  -7.115 -11.296   0.402
  321    H    LEU  40           HN       LEU  40 -10.364 -10.085   3.690
  322    HA   LEU  40           HA       LEU  40 -10.807 -12.084   5.677
  323   1HB   LEU  40          2HB       LEU  40 -12.134  -9.447   5.054
  324   2HB   LEU  40          3HB       LEU  40 -12.605 -10.473   6.394
  325    HG   LEU  40           HG       LEU  40  -9.863  -9.240   6.006
  326   1HD1  LEU  40          1HD1      LEU  40 -12.174  -7.966   6.805
  327   2HD1  LEU  40          2HD1      LEU  40 -11.417  -8.428   8.349
  328   3HD1  LEU  40          3HD1      LEU  40 -10.510  -7.449   7.170
  329   1HD2  LEU  40          1HD2      LEU  40  -9.578  -9.972   8.426
  330   2HD2  LEU  40          2HD2      LEU  40 -10.993 -11.020   8.168
  331   3HD2  LEU  40          3HD2      LEU  40  -9.525 -11.250   7.188
  332    H    LYS  41           HN       LYS  41 -12.202 -11.184   2.552
  333    HA   LYS  41           HA       LYS  41 -14.656 -12.555   2.970
  334   1HB   LYS  41          2HB       LYS  41 -15.172 -11.944   0.782
  335   2HB   LYS  41          3HB       LYS  41 -14.143 -10.640   1.339
  336   1HG   LYS  41          2HG       LYS  41 -12.712 -11.040  -0.370
  337   2HG   LYS  41          3HG       LYS  41 -12.394 -12.640   0.270
  338   1HD   LYS  41          2HD       LYS  41 -13.615 -13.634  -1.370
  339   2HD   LYS  41          3HD       LYS  41 -14.991 -12.592  -1.071
  340   1HE   LYS  41          2HE       LYS  41 -13.295 -10.812  -2.305
  341   2HE   LYS  41          3HE       LYS  41 -12.792 -12.303  -3.076
  342   1HZ   LYS  41          1HZ       LYS  41 -15.469 -11.122  -3.044
  343   2HZ   LYS  41          2HZ       LYS  41 -14.546 -11.501  -4.336
  344   3HZ   LYS  41          3HZ       LYS  41 -15.234 -12.686  -3.449
  345    H    GLY  42           HN       GLY  42 -11.373 -13.447   2.048
  346   1HA   GLY  42          1HA       GLY  42 -11.615 -15.679   0.548
  347   2HA   GLY  42          2HA       GLY  42 -10.458 -15.505   1.853
  348    H    MET  43           HN       MET  43 -11.363 -18.045   1.290
  349    HA   MET  43           HA       MET  43 -13.663 -18.670   2.809
  350   1HB   MET  43          2HB       MET  43 -11.385 -20.413   1.713
  351   2HB   MET  43          3HB       MET  43 -12.892 -21.047   2.344
  352   1HG   MET  43          2HG       MET  43 -13.837 -19.208   0.511
  353   2HG   MET  43          3HG       MET  43 -12.347 -19.705  -0.265
  354   1HE   MET  43          1HE       MET  43 -15.509 -19.831  -0.398
  355   2HE   MET  43          2HE       MET  43 -15.734 -21.207  -1.504
  356   3HE   MET  43          3HE       MET  43 -16.236 -21.342   0.198
  357    H    SER  44           HN       SER  44 -10.613 -17.678   3.761
  358    HA   SER  44           HA       SER  44 -10.464 -19.519   5.984
  359   1HB   SER  44          2HB       SER  44  -8.598 -17.320   4.999
  360   2HB   SER  44          3HB       SER  44  -8.303 -18.239   6.462
  361    HG   SER  44           HG       SER  44  -8.448 -19.238   3.751
  362    H    THR  45           HN       THR  45 -12.039 -18.942   7.496
  363    HA   THR  45           HA       THR  45 -12.863 -16.312   7.985
  364    HB   THR  45           HB       THR  45 -14.033 -17.359   9.878
  365    HG1  THR  45           HG1      THR  45 -12.354 -19.673   9.268
  366   1HG2  THR  45          1HG2      THR  45 -14.224 -19.849   8.504
  367   2HG2  THR  45          2HG2      THR  45 -15.340 -18.469   8.366
  368   3HG2  THR  45          3HG2      THR  45 -13.969 -18.622   7.240
  369    H    LEU  46           HN       LEU  46 -12.713 -15.289  10.270
  370    HA   LEU  46           HA       LEU  46 -10.155 -14.365  10.601
  371   1HB   LEU  46          2HB       LEU  46 -12.496 -13.585  11.484
  372   2HB   LEU  46          3HB       LEU  46 -12.055 -14.504  12.910
  373    HG   LEU  46           HG       LEU  46 -10.211 -13.107  13.392
  374   1HD1  LEU  46          1HD1      LEU  46  -9.687 -11.157  11.747
  375   2HD1  LEU  46          2HD1      LEU  46  -9.038 -12.783  11.427
  376   3HD1  LEU  46          3HD1      LEU  46 -10.468 -12.205  10.539
  377   1HD2  LEU  46          1HD2      LEU  46 -12.235 -12.080  14.091
  378   2HD2  LEU  46          2HD2      LEU  46 -11.220 -10.797  13.389
  379   3HD2  LEU  46          3HD2      LEU  46 -12.576 -11.472  12.453
  380    H    ASP  47           HN       ASP  47 -11.861 -16.755  12.751
  381    HA   ASP  47           HA       ASP  47  -9.856 -17.359  14.386
  382   1HB   ASP  47          2HB       ASP  47 -12.211 -18.756  13.319
  383   2HB   ASP  47          3HB       ASP  47 -10.940 -19.891  13.725
  384    H    GLU  48           HN       GLU  48 -10.542 -18.932  11.169
  385    HA   GLU  48           HA       GLU  48  -8.427 -20.661  11.169
  386   1HB   GLU  48          2HB       GLU  48 -10.365 -19.631   9.261
  387   2HB   GLU  48          3HB       GLU  48  -8.806 -19.795   8.478
  388   1HG   GLU  48          2HG       GLU  48  -8.815 -22.160   9.785
  389   2HG   GLU  48          3HG       GLU  48 -10.549 -21.921   9.708
  390    H    LEU  49           HN       LEU  49  -8.612 -17.254   9.955
  391    HA   LEU  49           HA       LEU  49  -5.994 -17.182   8.966
  392   1HB   LEU  49          2HB       LEU  49  -8.180 -15.569   8.877
  393   2HB   LEU  49          3HB       LEU  49  -7.168 -14.681   9.998
  394    HG   LEU  49           HG       LEU  49  -5.344 -15.166   8.067
  395   1HD1  LEU  49          1HD1      LEU  49  -6.243 -15.061   5.879
  396   2HD1  LEU  49          2HD1      LEU  49  -7.118 -16.363   6.720
  397   3HD1  LEU  49          3HD1      LEU  49  -7.892 -14.777   6.487
  398   1HD2  LEU  49          1HD2      LEU  49  -6.968 -12.954   8.930
  399   2HD2  LEU  49          2HD2      LEU  49  -5.306 -12.960   8.291
  400   3HD2  LEU  49          3HD2      LEU  49  -6.689 -12.853   7.175
  401    H    PHE  50           HN       PHE  50  -7.424 -16.352  12.176
  402    HA   PHE  50           HA       PHE  50  -5.111 -15.321  13.302
  403   1HB   PHE  50          2HB       PHE  50  -7.542 -15.321  14.153
  404   2HB   PHE  50          3HB       PHE  50  -7.354 -17.017  14.553
  405    HD1  PHE  50           HD1      PHE  50  -5.063 -14.118  15.083
  406    HD2  PHE  50           HD2      PHE  50  -7.393 -17.189  16.856
  407    HE1  PHE  50           HE1      PHE  50  -4.175 -13.487  17.345
  408    HE2  PHE  50           HE2      PHE  50  -6.504 -16.558  19.117
  409    HZ   PHE  50           HZ       PHE  50  -4.906 -14.715  19.335
  410    H    GLU  51           HN       GLU  51  -6.450 -18.698  13.427
  411    HA   GLU  51           HA       GLU  51  -4.266 -19.658  14.888
  412   1HB   GLU  51          2HB       GLU  51  -6.701 -20.744  13.619
  413   2HB   GLU  51          3HB       GLU  51  -5.359 -21.871  13.581
  414   1HG   GLU  51          2HG       GLU  51  -5.067 -21.711  16.009
  415   2HG   GLU  51          3HG       GLU  51  -6.236 -20.410  16.113
  416    H    GLU  52           HN       GLU  52  -5.065 -19.486  11.387
  417    HA   GLU  52           HA       GLU  52  -2.992 -21.115  10.529
  418   1HB   GLU  52          2HB       GLU  52  -4.936 -20.453   9.130
  419   2HB   GLU  52          3HB       GLU  52  -4.362 -18.797   9.094
  420   1HG   GLU  52          2HG       GLU  52  -2.214 -19.618   8.022
  421   2HG   GLU  52          3HG       GLU  52  -2.900 -21.230   7.963
  422    H    LEU  53           HN       LEU  53  -3.228 -17.486  10.672
  423    HA   LEU  53           HA       LEU  53  -0.655 -16.963   9.827
  424   1HB   LEU  53          2HB       LEU  53  -2.367 -15.407  11.770
  425   2HB   LEU  53          3HB       LEU  53  -0.956 -14.791  10.933
  426    HG   LEU  53           HG       LEU  53  -3.227 -15.903   9.319
  427   1HD1  LEU  53          1HD1      LEU  53  -4.677 -14.235   9.696
  428   2HD1  LEU  53          2HD1      LEU  53  -3.803 -14.051  11.236
  429   3HD1  LEU  53          3HD1      LEU  53  -3.394 -13.011   9.851
  430   1HD2  LEU  53          1HD2      LEU  53  -1.536 -15.344   7.885
  431   2HD2  LEU  53          2HD2      LEU  53  -2.417 -13.798   7.942
  432   3HD2  LEU  53          3HD2      LEU  53  -0.942 -14.019   8.914
  433    H    ASP  54           HN       ASP  54  -1.909 -17.371  13.209
  434    HA   ASP  54           HA       ASP  54   0.615 -17.082  14.349
  435   1HB   ASP  54          2HB       ASP  54  -1.810 -17.013  15.389
  436   2HB   ASP  54          3HB       ASP  54  -1.618 -18.747  15.561
  437    H    LYS  55           HN       LYS  55   1.804 -18.593  12.779
  438    HA   LYS  55           HA       LYS  55   1.267 -21.416  13.196
  439   1HB   LYS  55          2HB       LYS  55   2.314 -19.803  11.065
  440   2HB   LYS  55          3HB       LYS  55   3.529 -20.980  11.519
  441   1HG   LYS  55          2HG       LYS  55   0.610 -21.719  11.021
  442   2HG   LYS  55          3HG       LYS  55   1.831 -21.760   9.764
  443   1HD   LYS  55          2HD       LYS  55   3.116 -23.455  10.941
  444   2HD   LYS  55          3HD       LYS  55   2.154 -23.268  12.394
  445   1HE   LYS  55          2HE       LYS  55   0.117 -24.015  11.011
  446   2HE   LYS  55          3HE       LYS  55   1.232 -24.416   9.720
  447   1HZ   LYS  55          1HZ       LYS  55   0.634 -25.899  11.990
  448   2HZ   LYS  55          2HZ       LYS  55   1.620 -26.303  10.751
  449   3HZ   LYS  55          3HZ       LYS  55   2.222 -25.521  12.052
  450    H    ASN  56           HN       ASN  56   3.066 -18.894  14.625
  451    HA   ASN  56           HA       ASN  56   5.385 -20.371  15.223
  452   1HB   ASN  56          2HB       ASN  56   4.132 -17.783  16.177
  453   2HB   ASN  56          3HB       ASN  56   5.426 -18.471  17.139
  454   1HD2  ASN  56          1HD2      ASN  56   7.200 -19.482  15.521
  455   2HD2  ASN  56          2HD2      ASN  56   7.848 -18.337  14.395
  456    H    GLY  57           HN       GLY  57   2.167 -20.711  16.169
  457   1HA   GLY  57          1HA       GLY  57   1.086 -21.647  17.908
  458   2HA   GLY  57          2HA       GLY  57   2.520 -22.640  18.075
  459    H    ASP  58           HN       ASP  58   2.155 -19.066  18.543
  460    HA   ASP  58           HA       ASP  58   3.138 -19.507  21.247
  461   1HB   ASP  58          2HB       ASP  58   3.557 -16.905  21.005
  462   2HB   ASP  58          3HB       ASP  58   4.671 -18.040  20.270
  463    H    GLY  59           HN       GLY  59   0.806 -17.684  19.159
  464   1HA   GLY  59          1HA       GLY  59  -1.492 -17.622  20.008
  465   2HA   GLY  59          2HA       GLY  59  -0.836 -17.158  21.566
  466    H    GLU  60           HN       GLU  60   1.209 -15.716  19.353
  467    HA   GLU  60           HA       GLU  60  -0.528 -13.421  18.984
  468   1HB   GLU  60          2HB       GLU  60   2.112 -13.490  20.456
  469   2HB   GLU  60          3HB       GLU  60   1.657 -12.040  19.582
  470   1HG   GLU  60          2HG       GLU  60   0.501 -11.460  21.458
  471   2HG   GLU  60          3HG       GLU  60  -0.693 -12.633  20.939
  472    H    VAL  61           HN       VAL  61  -0.245 -12.385  17.002
  473    HA   VAL  61           HA       VAL  61   1.580 -13.705  15.182
  474    HB   VAL  61           HB       VAL  61  -0.606 -11.648  14.833
  475   1HG1  VAL  61          1HG1      VAL  61   1.190 -12.955  12.767
  476   2HG1  VAL  61          2HG1      VAL  61  -0.336 -12.124  12.377
  477   3HG1  VAL  61          3HG1      VAL  61   1.009 -11.218  13.112
  478   1HG2  VAL  61          1HG2      VAL  61  -0.909 -14.281  15.346
  479   2HG2  VAL  61          2HG2      VAL  61  -2.023 -13.347  14.319
  480   3HG2  VAL  61          3HG2      VAL  61  -0.745 -14.337  13.575
  481    H    SER  62           HN       SER  62   2.782 -12.201  13.569
  482    HA   SER  62           HA       SER  62   3.475  -9.649  14.549
  483   1HB   SER  62          2HB       SER  62   6.006 -11.082  14.437
  484   2HB   SER  62          3HB       SER  62   5.374 -10.056  15.709
  485    HG   SER  62           HG       SER  62   5.180 -12.886  15.395
  486    H    PHE  63           HN       PHE  63   5.448  -8.776  13.135
  487    HA   PHE  63           HA       PHE  63   4.745  -8.893  10.510
  488   1HB   PHE  63          2HB       PHE  63   6.319  -7.290  11.757
  489   2HB   PHE  63          3HB       PHE  63   7.543  -8.544  11.745
  490    HD1  PHE  63           HD1      PHE  63   9.236  -8.005  10.288
  491    HD2  PHE  63           HD2      PHE  63   5.235  -7.198   9.128
  492    HE1  PHE  63           HE1      PHE  63  10.047  -7.193   8.055
  493    HE2  PHE  63           HE2      PHE  63   6.046  -6.386   6.895
  494    HZ   PHE  63           HZ       PHE  63   8.443  -6.393   6.386
  495    H    GLU  64           HN       GLU  64   6.598 -11.232  12.377
  496    HA   GLU  64           HA       GLU  64   7.954 -12.355  10.192
  497   1HB   GLU  64          2HB       GLU  64   7.288 -14.033  12.590
  498   2HB   GLU  64          3HB       GLU  64   8.810 -13.866  11.737
  499   1HG   GLU  64          2HG       GLU  64   7.595 -12.028  13.816
  500   2HG   GLU  64          3HG       GLU  64   9.202 -12.727  13.777
  501    H    GLU  65           HN       GLU  65   5.052 -13.446  12.101
  502    HA   GLU  65           HA       GLU  65   4.519 -15.535  10.300
  503   1HB   GLU  65          2HB       GLU  65   2.786 -14.212  12.433
  504   2HB   GLU  65          3HB       GLU  65   2.331 -15.669  11.571
  505   1HG   GLU  65          2HG       GLU  65   4.351 -16.837  12.423
  506   2HG   GLU  65          3HG       GLU  65   4.882 -15.374  13.227
  507    H    PHE  66           HN       PHE  66   3.692 -12.104  10.463
  508    HA   PHE  66           HA       PHE  66   1.386 -12.113   8.919
  509   1HB   PHE  66          2HB       PHE  66   2.547 -10.235  10.283
  510   2HB   PHE  66          3HB       PHE  66   3.703 -10.090   8.974
  511    HD1  PHE  66           HD1      PHE  66  -0.023 -10.402   9.071
  512    HD2  PHE  66           HD2      PHE  66   3.340  -8.153   7.790
  513    HE1  PHE  66           HE1      PHE  66  -1.548  -8.787   7.902
  514    HE2  PHE  66           HE2      PHE  66   1.815  -6.538   6.622
  515    HZ   PHE  66           HZ       PHE  66  -0.611  -6.874   6.692
  516    H    GLN  67           HN       GLN  67   4.850 -12.278   8.030
  517    HA   GLN  67           HA       GLN  67   4.558 -11.613   5.369
  518   1HB   GLN  67          2HB       GLN  67   6.570 -13.504   6.667
  519   2HB   GLN  67          3HB       GLN  67   6.741 -12.800   5.072
  520   1HG   GLN  67          2HG       GLN  67   6.170 -10.623   6.833
  521   2HG   GLN  67          3HG       GLN  67   7.347 -11.619   7.666
  522   1HE2  GLN  67          1HE2      GLN  67   8.099  -9.173   6.970
  523   2HE2  GLN  67          2HE2      GLN  67   9.216  -9.170   5.645
  524    H    VAL  68           HN       VAL  68   3.377 -14.331   7.112
  525    HA   VAL  68           HA       VAL  68   3.556 -16.236   4.998
  526    HB   VAL  68           HB       VAL  68   1.854 -16.156   7.497
  527   1HG1  VAL  68          1HG1      VAL  68   0.943 -18.088   6.859
  528   2HG1  VAL  68          2HG1      VAL  68   1.744 -17.910   5.280
  529   3HG1  VAL  68          3HG1      VAL  68   2.551 -18.803   6.592
  530   1HG2  VAL  68          1HG2      VAL  68   3.805 -16.394   8.573
  531   2HG2  VAL  68          2HG2      VAL  68   3.883 -18.022   7.856
  532   3HG2  VAL  68          3HG2      VAL  68   4.701 -16.657   7.057
  533    H    LEU  69           HN       LEU  69   1.200 -13.792   6.132
  534    HA   LEU  69           HA       LEU  69  -0.852 -14.732   4.379
  535   1HB   LEU  69          2HB       LEU  69  -0.891 -13.348   6.653
  536   2HB   LEU  69          3HB       LEU  69  -0.870 -11.992   5.544
  537    HG   LEU  69           HG       LEU  69  -2.893 -12.943   4.414
  538   1HD1  LEU  69          1HD1      LEU  69  -2.271 -15.209   6.033
  539   2HD1  LEU  69          2HD1      LEU  69  -3.874 -14.598   6.509
  540   3HD1  LEU  69          3HD1      LEU  69  -3.551 -15.021   4.810
  541   1HD2  LEU  69          1HD2      LEU  69  -2.836 -11.976   7.236
  542   2HD2  LEU  69          2HD2      LEU  69  -3.505 -11.217   5.772
  543   3HD2  LEU  69          3HD2      LEU  69  -4.386 -12.542   6.570
  544    H    VAL  70           HN       VAL  70   1.751 -12.274   4.323
  545    HA   VAL  70           HA       VAL  70   0.944 -10.776   2.179
  546    HB   VAL  70           HB       VAL  70   3.574 -11.593   3.339
  547   1HG1  VAL  70          1HG1      VAL  70   4.670  -9.972   1.710
  548   2HG1  VAL  70          2HG1      VAL  70   4.200 -11.556   1.049
  549   3HG1  VAL  70          3HG1      VAL  70   3.199 -10.122   0.718
  550   1HG2  VAL  70          1HG2      VAL  70   3.372  -9.664   4.445
  551   2HG2  VAL  70          2HG2      VAL  70   3.100  -8.758   2.937
  552   3HG2  VAL  70          3HG2      VAL  70   1.729  -9.524   3.775
  553    H    LYS  71           HN       LYS  71   1.905 -14.143   2.305
  554    HA   LYS  71           HA       LYS  71   2.702 -14.350  -0.407
  555   1HB   LYS  71          2HB       LYS  71   2.966 -15.917   1.800
  556   2HB   LYS  71          3HB       LYS  71   1.652 -16.745   0.989
  557   1HG   LYS  71          2HG       LYS  71   3.353 -16.246  -1.135
  558   2HG   LYS  71          3HG       LYS  71   4.502 -16.459   0.170
  559   1HD   LYS  71          2HD       LYS  71   4.199 -18.662  -0.636
  560   2HD   LYS  71          3HD       LYS  71   3.156 -18.610   0.772
  561   1HE   LYS  71          2HE       LYS  71   1.758 -17.677  -1.648
  562   2HE   LYS  71          3HE       LYS  71   2.389 -19.299  -1.852
  563   1HZ   LYS  71          1HZ       LYS  71   0.136 -18.642  -0.532
  564   2HZ   LYS  71          2HZ       LYS  71   0.906 -20.079  -0.431
  565   3HZ   LYS  71          3HZ       LYS  71   1.185 -18.923   0.688
  566    H    LYS  72           HN       LYS  72  -0.379 -14.808   1.403
  567    HA   LYS  72           HA       LYS  72  -1.791 -15.745  -0.866
  568   1HB   LYS  72          2HB       LYS  72  -2.686 -14.646   1.811
  569   2HB   LYS  72          3HB       LYS  72  -3.792 -15.262   0.601
  570   1HG   LYS  72          2HG       LYS  72  -1.446 -16.890   1.676
  571   2HG   LYS  72          3HG       LYS  72  -3.045 -16.943   2.392
  572   1HD   LYS  72          2HD       LYS  72  -3.716 -17.360  -0.225
  573   2HD   LYS  72          3HD       LYS  72  -2.099 -18.037  -0.234
  574   1HE   LYS  72          2HE       LYS  72  -3.777 -18.848   2.098
  575   2HE   LYS  72          3HE       LYS  72  -4.356 -19.417   0.546
  576   1HZ   LYS  72          1HZ       LYS  72  -1.593 -19.760   1.481
  577   2HZ   LYS  72          2HZ       LYS  72  -2.753 -20.902   1.607
  578   3HZ   LYS  72          3HZ       LYS  72  -2.251 -20.407   0.134
  579    H    ILE  73           HN       ILE  73  -1.368 -12.533   0.726
  580    HA   ILE  73           HA       ILE  73  -3.102 -11.246  -1.135
  581    HB   ILE  73           HB       ILE  73  -1.096 -10.112   0.818
  582   1HG1  ILE  73          2HG1      ILE  73  -4.056 -10.222   1.301
  583   2HG1  ILE  73          3HG1      ILE  73  -3.088 -11.651   1.606
  584   1HG2  ILE  73          1HG2      ILE  73  -2.648  -8.860  -1.228
  585   2HG2  ILE  73          2HG2      ILE  73  -3.294  -8.373   0.357
  586   3HG2  ILE  73          3HG2      ILE  73  -1.574  -8.117  -0.019
  587   1HD1  ILE  73          1HD1      ILE  73  -2.237 -10.769   3.514
  588   2HD1  ILE  73          2HD1      ILE  73  -1.778  -9.263   2.685
  589   3HD1  ILE  73          3HD1      ILE  73  -3.423  -9.455   3.336
  590    H    SER  74           HN       SER  74  -0.027 -12.615  -1.408
  591    HA   SER  74           HA       SER  74   0.965 -10.573  -3.173
  592   1HB   SER  74          2HB       SER  74   2.060 -13.049  -1.884
  593   2HB   SER  74          3HB       SER  74   2.776 -12.584  -3.415
  594    HG   SER  74           HG       SER  74   2.652 -11.060  -0.968
  595    H    GLN  75           HN       GLN  75  -0.204 -13.992  -3.237
  596    HA   GLN  75           HA       GLN  75   0.236 -14.292  -5.993
  597   1HB   GLN  75          2HB       GLN  75  -0.375 -15.976  -3.882
  598   2HB   GLN  75          3HB       GLN  75  -1.888 -15.963  -4.765
  599   1HG   GLN  75          2HG       GLN  75  -0.964 -16.961  -6.661
  600   2HG   GLN  75          3HG       GLN  75   0.624 -16.273  -6.388
  601   1HE2  GLN  75          1HE2      GLN  75   1.431 -16.963  -4.017
  602   2HE2  GLN  75          2HE2      GLN  75   1.474 -18.676  -3.763
  Start of MODEL   12
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   2.848  -0.762  -1.161
    3   1HB   LYS   1          2HB       LYS   1   0.132  -0.169  -2.172
    4   2HB   LYS   1          3HB       LYS   1   1.429   0.184  -3.296
    5   1HG   LYS   1          2HG       LYS   1   1.286  -2.045  -3.804
    6   2HG   LYS   1          3HG       LYS   1   2.270  -2.255  -2.369
    7   1HD   LYS   1          2HD       LYS   1  -0.346  -2.068  -1.349
    8   2HD   LYS   1          3HD       LYS   1  -0.549  -2.990  -2.826
    9   1HE   LYS   1          2HE       LYS   1   1.745  -3.751  -1.025
   10   2HE   LYS   1          3HE       LYS   1   0.129  -4.160  -0.486
   11   1HZ   LYS   1          1HZ       LYS   1  -0.059  -5.019  -2.915
   12   2HZ   LYS   1          2HZ       LYS   1   1.568  -5.119  -2.811
   13   3HZ   LYS   1          3HZ       LYS   1   0.630  -5.943  -1.758
   14    H    SER   2           HN       SER   2   4.492   0.460  -2.053
   15    HA   SER   2           HA       SER   2   4.764   3.045  -1.118
   16   1HB   SER   2          2HB       SER   2   6.262   1.180  -2.847
   17   2HB   SER   2          3HB       SER   2   6.512   2.856  -3.296
   18    HG   SER   2           HG       SER   2   7.932   2.849  -1.689
   19    HA   PRO   3           HA       PRO   3   2.611   5.276  -4.186
   20   1HB   PRO   3          2HB       PRO   3   3.489   7.802  -3.624
   21   2HB   PRO   3          3HB       PRO   3   2.202   7.014  -2.733
   22   1HG   PRO   3          2HG       PRO   3   5.002   7.487  -1.913
   23   2HG   PRO   3          3HG       PRO   3   3.616   7.101  -0.913
   24   1HD   PRO   3          2HD       PRO   3   5.715   5.312  -1.701
   25   2HD   PRO   3          3HD       PRO   3   4.270   4.900  -0.799
   26    H    GLU   4           HN       GLU   4   6.049   5.898  -3.868
   27    HA   GLU   4           HA       GLU   4   6.298   7.052  -6.379
   28   1HB   GLU   4          2HB       GLU   4   7.965   6.529  -4.197
   29   2HB   GLU   4          3HB       GLU   4   8.660   5.538  -5.464
   30   1HG   GLU   4          2HG       GLU   4   7.883   8.322  -6.258
   31   2HG   GLU   4          3HG       GLU   4   9.231   8.192  -5.145
   32    H    GLU   5           HN       GLU   5   5.940   3.719  -5.315
   33    HA   GLU   5           HA       GLU   5   7.159   2.520  -7.527
   34   1HB   GLU   5          2HB       GLU   5   5.600   1.701  -5.182
   35   2HB   GLU   5          3HB       GLU   5   5.172   0.750  -6.590
   36   1HG   GLU   5          2HG       GLU   5   7.933   0.819  -6.808
   37   2HG   GLU   5          3HG       GLU   5   7.729   0.830  -5.067
   38    H    LEU   6           HN       LEU   6   3.912   3.843  -6.884
   39    HA   LEU   6           HA       LEU   6   2.563   2.597  -8.983
   40   1HB   LEU   6          2HB       LEU   6   2.161   5.050  -7.326
   41   2HB   LEU   6          3HB       LEU   6   1.165   4.819  -8.749
   42    HG   LEU   6           HG       LEU   6   1.400   2.848  -6.458
   43   1HD1  LEU   6          1HD1      LEU   6  -0.092   4.048  -5.345
   44   2HD1  LEU   6          2HD1      LEU   6  -0.049   5.289  -6.620
   45   3HD1  LEU   6          3HD1      LEU   6  -1.219   3.952  -6.719
   46   1HD2  LEU   6          1HD2      LEU   6   0.156   2.710  -9.125
   47   2HD2  LEU   6          2HD2      LEU   6   0.663   1.413  -8.016
   48   3HD2  LEU   6          3HD2      LEU   6  -0.902   2.226  -7.778
   49    H    LYS   7           HN       LYS   7   4.445   5.675  -8.808
   50    HA   LYS   7           HA       LYS   7   3.885   6.551 -11.375
   51   1HB   LYS   7          2HB       LYS   7   5.244   7.536  -9.254
   52   2HB   LYS   7          3HB       LYS   7   6.595   7.072 -10.269
   53   1HG   LYS   7          2HG       LYS   7   5.790   8.435 -12.117
   54   2HG   LYS   7          3HG       LYS   7   4.250   8.710 -11.327
   55   1HD   LYS   7          2HD       LYS   7   5.123  10.593 -10.414
   56   2HD   LYS   7          3HD       LYS   7   6.167   9.579  -9.437
   57   1HE   LYS   7          2HE       LYS   7   7.887   9.582 -11.244
   58   2HE   LYS   7          3HE       LYS   7   6.839  10.556 -12.255
   59   1HZ   LYS   7          1HZ       LYS   7   7.050  12.350 -10.827
   60   2HZ   LYS   7          2HZ       LYS   7   7.618  11.457  -9.583
   61   3HZ   LYS   7          3HZ       LYS   7   8.564  11.739 -10.884
   62    H    GLY   8           HN       GLY   8   6.688   4.571 -10.181
   63   1HA   GLY   8          1HA       GLY   8   7.900   4.170 -12.651
   64   2HA   GLY   8          2HA       GLY   8   8.029   3.122 -11.252
   65    H    ILE   9           HN       ILE   9   5.551   2.034 -10.865
   66    HA   ILE   9           HA       ILE   9   5.412   0.058 -12.780
   67    HB   ILE   9           HB       ILE   9   3.727   1.002 -10.531
   68   1HG1  ILE   9          2HG1      ILE   9   4.969  -1.646 -11.326
   69   2HG1  ILE   9          3HG1      ILE   9   5.560  -0.526 -10.114
   70   1HG2  ILE   9          1HG2      ILE   9   2.702  -0.887 -12.665
   71   2HG2  ILE   9          2HG2      ILE   9   1.999  -0.720 -11.038
   72   3HG2  ILE   9          3HG2      ILE   9   1.993   0.665 -12.156
   73   1HD1  ILE   9          1HD1      ILE   9   2.979  -2.144 -10.033
   74   2HD1  ILE   9          2HD1      ILE   9   4.370  -2.251  -8.927
   75   3HD1  ILE   9          3HD1      ILE   9   3.320  -0.814  -8.899
   76    H    PHE  10           HN       PHE  10   3.393   3.044 -12.404
   77    HA   PHE  10           HA       PHE  10   1.656   2.616 -14.464
   78   1HB   PHE  10          2HB       PHE  10   1.472   4.519 -12.935
   79   2HB   PHE  10          3HB       PHE  10   3.091   5.068 -13.318
   80    HD1  PHE  10           HD1      PHE  10  -0.394   5.233 -14.211
   81    HD2  PHE  10           HD2      PHE  10   3.533   6.102 -15.562
   82    HE1  PHE  10           HE1      PHE  10  -1.333   6.803 -15.930
   83    HE2  PHE  10           HE2      PHE  10   2.595   7.671 -17.281
   84    HZ   PHE  10           HZ       PHE  10   0.173   8.003 -17.445
   85    H    GLU  11           HN       GLU  11   4.840   4.370 -14.632
   86    HA   GLU  11           HA       GLU  11   4.694   4.784 -17.366
   87   1HB   GLU  11          2HB       GLU  11   6.623   5.167 -15.213
   88   2HB   GLU  11          3HB       GLU  11   7.441   4.610 -16.659
   89   1HG   GLU  11          2HG       GLU  11   5.994   6.427 -17.904
   90   2HG   GLU  11          3HG       GLU  11   5.734   7.096 -16.305
   91    H    LYS  12           HN       LYS  12   5.864   2.042 -15.394
   92    HA   LYS  12           HA       LYS  12   7.326   0.718 -17.341
   93   1HB   LYS  12          2HB       LYS  12   6.459   0.264 -14.688
   94   2HB   LYS  12          3HB       LYS  12   5.917  -1.122 -15.613
   95   1HG   LYS  12          2HG       LYS  12   8.474  -0.755 -16.625
   96   2HG   LYS  12          3HG       LYS  12   8.685  -0.249 -14.961
   97   1HD   LYS  12          2HD       LYS  12   7.104  -2.599 -14.806
   98   2HD   LYS  12          3HD       LYS  12   8.300  -2.947 -16.038
   99   1HE   LYS  12          2HE       LYS  12  10.127  -2.606 -14.548
  100   2HE   LYS  12          3HE       LYS  12   9.160  -1.679 -13.418
  101   1HZ   LYS  12          1HZ       LYS  12   7.908  -4.064 -13.528
  102   2HZ   LYS  12          2HZ       LYS  12   9.484  -4.487 -13.603
  103   3HZ   LYS  12          3HZ       LYS  12   8.939  -3.587 -12.354
  104    H    TYR  13           HN       TYR  13   3.830   1.087 -16.858
  105    HA   TYR  13           HA       TYR  13   3.308  -0.933 -18.897
  106   1HB   TYR  13          2HB       TYR  13   1.845   0.673 -16.768
  107   2HB   TYR  13          3HB       TYR  13   0.891   0.123 -18.132
  108    HD1  TYR  13           HD1      TYR  13   3.062  -1.052 -15.346
  109    HD2  TYR  13           HD2      TYR  13   0.137  -2.126 -18.277
  110    HE1  TYR  13           HE1      TYR  13   2.781  -3.324 -14.242
  111    HE2  TYR  13           HE2      TYR  13  -0.135  -4.395 -17.163
  112    HH   TYR  13           HH       TYR  13   1.741  -5.211 -14.254
  113    H    ALA  14           HN       ALA  14   3.039   2.598 -18.255
  114    HA   ALA  14           HA       ALA  14   1.610   3.182 -20.610
  115   1HB   ALA  14          1HB       ALA  14   2.215   4.525 -18.346
  116   2HB   ALA  14          2HB       ALA  14   3.462   5.201 -19.421
  117   3HB   ALA  14          3HB       ALA  14   1.741   5.342 -19.854
  118    H    ALA  15           HN       ALA  15   4.974   2.433 -19.906
  119    HA   ALA  15           HA       ALA  15   5.931   3.636 -22.346
  120   1HB   ALA  15          1HB       ALA  15   7.177   3.443 -20.099
  121   2HB   ALA  15          2HB       ALA  15   7.409   1.726 -20.511
  122   3HB   ALA  15          3HB       ALA  15   8.080   2.993 -21.566
  123    H    LYS  16           HN       LYS  16   4.491   0.644 -21.278
  124    HA   LYS  16           HA       LYS  16   5.693  -1.187 -22.948
  125   1HB   LYS  16          2HB       LYS  16   3.574  -1.142 -21.143
  126   2HB   LYS  16          3HB       LYS  16   2.809  -1.577 -22.659
  127   1HG   LYS  16          2HG       LYS  16   4.729  -3.298 -22.959
  128   2HG   LYS  16          3HG       LYS  16   5.133  -2.987 -21.283
  129   1HD   LYS  16          2HD       LYS  16   3.201  -4.007 -20.472
  130   2HD   LYS  16          3HD       LYS  16   2.248  -3.576 -21.878
  131   1HE   LYS  16          2HE       LYS  16   2.557  -5.947 -22.036
  132   2HE   LYS  16          3HE       LYS  16   3.660  -5.264 -23.214
  133   1HZ   LYS  16          1HZ       LYS  16   4.455  -6.995 -21.476
  134   2HZ   LYS  16          2HZ       LYS  16   5.443  -5.782 -21.944
  135   3HZ   LYS  16          3HZ       LYS  16   4.648  -5.685 -20.521
  136    H    GLU  17           HN       GLU  17   2.551   0.529 -23.598
  137    HA   GLU  17           HA       GLU  17   3.288   0.352 -26.417
  138   1HB   GLU  17          2HB       GLU  17   0.616   0.036 -25.024
  139   2HB   GLU  17          3HB       GLU  17   0.676   0.531 -26.704
  140   1HG   GLU  17          2HG       GLU  17   2.488  -1.635 -26.552
  141   2HG   GLU  17          3HG       GLU  17   1.150  -2.121 -25.530
  142    H    GLY  18           HN       GLY  18   3.347   2.256 -27.588
  143   1HA   GLY  18          1HA       GLY  18   3.190   4.448 -28.060
  144   2HA   GLY  18          2HA       GLY  18   1.803   4.535 -26.993
  145    H    ASP  19           HN       ASP  19   3.154   6.767 -26.831
  146    HA   ASP  19           HA       ASP  19   5.470   6.853 -25.392
  147   1HB   ASP  19          2HB       ASP  19   3.924   8.712 -26.545
  148   2HB   ASP  19          3HB       ASP  19   3.305   8.910 -24.917
  149    HA   PRO  20           HA       PRO  20   4.035   5.752 -21.384
  150   1HB   PRO  20          2HB       PRO  20   6.208   6.480 -19.896
  151   2HB   PRO  20          3HB       PRO  20   6.110   4.966 -20.773
  152   1HG   PRO  20          2HG       PRO  20   7.648   7.399 -21.444
  153   2HG   PRO  20          3HG       PRO  20   7.858   5.767 -22.047
  154   1HD   PRO  20          2HD       PRO  20   6.633   7.963 -23.427
  155   2HD   PRO  20          3HD       PRO  20   6.739   6.304 -23.982
  156    H    ASN  21           HN       ASN  21   4.207   8.782 -22.527
  157    HA   ASN  21           HA       ASN  21   3.737  10.037 -19.991
  158   1HB   ASN  21          2HB       ASN  21   3.969  10.978 -22.872
  159   2HB   ASN  21          3HB       ASN  21   3.258  12.049 -21.681
  160   1HD2  ASN  21          1HD2      ASN  21   6.060   9.924 -22.202
  161   2HD2  ASN  21          2HD2      ASN  21   7.240  10.911 -21.406
  162    H    GLN  22           HN       GLN  22   2.013   8.602 -22.705
  163    HA   GLN  22           HA       GLN  22  -0.479   9.537 -21.523
  164   1HB   GLN  22          2HB       GLN  22  -1.273   9.257 -24.086
  165   2HB   GLN  22          3HB       GLN  22  -0.665  10.773 -23.452
  166   1HG   GLN  22          2HG       GLN  22   1.594  10.286 -24.301
  167   2HG   GLN  22          3HG       GLN  22   1.104   8.678 -24.797
  168   1HE2  GLN  22          1HE2      GLN  22   1.768   9.168 -26.907
  169   2HE2  GLN  22          2HE2      GLN  22   0.799  10.115 -27.987
  170    H    LEU  23           HN       LEU  23  -1.733   7.852 -20.847
  171    HA   LEU  23           HA       LEU  23  -0.960   5.192 -21.640
  172   1HB   LEU  23          2HB       LEU  23  -2.180   6.439 -19.390
  173   2HB   LEU  23          3HB       LEU  23  -3.300   5.243 -20.011
  174    HG   LEU  23           HG       LEU  23  -0.671   4.084 -19.929
  175   1HD1  LEU  23          1HD1      LEU  23  -0.050   5.700 -18.266
  176   2HD1  LEU  23          2HD1      LEU  23  -1.557   5.422 -17.360
  177   3HD1  LEU  23          3HD1      LEU  23  -0.329   4.137 -17.462
  178   1HD2  LEU  23          1HD2      LEU  23  -3.317   3.559 -18.580
  179   2HD2  LEU  23          2HD2      LEU  23  -2.535   2.664 -19.904
  180   3HD2  LEU  23          3HD2      LEU  23  -1.876   2.567 -18.254
  181    H    SER  24           HN       SER  24  -2.968   3.617 -22.022
  182    HA   SER  24           HA       SER  24  -4.921   4.931 -23.691
  183   1HB   SER  24          2HB       SER  24  -3.021   2.759 -24.669
  184   2HB   SER  24          3HB       SER  24  -4.515   3.152 -25.495
  185    HG   SER  24           HG       SER  24  -2.283   4.933 -25.010
  186    H    LYS  25           HN       LYS  25  -6.613   3.176 -24.463
  187    HA   LYS  25           HA       LYS  25  -7.665   1.962 -22.217
  188   1HB   LYS  25          2HB       LYS  25  -8.866   2.626 -24.324
  189   2HB   LYS  25          3HB       LYS  25  -8.195   1.209 -25.105
  190   1HG   LYS  25          2HG       LYS  25  -9.193  -0.056 -22.968
  191   2HG   LYS  25          3HG       LYS  25 -10.220   1.360 -22.866
  192   1HD   LYS  25          2HD       LYS  25 -10.128   0.486 -25.629
  193   2HD   LYS  25          3HD       LYS  25 -10.493  -0.899 -24.620
  194   1HE   LYS  25          2HE       LYS  25 -12.628  -0.171 -24.403
  195   2HE   LYS  25          3HE       LYS  25 -12.051   1.268 -23.587
  196   1HZ   LYS  25          1HZ       LYS  25 -13.332   1.397 -25.832
  197   2HZ   LYS  25          2HZ       LYS  25 -12.146   2.464 -25.483
  198   3HZ   LYS  25          3HZ       LYS  25 -11.843   1.201 -26.474
  199    H    GLU  26           HN       GLU  26  -5.980   0.392 -25.033
  200    HA   GLU  26           HA       GLU  26  -5.976  -2.123 -23.937
  201   1HB   GLU  26          2HB       GLU  26  -4.981  -0.862 -26.262
  202   2HB   GLU  26          3HB       GLU  26  -3.572  -1.599 -25.526
  203   1HG   GLU  26          2HG       GLU  26  -6.018  -3.315 -25.563
  204   2HG   GLU  26          3HG       GLU  26  -5.353  -2.940 -27.141
  205    H    GLU  27           HN       GLU  27  -3.593   0.571 -23.643
  206    HA   GLU  27           HA       GLU  27  -1.651  -0.867 -22.318
  207   1HB   GLU  27          2HB       GLU  27  -2.334   1.989 -22.747
  208   2HB   GLU  27          3HB       GLU  27  -1.406   1.695 -21.290
  209   1HG   GLU  27          2HG       GLU  27   0.009   0.125 -23.002
  210   2HG   GLU  27          3HG       GLU  27  -0.623   1.279 -24.160
  211    H    LEU  28           HN       LEU  28  -4.221   1.316 -20.941
  212    HA   LEU  28           HA       LEU  28  -3.663   0.792 -18.285
  213   1HB   LEU  28          2HB       LEU  28  -5.197   2.529 -19.469
  214   2HB   LEU  28          3HB       LEU  28  -6.442   1.310 -19.284
  215    HG   LEU  28           HG       LEU  28  -6.653   1.646 -17.059
  216   1HD1  LEU  28          1HD1      LEU  28  -4.489   0.741 -16.464
  217   2HD1  LEU  28          2HD1      LEU  28  -3.693   2.273 -16.898
  218   3HD1  LEU  28          3HD1      LEU  28  -4.811   2.212 -15.514
  219   1HD2  LEU  28          1HD2      LEU  28  -6.292   3.984 -16.404
  220   2HD2  LEU  28          2HD2      LEU  28  -5.249   4.220 -17.827
  221   3HD2  LEU  28          3HD2      LEU  28  -6.977   3.851 -18.042
  222    H    LYS  29           HN       LYS  29  -5.776  -0.943 -20.634
  223    HA   LYS  29           HA       LYS  29  -7.090  -2.646 -19.011
  224   1HB   LYS  29          2HB       LYS  29  -7.360  -2.537 -21.442
  225   2HB   LYS  29          3HB       LYS  29  -5.789  -3.277 -21.677
  226   1HG   LYS  29          2HG       LYS  29  -6.507  -5.386 -20.946
  227   2HG   LYS  29          3HG       LYS  29  -7.761  -4.725 -19.916
  228   1HD   LYS  29          2HD       LYS  29  -9.233  -5.238 -21.570
  229   2HD   LYS  29          3HD       LYS  29  -8.558  -3.893 -22.468
  230   1HE   LYS  29          2HE       LYS  29  -6.689  -5.853 -23.005
  231   2HE   LYS  29          3HE       LYS  29  -8.139  -6.823 -22.845
  232   1HZ   LYS  29          1HZ       LYS  29  -8.973  -5.968 -24.704
  233   2HZ   LYS  29          2HZ       LYS  29  -8.490  -4.440 -24.386
  234   3HZ   LYS  29          3HZ       LYS  29  -7.444  -5.506 -25.046
  235    H    LEU  30           HN       LEU  30  -3.756  -3.215 -20.344
  236    HA   LEU  30           HA       LEU  30  -3.287  -5.576 -19.011
  237   1HB   LEU  30          2HB       LEU  30  -1.306  -3.411 -19.727
  238   2HB   LEU  30          3HB       LEU  30  -0.920  -5.081 -19.361
  239    HG   LEU  30           HG       LEU  30  -2.193  -3.911 -21.808
  240   1HD1  LEU  30          1HD1      LEU  30  -0.046  -4.273 -22.379
  241   2HD1  LEU  30          2HD1      LEU  30   0.205  -5.491 -21.106
  242   3HD1  LEU  30          3HD1      LEU  30  -0.603  -5.945 -22.625
  243   1HD2  LEU  30          1HD2      LEU  30  -2.598  -6.753 -20.846
  244   2HD2  LEU  30          2HD2      LEU  30  -3.845  -5.533 -21.200
  245   3HD2  LEU  30          3HD2      LEU  30  -2.863  -6.211 -22.521
  246    H    LEU  31           HN       LEU  31  -2.332  -2.222 -17.976
  247    HA   LEU  31           HA       LEU  31  -1.283  -2.875 -15.546
  248   1HB   LEU  31          2HB       LEU  31  -1.491  -0.634 -16.837
  249   2HB   LEU  31          3HB       LEU  31  -2.975  -0.426 -15.929
  250    HG   LEU  31           HG       LEU  31  -0.774  -1.170 -14.177
  251   1HD1  LEU  31          1HD1      LEU  31   0.001   1.450 -14.667
  252   2HD1  LEU  31          2HD1      LEU  31   0.902  -0.025 -15.091
  253   3HD1  LEU  31          3HD1      LEU  31  -0.167   0.740 -16.290
  254   1HD2  LEU  31          1HD2      LEU  31  -1.565   0.657 -12.861
  255   2HD2  LEU  31          2HD2      LEU  31  -2.427   1.365 -14.248
  256   3HD2  LEU  31          3HD2      LEU  31  -2.985  -0.171 -13.543
  257    H    LEU  32           HN       LEU  32  -4.708  -1.768 -16.086
  258    HA   LEU  32           HA       LEU  32  -5.632  -2.273 -13.574
  259   1HB   LEU  32          2HB       LEU  32  -7.136  -2.674 -16.163
  260   2HB   LEU  32          3HB       LEU  32  -7.841  -2.408 -14.581
  261    HG   LEU  32           HG       LEU  32  -6.038  -0.396 -15.946
  262   1HD1  LEU  32          1HD1      LEU  32  -8.389   0.778 -16.227
  263   2HD1  LEU  32          2HD1      LEU  32  -7.764  -0.360 -17.445
  264   3HD1  LEU  32          3HD1      LEU  32  -8.967  -0.905 -16.251
  265   1HD2  LEU  32          1HD2      LEU  32  -7.789   0.904 -14.219
  266   2HD2  LEU  32          2HD2      LEU  32  -7.305  -0.562 -13.334
  267   3HD2  LEU  32          3HD2      LEU  32  -6.065   0.562 -13.939
  268    H    GLN  33           HN       GLN  33  -4.598  -4.553 -16.024
  269    HA   GLN  33           HA       GLN  33  -6.095  -6.726 -15.063
  270   1HB   GLN  33          2HB       GLN  33  -4.549  -6.233 -17.292
  271   2HB   GLN  33          3HB       GLN  33  -3.495  -7.304 -16.390
  272   1HG   GLN  33          2HG       GLN  33  -5.409  -8.936 -16.156
  273   2HG   GLN  33          3HG       GLN  33  -6.400  -7.879 -17.141
  274   1HE2  GLN  33          1HE2      GLN  33  -6.236  -7.898 -19.295
  275   2HE2  GLN  33          2HE2      GLN  33  -5.144  -8.878 -20.216
  276    H    THR  34           HN       THR  34  -2.518  -6.052 -14.857
  277    HA   THR  34           HA       THR  34  -2.280  -7.909 -12.666
  278    HB   THR  34           HB       THR  34  -0.549  -6.427 -14.575
  279    HG1  THR  34           HG1      THR  34  -0.774  -8.722 -14.618
  280   1HG2  THR  34          1HG2      THR  34   1.460  -6.842 -13.011
  281   2HG2  THR  34          2HG2      THR  34   0.468  -5.419 -12.611
  282   3HG2  THR  34          3HG2      THR  34   0.285  -6.922 -11.675
  283    H    GLU  35           HN       GLU  35  -1.939  -4.334 -13.123
  284    HA   GLU  35           HA       GLU  35  -1.205  -3.675 -10.627
  285   1HB   GLU  35          2HB       GLU  35  -1.442  -2.053 -12.460
  286   2HB   GLU  35          3HB       GLU  35  -3.186  -2.231 -12.441
  287   1HG   GLU  35          2HG       GLU  35  -2.377  -1.614  -9.752
  288   2HG   GLU  35          3HG       GLU  35  -1.530  -0.502 -10.809
  289    H    PHE  36           HN       PHE  36  -4.660  -3.838 -11.776
  290    HA   PHE  36           HA       PHE  36  -5.411  -4.909  -9.202
  291   1HB   PHE  36          2HB       PHE  36  -5.834  -2.109 -10.177
  292   2HB   PHE  36          3HB       PHE  36  -7.317  -2.882  -9.655
  293    HD1  PHE  36           HD1      PHE  36  -7.851  -2.999  -7.381
  294    HD2  PHE  36           HD2      PHE  36  -3.867  -2.089  -8.525
  295    HE1  PHE  36           HE1      PHE  36  -7.287  -2.469  -4.994
  296    HE2  PHE  36           HE2      PHE  36  -3.303  -1.559  -6.137
  297    HZ   PHE  36           HZ       PHE  36  -5.019  -1.756  -4.400
  298    HA   PRO  37           HA       PRO  37  -7.819  -6.642 -12.555
  299   1HB   PRO  37          2HB       PRO  37  -7.766  -9.230 -11.678
  300   2HB   PRO  37          3HB       PRO  37  -6.583  -8.571 -12.790
  301   1HG   PRO  37          2HG       PRO  37  -6.285  -9.180  -9.912
  302   2HG   PRO  37          3HG       PRO  37  -5.037  -8.934 -11.117
  303   1HD   PRO  37          2HD       PRO  37  -5.878  -7.065  -9.110
  304   2HD   PRO  37          3HD       PRO  37  -4.713  -6.778 -10.386
  305    H    SER  38           HN       SER  38  -8.328  -5.926  -9.436
  306    HA   SER  38           HA       SER  38 -10.829  -7.328  -9.267
  307   1HB   SER  38          2HB       SER  38  -8.963  -6.262  -7.406
  308   2HB   SER  38          3HB       SER  38 -10.420  -5.310  -7.201
  309    HG   SER  38           HG       SER  38 -11.381  -7.732  -7.349
  310    H    LEU  39           HN       LEU  39  -9.512  -4.127 -10.051
  311    HA   LEU  39           HA       LEU  39 -11.931  -2.699  -9.726
  312   1HB   LEU  39          2HB       LEU  39  -9.212  -2.183 -10.422
  313   2HB   LEU  39          3HB       LEU  39 -10.235  -1.471 -11.654
  314    HG   LEU  39           HG       LEU  39  -9.553  -0.036  -9.631
  315   1HD1  LEU  39          1HD1      LEU  39 -12.523  -0.115 -10.164
  316   2HD1  LEU  39          2HD1      LEU  39 -11.485   1.290  -9.825
  317   3HD1  LEU  39          3HD1      LEU  39 -11.346   0.436 -11.380
  318   1HD2  LEU  39          1HD2      LEU  39 -11.883  -0.786  -8.088
  319   2HD2  LEU  39          2HD2      LEU  39 -10.740  -2.143  -8.220
  320   3HD2  LEU  39          3HD2      LEU  39 -10.192  -0.577  -7.575
  321    H    LEU  40           HN       LEU  40 -10.714  -4.934 -12.114
  322    HA   LEU  40           HA       LEU  40 -12.285  -3.922 -14.269
  323   1HB   LEU  40          2HB       LEU  40 -10.806  -6.516 -13.824
  324   2HB   LEU  40          3HB       LEU  40 -11.664  -6.129 -15.302
  325    HG   LEU  40           HG       LEU  40  -9.387  -4.477 -14.178
  326   1HD1  LEU  40          1HD1      LEU  40  -9.153  -6.276 -16.577
  327   2HD1  LEU  40          2HD1      LEU  40  -7.875  -5.572 -15.557
  328   3HD1  LEU  40          3HD1      LEU  40  -8.881  -6.902 -14.933
  329   1HD2  LEU  40          1HD2      LEU  40  -9.853  -4.222 -17.016
  330   2HD2  LEU  40          2HD2      LEU  40 -11.332  -3.845 -16.100
  331   3HD2  LEU  40          3HD2      LEU  40  -9.822  -2.972 -15.749
  332    H    LYS  41           HN       LYS  41 -12.777  -6.049 -11.498
  333    HA   LYS  41           HA       LYS  41 -15.030  -7.397 -12.559
  334   1HB   LYS  41          2HB       LYS  41 -14.034  -7.002  -9.724
  335   2HB   LYS  41          3HB       LYS  41 -15.388  -8.028 -10.154
  336   1HG   LYS  41          2HG       LYS  41 -13.455  -8.886 -11.951
  337   2HG   LYS  41          3HG       LYS  41 -12.475  -8.473 -10.558
  338   1HD   LYS  41          2HD       LYS  41 -13.339 -10.178  -9.266
  339   2HD   LYS  41          3HD       LYS  41 -14.956  -9.999  -9.918
  340   1HE   LYS  41          2HE       LYS  41 -12.796 -11.062 -11.743
  341   2HE   LYS  41          3HE       LYS  41 -13.440 -12.133 -10.515
  342   1HZ   LYS  41          1HZ       LYS  41 -15.129 -12.456 -11.867
  343   2HZ   LYS  41          2HZ       LYS  41 -15.604 -10.908 -11.656
  344   3HZ   LYS  41          3HZ       LYS  41 -14.633 -11.301 -12.909
  345    H    GLY  42           HN       GLY  42 -14.482  -4.339 -10.790
  346   1HA   GLY  42          1HA       GLY  42 -16.891  -3.660  -9.814
  347   2HA   GLY  42          2HA       GLY  42 -15.841  -2.531 -10.649
  348    H    MET  43           HN       MET  43 -18.628  -2.190 -10.715
  349    HA   MET  43           HA       MET  43 -19.747  -3.429 -12.977
  350   1HB   MET  43          2HB       MET  43 -20.504  -0.862 -11.472
  351   2HB   MET  43          3HB       MET  43 -21.547  -1.673 -12.623
  352   1HG   MET  43          2HG       MET  43 -20.431  -3.233 -10.274
  353   2HG   MET  43          3HG       MET  43 -21.801  -2.169 -10.026
  354   1HE   MET  43          1HE       MET  43 -21.821  -5.073  -9.407
  355   2HE   MET  43          2HE       MET  43 -23.460  -4.379  -9.388
  356   3HE   MET  43          3HE       MET  43 -23.146  -5.896 -10.265
  357    H    SER  44           HN       SER  44 -17.271  -1.184 -12.757
  358    HA   SER  44           HA       SER  44 -18.146   0.359 -15.032
  359   1HB   SER  44          2HB       SER  44 -15.579   0.532 -13.391
  360   2HB   SER  44          3HB       SER  44 -16.064   1.667 -14.635
  361    HG   SER  44           HG       SER  44 -17.533   1.116 -12.197
  362    H    THR  45           HN       THR  45 -18.002  -0.924 -16.887
  363    HA   THR  45           HA       THR  45 -15.995  -2.857 -17.282
  364    HB   THR  45           HB       THR  45 -16.986  -2.962 -19.533
  365    HG1  THR  45           HG1      THR  45 -18.425  -0.550 -18.741
  366   1HG2  THR  45          1HG2      THR  45 -19.551  -2.232 -18.603
  367   2HG2  THR  45          2HG2      THR  45 -18.835  -3.859 -18.519
  368   3HG2  THR  45          3HG2      THR  45 -18.686  -2.749 -17.136
  369    H    LEU  46           HN       LEU  46 -14.518  -2.780 -19.307
  370    HA   LEU  46           HA       LEU  46 -12.506  -0.989 -18.798
  371   1HB   LEU  46          2HB       LEU  46 -12.656  -3.192 -20.205
  372   2HB   LEU  46          3HB       LEU  46 -12.936  -2.099 -21.546
  373    HG   LEU  46           HG       LEU  46 -10.702  -1.023 -20.257
  374   1HD1  LEU  46          1HD1      LEU  46 -10.004  -2.739 -18.943
  375   2HD1  LEU  46          2HD1      LEU  46 -10.780  -3.984 -19.951
  376   3HD1  LEU  46          3HD1      LEU  46  -9.245  -3.248 -20.471
  377   1HD2  LEU  46          1HD2      LEU  46 -10.977  -2.763 -22.718
  378   2HD2  LEU  46          2HD2      LEU  46 -10.969  -0.985 -22.624
  379   3HD2  LEU  46          3HD2      LEU  46  -9.484  -1.902 -22.272
  380    H    ASP  47           HN       ASP  47 -14.816  -0.864 -21.608
  381    HA   ASP  47           HA       ASP  47 -14.076   1.456 -22.662
  382   1HB   ASP  47          2HB       ASP  47 -16.217  -0.218 -22.970
  383   2HB   ASP  47          3HB       ASP  47 -17.033   1.157 -22.252
  384    H    GLU  48           HN       GLU  48 -16.522   1.015 -19.993
  385    HA   GLU  48           HA       GLU  48 -17.076   3.658 -19.590
  386   1HB   GLU  48          2HB       GLU  48 -17.510   1.135 -18.213
  387   2HB   GLU  48          3HB       GLU  48 -17.152   2.386 -17.039
  388   1HG   GLU  48          2HG       GLU  48 -18.878   3.795 -18.569
  389   2HG   GLU  48          3HG       GLU  48 -19.459   2.191 -18.966
  390    H    LEU  49           HN       LEU  49 -14.460   1.606 -18.178
  391    HA   LEU  49           HA       LEU  49 -13.495   3.584 -16.431
  392   1HB   LEU  49          2HB       LEU  49 -13.066   0.920 -16.847
  393   2HB   LEU  49          3HB       LEU  49 -11.581   1.607 -17.475
  394    HG   LEU  49           HG       LEU  49 -11.658   2.947 -15.162
  395   1HD1  LEU  49          1HD1      LEU  49 -12.566   0.470 -13.922
  396   2HD1  LEU  49          2HD1      LEU  49 -12.982   2.161 -13.554
  397   3HD1  LEU  49          3HD1      LEU  49 -13.855   1.289 -14.836
  398   1HD2  LEU  49          1HD2      LEU  49  -9.713   1.864 -15.197
  399   2HD2  LEU  49          2HD2      LEU  49 -10.542   0.545 -14.335
  400   3HD2  LEU  49          3HD2      LEU  49 -10.397   0.496 -16.109
  401    H    PHE  50           HN       PHE  50 -12.610   2.612 -19.799
  402    HA   PHE  50           HA       PHE  50 -10.449   4.297 -20.093
  403   1HB   PHE  50          2HB       PHE  50 -11.351   2.447 -21.632
  404   2HB   PHE  50          3HB       PHE  50 -12.652   3.524 -22.099
  405    HD1  PHE  50           HD1      PHE  50 -12.318   4.074 -24.319
  406    HD2  PHE  50           HD2      PHE  50  -8.998   4.162 -21.677
  407    HE1  PHE  50           HE1      PHE  50 -10.883   5.012 -26.153
  408    HE2  PHE  50           HE2      PHE  50  -7.563   5.099 -23.511
  409    HZ   PHE  50           HZ       PHE  50  -8.523   5.513 -25.727
  410    H    GLU  51           HN       GLU  51 -13.924   4.893 -20.991
  411    HA   GLU  51           HA       GLU  51 -13.437   7.510 -21.806
  412   1HB   GLU  51          2HB       GLU  51 -15.638   5.708 -21.710
  413   2HB   GLU  51          3HB       GLU  51 -16.158   7.135 -20.835
  414   1HG   GLU  51          2HG       GLU  51 -15.596   8.583 -22.736
  415   2HG   GLU  51          3HG       GLU  51 -14.855   7.246 -23.594
  416    H    GLU  52           HN       GLU  52 -14.363   6.037 -18.664
  417    HA   GLU  52           HA       GLU  52 -15.043   8.380 -17.377
  418   1HB   GLU  52          2HB       GLU  52 -15.558   6.172 -16.453
  419   2HB   GLU  52          3HB       GLU  52 -13.855   5.788 -16.299
  420   1HG   GLU  52          2HG       GLU  52 -13.566   7.634 -14.655
  421   2HG   GLU  52          3HG       GLU  52 -15.250   8.082 -14.839
  422    H    LEU  53           HN       LEU  53 -11.874   6.602 -17.481
  423    HA   LEU  53           HA       LEU  53 -10.452   8.365 -15.903
  424   1HB   LEU  53          2HB       LEU  53  -9.486   6.702 -18.234
  425   2HB   LEU  53          3HB       LEU  53  -8.470   7.422 -17.001
  426    HG   LEU  53           HG       LEU  53 -10.658   5.575 -16.127
  427   1HD1  LEU  53          1HD1      LEU  53  -9.912   3.787 -17.201
  428   2HD1  LEU  53          2HD1      LEU  53  -8.730   4.798 -18.066
  429   3HD1  LEU  53          3HD1      LEU  53  -8.286   4.035 -16.521
  430   1HD2  LEU  53          1HD2      LEU  53  -9.259   6.812 -14.497
  431   2HD2  LEU  53          2HD2      LEU  53  -9.120   5.044 -14.345
  432   3HD2  LEU  53          3HD2      LEU  53  -7.823   5.973 -15.134
  433    H    ASP  54           HN       ASP  54 -10.775   8.307 -19.522
  434    HA   ASP  54           HA       ASP  54  -9.368  10.722 -19.777
  435   1HB   ASP  54          2HB       ASP  54  -9.585   8.995 -21.581
  436   2HB   ASP  54          3HB       ASP  54 -11.300   9.335 -21.696
  437    H    LYS  55           HN       LYS  55 -10.308  12.548 -18.786
  438    HA   LYS  55           HA       LYS  55 -13.161  12.992 -19.326
  439   1HB   LYS  55          2HB       LYS  55 -11.828  12.867 -16.881
  440   2HB   LYS  55          3HB       LYS  55 -11.995  14.587 -17.173
  441   1HG   LYS  55          2HG       LYS  55 -14.457  14.194 -17.690
  442   2HG   LYS  55          3HG       LYS  55 -14.244  12.521 -17.212
  443   1HD   LYS  55          2HD       LYS  55 -13.571  13.204 -14.939
  444   2HD   LYS  55          3HD       LYS  55 -13.610  14.895 -15.398
  445   1HE   LYS  55          2HE       LYS  55 -15.733  14.778 -14.502
  446   2HE   LYS  55          3HE       LYS  55 -16.140  14.238 -16.118
  447   1HZ   LYS  55          1HZ       LYS  55 -15.303  12.308 -14.093
  448   2HZ   LYS  55          2HZ       LYS  55 -16.850  12.829 -14.149
  449   3HZ   LYS  55          3HZ       LYS  55 -16.201  12.057 -15.434
  450    H    ASN  56           HN       ASN  56  -9.871  14.070 -19.801
  451    HA   ASN  56           HA       ASN  56 -10.417  16.765 -20.224
  452   1HB   ASN  56          2HB       ASN  56  -8.234  15.112 -21.590
  453   2HB   ASN  56          3HB       ASN  56  -8.194  16.834 -21.264
  454   1HD2  ASN  56          1HD2      ASN  56  -8.679  17.363 -18.862
  455   2HD2  ASN  56          2HD2      ASN  56  -7.767  16.472 -17.691
  456    H    GLY  57           HN       GLY  57  -9.968  13.928 -22.468
  457   1HA   GLY  57          1HA       GLY  57 -11.481  13.604 -24.287
  458   2HA   GLY  57          2HA       GLY  57 -11.617  15.342 -24.468
  459    H    ASP  58           HN       ASP  58  -8.916  12.903 -24.269
  460    HA   ASP  58           HA       ASP  58  -7.929  14.061 -26.747
  461   1HB   ASP  58          2HB       ASP  58  -6.055  13.126 -24.548
  462   2HB   ASP  58          3HB       ASP  58  -5.676  14.127 -25.935
  463    H    GLY  59           HN       GLY  59  -7.579  11.425 -24.257
  464   1HA   GLY  59          1HA       GLY  59  -8.218   9.183 -25.127
  465   2HA   GLY  59          2HA       GLY  59  -7.129   9.503 -26.462
  466    H    GLU  60           HN       GLU  60  -5.796  11.054 -23.785
  467    HA   GLU  60           HA       GLU  60  -4.107   8.732 -23.298
  468   1HB   GLU  60          2HB       GLU  60  -2.401  10.423 -22.544
  469   2HB   GLU  60          3HB       GLU  60  -2.855  10.587 -24.229
  470   1HG   GLU  60          2HG       GLU  60  -4.414  12.429 -23.665
  471   2HG   GLU  60          3HG       GLU  60  -4.073  12.229 -21.958
  472    H    VAL  61           HN       VAL  61  -4.162   7.776 -21.304
  473    HA   VAL  61           HA       VAL  61  -5.646   9.196 -19.223
  474    HB   VAL  61           HB       VAL  61  -4.958   6.293 -19.687
  475   1HG1  VAL  61          1HG1      VAL  61  -5.782   7.697 -17.205
  476   2HG1  VAL  61          2HG1      VAL  61  -6.677   6.209 -17.595
  477   3HG1  VAL  61          3HG1      VAL  61  -4.906   6.163 -17.423
  478   1HG2  VAL  61          1HG2      VAL  61  -6.911   7.595 -20.879
  479   2HG2  VAL  61          2HG2      VAL  61  -7.181   5.963 -20.221
  480   3HG2  VAL  61          3HG2      VAL  61  -7.728   7.391 -19.311
  481    H    SER  62           HN       SER  62  -3.434  10.530 -19.318
  482    HA   SER  62           HA       SER  62  -1.126   9.449 -18.358
  483   1HB   SER  62          2HB       SER  62  -1.546  12.122 -17.269
  484   2HB   SER  62          3HB       SER  62  -0.428  11.598 -18.512
  485    HG   SER  62           HG       SER  62  -3.127  12.535 -18.787
  486    H    PHE  63           HN       PHE  63  -0.116   9.993 -16.096
  487    HA   PHE  63           HA       PHE  63  -1.388   8.579 -14.157
  488   1HB   PHE  63          2HB       PHE  63   1.033   9.561 -14.375
  489   2HB   PHE  63          3HB       PHE  63   0.382  11.055 -13.730
  490    HD1  PHE  63           HD1      PHE  63   0.750  11.403 -11.492
  491    HD2  PHE  63           HD2      PHE  63   0.257   7.416 -12.861
  492    HE1  PHE  63           HE1      PHE  63   1.117  10.556  -9.158
  493    HE2  PHE  63           HE2      PHE  63   0.624   6.570 -10.526
  494    HZ   PHE  63           HZ       PHE  63   1.050   8.150  -8.703
  495    H    GLU  64           HN       GLU  64  -1.841  11.991 -15.064
  496    HA   GLU  64           HA       GLU  64  -2.942  12.956 -12.773
  497   1HB   GLU  64          2HB       GLU  64  -4.360  14.376 -14.514
  498   2HB   GLU  64          3HB       GLU  64  -2.625  14.590 -14.390
  499   1HG   GLU  64          2HG       GLU  64  -2.285  13.822 -16.505
  500   2HG   GLU  64          3HG       GLU  64  -3.258  12.392 -16.220
  501    H    GLU  65           HN       GLU  65  -4.666  11.383 -15.564
  502    HA   GLU  65           HA       GLU  65  -7.139  11.443 -14.252
  503   1HB   GLU  65          2HB       GLU  65  -6.191   9.695 -16.565
  504   2HB   GLU  65          3HB       GLU  65  -7.863   9.914 -16.091
  505   1HG   GLU  65          2HG       GLU  65  -7.581  12.413 -16.469
  506   2HG   GLU  65          3HG       GLU  65  -5.969  12.097 -17.081
  507    H    PHE  66           HN       PHE  66  -4.405   9.169 -14.322
  508    HA   PHE  66           HA       PHE  66  -5.699   6.892 -13.423
  509   1HB   PHE  66          2HB       PHE  66  -3.277   7.290 -14.268
  510   2HB   PHE  66          3HB       PHE  66  -2.911   7.969 -12.694
  511    HD1  PHE  66           HD1      PHE  66  -4.480   4.869 -14.082
  512    HD2  PHE  66           HD2      PHE  66  -1.878   6.569 -11.193
  513    HE1  PHE  66           HE1      PHE  66  -3.940   2.575 -13.218
  514    HE2  PHE  66           HE2      PHE  66  -1.339   4.275 -10.329
  515    HZ   PHE  66           HZ       PHE  66  -2.376   2.305 -11.352
  516    H    GLN  67           HN       GLN  67  -4.472   9.771 -11.667
  517    HA   GLN  67           HA       GLN  67  -4.586   8.686  -9.132
  518   1HB   GLN  67          2HB       GLN  67  -5.015  11.573 -10.020
  519   2HB   GLN  67          3HB       GLN  67  -4.688  11.074  -8.372
  520   1HG   GLN  67          2HG       GLN  67  -2.718   9.890 -10.173
  521   2HG   GLN  67          3HG       GLN  67  -2.788  11.623 -10.425
  522   1HE2  GLN  67          1HE2      GLN  67  -0.608  11.535  -9.572
  523   2HE2  GLN  67          2HE2      GLN  67  -0.339  11.591  -7.862
  524    H    VAL  68           HN       VAL  68  -7.111   9.390 -11.366
  525    HA   VAL  68           HA       VAL  68  -9.109  10.023  -9.416
  526    HB   VAL  68           HB       VAL  68  -9.372   9.167 -12.304
  527   1HG1  VAL  68          1HG1      VAL  68 -11.579   9.717 -12.220
  528   2HG1  VAL  68          2HG1      VAL  68 -11.372   9.289 -10.504
  529   3HG1  VAL  68          3HG1      VAL  68 -11.330  10.996 -11.007
  530   1HG2  VAL  68          1HG2      VAL  68  -7.893  11.224 -11.762
  531   2HG2  VAL  68          2HG2      VAL  68  -9.179  11.397 -12.981
  532   3HG2  VAL  68          3HG2      VAL  68  -9.425  12.023 -11.333
  533    H    LEU  69           HN       LEU  69  -7.898   7.125 -11.144
  534    HA   LEU  69           HA       LEU  69 -10.019   5.478 -10.160
  535   1HB   LEU  69          2HB       LEU  69  -8.444   5.317 -12.293
  536   2HB   LEU  69          3HB       LEU  69  -7.459   4.365 -11.200
  537    HG   LEU  69           HG       LEU  69  -9.485   2.921 -10.761
  538   1HD1  LEU  69          1HD1      LEU  69 -11.232   4.461 -11.435
  539   2HD1  LEU  69          2HD1      LEU  69 -10.616   4.473 -13.105
  540   3HD1  LEU  69          3HD1      LEU  69 -11.306   2.981 -12.422
  541   1HD2  LEU  69          1HD2      LEU  69  -7.933   1.889 -12.111
  542   2HD2  LEU  69          2HD2      LEU  69  -9.365   1.899 -13.169
  543   3HD2  LEU  69          3HD2      LEU  69  -8.077   3.106 -13.402
  544    H    VAL  70           HN       VAL  70  -6.863   6.591  -9.052
  545    HA   VAL  70           HA       VAL  70  -6.126   4.586  -7.346
  546    HB   VAL  70           HB       VAL  70  -5.795   7.542  -7.455
  547   1HG1  VAL  70          1HG1      VAL  70  -4.226   7.185  -5.369
  548   2HG1  VAL  70          2HG1      VAL  70  -5.956   7.545  -5.150
  549   3HG1  VAL  70          3HG1      VAL  70  -5.368   5.872  -4.996
  550   1HG2  VAL  70          1HG2      VAL  70  -4.190   6.537  -8.751
  551   2HG2  VAL  70          2HG2      VAL  70  -3.327   6.592  -7.195
  552   3HG2  VAL  70          3HG2      VAL  70  -4.109   5.084  -7.726
  553    H    LYS  71           HN       LYS  71  -8.839   6.846  -7.133
  554    HA   LYS  71           HA       LYS  71  -9.274   6.481  -4.352
  555   1HB   LYS  71          2HB       LYS  71 -10.129   8.269  -6.231
  556   2HB   LYS  71          3HB       LYS  71 -11.553   7.262  -6.069
  557   1HG   LYS  71          2HG       LYS  71 -10.696   7.630  -3.411
  558   2HG   LYS  71          3HG       LYS  71 -10.403   9.187  -4.159
  559   1HD   LYS  71          2HD       LYS  71 -12.615   9.581  -3.749
  560   2HD   LYS  71          3HD       LYS  71 -12.899   8.602  -5.174
  561   1HE   LYS  71          2HE       LYS  71 -12.774   6.567  -3.468
  562   2HE   LYS  71          3HE       LYS  71 -13.091   7.796  -2.259
  563   1HZ   LYS  71          1HZ       LYS  71 -15.009   8.459  -3.670
  564   2HZ   LYS  71          2HZ       LYS  71 -14.766   7.116  -4.567
  565   3HZ   LYS  71          3HZ       LYS  71 -15.145   6.982  -2.984
  566    H    LYS  72           HN       LYS  72 -10.616   5.019  -7.373
  567    HA   LYS  72           HA       LYS  72 -12.330   3.284  -5.880
  568   1HB   LYS  72          2HB       LYS  72 -11.574   3.422  -8.812
  569   2HB   LYS  72          3HB       LYS  72 -12.722   2.273  -8.155
  570   1HG   LYS  72          2HG       LYS  72 -12.983   5.293  -7.792
  571   2HG   LYS  72          3HG       LYS  72 -13.750   4.413  -9.098
  572   1HD   LYS  72          2HD       LYS  72 -14.522   2.901  -6.911
  573   2HD   LYS  72          3HD       LYS  72 -14.455   4.504  -6.206
  574   1HE   LYS  72          2HE       LYS  72 -15.906   5.355  -8.098
  575   2HE   LYS  72          3HE       LYS  72 -16.030   3.715  -8.704
  576   1HZ   LYS  72          1HZ       LYS  72 -17.690   4.773  -6.935
  577   2HZ   LYS  72          2HZ       LYS  72 -17.435   3.167  -7.082
  578   3HZ   LYS  72          3HZ       LYS  72 -16.657   4.014  -5.923
  579    H    ILE  73           HN       ILE  73  -8.980   3.393  -6.522
  580    HA   ILE  73           HA       ILE  73  -8.572   0.584  -6.805
  581    HB   ILE  73           HB       ILE  73  -6.825   2.985  -6.396
  582   1HG1  ILE  73          2HG1      ILE  73  -6.837   0.894  -8.586
  583   2HG1  ILE  73          3HG1      ILE  73  -7.804   2.354  -8.644
  584   1HG2  ILE  73          1HG2      ILE  73  -4.848   1.521  -6.461
  585   2HG2  ILE  73          2HG2      ILE  73  -5.826   1.270  -4.995
  586   3HG2  ILE  73          3HG2      ILE  73  -5.908   0.097  -6.332
  587   1HD1  ILE  73          1HD1      ILE  73  -4.976   2.868  -7.934
  588   2HD1  ILE  73          2HD1      ILE  73  -5.190   2.138  -9.543
  589   3HD1  ILE  73          3HD1      ILE  73  -6.008   3.668  -9.143
  590    H    SER  74           HN       SER  74  -8.176   2.995  -4.124
  591    HA   SER  74           HA       SER  74  -7.506   0.956  -2.291
  592   1HB   SER  74          2HB       SER  74  -7.873   3.902  -2.264
  593   2HB   SER  74          3HB       SER  74  -8.286   3.123  -0.749
  594    HG   SER  74           HG       SER  74  -5.767   3.265  -2.090
  595    H    GLN  75           HN       GLN  75 -10.469   2.786  -3.190
  596    HA   GLN  75           HA       GLN  75 -11.995   1.778  -1.057
  597   1HB   GLN  75          2HB       GLN  75 -12.318   3.822  -2.815
  598   2HB   GLN  75          3HB       GLN  75 -13.341   2.633  -3.596
  599   1HG   GLN  75          2HG       GLN  75 -14.619   4.035  -1.973
  600   2HG   GLN  75          3HG       GLN  75 -14.666   2.336  -1.546
  601   1HE2  GLN  75          1HE2      GLN  75 -12.328   4.996  -1.122
  602   2HE2  GLN  75          2HE2      GLN  75 -12.108   4.823   0.588
  Start of MODEL   13
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   2.254   1.040  -1.518
    3   1HB   LYS   1          2HB       LYS   1   3.426  -1.273  -0.148
    4   2HB   LYS   1          3HB       LYS   1   3.648  -1.328  -1.885
    5   1HG   LYS   1          2HG       LYS   1   4.752   0.810  -1.927
    6   2HG   LYS   1          3HG       LYS   1   4.211   1.213  -0.309
    7   1HD   LYS   1          2HD       LYS   1   5.588  -0.781   0.540
    8   2HD   LYS   1          3HD       LYS   1   6.252  -0.922  -1.075
    9   1HE   LYS   1          2HE       LYS   1   7.111   1.417  -0.942
   10   2HE   LYS   1          3HE       LYS   1   6.416   1.591   0.658
   11   1HZ   LYS   1          1HZ       LYS   1   7.867  -0.656   0.866
   12   2HZ   LYS   1          2HZ       LYS   1   8.795   0.250  -0.127
   13   3HZ   LYS   1          3HZ       LYS   1   8.362   0.826   1.339
   14    H    SER   2           HN       SER   2   0.549  -2.085  -1.034
   15    HA   SER   2           HA       SER   2   0.356  -2.754  -3.701
   16   1HB   SER   2          2HB       SER   2  -0.607  -3.730  -1.208
   17   2HB   SER   2          3HB       SER   2  -2.028  -3.533  -2.214
   18    HG   SER   2           HG       SER   2   0.215  -4.737  -3.463
   19    HA   PRO   3           HA       PRO   3  -2.983  -0.371  -5.197
   20   1HB   PRO   3          2HB       PRO   3  -4.775  -2.090  -6.337
   21   2HB   PRO   3          3HB       PRO   3  -3.274  -1.619  -7.109
   22   1HG   PRO   3          2HG       PRO   3  -3.958  -4.175  -5.790
   23   2HG   PRO   3          3HG       PRO   3  -2.659  -3.834  -6.916
   24   1HD   PRO   3          2HD       PRO   3  -2.428  -4.145  -4.074
   25   2HD   PRO   3          3HD       PRO   3  -1.152  -3.690  -5.186
   26    H    GLU   4           HN       GLU   4  -4.154  -2.985  -3.204
   27    HA   GLU   4           HA       GLU   4  -6.677  -2.068  -2.783
   28   1HB   GLU   4          2HB       GLU   4  -4.969  -4.043  -1.689
   29   2HB   GLU   4          3HB       GLU   4  -5.506  -3.103  -0.311
   30   1HG   GLU   4          2HG       GLU   4  -7.518  -4.000  -2.396
   31   2HG   GLU   4          3HG       GLU   4  -6.978  -5.128  -1.168
   32    H    GLU   5           HN       GLU   5  -3.626  -1.175  -1.051
   33    HA   GLU   5           HA       GLU   5  -4.920   0.526   0.752
   34   1HB   GLU   5          2HB       GLU   5  -2.156  -0.222   0.044
   35   2HB   GLU   5          3HB       GLU   5  -2.287   1.451   0.547
   36   1HG   GLU   5          2HG       GLU   5  -3.897   0.126   2.413
   37   2HG   GLU   5          3HG       GLU   5  -2.598  -1.020   2.145
   38    H    LEU   6           HN       LEU   6  -3.703   0.890  -2.562
   39    HA   LEU   6           HA       LEU   6  -3.521   3.685  -2.593
   40   1HB   LEU   6          2HB       LEU   6  -3.670   1.489  -4.591
   41   2HB   LEU   6          3HB       LEU   6  -4.046   3.106  -5.151
   42    HG   LEU   6           HG       LEU   6  -1.468   2.254  -3.803
   43   1HD1  LEU   6          1HD1      LEU   6  -2.217   2.726  -6.685
   44   2HD1  LEU   6          2HD1      LEU   6  -0.537   2.864  -6.114
   45   3HD1  LEU   6          3HD1      LEU   6  -1.410   1.322  -5.947
   46   1HD2  LEU   6          1HD2      LEU   6  -1.655   4.474  -3.184
   47   2HD2  LEU   6          2HD2      LEU   6  -0.757   4.584  -4.717
   48   3HD2  LEU   6          3HD2      LEU   6  -2.502   4.934  -4.681
   49    H    LYS   7           HN       LYS   7  -6.230   1.386  -3.131
   50    HA   LYS   7           HA       LYS   7  -8.046   3.300  -4.071
   51   1HB   LYS   7          2HB       LYS   7  -8.060   0.650  -4.015
   52   2HB   LYS   7          3HB       LYS   7  -8.946   0.897  -2.524
   53   1HG   LYS   7          2HG       LYS   7 -10.750   0.990  -3.953
   54   2HG   LYS   7          3HG       LYS   7 -10.283   2.674  -4.077
   55   1HD   LYS   7          2HD       LYS   7 -10.331   2.171  -6.335
   56   2HD   LYS   7          3HD       LYS   7  -8.669   1.723  -6.009
   57   1HE   LYS   7          2HE       LYS   7  -9.246  -0.632  -5.818
   58   2HE   LYS   7          3HE       LYS   7 -10.962  -0.277  -5.798
   59   1HZ   LYS   7          1HZ       LYS   7  -9.136  -0.303  -8.030
   60   2HZ   LYS   7          2HZ       LYS   7 -10.706  -0.749  -7.962
   61   3HZ   LYS   7          3HZ       LYS   7 -10.310   0.832  -8.073
   62    H    GLY   8           HN       GLY   8  -7.622   1.861  -0.759
   63   1HA   GLY   8          1HA       GLY   8  -9.500   3.399   0.560
   64   2HA   GLY   8          2HA       GLY   8  -8.057   2.709   1.276
   65    H    ILE   9           HN       ILE   9  -5.918   4.017   0.298
   66    HA   ILE   9           HA       ILE   9  -5.941   6.441   1.607
   67    HB   ILE   9           HB       ILE   9  -4.148   5.030  -0.283
   68   1HG1  ILE   9          2HG1      ILE   9  -3.882   6.243   2.478
   69   2HG1  ILE   9          3HG1      ILE   9  -3.965   4.543   2.060
   70   1HG2  ILE   9          1HG2      ILE   9  -2.577   6.954  -0.333
   71   2HG2  ILE   9          2HG2      ILE   9  -4.067   7.223  -1.270
   72   3HG2  ILE   9          3HG2      ILE   9  -3.871   7.984   0.328
   73   1HD1  ILE   9          1HD1      ILE   9  -1.715   6.494   1.415
   74   2HD1  ILE   9          2HD1      ILE   9  -1.639   5.046   2.447
   75   3HD1  ILE   9          3HD1      ILE   9  -1.829   4.875   0.685
   76    H    PHE  10           HN       PHE  10  -6.308   5.730  -1.926
   77    HA   PHE  10           HA       PHE  10  -6.423   8.294  -2.847
   78   1HB   PHE  10          2HB       PHE  10  -6.472   6.474  -4.415
   79   2HB   PHE  10          3HB       PHE  10  -7.720   5.625  -3.525
   80    HD1  PHE  10           HD1      PHE  10 -10.081   6.300  -3.749
   81    HD2  PHE  10           HD2      PHE  10  -7.032   8.127  -6.067
   82    HE1  PHE  10           HE1      PHE  10 -11.818   7.210  -5.316
   83    HE2  PHE  10           HE2      PHE  10  -8.768   9.036  -7.634
   84    HZ   PHE  10           HZ       PHE  10 -11.141   8.567  -7.240
   85    H    GLU  11           HN       GLU  11  -9.223   6.245  -1.750
   86    HA   GLU  11           HA       GLU  11 -11.099   8.245  -2.116
   87   1HB   GLU  11          2HB       GLU  11 -11.002   5.552  -1.079
   88   2HB   GLU  11          3HB       GLU  11 -11.928   6.535   0.039
   89   1HG   GLU  11          2HG       GLU  11 -12.877   7.402  -2.438
   90   2HG   GLU  11          3HG       GLU  11 -12.590   5.698  -2.726
   91    H    LYS  12           HN       LYS  12  -8.995   7.383   0.663
   92    HA   LYS  12           HA       LYS  12 -10.247   8.991   2.565
   93   1HB   LYS  12          2HB       LYS  12  -8.601   7.181   3.020
   94   2HB   LYS  12          3HB       LYS  12  -7.326   8.197   2.379
   95   1HG   LYS  12          2HG       LYS  12  -8.834   9.751   4.297
   96   2HG   LYS  12          3HG       LYS  12  -8.443   8.209   5.032
   97   1HD   LYS  12          2HD       LYS  12  -6.053   8.895   3.754
   98   2HD   LYS  12          3HD       LYS  12  -6.653  10.449   4.299
   99   1HE   LYS  12          2HE       LYS  12  -5.612   9.853   6.265
  100   2HE   LYS  12          3HE       LYS  12  -7.118   9.006   6.562
  101   1HZ   LYS  12          1HZ       LYS  12  -5.818   7.200   5.156
  102   2HZ   LYS  12          2HZ       LYS  12  -4.544   7.939   5.861
  103   3HZ   LYS  12          3HZ       LYS  12  -5.725   7.292   6.784
  104    H    TYR  13           HN       TYR  13  -8.349   9.767  -0.257
  105    HA   TYR  13           HA       TYR  13  -7.735  12.426   0.773
  106   1HB   TYR  13          2HB       TYR  13  -6.892  10.506  -1.378
  107   2HB   TYR  13          3HB       TYR  13  -6.947  12.170  -1.923
  108    HD1  TYR  13           HD1      TYR  13  -5.136   9.721   0.044
  109    HD2  TYR  13           HD2      TYR  13  -5.523  13.903  -0.773
  110    HE1  TYR  13           HE1      TYR  13  -2.847  10.140   1.068
  111    HE2  TYR  13           HE2      TYR  13  -3.232  14.308   0.254
  112    HH   TYR  13           HH       TYR  13  -1.672  13.400   1.582
  113    H    ALA  14           HN       ALA  14  -9.593  10.759  -1.843
  114    HA   ALA  14           HA       ALA  14 -10.515  13.136  -3.031
  115   1HB   ALA  14          1HB       ALA  14 -10.421  10.714  -3.941
  116   2HB   ALA  14          2HB       ALA  14 -11.950  10.468  -3.064
  117   3HB   ALA  14          3HB       ALA  14 -11.849  11.695  -4.349
  118    H    ALA  15           HN       ALA  15 -11.248  11.562  -0.036
  119    HA   ALA  15           HA       ALA  15 -13.948  12.584   0.089
  120   1HB   ALA  15          1HB       ALA  15 -12.184  10.767   1.656
  121   2HB   ALA  15          2HB       ALA  15 -13.380  11.693   2.594
  122   3HB   ALA  15          3HB       ALA  15 -13.917  10.630   1.271
  123    H    LYS  16           HN       LYS  16 -10.669  13.571   0.848
  124    HA   LYS  16           HA       LYS  16 -11.113  15.272   2.976
  125   1HB   LYS  16          2HB       LYS  16  -9.004  14.626   1.201
  126   2HB   LYS  16          3HB       LYS  16  -9.169  16.369   1.145
  127   1HG   LYS  16          2HG       LYS  16  -9.122  16.432   3.663
  128   2HG   LYS  16          3HG       LYS  16  -8.897  14.694   3.687
  129   1HD   LYS  16          2HD       LYS  16  -6.671  14.891   3.268
  130   2HD   LYS  16          3HD       LYS  16  -6.956  15.929   1.885
  131   1HE   LYS  16          2HE       LYS  16  -6.840  17.906   3.162
  132   2HE   LYS  16          3HE       LYS  16  -7.304  17.103   4.649
  133   1HZ   LYS  16          1HZ       LYS  16  -4.825  17.725   4.071
  134   2HZ   LYS  16          2HZ       LYS  16  -5.207  16.456   5.026
  135   3HZ   LYS  16          3HZ       LYS  16  -4.840  16.213   3.453
  136    H    GLU  17           HN       GLU  17 -10.901  16.237  -0.527
  137    HA   GLU  17           HA       GLU  17 -12.795  18.346   0.164
  138   1HB   GLU  17          2HB       GLU  17 -10.405  18.363  -1.709
  139   2HB   GLU  17          3HB       GLU  17 -11.693  19.540  -1.877
  140   1HG   GLU  17          2HG       GLU  17 -11.121  19.542   0.889
  141   2HG   GLU  17          3HG       GLU  17  -9.547  19.403   0.130
  142    H    GLY  18           HN       GLY  18 -14.694  18.421  -1.002
  143   1HA   GLY  18          1HA       GLY  18 -16.242  17.922  -2.555
  144   2HA   GLY  18          2HA       GLY  18 -14.944  17.567  -3.677
  145    H    ASP  19           HN       ASP  19 -16.973  15.946  -4.093
  146    HA   ASP  19           HA       ASP  19 -17.341  13.815  -2.418
  147   1HB   ASP  19          2HB       ASP  19 -18.481  14.571  -4.706
  148   2HB   ASP  19          3HB       ASP  19 -17.334  13.459  -5.426
  149    HA   PRO  20           HA       PRO  20 -13.597  11.597  -3.040
  150   1HB   PRO  20          2HB       PRO  20 -14.285   9.194  -1.935
  151   2HB   PRO  20          3HB       PRO  20 -13.772  10.574  -0.985
  152   1HG   PRO  20          2HG       PRO  20 -16.494   9.477  -1.340
  153   2HG   PRO  20          3HG       PRO  20 -15.900  10.557  -0.095
  154   1HD   PRO  20          2HD       PRO  20 -17.502  11.270  -2.364
  155   2HD   PRO  20          3HD       PRO  20 -16.811  12.365  -1.184
  156    H    ASN  21           HN       ASN  21 -16.311  11.174  -4.780
  157    HA   ASN  21           HA       ASN  21 -15.332   8.825  -6.124
  158   1HB   ASN  21          2HB       ASN  21 -17.784  10.573  -6.695
  159   2HB   ASN  21          3HB       ASN  21 -17.451   9.027  -7.449
  160   1HD2  ASN  21          1HD2      ASN  21 -19.742   8.973  -6.403
  161   2HD2  ASN  21          2HD2      ASN  21 -19.841   8.210  -4.852
  162    H    GLN  22           HN       GLN  22 -14.439  11.974  -6.100
  163    HA   GLN  22           HA       GLN  22 -13.579  11.875  -8.822
  164   1HB   GLN  22          2HB       GLN  22 -14.448  14.405  -9.004
  165   2HB   GLN  22          3HB       GLN  22 -15.445  13.051  -9.498
  166   1HG   GLN  22          2HG       GLN  22 -16.426  13.016  -7.138
  167   2HG   GLN  22          3HG       GLN  22 -15.544  14.495  -6.810
  168   1HE2  GLN  22          1HE2      GLN  22 -17.374  15.700  -6.489
  169   2HE2  GLN  22          2HE2      GLN  22 -18.442  16.193  -7.761
  170    H    LEU  23           HN       LEU  23 -11.505  12.663  -8.924
  171    HA   LEU  23           HA       LEU  23 -10.485  13.931  -6.527
  172   1HB   LEU  23          2HB       LEU  23  -9.277  12.626  -8.942
  173   2HB   LEU  23          3HB       LEU  23  -8.305  13.671  -7.925
  174    HG   LEU  23           HG       LEU  23  -8.267  11.127  -7.506
  175   1HD1  LEU  23          1HD1      LEU  23  -8.844  12.488  -4.931
  176   2HD1  LEU  23          2HD1      LEU  23  -7.431  11.534  -5.443
  177   3HD1  LEU  23          3HD1      LEU  23  -7.600  13.226  -5.970
  178   1HD2  LEU  23          1HD2      LEU  23 -10.598  10.622  -7.510
  179   2HD2  LEU  23          2HD2      LEU  23  -9.998  10.374  -5.853
  180   3HD2  LEU  23          3HD2      LEU  23 -10.929  11.838  -6.252
  181    H    SER  24           HN       SER  24  -9.193  15.918  -6.623
  182    HA   SER  24           HA       SER  24  -9.970  17.564  -8.900
  183   1HB   SER  24          2HB       SER  24  -9.697  18.621  -6.061
  184   2HB   SER  24          3HB       SER  24 -10.383  19.445  -7.447
  185    HG   SER  24           HG       SER  24 -12.266  18.657  -6.827
  186    H    LYS  25           HN       LYS  25  -8.470  19.540  -9.151
  187    HA   LYS  25           HA       LYS  25  -5.846  18.704  -9.345
  188   1HB   LYS  25          2HB       LYS  25  -6.870  20.525 -10.655
  189   2HB   LYS  25          3HB       LYS  25  -6.939  21.531  -9.222
  190   1HG   LYS  25          2HG       LYS  25  -4.347  21.043  -9.049
  191   2HG   LYS  25          3HG       LYS  25  -4.489  20.567 -10.730
  192   1HD   LYS  25          2HD       LYS  25  -4.104  22.804 -11.108
  193   2HD   LYS  25          3HD       LYS  25  -5.834  22.929 -10.855
  194   1HE   LYS  25          2HE       LYS  25  -4.128  23.010  -8.386
  195   2HE   LYS  25          3HE       LYS  25  -4.009  24.396  -9.452
  196   1HZ   LYS  25          1HZ       LYS  25  -6.199  23.553  -7.829
  197   2HZ   LYS  25          2HZ       LYS  25  -5.831  25.042  -8.391
  198   3HZ   LYS  25          3HZ       LYS  25  -6.644  23.989  -9.339
  199    H    GLU  26           HN       GLU  26  -7.252  21.052  -6.946
  200    HA   GLU  26           HA       GLU  26  -4.961  21.262  -5.454
  201   1HB   GLU  26          2HB       GLU  26  -7.702  22.115  -5.287
  202   2HB   GLU  26          3HB       GLU  26  -7.255  21.472  -3.719
  203   1HG   GLU  26          2HG       GLU  26  -5.002  22.958  -4.373
  204   2HG   GLU  26          3HG       GLU  26  -6.275  23.909  -5.112
  205    H    GLU  27           HN       GLU  27  -7.598  18.837  -5.378
  206    HA   GLU  27           HA       GLU  27  -6.883  17.691  -2.950
  207   1HB   GLU  27          2HB       GLU  27  -8.696  17.121  -5.180
  208   2HB   GLU  27          3HB       GLU  27  -8.001  15.644  -4.543
  209   1HG   GLU  27          2HG       GLU  27  -8.693  17.292  -2.289
  210   2HG   GLU  27          3HG       GLU  27 -10.063  17.314  -3.382
  211    H    LEU  28           HN       LEU  28  -6.164  16.649  -6.364
  212    HA   LEU  28           HA       LEU  28  -4.572  14.499  -5.739
  213   1HB   LEU  28          2HB       LEU  28  -5.515  15.398  -7.980
  214   2HB   LEU  28          3HB       LEU  28  -4.015  16.300  -8.075
  215    HG   LEU  28           HG       LEU  28  -2.767  14.473  -8.554
  216   1HD1  LEU  28          1HD1      LEU  28  -3.168  12.195  -7.697
  217   2HD1  LEU  28          2HD1      LEU  28  -3.040  13.403  -6.396
  218   3HD1  LEU  28          3HD1      LEU  28  -4.636  12.777  -6.876
  219   1HD2  LEU  28          1HD2      LEU  28  -4.992  14.564 -10.002
  220   2HD2  LEU  28          2HD2      LEU  28  -3.766  13.293 -10.227
  221   3HD2  LEU  28          3HD2      LEU  28  -5.233  12.957  -9.275
  222    H    LYS  29           HN       LYS  29  -3.679  17.984  -6.110
  223    HA   LYS  29           HA       LYS  29  -1.004  17.871  -5.947
  224   1HB   LYS  29          2HB       LYS  29  -2.288  19.935  -6.165
  225   2HB   LYS  29          3HB       LYS  29  -2.852  19.800  -4.512
  226   1HG   LYS  29          2HG       LYS  29  -0.649  20.152  -3.611
  227   2HG   LYS  29          3HG       LYS  29   0.121  19.858  -5.158
  228   1HD   LYS  29          2HD       LYS  29   0.047  22.082  -5.584
  229   2HD   LYS  29          3HD       LYS  29  -1.703  21.994  -5.621
  230   1HE   LYS  29          2HE       LYS  29  -0.921  21.959  -2.854
  231   2HE   LYS  29          3HE       LYS  29  -0.002  23.234  -3.629
  232   1HZ   LYS  29          1HZ       LYS  29  -1.851  24.402  -3.421
  233   2HZ   LYS  29          2HZ       LYS  29  -2.472  23.529  -4.653
  234   3HZ   LYS  29          3HZ       LYS  29  -2.787  23.101  -3.109
  235    H    LEU  30           HN       LEU  30  -3.226  17.861  -3.070
  236    HA   LEU  30           HA       LEU  30  -1.265  17.546  -1.164
  237   1HB   LEU  30          2HB       LEU  30  -4.087  16.466  -1.151
  238   2HB   LEU  30          3HB       LEU  30  -3.060  16.673   0.254
  239    HG   LEU  30           HG       LEU  30  -4.454  18.746  -1.405
  240   1HD1  LEU  30          1HD1      LEU  30  -4.110  18.897   1.553
  241   2HD1  LEU  30          2HD1      LEU  30  -5.498  19.338   0.530
  242   3HD1  LEU  30          3HD1      LEU  30  -5.170  17.627   0.895
  243   1HD2  LEU  30          1HD2      LEU  30  -3.016  20.419   0.007
  244   2HD2  LEU  30          2HD2      LEU  30  -1.831  19.091   0.004
  245   3HD2  LEU  30          3HD2      LEU  30  -2.403  19.778  -1.536
  246    H    LEU  31           HN       LEU  31  -3.236  14.956  -2.785
  247    HA   LEU  31           HA       LEU  31  -2.032  12.802  -1.618
  248   1HB   LEU  31          2HB       LEU  31  -4.018  13.046  -3.280
  249   2HB   LEU  31          3HB       LEU  31  -2.803  12.791  -4.517
  250    HG   LEU  31           HG       LEU  31  -2.591  10.788  -2.417
  251   1HD1  LEU  31          1HD1      LEU  31  -4.664  10.013  -2.153
  252   2HD1  LEU  31          2HD1      LEU  31  -5.214  11.577  -2.800
  253   3HD1  LEU  31          3HD1      LEU  31  -5.041  10.177  -3.885
  254   1HD2  LEU  31          1HD2      LEU  31  -1.525  10.197  -4.355
  255   2HD2  LEU  31          2HD2      LEU  31  -3.076   9.352  -4.575
  256   3HD2  LEU  31          3HD2      LEU  31  -2.782  10.902  -5.400
  257    H    LEU  32           HN       LEU  32  -1.141  14.134  -4.885
  258    HA   LEU  32           HA       LEU  32   1.130  12.658  -5.225
  259   1HB   LEU  32          2HB       LEU  32   0.667  15.510  -6.107
  260   2HB   LEU  32          3HB       LEU  32   1.822  14.386  -6.794
  261    HG   LEU  32           HG       LEU  32  -1.167  13.908  -6.805
  262   1HD1  LEU  32          1HD1      LEU  32  -0.895  14.530  -9.293
  263   2HD1  LEU  32          2HD1      LEU  32  -0.992  15.840  -8.092
  264   3HD1  LEU  32          3HD1      LEU  32   0.585  15.369  -8.770
  265   1HD2  LEU  32          1HD2      LEU  32  -0.733  12.194  -8.403
  266   2HD2  LEU  32          2HD2      LEU  32   0.981  12.658  -8.532
  267   3HD2  LEU  32          3HD2      LEU  32   0.366  11.931  -7.028
  268    H    GLN  33           HN       GLN  33   0.504  15.220  -2.933
  269    HA   GLN  33           HA       GLN  33   3.177  16.015  -2.611
  270   1HB   GLN  33          2HB       GLN  33   0.718  16.939  -1.750
  271   2HB   GLN  33          3HB       GLN  33   1.371  16.277  -0.265
  272   1HG   GLN  33          2HG       GLN  33   3.578  17.586  -1.006
  273   2HG   GLN  33          3HG       GLN  33   2.459  18.519  -1.980
  274   1HE2  GLN  33          1HE2      GLN  33   0.931  19.822  -1.036
  275   2HE2  GLN  33          2HE2      GLN  33   0.943  20.263   0.639
  276    H    THR  34           HN       THR  34   0.988  13.949  -0.558
  277    HA   THR  34           HA       THR  34   3.310  12.953   0.874
  278    HB   THR  34           HB       THR  34   0.362  13.145   1.236
  279    HG1  THR  34           HG1      THR  34   1.789  14.279   2.616
  280   1HG2  THR  34          1HG2      THR  34   1.959  10.683   2.078
  281   2HG2  THR  34          2HG2      THR  34   0.567  11.263   3.024
  282   3HG2  THR  34          3HG2      THR  34   0.340  10.737   1.339
  283    H    GLU  35           HN       GLU  35   0.632  11.619  -1.171
  284    HA   GLU  35           HA       GLU  35   1.347   9.036  -1.132
  285   1HB   GLU  35          2HB       GLU  35  -0.643   9.818  -2.295
  286   2HB   GLU  35          3HB       GLU  35   0.317  10.703  -3.464
  287   1HG   GLU  35          2HG       GLU  35  -0.013   8.802  -4.726
  288   2HG   GLU  35          3HG       GLU  35   1.402   8.251  -3.851
  289    H    PHE  36           HN       PHE  36   2.478  11.414  -3.652
  290    HA   PHE  36           HA       PHE  36   5.075  10.150  -3.604
  291   1HB   PHE  36          2HB       PHE  36   2.970   9.928  -5.754
  292   2HB   PHE  36          3HB       PHE  36   4.581  10.300  -6.335
  293    HD1  PHE  36           HD1      PHE  36   2.376   7.710  -5.509
  294    HD2  PHE  36           HD2      PHE  36   6.489   8.743  -5.360
  295    HE1  PHE  36           HE1      PHE  36   2.983   5.277  -5.387
  296    HE2  PHE  36           HE2      PHE  36   7.096   6.310  -5.237
  297    HZ   PHE  36           HZ       PHE  36   5.335   4.606  -5.252
  298    HA   PRO  37           HA       PRO  37   5.358  14.564  -4.254
  299   1HB   PRO  37          2HB       PRO  37   7.516  14.984  -2.630
  300   2HB   PRO  37          3HB       PRO  37   5.859  15.104  -2.072
  301   1HG   PRO  37          2HG       PRO  37   7.825  12.948  -1.593
  302   2HG   PRO  37          3HG       PRO  37   6.346  13.299  -0.721
  303   1HD   PRO  37          2HD       PRO  37   6.751  11.207  -2.641
  304   2HD   PRO  37          3HD       PRO  37   5.243  11.631  -1.856
  305    H    SER  38           HN       SER  38   6.997  11.958  -5.254
  306    HA   SER  38           HA       SER  38   9.243  13.403  -6.280
  307   1HB   SER  38          2HB       SER  38   8.793  10.755  -5.608
  308   2HB   SER  38          3HB       SER  38   8.680  10.691  -7.356
  309    HG   SER  38           HG       SER  38  10.838  10.478  -7.075
  310    H    LEU  39           HN       LEU  39   5.982  12.556  -7.231
  311    HA   LEU  39           HA       LEU  39   6.416  12.606 -10.036
  312   1HB   LEU  39          2HB       LEU  39   4.277  12.103  -8.198
  313   2HB   LEU  39          3HB       LEU  39   3.732  13.258  -9.398
  314    HG   LEU  39           HG       LEU  39   3.344  10.772  -9.858
  315   1HD1  LEU  39          1HD1      LEU  39   4.389  12.836 -11.726
  316   2HD1  LEU  39          2HD1      LEU  39   4.258  11.171 -12.341
  317   3HD1  LEU  39          3HD1      LEU  39   2.820  11.995 -11.693
  318   1HD2  LEU  39          1HD2      LEU  39   6.159  10.697  -9.509
  319   2HD2  LEU  39          2HD2      LEU  39   5.054   9.365  -9.925
  320   3HD2  LEU  39          3HD2      LEU  39   5.822  10.321 -11.216
  321    H    LEU  40           HN       LEU  40   6.165  15.014  -7.519
  322    HA   LEU  40           HA       LEU  40   5.230  17.104  -9.214
  323   1HB   LEU  40          2HB       LEU  40   6.541  17.112  -6.493
  324   2HB   LEU  40          3HB       LEU  40   5.911  18.539  -7.292
  325    HG   LEU  40           HG       LEU  40   4.243  16.116  -6.565
  326   1HD1  LEU  40          1HD1      LEU  40   3.316  17.608  -4.771
  327   2HD1  LEU  40          2HD1      LEU  40   4.995  17.075  -4.515
  328   3HD1  LEU  40          3HD1      LEU  40   4.664  18.726  -5.092
  329   1HD2  LEU  40          1HD2      LEU  40   2.603  17.019  -7.752
  330   2HD2  LEU  40          2HD2      LEU  40   2.761  18.557  -6.869
  331   3HD2  LEU  40          3HD2      LEU  40   3.736  18.264  -8.330
  332    H    LYS  41           HN       LYS  41   8.256  15.467  -8.718
  333    HA   LYS  41           HA       LYS  41   9.757  17.737  -9.756
  334   1HB   LYS  41          2HB       LYS  41  10.917  15.065  -8.986
  335   2HB   LYS  41          3HB       LYS  41  11.697  16.633  -9.030
  336   1HG   LYS  41          2HG       LYS  41   9.941  17.322  -7.200
  337   2HG   LYS  41          3HG       LYS  41   9.675  15.600  -7.010
  338   1HD   LYS  41          2HD       LYS  41  12.477  15.825  -7.017
  339   2HD   LYS  41          3HD       LYS  41  11.961  17.247  -6.133
  340   1HE   LYS  41          2HE       LYS  41  11.499  15.985  -4.306
  341   2HE   LYS  41          3HE       LYS  41  10.358  15.024  -5.226
  342   1HZ   LYS  41          1HZ       LYS  41  12.758  14.131  -6.062
  343   2HZ   LYS  41          2HZ       LYS  41  13.019  14.401  -4.472
  344   3HZ   LYS  41          3HZ       LYS  41  11.815  13.404  -4.944
  345    H    GLY  42           HN       GLY  42   8.080  17.225 -11.692
  346   1HA   GLY  42          1HA       GLY  42   9.652  15.630 -13.612
  347   2HA   GLY  42          2HA       GLY  42   7.923  15.390 -13.458
  348    H    MET  43           HN       MET  43   8.766  16.115 -15.933
  349    HA   MET  43           HA       MET  43   8.892  18.924 -16.226
  350   1HB   MET  43          2HB       MET  43   8.381  16.636 -18.208
  351   2HB   MET  43          3HB       MET  43   8.655  18.296 -18.700
  352   1HG   MET  43          2HG       MET  43  10.792  17.730 -16.929
  353   2HG   MET  43          3HG       MET  43  10.608  16.263 -17.870
  354   1HE   MET  43          1HE       MET  43  12.805  16.456 -18.712
  355   2HE   MET  43          2HE       MET  43  13.366  17.530 -20.016
  356   3HE   MET  43          3HE       MET  43  13.386  18.094 -18.328
  357    H    SER  44           HN       SER  44   6.351  16.872 -15.417
  358    HA   SER  44           HA       SER  44   4.415  18.394 -16.946
  359   1HB   SER  44          2HB       SER  44   4.063  15.918 -15.197
  360   2HB   SER  44          3HB       SER  44   2.786  16.678 -16.126
  361    HG   SER  44           HG       SER  44   3.564  15.003 -17.405
  362    H    THR  45           HN       THR  45   4.129  20.369 -15.892
  363    HA   THR  45           HA       THR  45   4.278  20.692 -13.108
  364    HB   THR  45           HB       THR  45   3.050  22.901 -13.791
  365    HG1  THR  45           HG1      THR  45   2.067  22.264 -15.735
  366   1HG2  THR  45          1HG2      THR  45   5.228  23.573 -13.994
  367   2HG2  THR  45          2HG2      THR  45   5.736  21.939 -14.486
  368   3HG2  THR  45          3HG2      THR  45   5.134  23.088 -15.705
  369    H    LEU  46           HN       LEU  46   2.360  21.677 -11.816
  370    HA   LEU  46           HA       LEU  46   0.581  19.656 -11.313
  371   1HB   LEU  46          2HB       LEU  46   1.263  21.772  -9.981
  372   2HB   LEU  46          3HB       LEU  46  -0.078  22.541 -10.805
  373    HG   LEU  46           HG       LEU  46  -1.680  21.197  -9.749
  374   1HD1  LEU  46          1HD1      LEU  46   0.584  19.285  -9.257
  375   2HD1  LEU  46          2HD1      LEU  46  -0.878  19.232  -8.243
  376   3HD1  LEU  46          3HD1      LEU  46  -1.007  18.999 -10.004
  377   1HD2  LEU  46          1HD2      LEU  46  -0.102  22.790  -8.277
  378   2HD2  LEU  46          2HD2      LEU  46  -1.489  21.898  -7.605
  379   3HD2  LEU  46          3HD2      LEU  46   0.160  21.253  -7.418
  380    H    ASP  47           HN       ASP  47  -0.248  22.799 -12.949
  381    HA   ASP  47           HA       ASP  47  -2.732  22.219 -13.695
  382   1HB   ASP  47          2HB       ASP  47  -0.904  24.181 -14.311
  383   2HB   ASP  47          3HB       ASP  47  -1.056  23.403 -15.873
  384    H    GLU  48           HN       GLU  48   0.314  21.443 -15.536
  385    HA   GLU  48           HA       GLU  48  -0.863  20.245 -17.690
  386   1HB   GLU  48          2HB       GLU  48   1.792  20.446 -16.524
  387   2HB   GLU  48          3HB       GLU  48   1.553  18.827 -17.152
  388   1HG   GLU  48          2HG       GLU  48   0.516  20.193 -19.241
  389   2HG   GLU  48          3HG       GLU  48   1.564  21.455 -18.624
  390    H    LEU  49           HN       LEU  49   0.114  18.833 -14.510
  391    HA   LEU  49           HA       LEU  49  -0.486  16.184 -15.171
  392   1HB   LEU  49          2HB       LEU  49   0.680  17.477 -13.088
  393   2HB   LEU  49          3HB       LEU  49  -0.863  17.050 -12.375
  394    HG   LEU  49           HG       LEU  49  -0.166  14.671 -13.516
  395   1HD1  LEU  49          1HD1      LEU  49   2.319  14.511 -12.569
  396   2HD1  LEU  49          2HD1      LEU  49   1.965  14.955 -14.256
  397   3HD1  LEU  49          3HD1      LEU  49   2.337  16.222 -13.062
  398   1HD2  LEU  49          1HD2      LEU  49  -0.985  15.079 -11.221
  399   2HD2  LEU  49          2HD2      LEU  49   0.366  13.922 -11.278
  400   3HD2  LEU  49          3HD2      LEU  49   0.651  15.597 -10.749
  401    H    PHE  50           HN       PHE  50  -2.454  18.826 -13.683
  402    HA   PHE  50           HA       PHE  50  -4.708  17.317 -13.163
  403   1HB   PHE  50          2HB       PHE  50  -4.114  19.732 -12.504
  404   2HB   PHE  50          3HB       PHE  50  -4.445  20.219 -14.154
  405    HD1  PHE  50           HD1      PHE  50  -6.314  17.927 -11.878
  406    HD2  PHE  50           HD2      PHE  50  -6.341  21.540 -14.103
  407    HE1  PHE  50           HE1      PHE  50  -8.731  18.268 -11.293
  408    HE2  PHE  50           HE2      PHE  50  -8.758  21.881 -13.518
  409    HZ   PHE  50           HZ       PHE  50  -9.924  20.242 -12.120
  410    H    GLU  51           HN       GLU  51  -3.902  19.306 -16.098
  411    HA   GLU  51           HA       GLU  51  -6.255  18.546 -17.416
  412   1HB   GLU  51          2HB       GLU  51  -3.857  20.163 -17.973
  413   2HB   GLU  51          3HB       GLU  51  -4.425  19.315 -19.398
  414   1HG   GLU  51          2HG       GLU  51  -6.820  20.197 -18.541
  415   2HG   GLU  51          3HG       GLU  51  -5.835  21.408 -17.745
  416    H    GLU  52           HN       GLU  52  -2.943  17.227 -17.222
  417    HA   GLU  52           HA       GLU  52  -3.151  15.556 -19.440
  418   1HB   GLU  52          2HB       GLU  52  -0.995  16.144 -18.408
  419   2HB   GLU  52          3HB       GLU  52  -1.444  15.330 -16.923
  420   1HG   GLU  52          2HG       GLU  52  -1.844  13.289 -18.709
  421   2HG   GLU  52          3HG       GLU  52  -0.574  14.166 -19.540
  422    H    LEU  53           HN       LEU  53  -3.587  14.915 -15.887
  423    HA   LEU  53           HA       LEU  53  -4.276  12.248 -16.129
  424   1HB   LEU  53          2HB       LEU  53  -5.201  14.269 -14.082
  425   2HB   LEU  53          3HB       LEU  53  -5.289  12.527 -13.914
  426    HG   LEU  53           HG       LEU  53  -2.619  13.790 -14.428
  427   1HD1  LEU  53          1HD1      LEU  53  -4.265  14.134 -11.972
  428   2HD1  LEU  53          2HD1      LEU  53  -2.540  13.747 -11.761
  429   3HD1  LEU  53          3HD1      LEU  53  -3.022  15.189 -12.686
  430   1HD2  LEU  53          1HD2      LEU  53  -1.784  11.911 -13.179
  431   2HD2  LEU  53          2HD2      LEU  53  -3.434  11.428 -12.715
  432   3HD2  LEU  53          3HD2      LEU  53  -2.921  11.323 -14.416
  433    H    ASP  54           HN       ASP  54  -6.398  15.190 -16.077
  434    HA   ASP  54           HA       ASP  54  -8.729  13.701 -16.436
  435   1HB   ASP  54          2HB       ASP  54  -8.598  16.059 -15.557
  436   2HB   ASP  54          3HB       ASP  54  -8.149  16.613 -17.158
  437    H    LYS  55           HN       LYS  55 -10.184  14.031 -18.489
  438    HA   LYS  55           HA       LYS  55  -9.123  14.824 -20.921
  439   1HB   LYS  55          2HB       LYS  55  -8.771  12.567 -21.980
  440   2HB   LYS  55          3HB       LYS  55  -7.523  13.080 -20.862
  441   1HG   LYS  55          2HG       LYS  55  -7.885  11.277 -19.534
  442   2HG   LYS  55          3HG       LYS  55  -9.585  11.670 -19.381
  443   1HD   LYS  55          2HD       LYS  55  -9.444  10.681 -21.985
  444   2HD   LYS  55          3HD       LYS  55  -8.261   9.693 -21.150
  445   1HE   LYS  55          2HE       LYS  55  -9.933   9.038 -19.455
  446   2HE   LYS  55          3HE       LYS  55 -11.115  10.129 -20.149
  447   1HZ   LYS  55          1HZ       LYS  55 -10.876   8.827 -22.227
  448   2HZ   LYS  55          2HZ       LYS  55  -9.975   7.738 -21.408
  449   3HZ   LYS  55          3HZ       LYS  55 -11.532   7.993 -20.985
  450    H    ASN  56           HN       ASN  56 -11.245  12.612 -19.070
  451    HA   ASN  56           HA       ASN  56 -13.106  12.142 -21.017
  452   1HB   ASN  56          2HB       ASN  56 -13.814  12.631 -18.086
  453   2HB   ASN  56          3HB       ASN  56 -14.598  11.529 -19.200
  454   1HD2  ASN  56          1HD2      ASN  56 -14.114   9.491 -18.990
  455   2HD2  ASN  56          2HD2      ASN  56 -12.649   8.814 -18.362
  456    H    GLY  57           HN       GLY  57 -12.221  15.082 -19.391
  457   1HA   GLY  57          1HA       GLY  57 -12.975  17.195 -19.624
  458   2HA   GLY  57          2HA       GLY  57 -14.133  16.635 -20.814
  459    H    ASP  58           HN       ASP  58 -13.535  16.292 -17.237
  460    HA   ASP  58           HA       ASP  58 -16.334  16.990 -16.885
  461   1HB   ASP  58          2HB       ASP  58 -14.876  14.854 -15.265
  462   2HB   ASP  58          3HB       ASP  58 -16.569  15.286 -15.133
  463    H    GLY  59           HN       GLY  59 -13.127  16.325 -15.291
  464   1HA   GLY  59          1HA       GLY  59 -12.046  18.272 -14.265
  465   2HA   GLY  59          2HA       GLY  59 -13.595  18.676 -13.553
  466    H    GLU  60           HN       GLU  60 -13.259  15.274 -13.711
  467    HA   GLU  60           HA       GLU  60 -12.281  15.269 -10.961
  468   1HB   GLU  60          2HB       GLU  60 -13.710  13.220 -10.644
  469   2HB   GLU  60          3HB       GLU  60 -14.630  14.675 -10.971
  470   1HG   GLU  60          2HG       GLU  60 -14.696  14.007 -13.425
  471   2HG   GLU  60          3HG       GLU  60 -13.919  12.498 -12.992
  472    H    VAL  61           HN       VAL  61 -10.451  14.080 -10.567
  473    HA   VAL  61           HA       VAL  61  -9.476  12.445 -12.784
  474    HB   VAL  61           HB       VAL  61  -8.167  13.745 -10.397
  475   1HG1  VAL  61          1HG1      VAL  61  -6.637  12.112 -10.418
  476   2HG1  VAL  61          2HG1      VAL  61  -7.308  11.399 -11.905
  477   3HG1  VAL  61          3HG1      VAL  61  -6.131  12.731 -12.009
  478   1HG2  VAL  61          1HG2      VAL  61  -7.360  14.114 -13.269
  479   2HG2  VAL  61          2HG2      VAL  61  -8.786  14.969 -12.636
  480   3HG2  VAL  61          3HG2      VAL  61  -7.191  15.224 -11.888
  481    H    SER  62           HN       SER  62 -11.551  11.149 -11.711
  482    HA   SER  62           HA       SER  62 -11.325   9.806  -9.405
  483   1HB   SER  62          2HB       SER  62 -12.226   7.962 -11.468
  484   2HB   SER  62          3HB       SER  62 -13.157   8.750 -10.210
  485    HG   SER  62           HG       SER  62 -12.672   9.579 -12.900
  486    H    PHE  63           HN       PHE  63 -10.795   7.363  -9.088
  487    HA   PHE  63           HA       PHE  63  -8.125   6.939  -9.358
  488   1HB   PHE  63          2HB       PHE  63  -9.931   5.702  -7.982
  489   2HB   PHE  63          3HB       PHE  63 -10.389   4.856  -9.447
  490    HD1  PHE  63           HD1      PHE  63  -8.569   3.448 -10.607
  491    HD2  PHE  63           HD2      PHE  63  -8.238   4.853  -6.616
  492    HE1  PHE  63           HE1      PHE  63  -6.843   1.689 -10.130
  493    HE2  PHE  63           HE2      PHE  63  -6.512   3.094  -6.140
  494    HZ   PHE  63           HZ       PHE  63  -5.835   1.533  -7.903
  495    H    GLU  64           HN       GLU  64 -10.716   6.334 -11.727
  496    HA   GLU  64           HA       GLU  64  -9.494   4.518 -13.332
  497   1HB   GLU  64          2HB       GLU  64 -10.809   5.851 -15.209
  498   2HB   GLU  64          3HB       GLU  64 -11.682   4.985 -13.960
  499   1HG   GLU  64          2HG       GLU  64 -12.580   6.905 -13.142
  500   2HG   GLU  64          3HG       GLU  64 -11.005   7.664 -13.018
  501    H    GLU  65           HN       GLU  65  -9.280   8.142 -13.531
  502    HA   GLU  65           HA       GLU  65  -7.382   8.024 -15.606
  503   1HB   GLU  65          2HB       GLU  65  -8.133  10.305 -13.725
  504   2HB   GLU  65          3HB       GLU  65  -7.157  10.485 -15.168
  505   1HG   GLU  65          2HG       GLU  65  -9.147   9.392 -16.446
  506   2HG   GLU  65          3HG       GLU  65 -10.084   9.668 -14.991
  507    H    PHE  66           HN       PHE  66  -7.262   7.962 -12.071
  508    HA   PHE  66           HA       PHE  66  -4.674   8.863 -11.674
  509   1HB   PHE  66          2HB       PHE  66  -6.614   8.235 -10.034
  510   2HB   PHE  66          3HB       PHE  66  -6.133   6.564 -10.249
  511    HD1  PHE  66           HD1      PHE  66  -4.143   9.688  -9.751
  512    HD2  PHE  66           HD2      PHE  66  -5.137   5.824  -8.307
  513    HE1  PHE  66           HE1      PHE  66  -2.451   9.939  -7.915
  514    HE2  PHE  66           HE2      PHE  66  -3.445   6.075  -6.470
  515    HZ   PHE  66           HZ       PHE  66  -2.122   8.130  -6.296
  516    H    GLN  67           HN       GLN  67  -5.929   5.721 -12.809
  517    HA   GLN  67           HA       GLN  67  -3.666   4.224 -12.308
  518   1HB   GLN  67          2HB       GLN  67  -5.623   3.893 -14.623
  519   2HB   GLN  67          3HB       GLN  67  -4.585   2.646 -13.960
  520   1HG   GLN  67          2HG       GLN  67  -5.810   3.293 -11.667
  521   2HG   GLN  67          3HG       GLN  67  -7.047   3.910 -12.745
  522   1HE2  GLN  67          1HE2      GLN  67  -4.918   1.075 -12.382
  523   2HE2  GLN  67          2HE2      GLN  67  -6.095  -0.135 -12.769
  524    H    VAL  68           HN       VAL  68  -4.131   6.875 -14.443
  525    HA   VAL  68           HA       VAL  68  -2.285   5.996 -16.455
  526    HB   VAL  68           HB       VAL  68  -3.448   8.726 -15.871
  527   1HG1  VAL  68          1HG1      VAL  68  -2.194   9.484 -17.550
  528   2HG1  VAL  68          2HG1      VAL  68  -1.442   7.879 -17.715
  529   3HG1  VAL  68          3HG1      VAL  68  -2.908   8.275 -18.644
  530   1HG2  VAL  68          1HG2      VAL  68  -5.111   6.838 -16.280
  531   2HG2  VAL  68          2HG2      VAL  68  -5.215   8.237 -17.376
  532   3HG2  VAL  68          3HG2      VAL  68  -4.437   6.732 -17.925
  533    H    LEU  69           HN       LEU  69  -2.255   7.982 -13.472
  534    HA   LEU  69           HA       LEU  69   0.442   8.845 -13.931
  535   1HB   LEU  69          2HB       LEU  69  -1.526  10.000 -12.659
  536   2HB   LEU  69          3HB       LEU  69  -0.997   9.017 -11.309
  537    HG   LEU  69           HG       LEU  69   1.214  10.033 -11.367
  538   1HD1  LEU  69          1HD1      LEU  69   1.111  12.231 -13.005
  539   2HD1  LEU  69          2HD1      LEU  69   1.953  10.705 -13.368
  540   3HD1  LEU  69          3HD1      LEU  69   0.310  10.985 -13.992
  541   1HD2  LEU  69          1HD2      LEU  69  -0.774  11.104 -10.172
  542   2HD2  LEU  69          2HD2      LEU  69   0.657  12.123 -10.457
  543   3HD2  LEU  69          3HD2      LEU  69  -0.778  12.295 -11.495
  544    H    VAL  70           HN       VAL  70  -1.232   6.127 -12.426
  545    HA   VAL  70           HA       VAL  70   0.602   5.292 -10.579
  546    HB   VAL  70           HB       VAL  70  -1.394   3.982 -12.361
  547   1HG1  VAL  70          1HG1      VAL  70  -0.877   1.756 -11.479
  548   2HG1  VAL  70          2HG1      VAL  70   0.498   2.406 -12.405
  549   3HG1  VAL  70          3HG1      VAL  70   0.541   2.410 -10.625
  550   1HG2  VAL  70          1HG2      VAL  70  -1.810   5.158 -10.093
  551   2HG2  VAL  70          2HG2      VAL  70  -2.558   3.567 -10.373
  552   3HG2  VAL  70          3HG2      VAL  70  -1.092   3.697  -9.372
  553    H    LYS  71           HN       LYS  71   0.838   5.373 -14.102
  554    HA   LYS  71           HA       LYS  71   2.943   3.480 -14.285
  555   1HB   LYS  71          2HB       LYS  71   1.229   4.516 -16.065
  556   2HB   LYS  71          3HB       LYS  71   2.574   5.601 -16.352
  557   1HG   LYS  71          2HG       LYS  71   3.933   3.236 -16.292
  558   2HG   LYS  71          3HG       LYS  71   2.375   2.647 -16.839
  559   1HD   LYS  71          2HD       LYS  71   3.781   5.016 -18.149
  560   2HD   LYS  71          3HD       LYS  71   4.036   3.364 -18.675
  561   1HE   LYS  71          2HE       LYS  71   1.190   3.769 -18.458
  562   2HE   LYS  71          3HE       LYS  71   1.848   5.138 -19.330
  563   1HZ   LYS  71          1HZ       LYS  71   1.854   3.778 -21.054
  564   2HZ   LYS  71          2HZ       LYS  71   3.139   3.021 -20.389
  565   3HZ   LYS  71          3HZ       LYS  71   1.633   2.436 -20.152
  566    H    LYS  72           HN       LYS  72   2.752   7.087 -14.115
  567    HA   LYS  72           HA       LYS  72   5.576   7.378 -14.250
  568   1HB   LYS  72          2HB       LYS  72   3.341   9.279 -13.490
  569   2HB   LYS  72          3HB       LYS  72   5.026   9.749 -13.589
  570   1HG   LYS  72          2HG       LYS  72   3.514   8.443 -15.898
  571   2HG   LYS  72          3HG       LYS  72   3.656  10.178 -15.701
  572   1HD   LYS  72          2HD       LYS  72   6.293   9.465 -15.458
  573   2HD   LYS  72          3HD       LYS  72   5.733   8.182 -16.513
  574   1HE   LYS  72          2HE       LYS  72   4.553  10.292 -17.765
  575   2HE   LYS  72          3HE       LYS  72   5.905  11.136 -17.037
  576   1HZ   LYS  72          1HZ       LYS  72   6.176   8.705 -18.664
  577   2HZ   LYS  72          2HZ       LYS  72   6.393  10.221 -19.229
  578   3HZ   LYS  72          3HZ       LYS  72   7.395   9.624 -18.086
  579    H    ILE  73           HN       ILE  73   3.340   6.399 -11.800
  580    HA   ILE  73           HA       ILE  73   4.867   7.401  -9.598
  581    HB   ILE  73           HB       ILE  73   2.451   5.693  -9.978
  582   1HG1  ILE  73          2HG1      ILE  73   2.986   8.124  -8.247
  583   2HG1  ILE  73          3HG1      ILE  73   2.344   8.185  -9.877
  584   1HG2  ILE  73          1HG2      ILE  73   4.290   5.603  -7.628
  585   2HG2  ILE  73          2HG2      ILE  73   2.536   5.609  -7.330
  586   3HG2  ILE  73          3HG2      ILE  73   3.263   4.333  -8.335
  587   1HD1  ILE  73          1HD1      ILE  73   1.062   6.946  -7.412
  588   2HD1  ILE  73          2HD1      ILE  73   0.429   8.250  -8.446
  589   3HD1  ILE  73          3HD1      ILE  73   0.489   6.580  -9.057
  590    H    SER  74           HN       SER  74   4.544   4.312 -11.413
  591    HA   SER  74           HA       SER  74   6.223   2.911  -9.647
  592   1HB   SER  74          2HB       SER  74   4.470   2.071 -11.445
  593   2HB   SER  74          3HB       SER  74   5.830   2.138 -12.547
  594    HG   SER  74           HG       SER  74   6.924   0.859 -10.622
  595    H    GLN  75           HN       GLN  75   6.663   4.620 -12.799
  596    HA   GLN  75           HA       GLN  75   9.374   3.869 -13.005
  597   1HB   GLN  75          2HB       GLN  75   7.501   4.870 -14.746
  598   2HB   GLN  75          3HB       GLN  75   8.447   6.313 -14.440
  599   1HG   GLN  75          2HG       GLN  75   9.326   5.012 -16.384
  600   2HG   GLN  75          3HG       GLN  75  10.517   5.173 -15.109
  601   1HE2  GLN  75          1HE2      GLN  75   7.712   3.055 -15.717
  602   2HE2  GLN  75          2HE2      GLN  75   8.526   1.543 -15.488
  Start of MODEL   14
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   1.706  -0.832  -1.847
    3   1HB   LYS   1          2HB       LYS   1   1.904   2.147  -1.377
    4   2HB   LYS   1          3HB       LYS   1   2.545   1.393  -2.823
    5   1HG   LYS   1          2HG       LYS   1   0.350   0.507  -3.428
    6   2HG   LYS   1          3HG       LYS   1  -0.329   0.984  -1.885
    7   1HD   LYS   1          2HD       LYS   1   0.542   3.416  -2.664
    8   2HD   LYS   1          3HD       LYS   1   0.392   2.699  -4.256
    9   1HE   LYS   1          2HE       LYS   1  -1.919   2.567  -4.139
   10   2HE   LYS   1          3HE       LYS   1  -1.925   2.232  -2.419
   11   1HZ   LYS   1          1HZ       LYS   1  -1.527   4.837  -3.706
   12   2HZ   LYS   1          2HZ       LYS   1  -2.755   4.387  -2.727
   13   3HZ   LYS   1          3HZ       LYS   1  -1.254   4.586  -2.115
   14    H    SER   2           HN       SER   2   3.724   1.630  -0.091
   15    HA   SER   2           HA       SER   2   6.056   0.196  -0.844
   16   1HB   SER   2          2HB       SER   2   5.442   2.741   0.639
   17   2HB   SER   2          3HB       SER   2   7.020   2.021   0.889
   18    HG   SER   2           HG       SER   2   7.170   1.961  -1.546
   19    HA   PRO   3           HA       PRO   3   6.599  -2.086   2.821
   20   1HB   PRO   3          2HB       PRO   3   9.309  -2.129   3.172
   21   2HB   PRO   3          3HB       PRO   3   8.475  -3.150   2.017
   22   1HG   PRO   3          2HG       PRO   3  10.097  -0.729   1.518
   23   2HG   PRO   3          3HG       PRO   3   9.621  -1.984   0.390
   24   1HD   PRO   3          2HD       PRO   3   8.482   0.638   0.620
   25   2HD   PRO   3          3HD       PRO   3   7.932  -0.655  -0.426
   26    H    GLU   4           HN       GLU   4   8.983   0.515   3.112
   27    HA   GLU   4           HA       GLU   4   8.966   0.646   5.804
   28   1HB   GLU   4          2HB       GLU   4   9.991   2.178   3.678
   29   2HB   GLU   4          3HB       GLU   4   9.054   3.328   4.610
   30   1HG   GLU   4          2HG       GLU   4  10.777   1.468   6.204
   31   2HG   GLU   4          3HG       GLU   4  11.634   2.631   5.212
   32    H    GLU   5           HN       GLU   5   6.686   2.229   3.495
   33    HA   GLU   5           HA       GLU   5   5.325   3.640   5.494
   34   1HB   GLU   5          2HB       GLU   5   3.993   4.425   3.766
   35   2HB   GLU   5          3HB       GLU   5   5.385   3.890   2.846
   36   1HG   GLU   5          2HG       GLU   5   4.284   1.746   2.328
   37   2HG   GLU   5          3HG       GLU   5   2.932   2.147   3.368
   38    H    LEU   6           HN       LEU   6   4.894   0.422   3.949
   39    HA   LEU   6           HA       LEU   6   2.382  -0.191   4.869
   40   1HB   LEU   6          2HB       LEU   6   4.773  -1.661   3.974
   41   2HB   LEU   6          3HB       LEU   6   3.683  -2.584   4.990
   42    HG   LEU   6           HG       LEU   6   2.798  -1.106   2.499
   43   1HD1  LEU   6          1HD1      LEU   6   3.752  -3.951   2.846
   44   2HD1  LEU   6          2HD1      LEU   6   2.713  -3.438   1.494
   45   3HD1  LEU   6          3HD1      LEU   6   4.327  -2.715   1.701
   46   1HD2  LEU   6          1HD2      LEU   6   1.131  -1.697   4.362
   47   2HD2  LEU   6          2HD2      LEU   6   0.742  -2.197   2.699
   48   3HD2  LEU   6          3HD2      LEU   6   1.375  -3.387   3.861
   49    H    LYS   7           HN       LYS   7   5.559  -0.378   6.555
   50    HA   LYS   7           HA       LYS   7   4.543  -1.638   8.853
   51   1HB   LYS   7          2HB       LYS   7   7.011  -1.164   7.900
   52   2HB   LYS   7          3HB       LYS   7   6.914   0.160   9.044
   53   1HG   LYS   7          2HG       LYS   7   6.100  -1.589  10.777
   54   2HG   LYS   7          3HG       LYS   7   6.588  -2.814   9.623
   55   1HD   LYS   7          2HD       LYS   7   8.793  -2.552  10.126
   56   2HD   LYS   7          3HD       LYS   7   8.701  -0.810   9.964
   57   1HE   LYS   7          2HE       LYS   7   7.456  -2.066  12.411
   58   2HE   LYS   7          3HE       LYS   7   9.205  -1.979  12.334
   59   1HZ   LYS   7          1HZ       LYS   7   8.605   0.460  11.604
   60   2HZ   LYS   7          2HZ       LYS   7   7.284   0.162  12.516
   61   3HZ   LYS   7          3HZ       LYS   7   8.774   0.040  13.173
   62    H    GLY   8           HN       GLY   8   5.247   1.838   8.081
   63   1HA   GLY   8          1HA       GLY   8   4.444   2.936  10.493
   64   2HA   GLY   8          2HA       GLY   8   4.395   3.734   8.933
   65    H    ILE   9           HN       ILE   9   2.483   2.571   7.443
   66    HA   ILE   9           HA       ILE   9   0.120   3.515   8.501
   67    HB   ILE   9           HB       ILE   9   0.817   1.674   6.241
   68   1HG1  ILE   9          2HG1      ILE   9  -0.237   4.505   6.453
   69   2HG1  ILE   9          3HG1      ILE   9   1.349   3.997   5.909
   70   1HG2  ILE   9          1HG2      ILE   9  -1.999   2.563   6.917
   71   2HG2  ILE   9          2HG2      ILE   9  -1.479   1.588   5.522
   72   3HG2  ILE   9          3HG2      ILE   9  -1.360   0.921   7.168
   73   1HD1  ILE   9          1HD1      ILE   9   0.091   4.444   3.916
   74   2HD1  ILE   9          2HD1      ILE   9   0.153   2.670   4.051
   75   3HD1  ILE   9          3HD1      ILE   9  -1.323   3.547   4.521
   76    H    PHE  10           HN       PHE  10   1.406   0.133   8.376
   77    HA   PHE  10           HA       PHE  10  -0.748  -1.166   9.429
   78   1HB   PHE  10          2HB       PHE  10   1.148  -2.443   8.694
   79   2HB   PHE  10          3HB       PHE  10   2.283  -1.416   9.547
   80    HD1  PHE  10           HD1      PHE  10   2.631  -1.699  11.974
   81    HD2  PHE  10           HD2      PHE  10   0.114  -4.319   9.781
   82    HE1  PHE  10           HE1      PHE  10   2.719  -3.358  13.855
   83    HE2  PHE  10           HE2      PHE  10   0.202  -5.978  11.662
   84    HZ   PHE  10           HZ       PHE  10   1.503  -5.478  13.677
   85    H    GLU  11           HN       GLU  11   2.052   0.253  11.269
   86    HA   GLU  11           HA       GLU  11   1.013  -0.391  13.751
   87   1HB   GLU  11          2HB       GLU  11   3.314   0.919  12.701
   88   2HB   GLU  11          3HB       GLU  11   2.607   2.042  13.846
   89   1HG   GLU  11          2HG       GLU  11   2.426  -0.439  15.162
   90   2HG   GLU  11          3HG       GLU  11   3.974  -0.522  14.345
   91    H    LYS  12           HN       LYS  12   0.554   2.439  11.600
   92    HA   LYS  12           HA       LYS  12  -0.654   4.128  13.452
   93   1HB   LYS  12          2HB       LYS  12   0.213   4.543  11.033
   94   2HB   LYS  12          3HB       LYS  12  -1.395   4.060  10.532
   95   1HG   LYS  12          2HG       LYS  12  -2.122   5.797  12.468
   96   2HG   LYS  12          3HG       LYS  12  -0.544   6.475  12.121
   97   1HD   LYS  12          2HD       LYS  12  -1.469   6.133   9.565
   98   2HD   LYS  12          3HD       LYS  12  -2.991   6.377  10.398
   99   1HE   LYS  12          2HE       LYS  12  -1.976   8.474  11.459
  100   2HE   LYS  12          3HE       LYS  12  -0.585   8.257  10.416
  101   1HZ   LYS  12          1HZ       LYS  12  -1.841   9.538   9.093
  102   2HZ   LYS  12          2HZ       LYS  12  -2.496   8.112   8.638
  103   3HZ   LYS  12          3HZ       LYS  12  -3.267   9.055   9.726
  104    H    TYR  13           HN       TYR  13  -1.787   1.220  11.817
  105    HA   TYR  13           HA       TYR  13  -4.546   1.816  12.553
  106   1HB   TYR  13          2HB       TYR  13  -2.949  -0.101  10.816
  107   2HB   TYR  13          3HB       TYR  13  -4.497  -0.682  11.398
  108    HD1  TYR  13           HD1      TYR  13  -2.875   1.054   8.797
  109    HD2  TYR  13           HD2      TYR  13  -6.537   0.986  11.009
  110    HE1  TYR  13           HE1      TYR  13  -4.052   2.270   6.900
  111    HE2  TYR  13           HE2      TYR  13  -7.701   2.202   9.104
  112    HH   TYR  13           HH       TYR  13  -7.530   2.758   6.955
  113    H    ALA  14           HN       ALA  14  -1.870  -0.514  13.213
  114    HA   ALA  14           HA       ALA  14  -3.394  -2.158  14.916
  115   1HB   ALA  14          1HB       ALA  14  -1.417  -3.322  15.171
  116   2HB   ALA  14          2HB       ALA  14  -1.035  -2.420  13.685
  117   3HB   ALA  14          3HB       ALA  14  -0.430  -1.843  15.256
  118    H    ALA  15           HN       ALA  15  -1.855   0.984  15.276
  119    HA   ALA  15           HA       ALA  15  -1.765   0.816  18.151
  120   1HB   ALA  15          1HB       ALA  15  -1.450   3.268  16.386
  121   2HB   ALA  15          2HB       ALA  15  -0.800   2.998  18.021
  122   3HB   ALA  15          3HB       ALA  15  -0.141   2.089  16.640
  123    H    LYS  16           HN       LYS  16  -4.052   1.631  15.633
  124    HA   LYS  16           HA       LYS  16  -5.592   3.539  16.894
  125   1HB   LYS  16          2HB       LYS  16  -5.697   2.020  14.549
  126   2HB   LYS  16          3HB       LYS  16  -7.171   1.598  15.397
  127   1HG   LYS  16          2HG       LYS  16  -7.511   4.143  15.768
  128   2HG   LYS  16          3HG       LYS  16  -6.224   4.383  14.603
  129   1HD   LYS  16          2HD       LYS  16  -7.496   3.601  12.811
  130   2HD   LYS  16          3HD       LYS  16  -8.430   2.502  13.807
  131   1HE   LYS  16          2HE       LYS  16 -10.098   4.033  13.926
  132   2HE   LYS  16          3HE       LYS  16  -9.021   5.141  14.753
  133   1HZ   LYS  16          1HZ       LYS  16  -9.865   5.155  12.043
  134   2HZ   LYS  16          2HZ       LYS  16  -9.247   6.369  12.944
  135   3HZ   LYS  16          3HZ       LYS  16  -8.247   5.324  12.186
  136    H    GLU  17           HN       GLU  17  -6.283  -0.033  16.812
  137    HA   GLU  17           HA       GLU  17  -7.522   0.367  19.424
  138   1HB   GLU  17          2HB       GLU  17  -8.253  -1.403  17.083
  139   2HB   GLU  17          3HB       GLU  17  -8.726  -1.881  18.701
  140   1HG   GLU  17          2HG       GLU  17  -9.393   0.868  18.548
  141   2HG   GLU  17          3HG       GLU  17  -9.850   0.217  16.986
  142    H    GLY  18           HN       GLY  18  -6.720  -0.795  21.149
  143   1HA   GLY  18          1HA       GLY  18  -5.439  -2.226  22.316
  144   2HA   GLY  18          2HA       GLY  18  -5.553  -3.339  20.967
  145    H    ASP  19           HN       ASP  19  -3.206  -3.587  22.090
  146    HA   ASP  19           HA       ASP  19  -1.274  -1.715  21.615
  147   1HB   ASP  19          2HB       ASP  19  -1.298  -4.113  22.819
  148   2HB   ASP  19          3HB       ASP  19  -0.657  -4.656  21.281
  149    HA   PRO  20           HA       PRO  20  -0.829  -2.064  17.253
  150   1HB   PRO  20          2HB       PRO  20   1.483  -0.647  16.915
  151   2HB   PRO  20          3HB       PRO  20  -0.089   0.110  17.078
  152   1HG   PRO  20          2HG       PRO  20   2.094  -0.075  19.064
  153   2HG   PRO  20          3HG       PRO  20   0.720   1.013  19.040
  154   1HD   PRO  20          2HD       PRO  20   1.037  -1.317  20.684
  155   2HD   PRO  20          3HD       PRO  20  -0.383  -0.295  20.576
  156    H    ASN  21           HN       ASN  21   0.888  -3.727  19.443
  157    HA   ASN  21           HA       ASN  21   2.804  -4.724  17.555
  158   1HB   ASN  21          2HB       ASN  21   2.219  -5.141  20.500
  159   2HB   ASN  21          3HB       ASN  21   3.160  -6.361  19.664
  160   1HD2  ASN  21          1HD2      ASN  21   2.950  -2.957  20.511
  161   2HD2  ASN  21          2HD2      ASN  21   4.633  -2.571  20.377
  162    H    GLN  22           HN       GLN  22  -0.458  -5.145  18.062
  163    HA   GLN  22           HA       GLN  22  -0.363  -7.789  16.938
  164   1HB   GLN  22          2HB       GLN  22  -2.348  -8.332  18.656
  165   2HB   GLN  22          3HB       GLN  22  -0.673  -8.663  19.050
  166   1HG   GLN  22          2HG       GLN  22  -1.517  -5.885  19.679
  167   2HG   GLN  22          3HG       GLN  22  -2.397  -7.107  20.575
  168   1HE2  GLN  22          1HE2      GLN  22  -1.514  -6.782  22.534
  169   2HE2  GLN  22          2HE2      GLN  22   0.143  -7.072  22.944
  170    H    LEU  23           HN       LEU  23  -1.832  -7.925  15.281
  171    HA   LEU  23           HA       LEU  23  -3.665  -5.701  14.986
  172   1HB   LEU  23          2HB       LEU  23  -2.595  -7.858  13.204
  173   2HB   LEU  23          3HB       LEU  23  -4.064  -7.013  12.760
  174    HG   LEU  23           HG       LEU  23  -1.811  -6.183  11.823
  175   1HD1  LEU  23          1HD1      LEU  23  -2.609  -3.934  11.674
  176   2HD1  LEU  23          2HD1      LEU  23  -4.020  -5.018  11.668
  177   3HD1  LEU  23          3HD1      LEU  23  -3.592  -4.123  13.145
  178   1HD2  LEU  23          1HD2      LEU  23  -1.620  -5.246  14.681
  179   2HD2  LEU  23          2HD2      LEU  23  -0.400  -6.072  13.681
  180   3HD2  LEU  23          3HD2      LEU  23  -0.818  -4.373  13.353
  181    H    SER  24           HN       SER  24  -5.961  -6.129  14.323
  182    HA   SER  24           HA       SER  24  -6.931  -8.639  15.406
  183   1HB   SER  24          2HB       SER  24  -7.951  -5.873  16.188
  184   2HB   SER  24          3HB       SER  24  -8.798  -7.363  16.557
  185    HG   SER  24           HG       SER  24  -7.139  -6.307  18.166
  186    H    LYS  25           HN       LYS  25  -9.447  -8.800  14.876
  187    HA   LYS  25           HA       LYS  25  -9.711  -8.650  12.117
  188   1HB   LYS  25          2HB       LYS  25 -10.925 -10.178  13.703
  189   2HB   LYS  25          3HB       LYS  25 -11.939  -8.826  14.165
  190   1HG   LYS  25          2HG       LYS  25 -12.141  -8.653  11.434
  191   2HG   LYS  25          3HG       LYS  25 -11.891 -10.379  11.608
  192   1HD   LYS  25          2HD       LYS  25 -13.998  -8.815  13.172
  193   2HD   LYS  25          3HD       LYS  25 -14.330  -9.642  11.663
  194   1HE   LYS  25          2HE       LYS  25 -14.644 -11.576  12.803
  195   2HE   LYS  25          3HE       LYS  25 -12.970 -11.537  13.319
  196   1HZ   LYS  25          1HZ       LYS  25 -13.687 -10.064  15.133
  197   2HZ   LYS  25          2HZ       LYS  25 -15.243 -10.281  14.689
  198   3HZ   LYS  25          3HZ       LYS  25 -14.360 -11.550  15.214
  199    H    GLU  26           HN       GLU  26 -11.264  -6.597  14.686
  200    HA   GLU  26           HA       GLU  26 -12.480  -4.883  12.918
  201   1HB   GLU  26          2HB       GLU  26 -12.284  -5.159  15.694
  202   2HB   GLU  26          3HB       GLU  26 -11.563  -3.588  15.406
  203   1HG   GLU  26          2HG       GLU  26 -14.054  -4.072  13.854
  204   2HG   GLU  26          3HG       GLU  26 -14.288  -4.079  15.591
  205    H    GLU  27           HN       GLU  27  -9.216  -4.738  14.467
  206    HA   GLU  27           HA       GLU  27  -8.547  -2.236  13.518
  207   1HB   GLU  27          2HB       GLU  27  -7.089  -4.611  14.592
  208   2HB   GLU  27          3HB       GLU  27  -6.117  -3.486  13.664
  209   1HG   GLU  27          2HG       GLU  27  -7.407  -1.669  15.174
  210   2HG   GLU  27          3HG       GLU  27  -7.591  -3.035  16.257
  211    H    LEU  28           HN       LEU  28  -7.662  -5.509  12.189
  212    HA   LEU  28           HA       LEU  28  -6.388  -4.580   9.921
  213   1HB   LEU  28          2HB       LEU  28  -6.678  -6.956  11.031
  214   2HB   LEU  28          3HB       LEU  28  -7.977  -7.109   9.865
  215    HG   LEU  28           HG       LEU  28  -6.536  -7.040   8.032
  216   1HD1  LEU  28          1HD1      LEU  28  -4.547  -5.721   9.876
  217   2HD1  LEU  28          2HD1      LEU  28  -4.067  -6.427   8.315
  218   3HD1  LEU  28          3HD1      LEU  28  -5.258  -5.104   8.365
  219   1HD2  LEU  28          1HD2      LEU  28  -4.796  -8.708   8.473
  220   2HD2  LEU  28          2HD2      LEU  28  -4.988  -8.451  10.223
  221   3HD2  LEU  28          3HD2      LEU  28  -6.329  -9.131   9.271
  222    H    LYS  29           HN       LYS  29  -9.872  -5.312  10.518
  223    HA   LYS  29           HA       LYS  29 -10.917  -5.152   8.061
  224   1HB   LYS  29          2HB       LYS  29 -12.201  -5.502  10.122
  225   2HB   LYS  29          3HB       LYS  29 -11.993  -3.820  10.564
  226   1HG   LYS  29          2HG       LYS  29 -13.461  -3.049   8.915
  227   2HG   LYS  29          3HG       LYS  29 -13.134  -4.392   7.837
  228   1HD   LYS  29          2HD       LYS  29 -14.377  -5.920   9.423
  229   2HD   LYS  29          3HD       LYS  29 -14.766  -4.530  10.417
  230   1HE   LYS  29          2HE       LYS  29 -16.683  -4.816   9.027
  231   2HE   LYS  29          3HE       LYS  29 -15.817  -3.477   8.300
  232   1HZ   LYS  29          1HZ       LYS  29 -14.708  -5.443   7.003
  233   2HZ   LYS  29          2HZ       LYS  29 -16.126  -6.182   7.334
  234   3HZ   LYS  29          3HZ       LYS  29 -16.113  -4.776   6.504
  235    H    LEU  30           HN       LEU  30 -10.196  -2.253  10.134
  236    HA   LEU  30           HA       LEU  30 -10.873  -0.358   8.253
  237   1HB   LEU  30          2HB       LEU  30  -8.722  -0.205  10.369
  238   2HB   LEU  30          3HB       LEU  30  -9.468   1.157   9.556
  239    HG   LEU  30           HG       LEU  30 -10.597  -0.656  11.660
  240   1HD1  LEU  30          1HD1      LEU  30 -11.528   1.755  12.269
  241   2HD1  LEU  30          2HD1      LEU  30  -9.876   1.245  12.691
  242   3HD1  LEU  30          3HD1      LEU  30 -10.153   2.268  11.261
  243   1HD2  LEU  30          1HD2      LEU  30 -12.311   0.983   9.772
  244   2HD2  LEU  30          2HD2      LEU  30 -12.198  -0.793   9.792
  245   3HD2  LEU  30          3HD2      LEU  30 -12.866   0.072  11.197
  246    H    LEU  31           HN       LEU  31  -7.569  -1.701   8.965
  247    HA   LEU  31           HA       LEU  31  -6.220  -0.396   6.982
  248   1HB   LEU  31          2HB       LEU  31  -5.461  -1.992   8.882
  249   2HB   LEU  31          3HB       LEU  31  -5.633  -3.255   7.680
  250    HG   LEU  31           HG       LEU  31  -4.083  -0.990   6.674
  251   1HD1  LEU  31          1HD1      LEU  31  -2.496  -2.482   8.678
  252   2HD1  LEU  31          2HD1      LEU  31  -2.400  -0.782   8.159
  253   3HD1  LEU  31          3HD1      LEU  31  -3.647  -1.288   9.324
  254   1HD2  LEU  31          1HD2      LEU  31  -4.271  -3.254   5.644
  255   2HD2  LEU  31          2HD2      LEU  31  -2.597  -2.710   5.913
  256   3HD2  LEU  31          3HD2      LEU  31  -3.332  -3.904   7.009
  257    H    LEU  32           HN       LEU  32  -7.525  -3.783   6.714
  258    HA   LEU  32           HA       LEU  32  -7.076  -4.116   4.051
  259   1HB   LEU  32          2HB       LEU  32  -9.467  -5.119   5.601
  260   2HB   LEU  32          3HB       LEU  32  -8.824  -5.796   4.118
  261    HG   LEU  32           HG       LEU  32  -7.183  -5.639   6.650
  262   1HD1  LEU  32          1HD1      LEU  32  -9.381  -7.499   5.953
  263   2HD1  LEU  32          2HD1      LEU  32  -7.885  -8.240   6.569
  264   3HD1  LEU  32          3HD1      LEU  32  -8.736  -7.014   7.539
  265   1HD2  LEU  32          1HD2      LEU  32  -6.950  -7.284   4.118
  266   2HD2  LEU  32          2HD2      LEU  32  -5.867  -5.984   4.670
  267   3HD2  LEU  32          3HD2      LEU  32  -5.952  -7.516   5.573
  268    H    GLN  33           HN       GLN  33  -9.337  -1.958   5.629
  269    HA   GLN  33           HA       GLN  33 -11.119  -1.750   3.471
  270   1HB   GLN  33          2HB       GLN  33 -11.099  -0.902   6.093
  271   2HB   GLN  33          3HB       GLN  33 -10.809   0.611   5.257
  272   1HG   GLN  33          2HG       GLN  33 -12.813   0.150   3.792
  273   2HG   GLN  33          3HG       GLN  33 -13.120  -1.312   4.708
  274   1HE2  GLN  33          1HE2      GLN  33 -13.805  -1.208   6.840
  275   2HE2  GLN  33          2HE2      GLN  33 -14.479   0.222   7.548
  276    H    THR  34           HN       THR  34  -8.649   0.616   4.732
  277    HA   THR  34           HA       THR  34  -8.691   2.024   2.218
  278    HB   THR  34           HB       THR  34  -7.703   2.387   5.000
  279    HG1  THR  34           HG1      THR  34  -8.472   4.024   2.686
  280   1HG2  THR  34          1HG2      THR  34  -6.085   4.183   4.255
  281   2HG2  THR  34          2HG2      THR  34  -5.501   2.543   3.884
  282   3HG2  THR  34          3HG2      THR  34  -6.203   3.551   2.595
  283    H    GLU  35           HN       GLU  35  -6.299   0.033   4.068
  284    HA   GLU  35           HA       GLU  35  -4.214   0.249   2.390
  285   1HB   GLU  35          2HB       GLU  35  -4.078  -0.982   4.487
  286   2HB   GLU  35          3HB       GLU  35  -5.206  -2.194   3.915
  287   1HG   GLU  35          2HG       GLU  35  -3.374  -3.378   3.262
  288   2HG   GLU  35          3HG       GLU  35  -3.260  -2.248   1.928
  289    H    PHE  36           HN       PHE  36  -6.721  -2.390   2.208
  290    HA   PHE  36           HA       PHE  36  -6.598  -2.240  -0.673
  291   1HB   PHE  36          2HB       PHE  36  -5.680  -4.566   1.093
  292   2HB   PHE  36          3HB       PHE  36  -6.302  -4.893  -0.512
  293    HD1  PHE  36           HD1      PHE  36  -3.413  -4.181   1.354
  294    HD2  PHE  36           HD2      PHE  36  -5.171  -3.510  -2.450
  295    HE1  PHE  36           HE1      PHE  36  -1.142  -3.735   0.383
  296    HE2  PHE  36           HE2      PHE  36  -2.900  -3.064  -3.421
  297    HZ   PHE  36           HZ       PHE  36  -0.913  -3.182  -1.993
  298    HA   PRO  37           HA       PRO  37 -10.715  -3.160   0.825
  299   1HB   PRO  37          2HB       PRO  37 -12.052  -1.493  -0.879
  300   2HB   PRO  37          3HB       PRO  37 -11.516  -1.004   0.717
  301   1HG   PRO  37          2HG       PRO  37 -10.370  -0.308  -1.918
  302   2HG   PRO  37          3HG       PRO  37 -10.132   0.484  -0.373
  303   1HD   PRO  37          2HD       PRO  37  -8.294  -1.271  -1.702
  304   2HD   PRO  37          3HD       PRO  37  -8.107  -0.572  -0.107
  305    H    SER  38           HN       SER  38  -9.136  -3.475  -2.143
  306    HA   SER  38           HA       SER  38 -11.285  -4.705  -3.483
  307   1HB   SER  38          2HB       SER  38  -8.546  -3.946  -4.042
  308   2HB   SER  38          3HB       SER  38  -8.788  -5.601  -4.565
  309    HG   SER  38           HG       SER  38 -10.083  -4.948  -6.156
  310    H    LEU  39           HN       LEU  39  -8.718  -5.749  -1.260
  311    HA   LEU  39           HA       LEU  39  -8.847  -8.499  -1.875
  312   1HB   LEU  39          2HB       LEU  39  -7.323  -6.787  -0.257
  313   2HB   LEU  39          3HB       LEU  39  -8.068  -7.926   0.847
  314    HG   LEU  39           HG       LEU  39  -6.381  -8.646  -1.566
  315   1HD1  LEU  39          1HD1      LEU  39  -5.768  -8.675   1.399
  316   2HD1  LEU  39          2HD1      LEU  39  -4.763  -9.457   0.155
  317   3HD1  LEU  39          3HD1      LEU  39  -4.990  -7.691   0.136
  318   1HD2  LEU  39          1HD2      LEU  39  -6.619 -10.856   0.150
  319   2HD2  LEU  39          2HD2      LEU  39  -8.266 -10.206  -0.032
  320   3HD2  LEU  39          3HD2      LEU  39  -7.322 -10.653  -1.473
  321    H    LEU  40           HN       LEU  40 -10.886  -6.289  -0.066
  322    HA   LEU  40           HA       LEU  40 -12.089  -8.317   1.542
  323   1HB   LEU  40          2HB       LEU  40 -12.844  -5.463   0.911
  324   2HB   LEU  40          3HB       LEU  40 -13.743  -6.489   2.011
  325    HG   LEU  40           HG       LEU  40 -10.801  -5.937   2.410
  326   1HD1  LEU  40          1HD1      LEU  40 -12.850  -4.371   3.920
  327   2HD1  LEU  40          2HD1      LEU  40 -11.163  -3.970   3.517
  328   3HD1  LEU  40          3HD1      LEU  40 -12.428  -3.857   2.269
  329   1HD2  LEU  40          1HD2      LEU  40 -12.065  -7.841   3.591
  330   2HD2  LEU  40          2HD2      LEU  40 -11.093  -6.729   4.585
  331   3HD2  LEU  40          3HD2      LEU  40 -12.863  -6.549   4.520
  332    H    LYS  41           HN       LYS  41 -12.486  -7.032  -1.719
  333    HA   LYS  41           HA       LYS  41 -15.158  -7.943  -2.043
  334   1HB   LYS  41          2HB       LYS  41 -13.022  -7.109  -4.025
  335   2HB   LYS  41          3HB       LYS  41 -14.668  -7.511  -4.470
  336   1HG   LYS  41          2HG       LYS  41 -15.115  -5.726  -2.411
  337   2HG   LYS  41          3HG       LYS  41 -13.618  -5.096  -3.070
  338   1HD   LYS  41          2HD       LYS  41 -14.658  -4.296  -4.931
  339   2HD   LYS  41          3HD       LYS  41 -15.476  -5.818  -5.221
  340   1HE   LYS  41          2HE       LYS  41 -16.952  -5.020  -3.110
  341   2HE   LYS  41          3HE       LYS  41 -16.407  -3.435  -3.623
  342   1HZ   LYS  41          1HZ       LYS  41 -17.139  -4.310  -5.926
  343   2HZ   LYS  41          2HZ       LYS  41 -18.066  -5.337  -5.058
  344   3HZ   LYS  41          3HZ       LYS  41 -18.253  -3.724  -4.884
  345    H    GLY  42           HN       GLY  42 -11.896  -9.328  -2.440
  346   1HA   GLY  42          1HA       GLY  42 -12.256 -11.456  -4.061
  347   2HA   GLY  42          2HA       GLY  42 -11.284 -11.498  -2.603
  348    H    MET  43           HN       MET  43 -12.462 -13.854  -3.393
  349    HA   MET  43           HA       MET  43 -15.035 -14.186  -2.325
  350   1HB   MET  43          2HB       MET  43 -12.806 -16.211  -2.922
  351   2HB   MET  43          3HB       MET  43 -14.480 -16.642  -2.637
  352   1HG   MET  43          2HG       MET  43 -13.759 -14.653  -4.820
  353   2HG   MET  43          3HG       MET  43 -13.644 -16.376  -5.118
  354   1HE   MET  43          1HE       MET  43 -15.896 -16.590  -6.986
  355   2HE   MET  43          2HE       MET  43 -16.882 -15.113  -6.872
  356   3HE   MET  43          3HE       MET  43 -15.107 -14.997  -6.910
  357    H    SER  44           HN       SER  44 -12.121 -13.568  -0.775
  358    HA   SER  44           HA       SER  44 -12.663 -15.351   1.431
  359   1HB   SER  44          2HB       SER  44 -10.408 -13.321   1.151
  360   2HB   SER  44          3HB       SER  44 -10.492 -14.648   2.293
  361    HG   SER  44           HG       SER  44 -10.794 -15.817  -0.069
  362    H    THR  45           HN       THR  45 -14.432 -14.550   2.587
  363    HA   THR  45           HA       THR  45 -14.999 -11.827   2.906
  364    HB   THR  45           HB       THR  45 -16.650 -12.681   4.524
  365    HG1  THR  45           HG1      THR  45 -15.218 -15.211   4.236
  366   1HG2  THR  45          1HG2      THR  45 -16.915 -15.138   3.130
  367   2HG2  THR  45          2HG2      THR  45 -17.744 -13.612   2.742
  368   3HG2  THR  45          3HG2      THR  45 -16.204 -14.015   1.946
  369    H    LEU  46           HN       LEU  46 -15.191 -10.780   5.177
  370    HA   LEU  46           HA       LEU  46 -12.660 -10.173   6.029
  371   1HB   LEU  46          2HB       LEU  46 -14.977  -9.056   6.407
  372   2HB   LEU  46          3HB       LEU  46 -15.030 -10.030   7.862
  373    HG   LEU  46           HG       LEU  46 -14.174  -7.612   8.027
  374   1HD1  LEU  46          1HD1      LEU  46 -13.517  -8.280  10.037
  375   2HD1  LEU  46          2HD1      LEU  46 -13.577  -9.965   9.464
  376   3HD1  LEU  46          3HD1      LEU  46 -12.060  -9.041   9.355
  377   1HD2  LEU  46          1HD2      LEU  46 -11.526  -8.781   7.196
  378   2HD2  LEU  46          2HD2      LEU  46 -12.606  -7.998   6.017
  379   3HD2  LEU  46          3HD2      LEU  46 -11.992  -7.077   7.411
  380    H    ASP  47           HN       ASP  47 -15.052 -12.232   7.841
  381    HA   ASP  47           HA       ASP  47 -13.473 -13.059   9.810
  382   1HB   ASP  47          2HB       ASP  47 -15.729 -14.255   8.280
  383   2HB   ASP  47          3HB       ASP  47 -14.766 -15.428   9.156
  384    H    GLU  48           HN       GLU  48 -13.738 -14.493   6.480
  385    HA   GLU  48           HA       GLU  48 -12.032 -16.596   6.838
  386   1HB   GLU  48          2HB       GLU  48 -13.268 -15.181   4.619
  387   2HB   GLU  48          3HB       GLU  48 -11.632 -15.632   4.184
  388   1HG   GLU  48          2HG       GLU  48 -12.372 -17.970   5.319
  389   2HG   GLU  48          3HG       GLU  48 -13.970 -17.399   4.882
  390    H    LEU  49           HN       LEU  49 -11.317 -13.183   5.881
  391    HA   LEU  49           HA       LEU  49  -8.567 -13.613   5.477
  392   1HB   LEU  49          2HB       LEU  49 -10.358 -11.601   5.009
  393   2HB   LEU  49          3HB       LEU  49  -9.429 -10.937   6.339
  394    HG   LEU  49           HG       LEU  49  -7.394 -11.780   4.783
  395   1HD1  LEU  49          1HD1      LEU  49  -9.702 -11.260   2.906
  396   2HD1  LEU  49          2HD1      LEU  49  -8.000 -11.089   2.414
  397   3HD1  LEU  49          3HD1      LEU  49  -8.612 -12.666   2.968
  398   1HD2  LEU  49          1HD2      LEU  49  -7.119  -9.621   5.353
  399   2HD2  LEU  49          2HD2      LEU  49  -7.755  -9.314   3.720
  400   3HD2  LEU  49          3HD2      LEU  49  -8.840  -9.226   5.128
  401    H    PHE  50           HN       PHE  50 -10.552 -12.662   8.325
  402    HA   PHE  50           HA       PHE  50  -8.451 -12.015  10.011
  403   1HB   PHE  50          2HB       PHE  50 -10.987 -11.702  10.301
  404   2HB   PHE  50          3HB       PHE  50 -11.125 -13.424  10.594
  405    HD1  PHE  50           HD1      PHE  50  -8.481 -11.146  11.863
  406    HD2  PHE  50           HD2      PHE  50 -11.898 -13.480  12.803
  407    HE1  PHE  50           HE1      PHE  50  -8.069 -10.764  14.309
  408    HE2  PHE  50           HE2      PHE  50 -11.486 -13.098  15.250
  409    HZ   PHE  50           HZ       PHE  50  -9.576 -11.745  15.973
  410    H    GLU  51           HN       GLU  51 -10.208 -15.172   9.600
  411    HA   GLU  51           HA       GLU  51  -8.567 -16.491  11.439
  412   1HB   GLU  51          2HB       GLU  51 -10.760 -17.159   9.589
  413   2HB   GLU  51          3HB       GLU  51  -9.593 -18.460   9.726
  414   1HG   GLU  51          2HG       GLU  51  -9.819 -18.488  12.172
  415   2HG   GLU  51          3HG       GLU  51 -10.828 -17.056  12.140
  416    H    GLU  52           HN       GLU  52  -8.531 -16.163   7.845
  417    HA   GLU  52           HA       GLU  52  -6.509 -17.990   7.395
  418   1HB   GLU  52          2HB       GLU  52  -8.000 -17.019   5.642
  419   2HB   GLU  52          3HB       GLU  52  -7.195 -15.472   5.814
  420   1HG   GLU  52          2HG       GLU  52  -5.036 -16.490   5.122
  421   2HG   GLU  52          3HG       GLU  52  -5.793 -18.067   5.015
  422    H    LEU  53           HN       LEU  53  -6.333 -14.363   7.662
  423    HA   LEU  53           HA       LEU  53  -3.603 -14.136   7.449
  424   1HB   LEU  53          2HB       LEU  53  -5.502 -12.461   9.098
  425   2HB   LEU  53          3HB       LEU  53  -3.887 -11.993   8.606
  426    HG   LEU  53           HG       LEU  53  -5.813 -12.763   6.456
  427   1HD1  LEU  53          1HD1      LEU  53  -6.667 -10.980   8.390
  428   2HD1  LEU  53          2HD1      LEU  53  -6.001  -9.925   7.120
  429   3HD1  LEU  53          3HD1      LEU  53  -7.276 -11.101   6.721
  430   1HD2  LEU  53          1HD2      LEU  53  -3.253 -11.517   6.653
  431   2HD2  LEU  53          2HD2      LEU  53  -4.183 -11.947   5.197
  432   3HD2  LEU  53          3HD2      LEU  53  -4.397 -10.348   5.950
  433    H    ASP  54           HN       ASP  54  -5.575 -14.395  10.493
  434    HA   ASP  54           HA       ASP  54  -3.296 -14.589  12.094
  435   1HB   ASP  54          2HB       ASP  54  -5.858 -14.066  12.629
  436   2HB   ASP  54          3HB       ASP  54  -5.960 -15.798  12.873
  437    H    LYS  55           HN       LYS  55  -2.261 -16.328  10.569
  438    HA   LYS  55           HA       LYS  55  -3.340 -18.912  10.455
  439   1HB   LYS  55          2HB       LYS  55  -1.625 -17.925   8.915
  440   2HB   LYS  55          3HB       LYS  55  -0.438 -18.075  10.195
  441   1HG   LYS  55          2HG       LYS  55  -0.057 -20.163   9.363
  442   2HG   LYS  55          3HG       LYS  55  -1.536 -20.617  10.185
  443   1HD   LYS  55          2HD       LYS  55  -2.687 -19.697   7.949
  444   2HD   LYS  55          3HD       LYS  55  -1.105 -19.997   7.258
  445   1HE   LYS  55          2HE       LYS  55  -2.100 -22.079   6.912
  446   2HE   LYS  55          3HE       LYS  55  -1.340 -22.361   8.466
  447   1HZ   LYS  55          1HZ       LYS  55  -3.461 -21.695   9.487
  448   2HZ   LYS  55          2HZ       LYS  55  -4.144 -21.622   8.005
  449   3HZ   LYS  55          3HZ       LYS  55  -3.583 -23.045   8.576
  450    H    ASN  56           HN       ASN  56  -1.794 -17.114  13.003
  451    HA   ASN  56           HA       ASN  56  -0.863 -19.455  14.342
  452   1HB   ASN  56          2HB       ASN  56  -1.046 -16.498  15.079
  453   2HB   ASN  56          3HB       ASN  56  -0.535 -17.693  16.255
  454   1HD2  ASN  56          1HD2      ASN  56   1.295 -19.047  15.750
  455   2HD2  ASN  56          2HD2      ASN  56   2.586 -18.448  14.762
  456    H    GLY  57           HN       GLY  57  -1.593 -19.414  16.914
  457   1HA   GLY  57          1HA       GLY  57  -4.550 -19.291  16.910
  458   2HA   GLY  57          2HA       GLY  57  -3.605 -20.510  17.741
  459    H    ASP  58           HN       ASP  58  -3.435 -16.879  17.487
  460    HA   ASP  58           HA       ASP  58  -3.462 -16.873  20.404
  461   1HB   ASP  58          2HB       ASP  58  -2.117 -14.724  18.734
  462   2HB   ASP  58          3HB       ASP  58  -1.866 -15.092  20.429
  463    H    GLY  59           HN       GLY  59  -3.939 -14.897  17.377
  464   1HA   GLY  59          1HA       GLY  59  -6.269 -14.092  17.087
  465   2HA   GLY  59          2HA       GLY  59  -6.169 -13.500  18.733
  466    H    GLU  60           HN       GLU  60  -3.058 -13.176  17.567
  467    HA   GLU  60           HA       GLU  60  -3.617 -10.419  16.831
  468   1HB   GLU  60          2HB       GLU  60  -0.929 -11.588  17.651
  469   2HB   GLU  60          3HB       GLU  60  -1.371  -9.894  17.569
  470   1HG   GLU  60          2HG       GLU  60  -1.707 -10.183  19.832
  471   2HG   GLU  60          3HG       GLU  60  -3.291 -10.709  19.296
  472    H    VAL  61           HN       VAL  61  -3.281  -9.745  14.748
  473    HA   VAL  61           HA       VAL  61  -1.954 -11.653  12.970
  474    HB   VAL  61           HB       VAL  61  -3.917  -9.404  12.525
  475   1HG1  VAL  61          1HG1      VAL  61  -2.003 -10.630  10.655
  476   2HG1  VAL  61          2HG1      VAL  61  -3.692 -10.676  10.097
  477   3HG1  VAL  61          3HG1      VAL  61  -2.936  -9.121  10.519
  478   1HG2  VAL  61          1HG2      VAL  61  -4.514 -11.857  13.328
  479   2HG2  VAL  61          2HG2      VAL  61  -5.508 -11.013  12.117
  480   3HG2  VAL  61          3HG2      VAL  61  -4.313 -12.226  11.599
  481    H    SER  62           HN       SER  62  -0.152 -10.403  14.601
  482    HA   SER  62           HA       SER  62   0.731  -7.950  14.073
  483   1HB   SER  62          2HB       SER  62   3.031  -9.717  14.058
  484   2HB   SER  62          3HB       SER  62   2.465  -8.660  15.336
  485    HG   SER  62           HG       SER  62   1.803 -11.414  14.847
  486    H    PHE  63           HN       PHE  63   2.706  -7.231  12.706
  487    HA   PHE  63           HA       PHE  63   2.136  -7.369  10.055
  488   1HB   PHE  63          2HB       PHE  63   3.746  -5.844  11.367
  489   2HB   PHE  63          3HB       PHE  63   4.894  -7.167  11.405
  490    HD1  PHE  63           HD1      PHE  63   2.757  -5.769   8.675
  491    HD2  PHE  63           HD2      PHE  63   6.675  -6.671  10.033
  492    HE1  PHE  63           HE1      PHE  63   3.694  -5.019   6.470
  493    HE2  PHE  63           HE2      PHE  63   7.612  -5.922   7.828
  494    HZ   PHE  63           HZ       PHE  63   6.110  -5.105   6.073
  495    H    GLU  64           HN       GLU  64   4.008  -9.663  12.040
  496    HA   GLU  64           HA       GLU  64   5.435 -10.928  10.112
  497   1HB   GLU  64          2HB       GLU  64   4.964 -13.027  11.664
  498   2HB   GLU  64          3HB       GLU  64   5.913 -11.679  12.258
  499   1HG   GLU  64          2HG       GLU  64   4.374 -11.190  13.858
  500   2HG   GLU  64          3HG       GLU  64   3.070 -11.163  12.688
  501    H    GLU  65           HN       GLU  65   2.059 -11.702  11.219
  502    HA   GLU  65           HA       GLU  65   1.746 -13.693   9.261
  503   1HB   GLU  65          2HB       GLU  65  -0.296 -12.185  10.952
  504   2HB   GLU  65          3HB       GLU  65  -0.686 -13.572   9.953
  505   1HG   GLU  65          2HG       GLU  65   1.147 -14.855  11.245
  506   2HG   GLU  65          3HG       GLU  65   1.193 -13.498  12.353
  507    H    PHE  66           HN       PHE  66   1.321 -10.188   9.356
  508    HA   PHE  66           HA       PHE  66  -0.519  -9.879   7.308
  509   1HB   PHE  66          2HB       PHE  66   0.657  -8.226   9.012
  510   2HB   PHE  66          3HB       PHE  66   1.953  -8.142   7.836
  511    HD1  PHE  66           HD1      PHE  66  -1.778  -8.074   7.566
  512    HD2  PHE  66           HD2      PHE  66   1.902  -6.148   6.696
  513    HE1  PHE  66           HE1      PHE  66  -3.014  -6.270   6.334
  514    HE2  PHE  66           HE2      PHE  66   0.666  -4.344   5.464
  515    HZ   PHE  66           HZ       PHE  66  -1.777  -4.427   5.297
  516    H    GLN  67           HN       GLN  67   2.999 -10.530   7.253
  517    HA   GLN  67           HA       GLN  67   3.443  -9.819   4.623
  518   1HB   GLN  67          2HB       GLN  67   4.811 -11.971   6.299
  519   2HB   GLN  67          3HB       GLN  67   5.449 -11.310   4.807
  520   1HG   GLN  67          2HG       GLN  67   4.906  -9.001   6.256
  521   2HG   GLN  67          3HG       GLN  67   5.379 -10.112   7.525
  522   1HE2  GLN  67          1HE2      GLN  67   6.865  -7.895   6.925
  523   2HE2  GLN  67          2HE2      GLN  67   8.391  -8.341   6.237
  524    H    VAL  68           HN       VAL  68   1.511 -12.339   5.934
  525    HA   VAL  68           HA       VAL  68   1.931 -14.235   3.837
  526    HB   VAL  68           HB       VAL  68  -0.258 -13.965   5.908
  527   1HG1  VAL  68          1HG1      VAL  68  -1.234 -15.779   5.047
  528   2HG1  VAL  68          2HG1      VAL  68  -0.154 -15.621   3.642
  529   3HG1  VAL  68          3HG1      VAL  68   0.310 -16.663   5.008
  530   1HG2  VAL  68          1HG2      VAL  68   1.688 -14.233   7.163
  531   2HG2  VAL  68          2HG2      VAL  68   1.127 -15.909   6.945
  532   3HG2  VAL  68          3HG2      VAL  68   2.455 -15.277   5.942
  533    H    LEU  69           HN       LEU  69  -0.304 -11.527   4.546
  534    HA   LEU  69           HA       LEU  69  -2.008 -12.154   2.339
  535   1HB   LEU  69          2HB       LEU  69  -2.468 -10.886   4.586
  536   2HB   LEU  69          3HB       LEU  69  -1.902  -9.487   3.695
  537    HG   LEU  69           HG       LEU  69  -3.653  -9.862   1.990
  538   1HD1  LEU  69          1HD1      LEU  69  -4.751 -11.777   1.797
  539   2HD1  LEU  69          2HD1      LEU  69  -3.813 -12.429   3.162
  540   3HD1  LEU  69          3HD1      LEU  69  -5.375 -11.629   3.457
  541   1HD2  LEU  69          1HD2      LEU  69  -3.970  -8.909   4.637
  542   2HD2  LEU  69          2HD2      LEU  69  -4.883  -8.454   3.179
  543   3HD2  LEU  69          3HD2      LEU  69  -5.462  -9.782   4.213
  544    H    VAL  70           HN       VAL  70   0.889 -10.173   2.945
  545    HA   VAL  70           HA       VAL  70   0.793  -8.452   0.825
  546    HB   VAL  70           HB       VAL  70   2.946  -9.813   2.377
  547   1HG1  VAL  70          1HG1      VAL  70   3.845  -9.825   0.098
  548   2HG1  VAL  70          2HG1      VAL  70   3.486  -8.089  -0.066
  549   3HG1  VAL  70          3HG1      VAL  70   4.701  -8.640   1.113
  550   1HG2  VAL  70          1HG2      VAL  70   2.479  -6.866   1.850
  551   2HG2  VAL  70          2HG2      VAL  70   1.651  -7.767   3.143
  552   3HG2  VAL  70          3HG2      VAL  70   3.425  -7.617   3.158
  553    H    LYS  71           HN       LYS  71   1.139 -11.952   0.841
  554    HA   LYS  71           HA       LYS  71   2.337 -12.154  -1.720
  555   1HB   LYS  71          2HB       LYS  71   1.907 -13.856   0.386
  556   2HB   LYS  71          3HB       LYS  71   0.703 -14.416  -0.758
  557   1HG   LYS  71          2HG       LYS  71   3.022 -13.958  -2.324
  558   2HG   LYS  71          3HG       LYS  71   3.620 -14.699  -0.853
  559   1HD   LYS  71          2HD       LYS  71   1.164 -15.994  -1.897
  560   2HD   LYS  71          3HD       LYS  71   2.510 -16.063  -3.018
  561   1HE   LYS  71          2HE       LYS  71   3.811 -16.731  -0.702
  562   2HE   LYS  71          3HE       LYS  71   2.212 -17.341  -0.324
  563   1HZ   LYS  71          1HZ       LYS  71   4.090 -18.278  -2.262
  564   2HZ   LYS  71          2HZ       LYS  71   2.897 -19.085  -1.492
  565   3HZ   LYS  71          3HZ       LYS  71   2.558 -18.198  -2.821
  566    H    LYS  72           HN       LYS  72  -1.044 -12.203  -0.465
  567    HA   LYS  72           HA       LYS  72  -2.171 -12.735  -3.009
  568   1HB   LYS  72          2HB       LYS  72  -3.347 -11.681  -0.422
  569   2HB   LYS  72          3HB       LYS  72  -4.299 -12.054  -1.844
  570   1HG   LYS  72          2HG       LYS  72  -2.416 -14.082  -0.563
  571   2HG   LYS  72          3HG       LYS  72  -4.093 -13.923  -0.079
  572   1HD   LYS  72          2HD       LYS  72  -4.349 -14.061  -2.830
  573   2HD   LYS  72          3HD       LYS  72  -2.942 -15.075  -2.574
  574   1HE   LYS  72          2HE       LYS  72  -4.168 -16.734  -1.580
  575   2HE   LYS  72          3HE       LYS  72  -5.087 -15.603  -0.607
  576   1HZ   LYS  72          1HZ       LYS  72  -5.934 -15.168  -3.146
  577   2HZ   LYS  72          2HZ       LYS  72  -5.779 -16.792  -3.071
  578   3HZ   LYS  72          3HZ       LYS  72  -6.731 -16.012  -1.998
  579    H    ILE  73           HN       ILE  73  -1.181  -9.817  -1.221
  580    HA   ILE  73           HA       ILE  73  -2.554  -8.042  -2.982
  581    HB   ILE  73           HB       ILE  73  -0.558  -7.759  -0.763
  582   1HG1  ILE  73          2HG1      ILE  73  -3.224  -6.392  -0.973
  583   2HG1  ILE  73          3HG1      ILE  73  -3.160  -8.095  -0.565
  584   1HG2  ILE  73          1HG2      ILE  73  -1.552  -5.497  -2.518
  585   2HG2  ILE  73          2HG2      ILE  73  -0.571  -5.341  -1.041
  586   3HG2  ILE  73          3HG2      ILE  73   0.109  -6.136  -2.480
  587   1HD1  ILE  73          1HD1      ILE  73  -1.376  -7.405   1.218
  588   2HD1  ILE  73          2HD1      ILE  73  -1.978  -5.751   0.955
  589   3HD1  ILE  73          3HD1      ILE  73  -3.083  -7.016   1.543
  590    H    SER  74           HN       SER  74   0.154 -10.063  -3.318
  591    HA   SER  74           HA       SER  74   1.569  -8.219  -5.013
  592   1HB   SER  74          2HB       SER  74   2.419 -10.243  -3.373
  593   2HB   SER  74          3HB       SER  74   2.377 -11.094  -4.905
  594    HG   SER  74           HG       SER  74   3.939  -9.777  -5.750
  595    H    GLN  75           HN       GLN  75  -0.308 -11.302  -5.195
  596    HA   GLN  75           HA       GLN  75   0.076 -11.597  -7.959
  597   1HB   GLN  75          2HB       GLN  75  -0.981 -13.136  -5.867
  598   2HB   GLN  75          3HB       GLN  75  -2.375 -12.828  -6.883
  599   1HG   GLN  75          2HG       GLN  75  -1.510 -14.744  -7.906
  600   2HG   GLN  75          3HG       GLN  75  -0.748 -13.492  -8.868
  601   1HE2  GLN  75          1HE2      GLN  75  -0.204 -15.015  -5.688
  602   2HE2  GLN  75          2HE2      GLN  75   1.480 -15.361  -5.897
  Start of MODEL   15
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   1.374  -0.237  -2.047
    3   1HB   LYS   1          2HB       LYS   1   2.700   1.963  -0.606
    4   2HB   LYS   1          3HB       LYS   1   3.648   1.308  -1.925
    5   1HG   LYS   1          2HG       LYS   1   1.967   1.788  -3.546
    6   2HG   LYS   1          3HG       LYS   1   0.706   1.929  -2.337
    7   1HD   LYS   1          2HD       LYS   1   1.158   4.134  -1.961
    8   2HD   LYS   1          3HD       LYS   1   2.884   3.850  -1.856
    9   1HE   LYS   1          2HE       LYS   1   2.648   5.232  -3.780
   10   2HE   LYS   1          3HE       LYS   1   2.854   3.622  -4.442
   11   1HZ   LYS   1          1HZ       LYS   1   0.858   3.745  -5.330
   12   2HZ   LYS   1          2HZ       LYS   1   0.142   4.124  -3.911
   13   3HZ   LYS   1          3HZ       LYS   1   0.749   5.306  -4.861
   14    H    SER   2           HN       SER   2   3.996  -0.245   0.475
   15    HA   SER   2           HA       SER   2   5.493  -2.105  -1.028
   16   1HB   SER   2          2HB       SER   2   5.736  -1.132   1.851
   17   2HB   SER   2          3HB       SER   2   6.907  -2.189   1.088
   18    HG   SER   2           HG       SER   2   7.823  -0.400   0.364
   19    HA   PRO   3           HA       PRO   3   3.774  -5.770   0.572
   20   1HB   PRO   3          2HB       PRO   3   5.826  -7.540   0.222
   21   2HB   PRO   3          3HB       PRO   3   4.755  -7.046  -1.074
   22   1HG   PRO   3          2HG       PRO   3   7.551  -6.229  -0.567
   23   2HG   PRO   3          3HG       PRO   3   6.619  -6.096  -2.045
   24   1HD   PRO   3          2HD       PRO   3   7.238  -3.980  -0.210
   25   2HD   PRO   3          3HD       PRO   3   6.210  -3.873  -1.626
   26    H    GLU   4           HN       GLU   4   6.905  -4.873   1.834
   27    HA   GLU   4           HA       GLU   4   6.813  -6.580   4.012
   28   1HB   GLU   4          2HB       GLU   4   8.495  -4.464   3.016
   29   2HB   GLU   4          3HB       GLU   4   8.204  -4.157   4.716
   30   1HG   GLU   4          2HG       GLU   4   8.768  -7.009   4.109
   31   2HG   GLU   4          3HG       GLU   4  10.092  -5.934   3.704
   32    H    GLU   5           HN       GLU   5   5.312  -3.423   3.366
   33    HA   GLU   5           HA       GLU   5   4.787  -2.735   6.002
   34   1HB   GLU   5          2HB       GLU   5   4.011  -1.838   3.318
   35   2HB   GLU   5          3HB       GLU   5   2.683  -1.679   4.451
   36   1HG   GLU   5          2HG       GLU   5   4.780  -0.727   5.977
   37   2HG   GLU   5          3HG       GLU   5   5.291  -0.236   4.374
   38    H    LEU   6           HN       LEU   6   3.175  -4.922   3.698
   39    HA   LEU   6           HA       LEU   6   0.712  -5.116   4.981
   40   1HB   LEU   6          2HB       LEU   6   2.246  -7.098   3.297
   41   2HB   LEU   6          3HB       LEU   6   0.581  -7.312   3.798
   42    HG   LEU   6           HG       LEU   6   1.520  -4.936   2.176
   43   1HD1  LEU   6          1HD1      LEU   6   2.024  -6.824   0.823
   44   2HD1  LEU   6          2HD1      LEU   6   0.483  -7.616   1.233
   45   3HD1  LEU   6          3HD1      LEU   6   0.489  -6.149   0.225
   46   1HD2  LEU   6          1HD2      LEU   6  -1.267  -6.073   2.494
   47   2HD2  LEU   6          2HD2      LEU   6  -0.616  -4.740   3.477
   48   3HD2  LEU   6          3HD2      LEU   6  -0.788  -4.545   1.716
   49    H    LYS   7           HN       LYS   7   3.844  -6.813   5.502
   50    HA   LYS   7           HA       LYS   7   2.862  -8.660   7.359
   51   1HB   LYS   7          2HB       LYS   7   5.175  -8.382   6.041
   52   2HB   LYS   7          3HB       LYS   7   5.668  -7.659   7.559
   53   1HG   LYS   7          2HG       LYS   7   4.221 -10.336   7.482
   54   2HG   LYS   7          3HG       LYS   7   5.959 -10.236   7.283
   55   1HD   LYS   7          2HD       LYS   7   5.229  -8.604   9.554
   56   2HD   LYS   7          3HD       LYS   7   4.437 -10.158   9.730
   57   1HE   LYS   7          2HE       LYS   7   6.539 -11.357   9.579
   58   2HE   LYS   7          3HE       LYS   7   7.395  -9.931   9.028
   59   1HZ   LYS   7          1HZ       LYS   7   6.953 -10.743  11.635
   60   2HZ   LYS   7          2HZ       LYS   7   7.765  -9.423  11.120
   61   3HZ   LYS   7          3HZ       LYS   7   6.166  -9.326  11.440
   62    H    GLY   8           HN       GLY   8   4.500  -5.451   7.817
   63   1HA   GLY   8          1HA       GLY   8   4.356  -5.399  10.600
   64   2HA   GLY   8          2HA       GLY   8   4.458  -4.009   9.539
   65    H    ILE   9           HN       ILE   9   2.115  -3.931   8.132
   66    HA   ILE   9           HA       ILE   9   0.320  -2.873   9.936
   67    HB   ILE   9           HB       ILE   9   0.188  -3.752   7.083
   68   1HG1  ILE   9          2HG1      ILE   9  -0.080  -1.084   8.498
   69   2HG1  ILE   9          3HG1      ILE   9   1.317  -1.661   7.612
   70   1HG2  ILE   9          1HG2      ILE   9  -2.108  -2.969   6.887
   71   2HG2  ILE   9          2HG2      ILE   9  -2.007  -4.342   8.015
   72   3HG2  ILE   9          3HG2      ILE   9  -2.182  -2.685   8.642
   73   1HD1  ILE   9          1HD1      ILE   9  -1.337  -0.708   6.569
   74   2HD1  ILE   9          2HD1      ILE   9   0.302  -0.405   5.945
   75   3HD1  ILE   9          3HD1      ILE   9  -0.489  -1.971   5.646
   76    H    PHE  10           HN       PHE  10   0.387  -6.146   8.390
   77    HA   PHE  10           HA       PHE  10  -1.965  -7.117   9.368
   78   1HB   PHE  10          2HB       PHE  10  -0.691  -8.485   7.871
   79   2HB   PHE  10          3HB       PHE  10   0.806  -8.192   8.732
   80    HD1  PHE  10           HD1      PHE  10   1.327  -9.456  10.784
   81    HD2  PHE  10           HD2      PHE  10  -2.153 -10.287   8.502
   82    HE1  PHE  10           HE1      PHE  10   1.086 -11.663  11.954
   83    HE2  PHE  10           HE2      PHE  10  -2.393 -12.494   9.672
   84    HZ   PHE  10           HZ       PHE  10  -0.771 -13.156  11.384
   85    H    GLU  11           HN       GLU  11   1.304  -7.338  10.951
   86    HA   GLU  11           HA       GLU  11   0.345  -8.590  13.225
   87   1HB   GLU  11          2HB       GLU  11   2.849  -7.455  12.269
   88   2HB   GLU  11          3HB       GLU  11   2.624  -7.050  13.959
   89   1HG   GLU  11          2HG       GLU  11   1.886  -9.661  14.071
   90   2HG   GLU  11          3HG       GLU  11   2.944  -9.750  12.677
   91    H    LYS  12           HN       LYS  12   0.551  -5.158  12.266
   92    HA   LYS  12           HA       LYS  12   0.227  -4.010  14.774
   93   1HB   LYS  12          2HB       LYS  12   0.674  -3.066  12.297
   94   2HB   LYS  12          3HB       LYS  12  -1.041  -2.722  12.403
   95   1HG   LYS  12          2HG       LYS  12   0.190  -1.979  14.916
   96   2HG   LYS  12          3HG       LYS  12   1.136  -1.284  13.615
   97   1HD   LYS  12          2HD       LYS  12  -1.141  -0.497  12.615
   98   2HD   LYS  12          3HD       LYS  12  -1.830  -0.894  14.176
   99   1HE   LYS  12          2HE       LYS  12  -0.492   0.739  15.317
  100   2HE   LYS  12          3HE       LYS  12   0.620   0.896  13.972
  101   1HZ   LYS  12          1HZ       LYS  12  -0.768   2.266  12.908
  102   2HZ   LYS  12          2HZ       LYS  12  -2.129   1.496  13.380
  103   3HZ   LYS  12          3HZ       LYS  12  -1.388   2.541  14.394
  104    H    TYR  13           HN       TYR  13  -2.044  -5.659  12.606
  105    HA   TYR  13           HA       TYR  13  -4.293  -4.776  14.240
  106   1HB   TYR  13          2HB       TYR  13  -3.731  -6.149  11.581
  107   2HB   TYR  13          3HB       TYR  13  -5.283  -6.471  12.328
  108    HD1  TYR  13           HD1      TYR  13  -3.099  -3.706  11.104
  109    HD2  TYR  13           HD2      TYR  13  -7.068  -4.934  12.126
  110    HE1  TYR  13           HE1      TYR  13  -4.026  -1.552  10.123
  111    HE2  TYR  13           HE2      TYR  13  -7.982  -2.775  11.141
  112    HH   TYR  13           HH       TYR  13  -6.182  -0.805   9.141
  113    H    ALA  14           HN       ALA  14  -2.389  -7.698  13.365
  114    HA   ALA  14           HA       ALA  14  -4.101  -9.526  14.655
  115   1HB   ALA  14          1HB       ALA  14  -1.143  -9.991  14.382
  116   2HB   ALA  14          2HB       ALA  14  -2.502 -11.092  14.053
  117   3HB   ALA  14          3HB       ALA  14  -2.116  -9.787  12.906
  118    H    ALA  15           HN       ALA  15  -1.563  -7.303  15.744
  119    HA   ALA  15           HA       ALA  15  -1.212  -8.615  18.265
  120   1HB   ALA  15          1HB       ALA  15   0.344  -6.880  18.697
  121   2HB   ALA  15          2HB       ALA  15   0.468  -7.166  16.945
  122   3HB   ALA  15          3HB       ALA  15  -0.449  -5.768  17.556
  123    H    LYS  16           HN       LYS  16  -3.480  -6.374  16.828
  124    HA   LYS  16           HA       LYS  16  -4.232  -4.882  19.023
  125   1HB   LYS  16          2HB       LYS  16  -5.049  -5.191  16.384
  126   2HB   LYS  16          3HB       LYS  16  -6.462  -5.676  17.300
  127   1HG   LYS  16          2HG       LYS  16  -6.093  -3.528  18.713
  128   2HG   LYS  16          3HG       LYS  16  -4.957  -3.034  17.474
  129   1HD   LYS  16          2HD       LYS  16  -6.618  -2.768  15.845
  130   2HD   LYS  16          3HD       LYS  16  -7.676  -3.964  16.568
  131   1HE   LYS  16          2HE       LYS  16  -7.484  -1.991  18.560
  132   2HE   LYS  16          3HE       LYS  16  -7.514  -1.060  17.075
  133   1HZ   LYS  16          1HZ       LYS  16  -9.405  -3.216  17.199
  134   2HZ   LYS  16          2HZ       LYS  16  -9.675  -2.001  18.257
  135   3HZ   LYS  16          3HZ       LYS  16  -9.599  -1.688  16.656
  136    H    GLU  17           HN       GLU  17  -5.912  -7.871  17.802
  137    HA   GLU  17           HA       GLU  17  -6.597  -8.363  20.596
  138   1HB   GLU  17          2HB       GLU  17  -8.190  -8.750  18.048
  139   2HB   GLU  17          3HB       GLU  17  -8.559  -9.709  19.468
  140   1HG   GLU  17          2HG       GLU  17  -8.306  -7.072  20.457
  141   2HG   GLU  17          3HG       GLU  17  -9.148  -6.881  18.932
  142    H    GLY  18           HN       GLY  18  -5.978 -10.321  21.470
  143   1HA   GLY  18          1HA       GLY  18  -5.092 -12.381  21.617
  144   2HA   GLY  18          2HA       GLY  18  -5.701 -12.705  20.006
  145    H    ASP  19           HN       ASP  19  -3.427 -13.952  20.332
  146    HA   ASP  19           HA       ASP  19  -1.073 -12.621  20.242
  147   1HB   ASP  19          2HB       ASP  19  -1.723 -15.204  20.187
  148   2HB   ASP  19          3HB       ASP  19  -1.533 -15.024  18.455
  149    HA   PRO  20           HA       PRO  20  -1.152 -10.766  16.260
  150   1HB   PRO  20          2HB       PRO  20   1.488 -10.119  15.975
  151   2HB   PRO  20          3HB       PRO  20   0.358  -9.149  16.898
  152   1HG   PRO  20          2HG       PRO  20   2.469 -10.971  17.880
  153   2HG   PRO  20          3HG       PRO  20   1.632  -9.695  18.742
  154   1HD   PRO  20          2HD       PRO  20   1.166 -12.515  18.976
  155   2HD   PRO  20          3HD       PRO  20   0.254 -11.235  19.749
  156    H    ASN  21           HN       ASN  21  -0.065 -13.750  16.859
  157    HA   ASN  21           HA       ASN  21   1.162 -14.106  14.292
  158   1HB   ASN  21          2HB       ASN  21   0.533 -15.972  16.628
  159   2HB   ASN  21          3HB       ASN  21   1.170 -16.584  15.114
  160   1HD2  ASN  21          1HD2      ASN  21   2.419 -16.753  17.640
  161   2HD2  ASN  21          2HD2      ASN  21   3.913 -15.878  17.596
  162    H    GLN  22           HN       GLN  22  -1.757 -15.186  16.170
  163    HA   GLN  22           HA       GLN  22  -2.856 -16.271  13.717
  164   1HB   GLN  22          2HB       GLN  22  -4.666 -17.119  15.372
  165   2HB   GLN  22          3HB       GLN  22  -3.075 -17.849  15.460
  166   1HG   GLN  22          2HG       GLN  22  -3.403 -15.416  17.148
  167   2HG   GLN  22          3HG       GLN  22  -4.429 -16.758  17.612
  168   1HE2  GLN  22          1HE2      GLN  22  -1.315 -17.054  16.006
  169   2HE2  GLN  22          2HE2      GLN  22  -0.443 -17.790  17.308
  170    H    LEU  23           HN       LEU  23  -4.545 -15.302  12.625
  171    HA   LEU  23           HA       LEU  23  -5.415 -12.738  13.665
  172   1HB   LEU  23          2HB       LEU  23  -5.408 -14.098  11.008
  173   2HB   LEU  23          3HB       LEU  23  -6.589 -12.837  11.300
  174    HG   LEU  23           HG       LEU  23  -4.303 -12.260  10.197
  175   1HD1  LEU  23          1HD1      LEU  23  -6.206 -10.798  11.604
  176   2HD1  LEU  23          2HD1      LEU  23  -4.649 -10.252  12.272
  177   3HD1  LEU  23          3HD1      LEU  23  -4.949 -10.156  10.520
  178   1HD2  LEU  23          1HD2      LEU  23  -3.534 -12.516  13.105
  179   2HD2  LEU  23          2HD2      LEU  23  -2.744 -13.217  11.673
  180   3HD2  LEU  23          3HD2      LEU  23  -2.652 -11.465  11.971
  181    H    SER  24           HN       SER  24  -7.831 -12.192  13.334
  182    HA   SER  24           HA       SER  24  -9.466 -14.535  13.803
  183   1HB   SER  24          2HB       SER  24  -9.666 -12.063  15.569
  184   2HB   SER  24          3HB       SER  24 -10.529 -13.575  15.766
  185    HG   SER  24           HG       SER  24  -7.643 -13.407  15.858
  186    H    LYS  25           HN       LYS  25 -11.879 -13.956  13.627
  187    HA   LYS  25           HA       LYS  25 -12.368 -12.623  11.270
  188   1HB   LYS  25          2HB       LYS  25 -13.836 -14.310  12.366
  189   2HB   LYS  25          3HB       LYS  25 -14.303 -13.110  13.555
  190   1HG   LYS  25          2HG       LYS  25 -14.888 -11.634  11.417
  191   2HG   LYS  25          3HG       LYS  25 -14.923 -13.180  10.592
  192   1HD   LYS  25          2HD       LYS  25 -16.446 -13.883  12.692
  193   2HD   LYS  25          3HD       LYS  25 -16.726 -12.156  12.785
  194   1HE   LYS  25          2HE       LYS  25 -17.038 -12.635  10.061
  195   2HE   LYS  25          3HE       LYS  25 -17.668 -14.114  10.758
  196   1HZ   LYS  25          1HZ       LYS  25 -18.682 -11.430  10.972
  197   2HZ   LYS  25          2HZ       LYS  25 -19.489 -12.849  10.932
  198   3HZ   LYS  25          3HZ       LYS  25 -18.804 -12.338  12.324
  199    H    GLU  26           HN       GLU  26 -13.049 -11.448  14.645
  200    HA   GLU  26           HA       GLU  26 -13.814  -8.930  13.860
  201   1HB   GLU  26          2HB       GLU  26 -13.368 -10.340  16.301
  202   2HB   GLU  26          3HB       GLU  26 -12.464  -8.844  16.431
  203   1HG   GLU  26          2HG       GLU  26 -15.340  -8.848  15.440
  204   2HG   GLU  26          3HG       GLU  26 -14.979  -8.842  17.155
  205    H    GLU  27           HN       GLU  27 -10.564 -10.275  14.632
  206    HA   GLU  27           HA       GLU  27  -9.211  -7.875  14.662
  207   1HB   GLU  27          2HB       GLU  27  -8.530 -10.753  14.379
  208   2HB   GLU  27          3HB       GLU  27  -7.343  -9.664  13.688
  209   1HG   GLU  27          2HG       GLU  27  -7.786  -8.372  16.047
  210   2HG   GLU  27          3HG       GLU  27  -8.174 -10.005  16.552
  211    H    LEU  28           HN       LEU  28  -9.559 -10.275  11.945
  212    HA   LEU  28           HA       LEU  28  -8.280  -8.703  10.043
  213   1HB   LEU  28          2HB       LEU  28  -9.110 -11.218  10.125
  214   2HB   LEU  28          3HB       LEU  28 -10.490 -10.552   9.274
  215    HG   LEU  28           HG       LEU  28  -9.226  -9.955   7.399
  216   1HD1  LEU  28          1HD1      LEU  28  -6.665 -10.127   7.442
  217   2HD1  LEU  28          2HD1      LEU  28  -7.422  -8.732   8.247
  218   3HD1  LEU  28          3HD1      LEU  28  -6.824 -10.101   9.215
  219   1HD2  LEU  28          1HD2      LEU  28  -9.378 -12.523   8.098
  220   2HD2  LEU  28          2HD2      LEU  28  -8.568 -11.982   6.608
  221   3HD2  LEU  28          3HD2      LEU  28  -7.605 -12.366   8.055
  222    H    LYS  29           HN       LYS  29 -11.726  -8.885  11.079
  223    HA   LYS  29           HA       LYS  29 -12.971  -7.458   9.184
  224   1HB   LYS  29          2HB       LYS  29 -13.929  -8.429  11.303
  225   2HB   LYS  29          3HB       LYS  29 -13.367  -7.004  12.154
  226   1HG   LYS  29          2HG       LYS  29 -14.667  -5.614  10.400
  227   2HG   LYS  29          3HG       LYS  29 -15.397  -7.121   9.883
  228   1HD   LYS  29          2HD       LYS  29 -16.773  -7.217  11.705
  229   2HD   LYS  29          3HD       LYS  29 -15.485  -6.793  12.815
  230   1HE   LYS  29          2HE       LYS  29 -15.754  -4.421  12.368
  231   2HE   LYS  29          3HE       LYS  29 -16.799  -4.728  10.995
  232   1HZ   LYS  29          1HZ       LYS  29 -17.933  -6.005  13.148
  233   2HZ   LYS  29          2HZ       LYS  29 -17.492  -4.530  13.692
  234   3HZ   LYS  29          3HZ       LYS  29 -18.476  -4.661  12.395
  235    H    LEU  30           HN       LEU  30 -11.161  -6.002  11.979
  236    HA   LEU  30           HA       LEU  30 -11.509  -3.371  11.233
  237   1HB   LEU  30          2HB       LEU  30  -9.070  -4.533  12.577
  238   2HB   LEU  30          3HB       LEU  30  -9.661  -2.886  12.682
  239    HG   LEU  30           HG       LEU  30 -11.719  -4.741  13.530
  240   1HD1  LEU  30          1HD1      LEU  30 -10.763  -5.982  15.184
  241   2HD1  LEU  30          2HD1      LEU  30  -9.406  -5.945  14.032
  242   3HD1  LEU  30          3HD1      LEU  30  -9.419  -4.840  15.428
  243   1HD2  LEU  30          1HD2      LEU  30 -10.532  -3.039  15.581
  244   2HD2  LEU  30          2HD2      LEU  30 -10.893  -2.155  14.079
  245   3HD2  LEU  30          3HD2      LEU  30 -12.182  -3.057  14.913
  246    H    LEU  31           HN       LEU  31  -8.642  -5.502  10.540
  247    HA   LEU  31           HA       LEU  31  -7.269  -3.770   8.953
  248   1HB   LEU  31          2HB       LEU  31  -6.744  -6.154   9.814
  249   2HB   LEU  31          3HB       LEU  31  -7.459  -6.697   8.309
  250    HG   LEU  31           HG       LEU  31  -5.515  -4.609   7.799
  251   1HD1  LEU  31          1HD1      LEU  31  -3.687  -6.567   8.466
  252   2HD1  LEU  31          2HD1      LEU  31  -3.983  -5.055   9.358
  253   3HD1  LEU  31          3HD1      LEU  31  -4.796  -6.557   9.858
  254   1HD2  LEU  31          1HD2      LEU  31  -6.003  -5.902   5.970
  255   2HD2  LEU  31          2HD2      LEU  31  -4.500  -6.677   6.525
  256   3HD2  LEU  31          3HD2      LEU  31  -6.075  -7.412   6.910
  257    H    LEU  32           HN       LEU  32  -9.501  -6.349   7.682
  258    HA   LEU  32           HA       LEU  32  -9.542  -5.518   5.091
  259   1HB   LEU  32          2HB       LEU  32 -11.864  -6.651   6.657
  260   2HB   LEU  32          3HB       LEU  32 -11.675  -6.674   4.914
  261    HG   LEU  32           HG       LEU  32  -9.732  -8.030   6.798
  262   1HD1  LEU  32          1HD1      LEU  32 -10.930 -10.151   6.071
  263   2HD1  LEU  32          2HD1      LEU  32 -11.775  -9.118   7.249
  264   3HD1  LEU  32          3HD1      LEU  32 -12.261  -9.096   5.537
  265   1HD2  LEU  32          1HD2      LEU  32  -8.519  -8.278   4.955
  266   2HD2  LEU  32          2HD2      LEU  32  -9.810  -9.322   4.312
  267   3HD2  LEU  32          3HD2      LEU  32  -9.806  -7.581   3.942
  268    H    GLN  33           HN       GLN  33 -10.883  -3.933   7.915
  269    HA   GLN  33           HA       GLN  33 -12.815  -2.437   6.539
  270   1HB   GLN  33          2HB       GLN  33 -12.196  -2.889   9.185
  271   2HB   GLN  33          3HB       GLN  33 -11.615  -1.247   8.989
  272   1HG   GLN  33          2HG       GLN  33 -13.895  -0.708   7.899
  273   2HG   GLN  33          3HG       GLN  33 -14.431  -2.284   8.449
  274   1HE2  GLN  33          1HE2      GLN  33 -13.925  -2.763  10.803
  275   2HE2  GLN  33          2HE2      GLN  33 -14.262  -1.515  11.956
  276    H    THR  34           HN       THR  34  -9.631  -1.415   7.989
  277    HA   THR  34           HA       THR  34  -9.633   0.963   6.361
  278    HB   THR  34           HB       THR  34  -8.193  -0.179   8.702
  279    HG1  THR  34           HG1      THR  34  -8.171   2.305   8.930
  280   1HG2  THR  34          1HG2      THR  34  -6.192   0.049   7.323
  281   2HG2  THR  34          2HG2      THR  34  -6.788   1.574   6.624
  282   3HG2  THR  34          3HG2      THR  34  -6.296   1.511   8.334
  283    H    GLU  35           HN       GLU  35  -7.689  -2.082   6.561
  284    HA   GLU  35           HA       GLU  35  -5.873  -1.526   4.659
  285   1HB   GLU  35          2HB       GLU  35  -5.785  -3.584   5.934
  286   2HB   GLU  35          3HB       GLU  35  -7.309  -4.140   5.271
  287   1HG   GLU  35          2HG       GLU  35  -5.685  -5.327   4.010
  288   2HG   GLU  35          3HG       GLU  35  -6.163  -4.021   2.943
  289    H    PHE  36           HN       PHE  36  -9.084  -3.141   4.070
  290    HA   PHE  36           HA       PHE  36  -9.259  -1.751   1.546
  291   1HB   PHE  36          2HB       PHE  36  -8.965  -4.770   1.966
  292   2HB   PHE  36          3HB       PHE  36  -9.819  -4.166   0.561
  293    HD1  PHE  36           HD1      PHE  36  -6.847  -5.488   1.449
  294    HD2  PHE  36           HD2      PHE  36  -8.336  -2.023  -0.496
  295    HE1  PHE  36           HE1      PHE  36  -4.665  -5.233   0.234
  296    HE2  PHE  36           HE2      PHE  36  -6.155  -1.768  -1.711
  297    HZ   PHE  36           HZ       PHE  36  -4.345  -3.376  -1.332
  298    HA   PRO  37           HA       PRO  37 -13.242  -2.222   3.537
  299   1HB   PRO  37          2HB       PRO  37 -14.150   0.306   3.034
  300   2HB   PRO  37          3HB       PRO  37 -13.300  -0.132   4.502
  301   1HG   PRO  37          2HG       PRO  37 -12.308   1.388   2.169
  302   2HG   PRO  37          3HG       PRO  37 -11.643   1.305   3.789
  303   1HD   PRO  37          2HD       PRO  37 -10.652  -0.038   1.455
  304   2HD   PRO  37          3HD       PRO  37 -10.059  -0.211   3.095
  305    H    SER  38           HN       SER  38 -12.146  -2.069   0.484
  306    HA   SER  38           HA       SER  38 -14.766  -1.839  -0.683
  307   1HB   SER  38          2HB       SER  38 -12.097  -1.364  -1.560
  308   2HB   SER  38          3HB       SER  38 -12.689  -2.692  -2.537
  309    HG   SER  38           HG       SER  38 -14.712  -1.202  -2.736
  310    H    LEU  39           HN       LEU  39 -12.260  -4.268   0.101
  311    HA   LEU  39           HA       LEU  39 -13.410  -6.359  -1.414
  312   1HB   LEU  39          2HB       LEU  39 -11.130  -5.912   0.258
  313   2HB   LEU  39          3HB       LEU  39 -11.931  -7.381   0.780
  314    HG   LEU  39           HG       LEU  39 -10.081  -7.611  -0.950
  315   1HD1  LEU  39          1HD1      LEU  39 -12.809  -8.779  -1.565
  316   2HD1  LEU  39          2HD1      LEU  39 -11.256  -9.392  -2.180
  317   3HD1  LEU  39          3HD1      LEU  39 -11.600  -9.433  -0.434
  318   1HD2  LEU  39          1HD2      LEU  39 -10.170  -6.431  -2.823
  319   2HD2  LEU  39          2HD2      LEU  39 -11.666  -7.281  -3.282
  320   3HD2  LEU  39          3HD2      LEU  39 -11.753  -5.764  -2.355
  321    H    LEU  40           HN       LEU  40 -14.208  -4.803   1.608
  322    HA   LEU  40           HA       LEU  40 -15.560  -7.050   2.730
  323   1HB   LEU  40          2HB       LEU  40 -15.549  -4.102   3.375
  324   2HB   LEU  40          3HB       LEU  40 -16.464  -5.289   4.284
  325    HG   LEU  40           HG       LEU  40 -13.455  -5.361   3.932
  326   1HD1  LEU  40          1HD1      LEU  40 -13.325  -4.565   6.252
  327   2HD1  LEU  40          2HD1      LEU  40 -14.095  -3.372   5.179
  328   3HD1  LEU  40          3HD1      LEU  40 -15.093  -4.356   6.276
  329   1HD2  LEU  40          1HD2      LEU  40 -13.987  -7.539   4.422
  330   2HD2  LEU  40          2HD2      LEU  40 -13.800  -6.865   6.059
  331   3HD2  LEU  40          3HD2      LEU  40 -15.426  -7.095   5.372
  332    H    LYS  41           HN       LYS  41 -16.299  -4.484   0.420
  333    HA   LYS  41           HA       LYS  41 -19.116  -4.672   0.684
  334   1HB   LYS  41          2HB       LYS  41 -19.201  -3.076  -0.969
  335   2HB   LYS  41          3HB       LYS  41 -17.608  -2.780  -0.302
  336   1HG   LYS  41          2HG       LYS  41 -16.849  -2.996  -2.440
  337   2HG   LYS  41          3HG       LYS  41 -17.054  -4.720  -2.207
  338   1HD   LYS  41          2HD       LYS  41 -19.127  -4.771  -3.346
  339   2HD   LYS  41          3HD       LYS  41 -19.438  -3.068  -3.074
  340   1HE   LYS  41          2HE       LYS  41 -18.480  -2.535  -5.060
  341   2HE   LYS  41          3HE       LYS  41 -16.978  -3.296  -4.577
  342   1HZ   LYS  41          1HZ       LYS  41 -19.060  -4.314  -6.237
  343   2HZ   LYS  41          2HZ       LYS  41 -17.479  -4.723  -6.181
  344   3HZ   LYS  41          3HZ       LYS  41 -18.534  -5.394  -5.131
  345    H    GLY  42           HN       GLY  42 -16.606  -6.500  -1.006
  346   1HA   GLY  42          1HA       GLY  42 -17.858  -7.662  -3.100
  347   2HA   GLY  42          2HA       GLY  42 -16.753  -8.507  -2.035
  348    H    MET  43           HN       MET  43 -18.721 -10.004  -3.231
  349    HA   MET  43           HA       MET  43 -21.061 -10.089  -1.654
  350   1HB   MET  43          2HB       MET  43 -19.818 -12.117  -3.596
  351   2HB   MET  43          3HB       MET  43 -21.455 -12.222  -2.980
  352   1HG   MET  43          2HG       MET  43 -22.202 -10.762  -4.553
  353   2HG   MET  43          3HG       MET  43 -21.032  -9.556  -4.056
  354   1HE   MET  43          1HE       MET  43 -20.031  -9.404  -7.699
  355   2HE   MET  43          2HE       MET  43 -21.674  -9.430  -7.015
  356   3HE   MET  43          3HE       MET  43 -20.376  -8.543  -6.180
  357    H    SER  44           HN       SER  44 -17.902 -10.920  -0.923
  358    HA   SER  44           HA       SER  44 -18.597 -13.331   0.495
  359   1HB   SER  44          2HB       SER  44 -16.438 -13.114  -0.795
  360   2HB   SER  44          3HB       SER  44 -15.925 -11.868   0.326
  361    HG   SER  44           HG       SER  44 -16.532 -14.627   0.973
  362    H    THR  45           HN       THR  45 -19.827 -12.800   2.314
  363    HA   THR  45           HA       THR  45 -19.423 -10.454   3.821
  364    HB   THR  45           HB       THR  45 -21.017 -11.609   5.376
  365    HG1  THR  45           HG1      THR  45 -21.513 -13.863   4.706
  366   1HG2  THR  45          1HG2      THR  45 -21.620 -10.867   2.792
  367   2HG2  THR  45          2HG2      THR  45 -22.022 -12.601   2.737
  368   3HG2  THR  45          3HG2      THR  45 -22.820 -11.540   3.922
  369    H    LEU  46           HN       LEU  46 -18.990 -10.579   6.288
  370    HA   LEU  46           HA       LEU  46 -16.325 -11.111   6.638
  371   1HB   LEU  46          2HB       LEU  46 -18.164  -9.804   8.025
  372   2HB   LEU  46          3HB       LEU  46 -18.186 -11.284   8.963
  373    HG   LEU  46           HG       LEU  46 -15.908 -11.048   9.599
  374   1HD1  LEU  46          1HD1      LEU  46 -15.768  -9.107   7.327
  375   2HD1  LEU  46          2HD1      LEU  46 -14.668  -8.901   8.711
  376   3HD1  LEU  46          3HD1      LEU  46 -14.658 -10.420   7.784
  377   1HD2  LEU  46          1HD2      LEU  46 -15.928  -9.030  10.861
  378   2HD2  LEU  46          2HD2      LEU  46 -17.044  -8.247   9.717
  379   3HD2  LEU  46          3HD2      LEU  46 -17.612  -9.591  10.736
  380    H    ASP  47           HN       ASP  47 -19.046 -13.073   8.048
  381    HA   ASP  47           HA       ASP  47 -17.625 -15.100   9.012
  382   1HB   ASP  47          2HB       ASP  47 -20.305 -14.624   8.452
  383   2HB   ASP  47          3HB       ASP  47 -19.978 -16.012   7.434
  384    H    GLU  48           HN       GLU  48 -18.897 -14.782   5.613
  385    HA   GLU  48           HA       GLU  48 -17.949 -17.154   4.650
  386   1HB   GLU  48          2HB       GLU  48 -19.018 -14.672   3.581
  387   2HB   GLU  48          3HB       GLU  48 -17.720 -15.238   2.548
  388   1HG   GLU  48          2HG       GLU  48 -18.973 -17.606   2.901
  389   2HG   GLU  48          3HG       GLU  48 -20.348 -16.560   3.196
  390    H    LEU  49           HN       LEU  49 -16.324 -13.927   4.826
  391    HA   LEU  49           HA       LEU  49 -13.999 -14.706   3.484
  392   1HB   LEU  49          2HB       LEU  49 -15.043 -12.381   4.391
  393   2HB   LEU  49          3HB       LEU  49 -13.802 -12.651   5.600
  394    HG   LEU  49           HG       LEU  49 -12.324 -13.088   3.394
  395   1HD1  LEU  49          1HD1      LEU  49 -14.325 -12.661   1.934
  396   2HD1  LEU  49          2HD1      LEU  49 -14.272 -10.965   2.471
  397   3HD1  LEU  49          3HD1      LEU  49 -12.898 -11.659   1.578
  398   1HD2  LEU  49          1HD2      LEU  49 -12.506 -11.145   5.363
  399   2HD2  LEU  49          2HD2      LEU  49 -11.202 -11.325   4.165
  400   3HD2  LEU  49          3HD2      LEU  49 -12.557 -10.217   3.845
  401    H    PHE  50           HN       PHE  50 -14.877 -14.662   6.995
  402    HA   PHE  50           HA       PHE  50 -12.428 -15.471   7.969
  403   1HB   PHE  50          2HB       PHE  50 -14.570 -14.676   9.176
  404   2HB   PHE  50          3HB       PHE  50 -15.257 -16.261   8.885
  405    HD1  PHE  50           HD1      PHE  50 -11.863 -15.214  10.042
  406    HD2  PHE  50           HD2      PHE  50 -15.423 -17.355  10.909
  407    HE1  PHE  50           HE1      PHE  50 -10.840 -16.050  12.176
  408    HE2  PHE  50           HE2      PHE  50 -14.400 -18.191  13.043
  409    HZ   PHE  50           HZ       PHE  50 -12.121 -17.528  13.651
  410    H    GLU  51           HN       GLU  51 -15.305 -17.501   7.062
  411    HA   GLU  51           HA       GLU  51 -14.057 -19.902   7.659
  412   1HB   GLU  51          2HB       GLU  51 -16.532 -18.995   6.346
  413   2HB   GLU  51          3HB       GLU  51 -15.920 -20.479   5.643
  414   1HG   GLU  51          2HG       GLU  51 -17.043 -21.469   7.382
  415   2HG   GLU  51          3HG       GLU  51 -15.594 -21.079   8.288
  416    H    GLU  52           HN       GLU  52 -14.302 -17.986   4.610
  417    HA   GLU  52           HA       GLU  52 -13.159 -19.886   2.965
  418   1HB   GLU  52          2HB       GLU  52 -14.377 -17.751   2.294
  419   2HB   GLU  52          3HB       GLU  52 -12.917 -16.861   2.679
  420   1HG   GLU  52          2HG       GLU  52 -11.641 -18.065   0.981
  421   2HG   GLU  52          3HG       GLU  52 -12.955 -19.193   0.712
  422    H    LEU  53           HN       LEU  53 -11.644 -17.044   4.656
  423    HA   LEU  53           HA       LEU  53  -9.059 -17.484   3.817
  424   1HB   LEU  53          2HB       LEU  53 -10.014 -16.369   6.458
  425   2HB   LEU  53          3HB       LEU  53  -8.409 -16.174   5.783
  426    HG   LEU  53           HG       LEU  53 -10.727 -15.263   4.131
  427   1HD1  LEU  53          1HD1      LEU  53  -9.675 -13.673   6.487
  428   2HD1  LEU  53          2HD1      LEU  53 -10.854 -13.122   5.273
  429   3HD1  LEU  53          3HD1      LEU  53 -11.275 -14.446   6.386
  430   1HD2  LEU  53          1HD2      LEU  53  -8.107 -15.216   3.660
  431   2HD2  LEU  53          2HD2      LEU  53  -9.205 -13.942   3.078
  432   3HD2  LEU  53          3HD2      LEU  53  -8.238 -13.680   4.549
  433    H    ASP  54           HN       ASP  54 -10.643 -18.640   6.878
  434    HA   ASP  54           HA       ASP  54  -8.418 -20.200   7.558
  435   1HB   ASP  54          2HB       ASP  54 -10.114 -19.372   9.193
  436   2HB   ASP  54          3HB       ASP  54 -11.336 -20.383   8.448
  437    H    LYS  55           HN       LYS  55  -7.854 -21.822   6.047
  438    HA   LYS  55           HA       LYS  55 -10.032 -23.600   5.196
  439   1HB   LYS  55          2HB       LYS  55  -7.752 -22.383   3.769
  440   2HB   LYS  55          3HB       LYS  55  -7.963 -24.095   3.466
  441   1HG   LYS  55          2HG       LYS  55 -10.153 -23.812   2.595
  442   2HG   LYS  55          3HG       LYS  55 -10.377 -22.264   3.386
  443   1HD   LYS  55          2HD       LYS  55 -10.007 -21.694   1.107
  444   2HD   LYS  55          3HD       LYS  55  -8.465 -21.378   1.877
  445   1HE   LYS  55          2HE       LYS  55  -7.696 -23.693   1.169
  446   2HE   LYS  55          3HE       LYS  55  -9.205 -23.890   0.301
  447   1HZ   LYS  55          1HZ       LYS  55  -8.611 -22.324  -1.219
  448   2HZ   LYS  55          2HZ       LYS  55  -7.595 -21.525  -0.220
  449   3HZ   LYS  55          3HZ       LYS  55  -7.140 -22.948  -0.881
  450    H    ASN  56           HN       ASN  56  -7.149 -23.230   7.087
  451    HA   ASN  56           HA       ASN  56  -6.265 -25.881   6.914
  452   1HB   ASN  56          2HB       ASN  56  -5.897 -23.937   9.250
  453   2HB   ASN  56          3HB       ASN  56  -4.868 -25.302   8.863
  454   1HD2  ASN  56          1HD2      ASN  56  -3.978 -25.299   6.583
  455   2HD2  ASN  56          2HD2      ASN  56  -3.349 -23.804   5.975
  456    H    GLY  57           HN       GLY  57  -8.422 -24.003   9.130
  457   1HA   GLY  57          1HA       GLY  57 -10.291 -24.916  10.184
  458   2HA   GLY  57          2HA       GLY  57  -9.590 -26.519  10.077
  459    H    ASP  58           HN       ASP  58  -8.687 -23.279  11.479
  460    HA   ASP  58           HA       ASP  58  -8.177 -24.692  13.964
  461   1HB   ASP  58          2HB       ASP  58  -6.399 -22.424  12.992
  462   2HB   ASP  58          3HB       ASP  58  -6.096 -23.531  14.316
  463    H    GLY  59           HN       GLY  59  -8.365 -21.481  12.255
  464   1HA   GLY  59          1HA       GLY  59 -10.304 -20.105  12.969
  465   2HA   GLY  59          2HA       GLY  59  -9.778 -20.390  14.616
  466    H    GLU  60           HN       GLU  60  -6.980 -20.289  12.736
  467    HA   GLU  60           HA       GLU  60  -6.678 -17.457  13.356
  468   1HB   GLU  60          2HB       GLU  60  -4.254 -17.906  13.528
  469   2HB   GLU  60          3HB       GLU  60  -5.159 -18.930  14.625
  470   1HG   GLU  60          2HG       GLU  60  -5.092 -20.762  12.848
  471   2HG   GLU  60          3HG       GLU  60  -4.027 -19.738  11.906
  472    H    VAL  61           HN       VAL  61  -6.438 -16.049  11.666
  473    HA   VAL  61           HA       VAL  61  -6.056 -17.239   9.026
  474    HB   VAL  61           HB       VAL  61  -7.149 -14.606  10.011
  475   1HG1  VAL  61          1HG1      VAL  61  -6.130 -15.364   7.312
  476   2HG1  VAL  61          2HG1      VAL  61  -7.663 -14.462   7.384
  477   3HG1  VAL  61          3HG1      VAL  61  -6.191 -13.775   8.113
  478   1HG2  VAL  61          1HG2      VAL  61  -8.477 -16.874   9.918
  479   2HG2  VAL  61          2HG2      VAL  61  -9.232 -15.363   9.356
  480   3HG2  VAL  61          3HG2      VAL  61  -8.565 -16.517   8.176
  481    H    SER  62           HN       SER  62  -3.720 -17.515  10.180
  482    HA   SER  62           HA       SER  62  -2.079 -15.394  10.529
  483   1HB   SER  62          2HB       SER  62  -0.661 -17.533   9.144
  484   2HB   SER  62          3HB       SER  62  -0.541 -17.030  10.819
  485    HG   SER  62           HG       SER  62  -2.277 -18.987   9.638
  486    H    PHE  63           HN       PHE  63  -0.155 -14.738   9.030
  487    HA   PHE  63           HA       PHE  63  -1.085 -13.428   6.839
  488   1HB   PHE  63          2HB       PHE  63   1.168 -13.294   8.117
  489   2HB   PHE  63          3HB       PHE  63   1.687 -14.707   7.221
  490    HD1  PHE  63           HD1      PHE  63  -0.099 -11.591   6.185
  491    HD2  PHE  63           HD2      PHE  63   3.296 -14.090   5.694
  492    HE1  PHE  63           HE1      PHE  63   0.721 -10.113   4.329
  493    HE2  PHE  63           HE2      PHE  63   4.116 -12.611   3.839
  494    HZ   PHE  63           HZ       PHE  63   2.819 -10.640   3.178
  495    H    GLU  64           HN       GLU  64  -0.033 -16.823   7.112
  496    HA   GLU  64           HA       GLU  64   0.502 -17.377   4.510
  497   1HB   GLU  64          2HB       GLU  64  -0.549 -19.719   5.187
  498   2HB   GLU  64          3HB       GLU  64   0.933 -19.158   5.936
  499   1HG   GLU  64          2HG       GLU  64  -0.041 -19.048   7.987
  500   2HG   GLU  64          3HG       GLU  64  -1.385 -18.104   7.374
  501    H    GLU  65           HN       GLU  65  -2.718 -17.558   6.189
  502    HA   GLU  65           HA       GLU  65  -4.068 -18.215   3.820
  503   1HB   GLU  65          2HB       GLU  65  -5.109 -17.072   6.450
  504   2HB   GLU  65          3HB       GLU  65  -6.124 -17.725   5.181
  505   1HG   GLU  65          2HG       GLU  65  -4.769 -19.907   5.378
  506   2HG   GLU  65          3HG       GLU  65  -4.033 -19.228   6.816
  507    H    PHE  66           HN       PHE  66  -3.089 -15.186   5.385
  508    HA   PHE  66           HA       PHE  66  -4.885 -13.449   4.195
  509   1HB   PHE  66          2HB       PHE  66  -3.014 -13.160   6.023
  510   2HB   PHE  66          3HB       PHE  66  -1.889 -12.994   4.690
  511    HD1  PHE  66           HD1      PHE  66  -4.144 -11.289   6.831
  512    HD2  PHE  66           HD2      PHE  66  -2.395 -11.128   2.968
  513    HE1  PHE  66           HE1      PHE  66  -4.661  -8.837   6.699
  514    HE2  PHE  66           HE2      PHE  66  -2.912  -8.675   2.836
  515    HZ   PHE  66           HZ       PHE  66  -4.039  -7.559   4.703
  516    H    GLN  67           HN       GLN  67  -1.846 -14.918   2.965
  517    HA   GLN  67           HA       GLN  67  -1.545 -13.261   0.778
  518   1HB   GLN  67          2HB       GLN  67  -0.779 -16.201   1.061
  519   2HB   GLN  67          3HB       GLN  67  -0.133 -15.099  -0.138
  520   1HG   GLN  67          2HG       GLN  67   0.416 -13.618   2.051
  521   2HG   GLN  67          3HG       GLN  67   0.371 -15.186   2.832
  522   1HE2  GLN  67          1HE2      GLN  67   2.591 -13.346   2.353
  523   2HE2  GLN  67          2HE2      GLN  67   3.806 -14.220   1.480
  524    H    VAL  68           HN       VAL  68  -4.013 -15.543   1.505
  525    HA   VAL  68           HA       VAL  68  -4.545 -16.357  -1.181
  526    HB   VAL  68           HB       VAL  68  -6.291 -16.476   1.285
  527   1HG1  VAL  68          1HG1      VAL  68  -7.361 -18.378   0.124
  528   2HG1  VAL  68          2HG1      VAL  68  -7.527 -16.857  -0.785
  529   3HG1  VAL  68          3HG1      VAL  68  -6.334 -18.074  -1.298
  530   1HG2  VAL  68          1HG2      VAL  68  -3.819 -17.607   1.102
  531   2HG2  VAL  68          2HG2      VAL  68  -5.165 -18.279   2.053
  532   3HG2  VAL  68          3HG2      VAL  68  -4.832 -18.901   0.419
  533    H    LEU  69           HN       LEU  69  -5.661 -13.802   1.077
  534    HA   LEU  69           HA       LEU  69  -7.763 -12.949  -0.639
  535   1HB   LEU  69          2HB       LEU  69  -7.348 -12.675   1.948
  536   2HB   LEU  69          3HB       LEU  69  -6.529 -11.208   1.452
  537    HG   LEU  69           HG       LEU  69  -8.535 -10.323   0.459
  538   1HD1  LEU  69          1HD1      LEU  69  -9.542 -13.117   0.779
  539   2HD1  LEU  69          2HD1      LEU  69 -10.704 -11.774   0.894
  540   3HD1  LEU  69          3HD1      LEU  69  -9.721 -11.977  -0.577
  541   1HD2  LEU  69          1HD2      LEU  69  -8.138 -10.330   3.023
  542   2HD2  LEU  69          2HD2      LEU  69  -9.724  -9.830   2.387
  543   3HD2  LEU  69          3HD2      LEU  69  -9.512 -11.462   3.065
  544    H    VAL  70           HN       VAL  70  -4.297 -12.250  -0.258
  545    HA   VAL  70           HA       VAL  70  -4.170  -9.825  -1.565
  546    HB   VAL  70           HB       VAL  70  -2.331 -12.139  -1.138
  547   1HG1  VAL  70          1HG1      VAL  70  -1.936  -9.940  -3.145
  548   2HG1  VAL  70          2HG1      VAL  70  -0.540 -10.541  -2.218
  549   3HG1  VAL  70          3HG1      VAL  70  -1.483 -11.659  -3.234
  550   1HG2  VAL  70          1HG2      VAL  70  -2.384 -10.767   0.731
  551   2HG2  VAL  70          2HG2      VAL  70  -0.986 -10.116  -0.158
  552   3HG2  VAL  70          3HG2      VAL  70  -2.556  -9.280  -0.232
  553    H    LYS  71           HN       LYS  71  -4.974 -13.016  -2.766
  554    HA   LYS  71           HA       LYS  71  -4.232 -12.545  -5.460
  555   1HB   LYS  71          2HB       LYS  71  -4.886 -14.745  -4.007
  556   2HB   LYS  71          3HB       LYS  71  -6.397 -14.480  -4.854
  557   1HG   LYS  71          2HG       LYS  71  -4.302 -14.082  -6.773
  558   2HG   LYS  71          3HG       LYS  71  -3.902 -15.541  -5.889
  559   1HD   LYS  71          2HD       LYS  71  -6.773 -15.345  -6.631
  560   2HD   LYS  71          3HD       LYS  71  -5.692 -15.397  -8.009
  561   1HE   LYS  71          2HE       LYS  71  -4.584 -17.446  -6.997
  562   2HE   LYS  71          3HE       LYS  71  -5.785 -17.421  -5.722
  563   1HZ   LYS  71          1HZ       LYS  71  -6.405 -18.877  -7.524
  564   2HZ   LYS  71          2HZ       LYS  71  -7.489 -17.664  -7.383
  565   3HZ   LYS  71          3HZ       LYS  71  -6.389 -17.640  -8.590
  566    H    LYS  72           HN       LYS  72  -7.331 -12.307  -3.602
  567    HA   LYS  72           HA       LYS  72  -8.789 -11.406  -5.857
  568   1HB   LYS  72          2HB       LYS  72  -9.393 -11.285  -2.888
  569   2HB   LYS  72          3HB       LYS  72 -10.534 -10.888  -4.156
  570   1HG   LYS  72          2HG       LYS  72 -11.062 -13.135  -3.809
  571   2HG   LYS  72          3HG       LYS  72  -9.895 -13.285  -5.108
  572   1HD   LYS  72          2HD       LYS  72  -8.203 -14.090  -3.696
  573   2HD   LYS  72          3HD       LYS  72  -8.848 -13.285  -2.280
  574   1HE   LYS  72          2HE       LYS  72  -9.746 -15.292  -1.694
  575   2HE   LYS  72          3HE       LYS  72 -10.913 -15.043  -2.977
  576   1HZ   LYS  72          1HZ       LYS  72  -9.219 -17.075  -2.883
  577   2HZ   LYS  72          2HZ       LYS  72  -9.889 -16.523  -4.266
  578   3HZ   LYS  72          3HZ       LYS  72  -8.380 -16.059  -3.849
  579    H    ILE  73           HN       ILE  73  -6.835  -9.868  -3.306
  580    HA   ILE  73           HA       ILE  73  -7.783  -7.244  -3.900
  581    HB   ILE  73           HB       ILE  73  -5.600  -8.416  -2.212
  582   1HG1  ILE  73          2HG1      ILE  73  -7.855  -6.575  -1.408
  583   2HG1  ILE  73          3HG1      ILE  73  -8.088  -8.306  -1.558
  584   1HG2  ILE  73          1HG2      ILE  73  -6.041  -5.456  -2.693
  585   2HG2  ILE  73          2HG2      ILE  73  -4.936  -6.182  -1.501
  586   3HG2  ILE  73          3HG2      ILE  73  -4.641  -6.407  -3.242
  587   1HD1  ILE  73          1HD1      ILE  73  -5.752  -7.259   0.059
  588   2HD1  ILE  73          2HD1      ILE  73  -7.383  -7.294   0.771
  589   3HD1  ILE  73          3HD1      ILE  73  -6.621  -8.804   0.216
  590    H    SER  74           HN       SER  74  -5.836  -9.467  -5.566
  591    HA   SER  74           HA       SER  74  -4.094  -7.446  -6.640
  592   1HB   SER  74          2HB       SER  74  -3.205  -9.708  -6.157
  593   2HB   SER  74          3HB       SER  74  -4.366 -10.421  -7.258
  594    HG   SER  74           HG       SER  74  -3.301  -9.577  -9.020
  595    H    GLN  75           HN       GLN  75  -6.773  -9.650  -7.670
  596    HA   GLN  75           HA       GLN  75  -6.753  -8.733 -10.322
  597   1HB   GLN  75          2HB       GLN  75  -7.941 -10.826  -8.933
  598   2HB   GLN  75          3HB       GLN  75  -9.318  -9.809  -9.306
  599   1HG   GLN  75          2HG       GLN  75  -9.080 -10.074 -11.614
  600   2HG   GLN  75          3HG       GLN  75  -7.344 -10.296 -11.523
  601   1HE2  GLN  75          1HE2      GLN  75  -6.797 -12.273  -9.976
  602   2HE2  GLN  75          2HE2      GLN  75  -7.579 -13.758 -10.405
  Start of MODEL   16
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   2.417  -1.019  -1.420
    3   1HB   LYS   1          2HB       LYS   1   0.604   1.280  -2.172
    4   2HB   LYS   1          3HB       LYS   1   1.770   0.607  -3.293
    5   1HG   LYS   1          2HG       LYS   1   0.728  -1.565  -3.248
    6   2HG   LYS   1          3HG       LYS   1  -0.213  -1.173  -1.823
    7   1HD   LYS   1          2HD       LYS   1  -0.668   0.681  -4.101
    8   2HD   LYS   1          3HD       LYS   1  -1.121  -0.977  -4.442
    9   1HE   LYS   1          2HE       LYS   1  -2.852  -0.973  -2.905
   10   2HE   LYS   1          3HE       LYS   1  -1.991   0.049  -1.771
   11   1HZ   LYS   1          1HZ       LYS   1  -3.282   0.938  -4.256
   12   2HZ   LYS   1          2HZ       LYS   1  -3.790   1.243  -2.734
   13   3HZ   LYS   1          3HZ       LYS   1  -2.401   1.907  -3.279
   14    H    SER   2           HN       SER   2   2.099   2.571  -0.920
   15    HA   SER   2           HA       SER   2   4.860   2.870  -1.504
   16   1HB   SER   2          2HB       SER   2   2.523   4.555  -1.309
   17   2HB   SER   2          3HB       SER   2   3.777   5.243  -0.297
   18    HG   SER   2           HG       SER   2   3.971   4.581  -3.109
   19    HA   PRO   3           HA       PRO   3   6.389   2.955   2.573
   20   1HB   PRO   3          2HB       PRO   3   8.228   4.976   2.595
   21   2HB   PRO   3          3HB       PRO   3   8.546   3.399   1.900
   22   1HG   PRO   3          2HG       PRO   3   7.992   5.954   0.521
   23   2HG   PRO   3          3HG       PRO   3   8.718   4.494  -0.122
   24   1HD   PRO   3          2HD       PRO   3   6.029   5.403  -0.541
   25   2HD   PRO   3          3HD       PRO   3   6.721   3.888  -1.086
   26    H    GLU   4           HN       GLU   4   5.895   6.342   1.679
   27    HA   GLU   4           HA       GLU   4   5.476   7.194   4.254
   28   1HB   GLU   4          2HB       GLU   4   5.500   8.336   1.707
   29   2HB   GLU   4          3HB       GLU   4   3.851   8.608   2.234
   30   1HG   GLU   4          2HG       GLU   4   5.905   9.156   4.319
   31   2HG   GLU   4          3HG       GLU   4   6.008  10.202   2.917
   32    H    GLU   5           HN       GLU   5   3.254   5.694   1.882
   33    HA   GLU   5           HA       GLU   5   0.921   6.293   3.305
   34   1HB   GLU   5          2HB       GLU   5   1.703   4.685   0.955
   35   2HB   GLU   5          3HB       GLU   5   0.372   3.973   1.845
   36   1HG   GLU   5          2HG       GLU   5  -0.388   6.630   1.814
   37   2HG   GLU   5          3HG       GLU   5   0.467   6.514   0.289
   38    H    LEU   6           HN       LEU   6   3.348   3.687   3.471
   39    HA   LEU   6           HA       LEU   6   1.832   1.856   4.940
   40   1HB   LEU   6          2HB       LEU   6   4.746   2.348   4.478
   41   2HB   LEU   6          3HB       LEU   6   4.258   1.203   5.711
   42    HG   LEU   6           HG       LEU   6   3.227   1.003   2.880
   43   1HD1  LEU   6          1HD1      LEU   6   5.704   1.056   2.828
   44   2HD1  LEU   6          2HD1      LEU   6   5.731  -0.328   3.947
   45   3HD1  LEU   6          3HD1      LEU   6   5.023  -0.510   2.324
   46   1HD2  LEU   6          1HD2      LEU   6   3.625  -1.164   4.953
   47   2HD2  LEU   6          2HD2      LEU   6   2.111  -0.248   4.761
   48   3HD2  LEU   6          3HD2      LEU   6   2.718  -1.253   3.423
   49    H    LYS   7           HN       LYS   7   3.908   4.639   5.910
   50    HA   LYS   7           HA       LYS   7   3.835   4.169   8.645
   51   1HB   LYS   7          2HB       LYS   7   5.097   5.930   7.043
   52   2HB   LYS   7          3HB       LYS   7   3.839   6.981   7.663
   53   1HG   LYS   7          2HG       LYS   7   5.179   5.254   9.705
   54   2HG   LYS   7          3HG       LYS   7   6.200   6.475   8.973
   55   1HD   LYS   7          2HD       LYS   7   5.206   8.125  10.173
   56   2HD   LYS   7          3HD       LYS   7   3.617   7.651   9.607
   57   1HE   LYS   7          2HE       LYS   7   3.181   6.336  11.473
   58   2HE   LYS   7          3HE       LYS   7   4.857   5.867  11.675
   59   1HZ   LYS   7          1HZ       LYS   7   5.120   7.499  13.107
   60   2HZ   LYS   7          2HZ       LYS   7   4.581   8.629  12.058
   61   3HZ   LYS   7          3HZ       LYS   7   3.525   7.840  13.022
   62    H    GLY   8           HN       GLY   8   1.734   6.362   6.644
   63   1HA   GLY   8          1HA       GLY   8  -0.002   7.109   8.679
   64   2HA   GLY   8          2HA       GLY   8  -0.370   7.079   6.966
   65    H    ILE   9           HN       ILE   9  -0.277   4.393   6.274
   66    HA   ILE   9           HA       ILE   9  -2.739   3.472   7.097
   67    HB   ILE   9           HB       ILE   9  -0.418   2.409   5.614
   68   1HG1  ILE   9          2HG1      ILE   9  -3.404   2.392   5.085
   69   2HG1  ILE   9          3HG1      ILE   9  -2.292   3.641   4.560
   70   1HG2  ILE   9          1HG2      ILE   9  -1.655   0.152   5.467
   71   2HG2  ILE   9          2HG2      ILE   9  -0.631   0.470   6.888
   72   3HG2  ILE   9          3HG2      ILE   9  -2.400   0.625   7.012
   73   1HD1  ILE   9          1HD1      ILE   9  -2.497   2.196   2.678
   74   2HD1  ILE   9          2HD1      ILE   9  -0.944   1.737   3.416
   75   3HD1  ILE   9          3HD1      ILE   9  -2.389   0.732   3.685
   76    H    PHE  10           HN       PHE  10   0.562   2.470   8.223
   77    HA   PHE  10           HA       PHE  10  -0.211   0.565  10.020
   78   1HB   PHE  10          2HB       PHE  10   2.129   0.887   9.627
   79   2HB   PHE  10          3HB       PHE  10   2.004   2.630   9.754
   80    HD1  PHE  10           HD1      PHE  10   2.489  -0.478  11.576
   81    HD2  PHE  10           HD2      PHE  10   1.951   3.713  11.965
   82    HE1  PHE  10           HE1      PHE  10   3.316  -0.591  13.943
   83    HE2  PHE  10           HE2      PHE  10   2.778   3.600  14.332
   84    HZ   PHE  10           HZ       PHE  10   3.451   1.449  15.293
   85    H    GLU  11           HN       GLU  11   0.320   4.104  10.684
   86    HA   GLU  11           HA       GLU  11  -0.469   3.929  13.332
   87   1HB   GLU  11          2HB       GLU  11   0.302   5.986  11.441
   88   2HB   GLU  11          3HB       GLU  11  -1.086   6.546  12.353
   89   1HG   GLU  11          2HG       GLU  11   0.229   5.651  14.457
   90   2HG   GLU  11          3HG       GLU  11   1.627   5.674  13.400
   91    H    LYS  12           HN       LYS  12  -2.291   4.574  10.296
   92    HA   LYS  12           HA       LYS  12  -4.675   5.403  11.393
   93   1HB   LYS  12          2HB       LYS  12  -3.900   5.292   8.943
   94   2HB   LYS  12          3HB       LYS  12  -4.467   3.634   8.953
   95   1HG   LYS  12          2HG       LYS  12  -6.540   5.191  10.163
   96   2HG   LYS  12          3HG       LYS  12  -6.016   6.089   8.753
   97   1HD   LYS  12          2HD       LYS  12  -6.532   4.303   7.261
   98   2HD   LYS  12          3HD       LYS  12  -6.534   3.106   8.542
   99   1HE   LYS  12          2HE       LYS  12  -8.515   5.201   9.081
  100   2HE   LYS  12          3HE       LYS  12  -8.780   4.491   7.501
  101   1HZ   LYS  12          1HZ       LYS  12  -9.909   3.239   9.164
  102   2HZ   LYS  12          2HZ       LYS  12  -8.704   2.314   8.565
  103   3HZ   LYS  12          3HZ       LYS  12  -8.543   3.016  10.031
  104    H    TYR  13           HN       TYR  13  -3.135   2.233  11.405
  105    HA   TYR  13           HA       TYR  13  -5.620   0.969  12.261
  106   1HB   TYR  13          2HB       TYR  13  -2.884   0.264  11.196
  107   2HB   TYR  13          3HB       TYR  13  -3.538  -0.890  12.341
  108    HD1  TYR  13           HD1      TYR  13  -3.861   0.536   8.982
  109    HD2  TYR  13           HD2      TYR  13  -5.565  -2.190  11.805
  110    HE1  TYR  13           HE1      TYR  13  -5.230  -0.538   7.129
  111    HE2  TYR  13           HE2      TYR  13  -6.928  -3.255   9.942
  112    HH   TYR  13           HH       TYR  13  -7.551  -3.115   7.865
  113    H    ALA  14           HN       ALA  14  -2.299   1.778  13.412
  114    HA   ALA  14           HA       ALA  14  -2.513   0.447  15.867
  115   1HB   ALA  14          1HB       ALA  14  -0.895   2.963  15.472
  116   2HB   ALA  14          2HB       ALA  14  -0.470   1.472  16.347
  117   3HB   ALA  14          3HB       ALA  14  -0.478   1.487  14.567
  118    H    ALA  15           HN       ALA  15  -3.956   3.377  14.617
  119    HA   ALA  15           HA       ALA  15  -4.407   4.492  17.243
  120   1HB   ALA  15          1HB       ALA  15  -5.808   5.466  14.777
  121   2HB   ALA  15          2HB       ALA  15  -5.060   6.388  16.104
  122   3HB   ALA  15          3HB       ALA  15  -4.038   5.641  14.852
  123    H    LYS  16           HN       LYS  16  -5.893   2.236  15.021
  124    HA   LYS  16           HA       LYS  16  -8.567   2.591  15.602
  125   1HB   LYS  16          2HB       LYS  16  -7.004   0.815  14.130
  126   2HB   LYS  16          3HB       LYS  16  -7.790  -0.211  15.313
  127   1HG   LYS  16          2HG       LYS  16  -9.992   1.012  14.687
  128   2HG   LYS  16          3HG       LYS  16  -9.117   1.674  13.321
  129   1HD   LYS  16          2HD       LYS  16  -8.934  -0.389  12.245
  130   2HD   LYS  16          3HD       LYS  16  -8.926  -1.297  13.744
  131   1HE   LYS  16          2HE       LYS  16 -11.061  -1.797  12.883
  132   2HE   LYS  16          3HE       LYS  16 -11.416  -0.492  13.998
  133   1HZ   LYS  16          1HZ       LYS  16 -10.721   0.317  11.328
  134   2HZ   LYS  16          2HZ       LYS  16 -12.141  -0.478  11.471
  135   3HZ   LYS  16          3HZ       LYS  16 -11.882   0.891  12.323
  136    H    GLU  17           HN       GLU  17  -6.351   0.140  17.127
  137    HA   GLU  17           HA       GLU  17  -7.980   0.480  19.525
  138   1HB   GLU  17          2HB       GLU  17  -6.762  -2.029  18.318
  139   2HB   GLU  17          3HB       GLU  17  -7.233  -1.963  20.005
  140   1HG   GLU  17          2HG       GLU  17  -9.454  -0.884  18.644
  141   2HG   GLU  17          3HG       GLU  17  -8.923  -2.191  17.605
  142    H    GLY  18           HN       GLY  18  -6.894   1.016  21.399
  143   1HA   GLY  18          1HA       GLY  18  -5.194   1.452  22.807
  144   2HA   GLY  18          2HA       GLY  18  -4.229   0.266  21.950
  145    H    ASP  19           HN       ASP  19  -2.690   2.230  22.735
  146    HA   ASP  19           HA       ASP  19  -2.719   4.591  21.352
  147   1HB   ASP  19          2HB       ASP  19  -1.191   3.586  23.322
  148   2HB   ASP  19          3HB       ASP  19  -0.093   3.246  21.999
  149    HA   PRO  20           HA       PRO  20  -1.369   3.244  17.390
  150   1HB   PRO  20          2HB       PRO  20  -0.780   5.659  16.254
  151   2HB   PRO  20          3HB       PRO  20  -2.407   5.016  16.349
  152   1HG   PRO  20          2HG       PRO  20  -1.169   7.171  17.950
  153   2HG   PRO  20          3HG       PRO  20  -2.869   6.807  17.727
  154   1HD   PRO  20          2HD       PRO  20  -1.274   6.211  20.036
  155   2HD   PRO  20          3HD       PRO  20  -2.941   5.745  19.765
  156    H    ASN  21           HN       ASN  21   0.592   4.323  19.763
  157    HA   ASN  21           HA       ASN  21   2.927   4.395  18.088
  158   1HB   ASN  21          2HB       ASN  21   2.492   4.722  21.099
  159   2HB   ASN  21          3HB       ASN  21   4.085   4.754  20.370
  160   1HD2  ASN  21          1HD2      ASN  21   4.399   6.284  18.549
  161   2HD2  ASN  21          2HD2      ASN  21   3.666   7.850  18.644
  162    H    GLN  22           HN       GLN  22   0.959   2.011  19.265
  163    HA   GLN  22           HA       GLN  22   3.126   0.130  19.318
  164   1HB   GLN  22          2HB       GLN  22   2.034  -0.950  21.435
  165   2HB   GLN  22          3HB       GLN  22   3.114   0.413  21.648
  166   1HG   GLN  22          2HG       GLN  22   0.523   1.529  21.195
  167   2HG   GLN  22          3HG       GLN  22   0.285   0.201  22.314
  168   1HE2  GLN  22          1HE2      GLN  22   2.609   2.831  21.688
  169   2HE2  GLN  22          2HE2      GLN  22   2.815   3.338  23.331
  170    H    LEU  23           HN       LEU  23   2.537  -1.726  18.235
  171    HA   LEU  23           HA       LEU  23  -0.254  -1.890  17.429
  172   1HB   LEU  23          2HB       LEU  23   2.325  -3.029  16.399
  173   2HB   LEU  23          3HB       LEU  23   0.789  -3.727  15.924
  174    HG   LEU  23           HG       LEU  23   1.921  -1.934  14.423
  175   1HD1  LEU  23          1HD1      LEU  23  -0.987  -1.409  15.001
  176   2HD1  LEU  23          2HD1      LEU  23  -0.130  -1.437  13.441
  177   3HD1  LEU  23          3HD1      LEU  23  -0.445  -2.958  14.311
  178   1HD2  LEU  23          1HD2      LEU  23   2.364  -0.238  16.057
  179   2HD2  LEU  23          2HD2      LEU  23   1.138   0.383  14.925
  180   3HD2  LEU  23          3HD2      LEU  23   0.652  -0.182  16.542
  181    H    SER  24           HN       SER  24  -1.523  -3.798  17.707
  182    HA   SER  24           HA       SER  24  -0.433  -5.540  19.778
  183   1HB   SER  24          2HB       SER  24  -3.231  -4.422  19.397
  184   2HB   SER  24          3HB       SER  24  -2.958  -5.860  20.360
  185    HG   SER  24           HG       SER  24  -1.206  -4.353  21.421
  186    H    LYS  25           HN       LYS  25  -1.535  -7.790  19.783
  187    HA   LYS  25           HA       LYS  25  -1.189  -8.988  17.320
  188   1HB   LYS  25          2HB       LYS  25  -1.025 -10.154  19.469
  189   2HB   LYS  25          3HB       LYS  25  -2.745  -9.953  19.738
  190   1HG   LYS  25          2HG       LYS  25  -2.801 -11.107  17.254
  191   2HG   LYS  25          3HG       LYS  25  -1.317 -11.807  17.869
  192   1HD   LYS  25          2HD       LYS  25  -3.339 -11.901  19.954
  193   2HD   LYS  25          3HD       LYS  25  -4.008 -12.578  18.482
  194   1HE   LYS  25          2HE       LYS  25  -2.313 -14.257  18.335
  195   2HE   LYS  25          3HE       LYS  25  -1.239 -13.402  19.423
  196   1HZ   LYS  25          1HZ       LYS  25  -3.830 -14.212  20.441
  197   2HZ   LYS  25          2HZ       LYS  25  -2.694 -15.367  20.242
  198   3HZ   LYS  25          3HZ       LYS  25  -2.400 -14.093  21.221
  199    H    GLU  26           HN       GLU  26  -4.325  -8.351  19.053
  200    HA   GLU  26           HA       GLU  26  -5.927  -9.133  16.984
  201   1HB   GLU  26          2HB       GLU  26  -6.224  -7.853  19.529
  202   2HB   GLU  26          3HB       GLU  26  -7.150  -6.909  18.379
  203   1HG   GLU  26          2HG       GLU  26  -7.778  -9.529  17.644
  204   2HG   GLU  26          3HG       GLU  26  -7.635  -9.653  19.387
  205    H    GLU  27           HN       GLU  27  -4.338  -5.975  17.621
  206    HA   GLU  27           HA       GLU  27  -5.722  -4.551  15.683
  207   1HB   GLU  27          2HB       GLU  27  -3.401  -4.165  17.429
  208   2HB   GLU  27          3HB       GLU  27  -3.147  -3.409  15.868
  209   1HG   GLU  27          2HG       GLU  27  -5.854  -2.837  16.640
  210   2HG   GLU  27          3HG       GLU  27  -4.850  -2.534  18.044
  211    H    LEU  28           HN       LEU  28  -2.443  -6.123  15.584
  212    HA   LEU  28           HA       LEU  28  -1.878  -5.528  12.949
  213   1HB   LEU  28          2HB       LEU  28  -0.544  -6.664  14.948
  214   2HB   LEU  28          3HB       LEU  28  -1.005  -8.131  14.107
  215    HG   LEU  28           HG       LEU  28   0.260  -7.620  12.217
  216   1HD1  LEU  28          1HD1      LEU  28   0.113  -4.752  13.130
  217   2HD1  LEU  28          2HD1      LEU  28   1.318  -5.293  11.938
  218   3HD1  LEU  28          3HD1      LEU  28  -0.419  -5.474  11.593
  219   1HD2  LEU  28          1HD2      LEU  28   2.500  -7.121  13.012
  220   2HD2  LEU  28          2HD2      LEU  28   1.840  -6.434  14.516
  221   3HD2  LEU  28          3HD2      LEU  28   1.650  -8.170  14.173
  222    H    LYS  29           HN       LYS  29  -3.798  -8.205  14.390
  223    HA   LYS  29           HA       LYS  29  -4.082  -9.833  12.235
  224   1HB   LYS  29          2HB       LYS  29  -4.959 -10.321  14.461
  225   2HB   LYS  29          3HB       LYS  29  -6.163  -9.058  14.300
  226   1HG   LYS  29          2HG       LYS  29  -7.363 -10.237  12.609
  227   2HG   LYS  29          3HG       LYS  29  -6.001 -11.272  12.230
  228   1HD   LYS  29          2HD       LYS  29  -6.833 -12.823  13.656
  229   2HD   LYS  29          3HD       LYS  29  -6.518 -11.726  14.985
  230   1HE   LYS  29          2HE       LYS  29  -9.074 -11.723  13.307
  231   2HE   LYS  29          3HE       LYS  29  -8.918 -12.482  14.880
  232   1HZ   LYS  29          1HZ       LYS  29  -9.429 -10.522  15.709
  233   2HZ   LYS  29          2HZ       LYS  29  -7.985  -9.944  15.211
  234   3HZ   LYS  29          3HZ       LYS  29  -9.306  -9.766  14.267
  235    H    LEU  30           HN       LEU  30  -6.213  -6.998  13.040
  236    HA   LEU  30           HA       LEU  30  -7.749  -7.124  10.756
  237   1HB   LEU  30          2HB       LEU  30  -6.920  -4.683  12.331
  238   2HB   LEU  30          3HB       LEU  30  -8.268  -4.776  11.214
  239    HG   LEU  30           HG       LEU  30  -8.002  -5.850  13.983
  240   1HD1  LEU  30          1HD1      LEU  30  -9.234  -3.769  13.482
  241   2HD1  LEU  30          2HD1      LEU  30 -10.352  -4.698  12.455
  242   3HD1  LEU  30          3HD1      LEU  30 -10.267  -5.027  14.202
  243   1HD2  LEU  30          1HD2      LEU  30  -9.746  -7.166  11.882
  244   2HD2  LEU  30          2HD2      LEU  30  -8.368  -7.901  12.735
  245   3HD2  LEU  30          3HD2      LEU  30  -9.837  -7.455  13.636
  246    H    LEU  31           HN       LEU  31  -4.789  -5.098  11.353
  247    HA   LEU  31           HA       LEU  31  -4.603  -3.986   8.867
  248   1HB   LEU  31          2HB       LEU  31  -3.232  -3.677  11.047
  249   2HB   LEU  31          3HB       LEU  31  -2.178  -4.906  10.377
  250    HG   LEU  31           HG       LEU  31  -2.793  -2.729   8.494
  251   1HD1  LEU  31          1HD1      LEU  31  -0.787  -1.665  10.245
  252   2HD1  LEU  31          2HD1      LEU  31  -2.327  -0.942   9.719
  253   3HD1  LEU  31          3HD1      LEU  31  -2.276  -1.971  11.172
  254   1HD2  LEU  31          1HD2      LEU  31  -0.768  -3.240   7.668
  255   2HD2  LEU  31          2HD2      LEU  31  -0.009  -3.310   9.277
  256   3HD2  LEU  31          3HD2      LEU  31  -0.930  -4.706   8.665
  257    H    LEU  32           HN       LEU  32  -2.752  -6.933   9.932
  258    HA   LEU  32           HA       LEU  32  -1.807  -7.642   7.479
  259   1HB   LEU  32          2HB       LEU  32  -2.722  -9.519   9.662
  260   2HB   LEU  32          3HB       LEU  32  -1.583  -9.885   8.382
  261    HG   LEU  32           HG       LEU  32  -1.094  -7.716  10.434
  262   1HD1  LEU  32          1HD1      LEU  32  -1.259  -9.615  11.786
  263   2HD1  LEU  32          2HD1      LEU  32  -0.502 -10.669  10.568
  264   3HD1  LEU  32          3HD1      LEU  32   0.482  -9.474  11.446
  265   1HD2  LEU  32          1HD2      LEU  32   0.858  -7.344   9.420
  266   2HD2  LEU  32          2HD2      LEU  32   1.199  -9.081   9.235
  267   3HD2  LEU  32          3HD2      LEU  32   0.177  -8.243   8.043
  268    H    GLN  33           HN       GLN  33  -5.107  -7.719   8.659
  269    HA   GLN  33           HA       GLN  33  -6.032  -9.697   6.909
  270   1HB   GLN  33          2HB       GLN  33  -7.082  -8.261   9.034
  271   2HB   GLN  33          3HB       GLN  33  -7.959  -7.577   7.681
  272   1HG   GLN  33          2HG       GLN  33  -9.046  -9.570   7.183
  273   2HG   GLN  33          3HG       GLN  33  -7.702 -10.565   7.707
  274   1HE2  GLN  33          1HE2      GLN  33 -10.635 -10.527   8.312
  275   2HE2  GLN  33          2HE2      GLN  33 -10.767 -10.542  10.039
  276    H    THR  34           HN       THR  34  -6.370  -6.070   6.813
  277    HA   THR  34           HA       THR  34  -7.121  -6.228   4.017
  278    HB   THR  34           HB       THR  34  -7.273  -4.305   6.284
  279    HG1  THR  34           HG1      THR  34  -9.306  -4.186   5.283
  280   1HG2  THR  34          1HG2      THR  34  -7.532  -2.358   4.694
  281   2HG2  THR  34          2HG2      THR  34  -5.848  -2.921   4.805
  282   3HG2  THR  34          3HG2      THR  34  -6.844  -3.366   3.399
  283    H    GLU  35           HN       GLU  35  -4.436  -4.833   6.004
  284    HA   GLU  35           HA       GLU  35  -3.025  -3.687   4.026
  285   1HB   GLU  35          2HB       GLU  35  -2.282  -3.461   6.290
  286   2HB   GLU  35          3HB       GLU  35  -2.119  -5.193   6.503
  287   1HG   GLU  35          2HG       GLU  35   0.111  -4.282   6.213
  288   2HG   GLU  35          3HG       GLU  35  -0.277  -5.190   4.766
  289    H    PHE  36           HN       PHE  36  -2.571  -7.117   5.170
  290    HA   PHE  36           HA       PHE  36  -2.062  -7.900   2.436
  291   1HB   PHE  36          2HB       PHE  36  -0.036  -7.501   4.582
  292   2HB   PHE  36          3HB       PHE  36   0.001  -9.136   3.952
  293    HD1  PHE  36           HD1      PHE  36   1.126  -9.599   1.960
  294    HD2  PHE  36           HD2      PHE  36   0.116  -5.580   2.870
  295    HE1  PHE  36           HE1      PHE  36   2.489  -8.814   0.004
  296    HE2  PHE  36           HE2      PHE  36   1.479  -4.794   0.914
  297    HZ   PHE  36           HZ       PHE  36   2.649  -6.421  -0.496
  298    HA   PRO  37           HA       PRO  37  -4.296 -11.039   4.709
  299   1HB   PRO  37          2HB       PRO  37  -6.030 -11.705   2.705
  300   2HB   PRO  37          3HB       PRO  37  -6.384 -10.486   3.912
  301   1HG   PRO  37          2HG       PRO  37  -5.623 -10.122   1.079
  302   2HG   PRO  37          3HG       PRO  37  -6.382  -8.977   2.168
  303   1HD   PRO  37          2HD       PRO  37  -3.631  -9.009   1.355
  304   2HD   PRO  37          3HD       PRO  37  -4.364  -7.937   2.531
  305    H    SER  38           HN       SER  38  -2.079 -11.006   2.342
  306    HA   SER  38           HA       SER  38  -2.368 -13.776   1.665
  307   1HB   SER  38          2HB       SER  38  -1.419 -11.694   0.247
  308   2HB   SER  38          3HB       SER  38   0.096 -12.190   0.975
  309    HG   SER  38           HG       SER  38  -1.624 -14.105  -0.324
  310    H    LEU  39           HN       LEU  39  -0.453 -11.658   3.804
  311    HA   LEU  39           HA       LEU  39   1.538 -13.570   4.410
  312   1HB   LEU  39          2HB       LEU  39   0.930 -10.859   5.010
  313   2HB   LEU  39          3HB       LEU  39   1.154 -11.698   6.532
  314    HG   LEU  39           HG       LEU  39   3.184 -10.571   5.399
  315   1HD1  LEU  39          1HD1      LEU  39   4.682 -12.079   6.439
  316   2HD1  LEU  39          2HD1      LEU  39   3.172 -12.147   7.380
  317   3HD1  LEU  39          3HD1      LEU  39   3.567 -13.451   6.234
  318   1HD2  LEU  39          1HD2      LEU  39   3.469 -13.168   3.916
  319   2HD2  LEU  39          2HD2      LEU  39   2.590 -11.804   3.184
  320   3HD2  LEU  39          3HD2      LEU  39   4.294 -11.612   3.659
  321    H    LEU  40           HN       LEU  40  -1.807 -13.194   5.286
  322    HA   LEU  40           HA       LEU  40  -1.601 -14.505   7.810
  323   1HB   LEU  40          2HB       LEU  40  -3.925 -13.849   6.000
  324   2HB   LEU  40          3HB       LEU  40  -4.100 -14.634   7.557
  325    HG   LEU  40           HG       LEU  40  -2.814 -11.917   7.184
  326   1HD1  LEU  40          1HD1      LEU  40  -5.684 -12.694   7.630
  327   2HD1  LEU  40          2HD1      LEU  40  -5.047 -11.157   8.261
  328   3HD1  LEU  40          3HD1      LEU  40  -4.992 -11.492   6.514
  329   1HD2  LEU  40          1HD2      LEU  40  -2.827 -13.703   9.366
  330   2HD2  LEU  40          2HD2      LEU  40  -2.285 -12.008   9.335
  331   3HD2  LEU  40          3HD2      LEU  40  -3.965 -12.397   9.777
  332    H    LYS  41           HN       LYS  41  -1.882 -15.461   4.416
  333    HA   LYS  41           HA       LYS  41  -2.819 -18.084   4.955
  334   1HB   LYS  41          2HB       LYS  41  -2.838 -18.341   2.693
  335   2HB   LYS  41          3HB       LYS  41  -2.836 -16.591   2.765
  336   1HG   LYS  41          2HG       LYS  41  -1.079 -16.921   1.275
  337   2HG   LYS  41          3HG       LYS  41  -0.184 -16.890   2.781
  338   1HD   LYS  41          2HD       LYS  41   0.086 -19.248   2.828
  339   2HD   LYS  41          3HD       LYS  41  -1.268 -19.527   1.752
  340   1HE   LYS  41          2HE       LYS  41   0.892 -17.875   0.549
  341   2HE   LYS  41          3HE       LYS  41   1.402 -19.494   0.982
  342   1HZ   LYS  41          1HZ       LYS  41  -0.879 -18.790  -0.729
  343   2HZ   LYS  41          2HZ       LYS  41   0.509 -19.516  -1.194
  344   3HZ   LYS  41          3HZ       LYS  41  -0.548 -20.312  -0.237
  345    H    GLY  42           HN       GLY  42   0.373 -16.493   4.723
  346   1HA   GLY  42          1HA       GLY  42   2.126 -18.501   4.380
  347   2HA   GLY  42          2HA       GLY  42   2.365 -17.204   5.535
  348    H    MET  43           HN       MET  43   3.480 -19.732   6.012
  349    HA   MET  43           HA       MET  43   1.743 -21.307   7.577
  350   1HB   MET  43          2HB       MET  43   4.807 -21.181   7.410
  351   2HB   MET  43          3HB       MET  43   3.916 -22.476   8.185
  352   1HG   MET  43          2HG       MET  43   2.955 -23.213   6.099
  353   2HG   MET  43          3HG       MET  43   3.407 -21.734   5.275
  354   1HE   MET  43          1HE       MET  43   5.108 -24.971   4.003
  355   2HE   MET  43          2HE       MET  43   5.055 -25.550   5.685
  356   3HE   MET  43          3HE       MET  43   3.622 -24.780   4.963
  357    H    SER  44           HN       SER  44   3.010 -18.263   8.143
  358    HA   SER  44           HA       SER  44   3.633 -18.738  10.912
  359   1HB   SER  44          2HB       SER  44   3.581 -16.145   9.303
  360   2HB   SER  44          3HB       SER  44   4.187 -16.307  10.940
  361    HG   SER  44           HG       SER  44   5.639 -18.065   9.900
  362    H    THR  45           HN       THR  45   1.734 -19.189  12.052
  363    HA   THR  45           HA       THR  45  -0.741 -17.965  11.471
  364    HB   THR  45           HB       THR  45  -1.375 -19.076  13.643
  365    HG1  THR  45           HG1      THR  45   0.543 -20.202  14.646
  366   1HG2  THR  45          1HG2      THR  45  -1.266 -20.598  11.706
  367   2HG2  THR  45          2HG2      THR  45   0.506 -20.695  11.846
  368   3HG2  THR  45          3HG2      THR  45  -0.527 -21.409  13.108
  369    H    LEU  46           HN       LEU  46  -2.008 -16.747  13.259
  370    HA   LEU  46           HA       LEU  46  -0.943 -14.229  13.463
  371   1HB   LEU  46          2HB       LEU  46  -3.345 -15.250  13.830
  372   2HB   LEU  46          3HB       LEU  46  -2.871 -15.225  15.517
  373    HG   LEU  46           HG       LEU  46  -2.194 -12.679  14.655
  374   1HD1  LEU  46          1HD1      LEU  46  -4.693 -12.167  13.719
  375   2HD1  LEU  46          2HD1      LEU  46  -3.252 -12.375  12.696
  376   3HD1  LEU  46          3HD1      LEU  46  -4.362 -13.742  12.958
  377   1HD2  LEU  46          1HD2      LEU  46  -4.762 -13.599  15.977
  378   2HD2  LEU  46          2HD2      LEU  46  -3.215 -13.271  16.794
  379   3HD2  LEU  46          3HD2      LEU  46  -4.101 -11.946  16.002
  380    H    ASP  47           HN       ASP  47  -1.306 -16.573  16.223
  381    HA   ASP  47           HA       ASP  47   0.036 -15.226  18.077
  382   1HB   ASP  47          2HB       ASP  47  -0.702 -17.951  17.602
  383   2HB   ASP  47          3HB       ASP  47   0.970 -17.986  18.127
  384    H    GLU  48           HN       GLU  48   1.468 -17.531  15.642
  385    HA   GLU  48           HA       GLU  48   4.074 -17.292  16.418
  386   1HB   GLU  48          2HB       GLU  48   2.594 -18.327  14.142
  387   2HB   GLU  48          3HB       GLU  48   4.060 -17.551  13.576
  388   1HG   GLU  48          2HG       GLU  48   5.134 -18.906  15.654
  389   2HG   GLU  48          3HG       GLU  48   3.749 -19.944  15.378
  390    H    LEU  49           HN       LEU  49   2.158 -15.272  14.116
  391    HA   LEU  49           HA       LEU  49   4.328 -13.675  13.315
  392   1HB   LEU  49          2HB       LEU  49   1.768 -14.055  12.498
  393   2HB   LEU  49          3HB       LEU  49   1.618 -12.505  13.302
  394    HG   LEU  49           HG       LEU  49   3.807 -11.994  11.814
  395   1HD1  LEU  49          1HD1      LEU  49   2.210 -13.852  10.039
  396   2HD1  LEU  49          2HD1      LEU  49   3.724 -12.998   9.657
  397   3HD1  LEU  49          3HD1      LEU  49   3.723 -14.316  10.854
  398   1HD2  LEU  49          1HD2      LEU  49   1.696 -11.492  10.036
  399   2HD2  LEU  49          2HD2      LEU  49   0.976 -11.434  11.663
  400   3HD2  LEU  49          3HD2      LEU  49   2.367 -10.396  11.267
  401    H    PHE  50           HN       PHE  50   1.833 -13.358  15.906
  402    HA   PHE  50           HA       PHE  50   2.541 -10.819  16.743
  403   1HB   PHE  50          2HB       PHE  50   0.546 -12.331  17.384
  404   2HB   PHE  50          3HB       PHE  50   1.642 -13.259  18.389
  405    HD1  PHE  50           HD1      PHE  50   1.508  -9.565  17.988
  406    HD2  PHE  50           HD2      PHE  50   0.813 -12.884  20.540
  407    HE1  PHE  50           HE1      PHE  50   1.075  -8.002  19.904
  408    HE2  PHE  50           HE2      PHE  50   0.380 -11.320  22.456
  409    HZ   PHE  50           HZ       PHE  50   0.517  -8.898  22.114
  410    H    GLU  51           HN       GLU  51   3.634 -14.045  18.022
  411    HA   GLU  51           HA       GLU  51   5.420 -12.872  19.828
  412   1HB   GLU  51          2HB       GLU  51   6.189 -15.142  20.235
  413   2HB   GLU  51          3HB       GLU  51   4.448 -15.176  20.038
  414   1HG   GLU  51          2HG       GLU  51   5.153 -16.977  18.685
  415   2HG   GLU  51          3HG       GLU  51   4.934 -15.687  17.519
  416    H    GLU  52           HN       GLU  52   5.717 -14.151  16.478
  417    HA   GLU  52           HA       GLU  52   8.477 -14.094  16.358
  418   1HB   GLU  52          2HB       GLU  52   7.155 -15.266  14.685
  419   2HB   GLU  52          3HB       GLU  52   6.353 -13.786  14.196
  420   1HG   GLU  52          2HG       GLU  52   8.654 -12.867  13.538
  421   2HG   GLU  52          3HG       GLU  52   9.306 -14.467  13.832
  422    H    LEU  53           HN       LEU  53   6.050 -11.638  15.205
  423    HA   LEU  53           HA       LEU  53   7.869  -9.745  14.372
  424   1HB   LEU  53          2HB       LEU  53   5.125  -9.342  15.571
  425   2HB   LEU  53          3HB       LEU  53   6.022  -8.147  14.655
  426    HG   LEU  53           HG       LEU  53   5.456 -10.803  13.385
  427   1HD1  LEU  53          1HD1      LEU  53   3.388  -9.265  14.490
  428   2HD1  LEU  53          2HD1      LEU  53   3.379  -8.897  12.749
  429   3HD1  LEU  53          3HD1      LEU  53   3.249 -10.584  13.302
  430   1HD2  LEU  53          1HD2      LEU  53   6.056  -9.789  11.484
  431   2HD2  LEU  53          2HD2      LEU  53   5.119  -8.321  11.854
  432   3HD2  LEU  53          3HD2      LEU  53   6.748  -8.535  12.540
  433    H    ASP  54           HN       ASP  54   6.290 -10.107  17.620
  434    HA   ASP  54           HA       ASP  54   7.703  -7.968  18.715
  435   1HB   ASP  54          2HB       ASP  54   5.599  -8.927  19.664
  436   2HB   ASP  54          3HB       ASP  54   6.448 -10.409  20.058
  437    H    LYS  55           HN       LYS  55   9.410  -8.183  20.483
  438    HA   LYS  55           HA       LYS  55  10.765 -10.647  20.816
  439   1HB   LYS  55          2HB       LYS  55  11.499 -10.073  18.507
  440   2HB   LYS  55          3HB       LYS  55  12.180  -8.576  19.111
  441   1HG   LYS  55          2HG       LYS  55  14.069  -9.663  19.727
  442   2HG   LYS  55          3HG       LYS  55  13.145 -10.682  20.814
  443   1HD   LYS  55          2HD       LYS  55  12.741 -11.534  18.046
  444   2HD   LYS  55          3HD       LYS  55  14.453 -11.468  18.413
  445   1HE   LYS  55          2HE       LYS  55  13.769 -12.738  20.634
  446   2HE   LYS  55          3HE       LYS  55  12.298 -13.122  19.763
  447   1HZ   LYS  55          1HZ       LYS  55  15.003 -13.672  18.755
  448   2HZ   LYS  55          2HZ       LYS  55  14.040 -14.775  19.478
  449   3HZ   LYS  55          3HZ       LYS  55  13.600 -14.120  18.048
  450    H    ASN  56           HN       ASN  56  10.849  -7.046  20.921
  451    HA   ASN  56           HA       ASN  56  12.734  -6.715  22.825
  452   1HB   ASN  56          2HB       ASN  56  11.234  -4.675  23.526
  453   2HB   ASN  56          3HB       ASN  56  11.828  -4.729  21.878
  454   1HD2  ASN  56          1HD2      ASN  56  10.388  -4.189  20.445
  455   2HD2  ASN  56          2HD2      ASN  56   8.687  -4.511  20.480
  456    H    GLY  57           HN       GLY  57   9.569  -8.198  23.052
  457   1HA   GLY  57          1HA       GLY  57   8.589  -9.312  24.756
  458   2HA   GLY  57          2HA       GLY  57   9.971  -8.959  25.774
  459    H    ASP  58           HN       ASP  58   7.316  -7.082  24.127
  460    HA   ASP  58           HA       ASP  58   6.828  -5.855  26.719
  461   1HB   ASP  58          2HB       ASP  58   6.526  -4.304  24.129
  462   2HB   ASP  58          3HB       ASP  58   6.646  -3.675  25.760
  463    H    GLY  59           HN       GLY  59   5.687  -6.246  23.279
  464   1HA   GLY  59          1HA       GLY  59   3.598  -7.566  23.074
  465   2HA   GLY  59          2HA       GLY  59   2.925  -6.519  24.308
  466    H    GLU  60           HN       GLU  60   5.067  -4.618  22.527
  467    HA   GLU  60           HA       GLU  60   2.847  -3.676  20.895
  468   1HB   GLU  60          2HB       GLU  60   5.358  -2.133  21.666
  469   2HB   GLU  60          3HB       GLU  60   3.901  -1.482  20.940
  470   1HG   GLU  60          2HG       GLU  60   3.193  -1.045  23.056
  471   2HG   GLU  60          3HG       GLU  60   2.915  -2.768  23.216
  472    H    VAL  61           HN       VAL  61   2.962  -3.974  18.711
  473    HA   VAL  61           HA       VAL  61   5.544  -4.811  17.633
  474    HB   VAL  61           HB       VAL  61   2.686  -5.070  16.703
  475   1HG1  VAL  61          1HG1      VAL  61   5.157  -5.092  15.119
  476   2HG1  VAL  61          2HG1      VAL  61   4.195  -6.579  14.946
  477   3HG1  VAL  61          3HG1      VAL  61   3.459  -4.997  14.596
  478   1HG2  VAL  61          1HG2      VAL  61   2.871  -7.332  17.167
  479   2HG2  VAL  61          2HG2      VAL  61   4.646  -7.325  17.043
  480   3HG2  VAL  61          3HG2      VAL  61   3.851  -6.620  18.471
  481    H    SER  62           HN       SER  62   5.726  -2.201  18.241
  482    HA   SER  62           HA       SER  62   4.661  -0.328  16.649
  483   1HB   SER  62          2HB       SER  62   7.509   0.201  16.936
  484   2HB   SER  62          3HB       SER  62   6.156   0.985  17.726
  485    HG   SER  62           HG       SER  62   7.711  -1.256  18.593
  486    H    PHE  63           HN       PHE  63   5.786   0.939  14.788
  487    HA   PHE  63           HA       PHE  63   5.927  -0.596  12.551
  488   1HB   PHE  63          2HB       PHE  63   5.898   2.026  13.069
  489   2HB   PHE  63          3HB       PHE  63   7.645   1.896  13.008
  490    HD1  PHE  63           HD1      PHE  63   4.954   0.373  10.909
  491    HD2  PHE  63           HD2      PHE  63   8.394   2.853  11.051
  492    HE1  PHE  63           HE1      PHE  63   4.884   0.613   8.411
  493    HE2  PHE  63           HE2      PHE  63   8.325   3.093   8.553
  494    HZ   PHE  63           HZ       PHE  63   6.571   1.969   7.263
  495    H    GLU  64           HN       GLU  64   8.491   0.101  14.925
  496    HA   GLU  64           HA       GLU  64  10.696  -0.436  13.443
  497   1HB   GLU  64          2HB       GLU  64  11.549  -1.425  15.754
  498   2HB   GLU  64          3HB       GLU  64  11.190   0.283  15.594
  499   1HG   GLU  64          2HG       GLU  64   9.491   0.158  17.099
  500   2HG   GLU  64          3HG       GLU  64   8.759  -1.198  16.263
  501    H    GLU  65           HN       GLU  65   8.674  -2.806  15.317
  502    HA   GLU  65           HA       GLU  65  10.168  -4.994  14.363
  503   1HB   GLU  65          2HB       GLU  65   7.406  -4.898  15.656
  504   2HB   GLU  65          3HB       GLU  65   8.355  -6.353  15.426
  505   1HG   GLU  65          2HG       GLU  65  10.229  -5.191  16.771
  506   2HG   GLU  65          3HG       GLU  65   9.054  -3.953  17.173
  507    H    PHE  66           HN       PHE  66   7.335  -3.177  13.246
  508    HA   PHE  66           HA       PHE  66   6.201  -5.079  11.581
  509   1HB   PHE  66          2HB       PHE  66   5.408  -2.716  12.308
  510   2HB   PHE  66          3HB       PHE  66   6.537  -2.053  11.144
  511    HD1  PHE  66           HD1      PHE  66   5.829  -1.653   8.970
  512    HD2  PHE  66           HD2      PHE  66   3.653  -4.404  11.359
  513    HE1  PHE  66           HE1      PHE  66   4.082  -1.829   7.176
  514    HE2  PHE  66           HE2      PHE  66   1.907  -4.580   9.565
  515    HZ   PHE  66           HZ       PHE  66   2.142  -3.291   7.495
  516    H    GLN  67           HN       GLN  67   9.003  -2.887  11.116
  517    HA   GLN  67           HA       GLN  67   9.201  -3.175   8.379
  518   1HB   GLN  67          2HB       GLN  67  11.429  -2.745  10.418
  519   2HB   GLN  67          3HB       GLN  67  11.563  -2.439   8.698
  520   1HG   GLN  67          2HG       GLN  67   9.238  -1.040   9.410
  521   2HG   GLN  67          3HG       GLN  67  10.282  -0.803  10.798
  522   1HE2  GLN  67          1HE2      GLN  67   9.536   1.285   9.206
  523   2HE2  GLN  67          2HE2      GLN  67  10.889   1.907   8.322
  524    H    VAL  68           HN       VAL  68   9.595  -5.500  10.875
  525    HA   VAL  68           HA       VAL  68  11.615  -7.058   9.574
  526    HB   VAL  68           HB       VAL  68   9.687  -7.774  11.791
  527   1HG1  VAL  68          1HG1      VAL  68  10.552  -9.821  11.279
  528   2HG1  VAL  68          2HG1      VAL  68  12.020  -9.141  10.537
  529   3HG1  VAL  68          3HG1      VAL  68  11.880  -9.234  12.309
  530   1HG2  VAL  68          1HG2      VAL  68  11.271  -5.703  12.056
  531   2HG2  VAL  68          2HG2      VAL  68  11.152  -6.905  13.363
  532   3HG2  VAL  68          3HG2      VAL  68  12.539  -6.937  12.248
  533    H    LEU  69           HN       LEU  69   8.044  -6.886   9.678
  534    HA   LEU  69           HA       LEU  69   7.733  -9.360   8.275
  535   1HB   LEU  69          2HB       LEU  69   6.137  -8.277   9.944
  536   2HB   LEU  69          3HB       LEU  69   5.680  -7.187   8.649
  537    HG   LEU  69           HG       LEU  69   4.923  -9.084   7.286
  538   1HD1  LEU  69          1HD1      LEU  69   5.985 -10.702   9.590
  539   2HD1  LEU  69          2HD1      LEU  69   4.679 -11.324   8.553
  540   3HD1  LEU  69          3HD1      LEU  69   6.256 -10.905   7.843
  541   1HD2  LEU  69          1HD2      LEU  69   2.899  -8.974   8.215
  542   2HD2  LEU  69          2HD2      LEU  69   3.452  -9.736   9.726
  543   3HD2  LEU  69          3HD2      LEU  69   3.660  -7.985   9.483
  544    H    VAL  70           HN       VAL  70   8.136  -5.924   7.488
  545    HA   VAL  70           HA       VAL  70   7.080  -5.825   4.969
  546    HB   VAL  70           HB       VAL  70   9.308  -4.480   6.415
  547   1HG1  VAL  70          1HG1      VAL  70   9.770  -3.044   4.427
  548   2HG1  VAL  70          2HG1      VAL  70  10.315  -4.727   4.231
  549   3HG1  VAL  70          3HG1      VAL  70   8.822  -4.177   3.434
  550   1HG2  VAL  70          1HG2      VAL  70   7.402  -3.347   6.910
  551   2HG2  VAL  70          2HG2      VAL  70   7.765  -2.522   5.375
  552   3HG2  VAL  70          3HG2      VAL  70   6.581  -3.851   5.413
  553    H    LYS  71           HN       LYS  71   9.897  -7.587   6.151
  554    HA   LYS  71           HA       LYS  71  11.122  -7.901   3.610
  555   1HB   LYS  71          2HB       LYS  71  11.863  -8.308   6.233
  556   2HB   LYS  71          3HB       LYS  71  11.666  -9.949   5.653
  557   1HG   LYS  71          2HG       LYS  71  13.010  -8.883   3.524
  558   2HG   LYS  71          3HG       LYS  71  13.631  -7.853   4.798
  559   1HD   LYS  71          2HD       LYS  71  13.615 -10.596   5.747
  560   2HD   LYS  71          3HD       LYS  71  14.399 -10.548   4.180
  561   1HE   LYS  71          2HE       LYS  71  15.621  -8.397   5.242
  562   2HE   LYS  71          3HE       LYS  71  15.208  -9.189   6.750
  563   1HZ   LYS  71          1HZ       LYS  71  17.186  -9.889   4.880
  564   2HZ   LYS  71          2HZ       LYS  71  16.966 -10.445   6.399
  565   3HZ   LYS  71          3HZ       LYS  71  16.196 -11.160   5.149
  566    H    LYS  72           HN       LYS  72   8.913  -9.914   5.650
  567    HA   LYS  72           HA       LYS  72   8.795 -11.963   3.665
  568   1HB   LYS  72          2HB       LYS  72   7.080 -11.497   6.123
  569   2HB   LYS  72          3HB       LYS  72   7.125 -12.961   5.163
  570   1HG   LYS  72          2HG       LYS  72   8.742 -13.634   6.631
  571   2HG   LYS  72          3HG       LYS  72   9.810 -12.621   5.680
  572   1HD   LYS  72          2HD       LYS  72   9.849 -10.914   7.265
  573   2HD   LYS  72          3HD       LYS  72   8.223 -11.247   7.830
  574   1HE   LYS  72          2HE       LYS  72   9.064 -13.355   8.930
  575   2HE   LYS  72          3HE       LYS  72  10.689 -12.959   8.409
  576   1HZ   LYS  72          1HZ       LYS  72   9.018 -11.287  10.155
  577   2HZ   LYS  72          2HZ       LYS  72  10.275 -12.209  10.638
  578   3HZ   LYS  72          3HZ       LYS  72  10.533 -10.920   9.670
  579    H    ILE  73           HN       ILE  73   7.471  -8.831   3.959
  580    HA   ILE  73           HA       ILE  73   4.928  -9.399   2.797
  581    HB   ILE  73           HB       ILE  73   6.500  -6.926   3.436
  582   1HG1  ILE  73          2HG1      ILE  73   3.764  -7.853   4.353
  583   2HG1  ILE  73          3HG1      ILE  73   5.254  -8.214   5.203
  584   1HG2  ILE  73          1HG2      ILE  73   4.756  -5.524   2.550
  585   2HG2  ILE  73          2HG2      ILE  73   5.378  -6.567   1.248
  586   3HG2  ILE  73          3HG2      ILE  73   3.821  -6.944   2.023
  587   1HD1  ILE  73          1HD1      ILE  73   5.008  -5.351   4.517
  588   2HD1  ILE  73          2HD1      ILE  73   3.699  -5.936   5.571
  589   3HD1  ILE  73          3HD1      ILE  73   5.396  -6.115   6.077
  590    H    SER  74           HN       SER  74   8.078  -8.055   1.612
  591    HA   SER  74           HA       SER  74   7.118  -7.892  -1.033
  592   1HB   SER  74          2HB       SER  74   9.004  -6.519   0.014
  593   2HB   SER  74          3HB       SER  74  10.019  -7.943  -0.101
  594    HG   SER  74           HG       SER  74   8.940  -6.313  -2.195
  595    H    GLN  75           HN       GLN  75   9.113 -10.221   0.866
  596    HA   GLN  75           HA       GLN  75   9.725 -11.822  -1.356
  597   1HB   GLN  75          2HB       GLN  75  10.537 -11.659   1.312
  598   2HB   GLN  75          3HB       GLN  75   9.696 -13.195   1.257
  599   1HG   GLN  75          2HG       GLN  75  11.187 -14.125  -0.300
  600   2HG   GLN  75          3HG       GLN  75  11.624 -12.568  -0.977
  601   1HE2  GLN  75          1HE2      GLN  75  12.487 -11.023   0.892
  602   2HE2  GLN  75          2HE2      GLN  75  13.804 -11.676   1.809
  Start of MODEL   17
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   3.005  -0.537  -1.067
    3   1HB   LYS   1          2HB       LYS   1   0.240  -0.712  -2.132
    4   2HB   LYS   1          3HB       LYS   1   1.480  -0.297  -3.298
    5   1HG   LYS   1          2HG       LYS   1   2.807  -2.285  -2.653
    6   2HG   LYS   1          3HG       LYS   1   1.657  -2.677  -1.391
    7   1HD   LYS   1          2HD       LYS   1  -0.137  -2.966  -3.113
    8   2HD   LYS   1          3HD       LYS   1   1.012  -2.572  -4.376
    9   1HE   LYS   1          2HE       LYS   1   2.231  -4.583  -4.089
   10   2HE   LYS   1          3HE       LYS   1   1.664  -4.814  -2.446
   11   1HZ   LYS   1          1HZ       LYS   1  -0.215  -5.756  -3.165
   12   2HZ   LYS   1          2HZ       LYS   1  -0.381  -4.785  -4.467
   13   3HZ   LYS   1          3HZ       LYS   1   0.639  -6.060  -4.523
   14    H    SER   2           HN       SER   2   1.084   2.174  -0.240
   15    HA   SER   2           HA       SER   2   2.068   3.865  -2.300
   16   1HB   SER   2          2HB       SER   2  -0.052   3.965  -0.508
   17   2HB   SER   2          3HB       SER   2   1.051   5.145   0.172
   18    HG   SER   2           HG       SER   2  -0.571   5.397  -1.999
   19    HA   PRO   3           HA       PRO   3   5.698   5.175  -0.291
   20   1HB   PRO   3          2HB       PRO   3   6.009   7.731  -1.205
   21   2HB   PRO   3          3HB       PRO   3   6.431   6.318  -2.151
   22   1HG   PRO   3          2HG       PRO   3   4.097   8.109  -2.437
   23   2HG   PRO   3          3HG       PRO   3   4.760   6.976  -3.598
   24   1HD   PRO   3          2HD       PRO   3   2.407   6.614  -1.997
   25   2HD   PRO   3          3HD       PRO   3   3.136   5.436  -3.072
   26    H    GLU   4           HN       GLU   4   2.993   7.361   0.049
   27    HA   GLU   4           HA       GLU   4   4.022   8.848   2.108
   28   1HB   GLU   4          2HB       GLU   4   1.587   8.650   0.733
   29   2HB   GLU   4          3HB       GLU   4   1.143   8.296   2.391
   30   1HG   GLU   4          2HG       GLU   4   2.929  10.670   1.751
   31   2HG   GLU   4          3HG       GLU   4   1.188  10.802   1.591
   32    H    GLU   5           HN       GLU   5   2.505   5.608   2.088
   33    HA   GLU   5           HA       GLU   5   2.111   5.454   4.841
   34   1HB   GLU   5          2HB       GLU   5   1.906   3.701   2.511
   35   2HB   GLU   5          3HB       GLU   5   2.562   2.827   3.881
   36   1HG   GLU   5          2HG       GLU   5   0.480   4.354   5.006
   37   2HG   GLU   5          3HG       GLU   5  -0.166   3.854   3.456
   38    H    LEU   6           HN       LEU   6   4.898   4.766   2.703
   39    HA   LEU   6           HA       LEU   6   6.431   3.325   4.523
   40   1HB   LEU   6          2HB       LEU   6   6.955   4.931   2.064
   41   2HB   LEU   6          3HB       LEU   6   8.321   4.462   3.058
   42    HG   LEU   6           HG       LEU   6   6.304   2.555   1.840
   43   1HD1  LEU   6          1HD1      LEU   6   8.901   2.099   0.828
   44   2HD1  LEU   6          2HD1      LEU   6   7.469   2.704  -0.039
   45   3HD1  LEU   6          3HD1      LEU   6   8.605   3.851   0.711
   46   1HD2  LEU   6          1HD2      LEU   6   7.012   1.352   3.649
   47   2HD2  LEU   6          2HD2      LEU   6   8.296   0.938   2.487
   48   3HD2  LEU   6          3HD2      LEU   6   8.586   2.178   3.731
   49    H    LYS   7           HN       LYS   7   5.978   6.854   4.017
   50    HA   LYS   7           HA       LYS   7   8.013   7.587   5.841
   51   1HB   LYS   7          2HB       LYS   7   6.613   8.879   3.906
   52   2HB   LYS   7          3HB       LYS   7   5.769   9.458   5.327
   53   1HG   LYS   7          2HG       LYS   7   7.473  10.880   5.776
   54   2HG   LYS   7          3HG       LYS   7   8.572   9.526   5.945
   55   1HD   LYS   7          2HD       LYS   7   9.501  10.910   4.214
   56   2HD   LYS   7          3HD       LYS   7   8.816   9.520   3.396
   57   1HE   LYS   7          2HE       LYS   7   6.751  11.542   3.674
   58   2HE   LYS   7          3HE       LYS   7   8.181  12.291   2.993
   59   1HZ   LYS   7          1HZ       LYS   7   6.919   9.842   1.970
   60   2HZ   LYS   7          2HZ       LYS   7   6.779  11.328   1.306
   61   3HZ   LYS   7          3HZ       LYS   7   8.228  10.575   1.325
   62    H    GLY   8           HN       GLY   8   4.399   7.368   6.068
   63   1HA   GLY   8          1HA       GLY   8   4.139   8.167   8.712
   64   2HA   GLY   8          2HA       GLY   8   3.050   7.104   7.844
   65    H    ILE   9           HN       ILE   9   4.335   4.777   7.390
   66    HA   ILE   9           HA       ILE   9   4.319   3.505   9.833
   67    HB   ILE   9           HB       ILE   9   5.201   2.845   7.075
   68   1HG1  ILE   9          2HG1      ILE   9   3.362   1.389   8.991
   69   2HG1  ILE   9          3HG1      ILE   9   2.831   2.683   7.935
   70   1HG2  ILE   9          1HG2      ILE   9   6.105   1.377   9.535
   71   2HG2  ILE   9          2HG2      ILE   9   5.762   0.491   8.029
   72   3HG2  ILE   9          3HG2      ILE   9   7.002   1.768   8.048
   73   1HD1  ILE   9          1HD1      ILE   9   2.395   0.568   6.815
   74   2HD1  ILE   9          2HD1      ILE   9   3.734   1.372   5.961
   75   3HD1  ILE   9          3HD1      ILE   9   4.071   0.030   7.080
   76    H    PHE  10           HN       PHE  10   7.116   4.719   7.881
   77    HA   PHE  10           HA       PHE  10   9.145   3.790   9.451
   78   1HB   PHE  10          2HB       PHE  10   9.663   4.924   7.396
   79   2HB   PHE  10          3HB       PHE  10   8.589   6.260   7.759
   80    HD1  PHE  10           HD1      PHE  10   9.309   8.049   9.294
   81    HD2  PHE  10           HD2      PHE  10  11.940   4.916   8.166
   82    HE1  PHE  10           HE1      PHE  10  11.264   9.399  10.103
   83    HE2  PHE  10           HE2      PHE  10  13.895   6.267   8.975
   84    HZ   PHE  10           HZ       PHE  10  13.534   8.492   9.934
   85    H    GLU  11           HN       GLU  11   7.481   7.016   9.733
   86    HA   GLU  11           HA       GLU  11   8.894   7.769  11.992
   87   1HB   GLU  11          2HB       GLU  11   6.924   8.881  10.304
   88   2HB   GLU  11          3HB       GLU  11   6.186   8.886  11.894
   89   1HG   GLU  11          2HG       GLU  11   8.798   9.750  12.420
   90   2HG   GLU  11          3HG       GLU  11   8.452  10.488  10.869
   91    H    LYS  12           HN       LYS  12   5.778   6.017  11.557
   92    HA   LYS  12           HA       LYS  12   4.944   6.058  14.197
   93   1HB   LYS  12          2HB       LYS  12   3.608   5.363  12.202
   94   2HB   LYS  12          3HB       LYS  12   4.511   3.863  12.151
   95   1HG   LYS  12          2HG       LYS  12   3.731   3.983  14.825
   96   2HG   LYS  12          3HG       LYS  12   2.358   4.703  14.009
   97   1HD   LYS  12          2HD       LYS  12   1.820   2.745  12.862
   98   2HD   LYS  12          3HD       LYS  12   3.483   2.195  12.794
   99   1HE   LYS  12          2HE       LYS  12   3.424   1.282  14.959
  100   2HE   LYS  12          3HE       LYS  12   2.170   2.376  15.506
  101   1HZ   LYS  12          1HZ       LYS  12   0.817   1.110  13.696
  102   2HZ   LYS  12          2HZ       LYS  12   1.912  -0.069  13.978
  103   3HZ   LYS  12          3HZ       LYS  12   0.986   0.495  15.199
  104    H    TYR  13           HN       TYR  13   7.585   4.351  12.632
  105    HA   TYR  13           HA       TYR  13   7.839   2.530  14.896
  106   1HB   TYR  13          2HB       TYR  13   8.826   2.886  12.057
  107   2HB   TYR  13          3HB       TYR  13   9.959   2.114  13.148
  108    HD1  TYR  13           HD1      TYR  13   9.885  -0.200  13.372
  109    HD2  TYR  13           HD2      TYR  13   6.357   1.870  12.118
  110    HE1  TYR  13           HE1      TYR  13   8.697  -2.421  13.023
  111    HE2  TYR  13           HE2      TYR  13   5.181  -0.357  11.772
  112    HH   TYR  13           HH       TYR  13   6.827  -3.260  11.633
  113    H    ALA  14           HN       ALA  14   9.653   5.131  13.146
  114    HA   ALA  14           HA       ALA  14  11.918   5.052  14.764
  115   1HB   ALA  14          1HB       ALA  14  10.859   7.594  13.527
  116   2HB   ALA  14          2HB       ALA  14  12.533   6.999  13.624
  117   3HB   ALA  14          3HB       ALA  14  11.386   6.248  12.488
  118    H    ALA  15           HN       ALA  15   8.657   6.139  15.376
  119    HA   ALA  15           HA       ALA  15   9.454   7.925  17.504
  120   1HB   ALA  15          1HB       ALA  15   7.419   8.094  15.853
  121   2HB   ALA  15          2HB       ALA  15   6.644   6.954  16.979
  122   3HB   ALA  15          3HB       ALA  15   7.200   8.541  17.562
  123    H    LYS  16           HN       LYS  16   8.700   4.539  16.992
  124    HA   LYS  16           HA       LYS  16   7.664   3.850  19.454
  125   1HB   LYS  16          2HB       LYS  16   8.458   2.544  17.130
  126   2HB   LYS  16          3HB       LYS  16   9.522   1.876  18.351
  127   1HG   LYS  16          2HG       LYS  16   7.397   1.573  19.815
  128   2HG   LYS  16          3HG       LYS  16   6.476   1.915  18.364
  129   1HD   LYS  16          2HD       LYS  16   7.102  -0.075  17.317
  130   2HD   LYS  16          3HD       LYS  16   8.648  -0.152  18.137
  131   1HE   LYS  16          2HE       LYS  16   6.919  -0.393  20.278
  132   2HE   LYS  16          3HE       LYS  16   5.985  -1.170  19.015
  133   1HZ   LYS  16          1HZ       LYS  16   7.410  -2.856  18.934
  134   2HZ   LYS  16          2HZ       LYS  16   8.743  -1.920  19.055
  135   3HZ   LYS  16          3HZ       LYS  16   7.923  -2.350  20.400
  136    H    GLU  17           HN       GLU  17  11.145   3.542  18.437
  137    HA   GLU  17           HA       GLU  17  11.783   4.053  21.239
  138   1HB   GLU  17          2HB       GLU  17  13.056   2.157  19.237
  139   2HB   GLU  17          3HB       GLU  17  13.927   2.691  20.660
  140   1HG   GLU  17          2HG       GLU  17  11.396   1.942  21.657
  141   2HG   GLU  17          3HG       GLU  17  11.745   0.730  20.440
  142    H    GLY  18           HN       GLY  18  13.151   5.761  21.661
  143   1HA   GLY  18          1HA       GLY  18  14.565   7.476  21.309
  144   2HA   GLY  18          2HA       GLY  18  15.162   6.645  19.886
  145    H    ASP  19           HN       ASP  19  15.158   9.225  19.447
  146    HA   ASP  19           HA       ASP  19  12.789  10.475  18.870
  147   1HB   ASP  19          2HB       ASP  19  15.365  11.239  18.858
  148   2HB   ASP  19          3HB       ASP  19  15.219  10.941  17.137
  149    HA   PRO  20           HA       PRO  20  11.672   8.434  15.140
  150   1HB   PRO  20          2HB       PRO  20   9.735  10.136  14.234
  151   2HB   PRO  20          3HB       PRO  20   9.442   8.913  15.455
  152   1HG   PRO  20          2HG       PRO  20   9.729  11.836  15.791
  153   2HG   PRO  20          3HG       PRO  20   9.028  10.668  16.894
  154   1HD   PRO  20          2HD       PRO  20  11.614  11.890  17.105
  155   2HD   PRO  20          3HD       PRO  20  10.959  10.638  18.140
  156    H    ASN  21           HN       ASN  21  13.422  11.192  15.303
  157    HA   ASN  21           HA       ASN  21  13.370  11.650  12.470
  158   1HB   ASN  21          2HB       ASN  21  14.766  12.941  14.846
  159   2HB   ASN  21          3HB       ASN  21  15.302  13.313  13.219
  160   1HD2  ASN  21          1HD2      ASN  21  13.160  14.052  15.675
  161   2HD2  ASN  21          2HD2      ASN  21  12.036  15.055  14.821
  162    H    GLN  22           HN       GLN  22  14.723   9.371  14.490
  163    HA   GLN  22           HA       GLN  22  16.861   8.895  12.629
  164   1HB   GLN  22          2HB       GLN  22  18.416   8.421  14.675
  165   2HB   GLN  22          3HB       GLN  22  18.207  10.078  14.146
  166   1HG   GLN  22          2HG       GLN  22  16.074   9.545  15.981
  167   2HG   GLN  22          3HG       GLN  22  17.525   8.887  16.709
  168   1HE2  GLN  22          1HE2      GLN  22  16.455  11.740  14.863
  169   2HE2  GLN  22          2HE2      GLN  22  17.310  12.932  15.784
  170    H    LEU  23           HN       LEU  23  17.028   6.714  12.190
  171    HA   LEU  23           HA       LEU  23  15.308   4.974  13.756
  172   1HB   LEU  23          2HB       LEU  23  16.647   4.776  11.071
  173   2HB   LEU  23          3HB       LEU  23  15.967   3.365  11.857
  174    HG   LEU  23           HG       LEU  23  14.587   4.785  10.115
  175   1HD1  LEU  23          1HD1      LEU  23  13.145   3.204  10.692
  176   2HD1  LEU  23          2HD1      LEU  23  13.925   3.020  12.281
  177   3HD1  LEU  23          3HD1      LEU  23  12.622   4.212  12.062
  178   1HD2  LEU  23          1HD2      LEU  23  13.024   6.340  11.365
  179   2HD2  LEU  23          2HD2      LEU  23  14.208   6.313  12.694
  180   3HD2  LEU  23          3HD2      LEU  23  14.680   6.935  11.095
  181    H    SER  24           HN       SER  24  16.093   2.840  14.487
  182    HA   SER  24           HA       SER  24  18.963   2.907  14.990
  183   1HB   SER  24          2HB       SER  24  16.889   1.908  16.985
  184   2HB   SER  24          3HB       SER  24  18.608   2.108  17.261
  185    HG   SER  24           HG       SER  24  17.002   4.362  16.477
  186    H    LYS  25           HN       LYS  25  19.856   0.662  15.525
  187    HA   LYS  25           HA       LYS  25  19.177  -1.145  13.565
  188   1HB   LYS  25          2HB       LYS  25  21.331  -1.044  14.789
  189   2HB   LYS  25          3HB       LYS  25  20.547  -1.693  16.215
  190   1HG   LYS  25          2HG       LYS  25  19.749  -3.563  14.396
  191   2HG   LYS  25          3HG       LYS  25  21.251  -3.065  13.642
  192   1HD   LYS  25          2HD       LYS  25  21.573  -3.435  16.544
  193   2HD   LYS  25          3HD       LYS  25  20.966  -4.888  15.776
  194   1HE   LYS  25          2HE       LYS  25  22.948  -5.296  14.710
  195   2HE   LYS  25          3HE       LYS  25  23.128  -3.626  14.211
  196   1HZ   LYS  25          1HZ       LYS  25  23.677  -4.611  16.925
  197   2HZ   LYS  25          2HZ       LYS  25  24.815  -4.328  15.788
  198   3HZ   LYS  25          3HZ       LYS  25  23.931  -3.091  16.384
  199    H    GLU  26           HN       GLU  26  18.385  -1.335  17.111
  200    HA   GLU  26           HA       GLU  26  16.802  -3.567  16.873
  201   1HB   GLU  26          2HB       GLU  26  17.517  -1.665  18.904
  202   2HB   GLU  26          3HB       GLU  26  15.776  -1.858  18.964
  203   1HG   GLU  26          2HG       GLU  26  16.652  -4.489  18.644
  204   2HG   GLU  26          3HG       GLU  26  17.910  -3.798  19.649
  205    H    GLU  27           HN       GLU  27  16.050  -0.082  16.454
  206    HA   GLU  27           HA       GLU  27  13.292  -0.371  16.409
  207   1HB   GLU  27          2HB       GLU  27  15.274   1.705  15.828
  208   2HB   GLU  27          3HB       GLU  27  13.932   1.792  14.705
  209   1HG   GLU  27          2HG       GLU  27  12.819   1.311  17.313
  210   2HG   GLU  27          3HG       GLU  27  14.008   2.587  17.489
  211    H    LEU  28           HN       LEU  28  15.648  -0.032  13.651
  212    HA   LEU  28           HA       LEU  28  13.793  -0.466  11.642
  213   1HB   LEU  28          2HB       LEU  28  16.251   0.363  11.616
  214   2HB   LEU  28          3HB       LEU  28  16.660  -1.333  11.450
  215    HG   LEU  28           HG       LEU  28  15.994  -1.437   9.295
  216   1HD1  LEU  28          1HD1      LEU  28  13.627  -1.193   9.777
  217   2HD1  LEU  28          2HD1      LEU  28  13.805   0.575   9.885
  218   3HD1  LEU  28          3HD1      LEU  28  14.063  -0.252   8.330
  219   1HD2  LEU  28          1HD2      LEU  28  17.075   0.227   8.288
  220   2HD2  LEU  28          2HD2      LEU  28  15.878   1.433   8.820
  221   3HD2  LEU  28          3HD2      LEU  28  17.224   0.981   9.894
  222    H    LYS  29           HN       LYS  29  15.623  -2.741  13.713
  223    HA   LYS  29           HA       LYS  29  15.286  -5.064  12.329
  224   1HB   LYS  29          2HB       LYS  29  16.603  -4.843  14.378
  225   2HB   LYS  29          3HB       LYS  29  15.147  -4.609  15.324
  226   1HG   LYS  29          2HG       LYS  29  14.396  -6.854  14.948
  227   2HG   LYS  29          3HG       LYS  29  15.490  -7.089  13.599
  228   1HD   LYS  29          2HD       LYS  29  17.158  -7.795  14.971
  229   2HD   LYS  29          3HD       LYS  29  17.008  -6.375  15.987
  230   1HE   LYS  29          2HE       LYS  29  16.368  -7.961  17.545
  231   2HE   LYS  29          3HE       LYS  29  14.793  -7.660  16.838
  232   1HZ   LYS  29          1HZ       LYS  29  15.763 -10.046  17.004
  233   2HZ   LYS  29          2HZ       LYS  29  14.845  -9.611  15.724
  234   3HZ   LYS  29          3HZ       LYS  29  16.472  -9.662  15.584
  235    H    LEU  30           HN       LEU  30  12.969  -3.594  14.710
  236    HA   LEU  30           HA       LEU  30  11.003  -5.507  14.465
  237   1HB   LEU  30          2HB       LEU  30  10.670  -2.543  14.947
  238   2HB   LEU  30          3HB       LEU  30   9.492  -3.787  15.312
  239    HG   LEU  30           HG       LEU  30  12.100  -3.189  16.684
  240   1HD1  LEU  30          1HD1      LEU  30  10.845  -2.625  18.466
  241   2HD1  LEU  30          2HD1      LEU  30   9.567  -2.418  17.244
  242   3HD1  LEU  30          3HD1      LEU  30   9.662  -3.925  18.187
  243   1HD2  LEU  30          1HD2      LEU  30  12.492  -5.434  16.587
  244   2HD2  LEU  30          2HD2      LEU  30  11.438  -5.381  18.020
  245   3HD2  LEU  30          3HD2      LEU  30  10.767  -5.848  16.439
  246    H    LEU  31           HN       LEU  31  11.288  -2.360  12.665
  247    HA   LEU  31           HA       LEU  31   9.122  -2.705  11.026
  248   1HB   LEU  31          2HB       LEU  31  10.783  -0.739  11.375
  249   2HB   LEU  31          3HB       LEU  31  11.674  -1.463  10.051
  250    HG   LEU  31           HG       LEU  31   8.930  -1.276   9.261
  251   1HD1  LEU  31          1HD1      LEU  31   8.203   0.496  10.417
  252   2HD1  LEU  31          2HD1      LEU  31   9.842   0.957  10.936
  253   3HD1  LEU  31          3HD1      LEU  31   9.247   1.446   9.332
  254   1HD2  LEU  31          1HD2      LEU  31  11.565  -0.152   8.376
  255   2HD2  LEU  31          2HD2      LEU  31  10.466  -1.281   7.548
  256   3HD2  LEU  31          3HD2      LEU  31  10.057   0.449   7.645
  257    H    LEU  32           HN       LEU  32  12.568  -3.475  10.143
  258    HA   LEU  32           HA       LEU  32  12.025  -4.748   7.789
  259   1HB   LEU  32          2HB       LEU  32  14.184  -5.458   9.779
  260   2HB   LEU  32          3HB       LEU  32  14.181  -5.837   8.068
  261    HG   LEU  32           HG       LEU  32  14.146  -3.007   9.143
  262   1HD1  LEU  32          1HD1      LEU  32  16.187  -3.771   9.944
  263   2HD1  LEU  32          2HD1      LEU  32  16.452  -4.845   8.550
  264   3HD1  LEU  32          3HD1      LEU  32  16.612  -3.082   8.359
  265   1HD2  LEU  32          1HD2      LEU  32  13.640  -4.012   6.585
  266   2HD2  LEU  32          2HD2      LEU  32  13.993  -2.326   7.034
  267   3HD2  LEU  32          3HD2      LEU  32  15.312  -3.404   6.519
  268    H    GLN  33           HN       GLN  33  11.271  -5.752  11.049
  269    HA   GLN  33           HA       GLN  33  11.206  -8.508  10.530
  270   1HB   GLN  33          2HB       GLN  33  11.030  -6.917  12.779
  271   2HB   GLN  33          3HB       GLN  33   9.370  -7.454  12.617
  272   1HG   GLN  33          2HG       GLN  33  10.575  -9.839  12.207
  273   2HG   GLN  33          3HG       GLN  33  11.853  -9.078  13.135
  274   1HE2  GLN  33          1HE2      GLN  33  11.001  -7.794  15.094
  275   2HE2  GLN  33          2HE2      GLN  33   9.865  -8.613  16.113
  276    H    THR  34           HN       THR  34   8.566  -6.021  10.852
  277    HA   THR  34           HA       THR  34   6.704  -7.890   9.624
  278    HB   THR  34           HB       THR  34   6.628  -5.466  11.352
  279    HG1  THR  34           HG1      THR  34   4.728  -7.598  10.694
  280   1HG2  THR  34          1HG2      THR  34   5.418  -4.424   9.517
  281   2HG2  THR  34          2HG2      THR  34   4.591  -5.951   9.123
  282   3HG2  THR  34          3HG2      THR  34   4.187  -5.081  10.623
  283    H    GLU  35           HN       GLU  35   8.057  -4.589   9.006
  284    HA   GLU  35           HA       GLU  35   6.753  -4.046   6.721
  285   1HB   GLU  35          2HB       GLU  35   8.247  -2.434   7.737
  286   2HB   GLU  35          3HB       GLU  35   9.640  -3.471   7.497
  287   1HG   GLU  35          2HG       GLU  35   9.992  -2.429   5.514
  288   2HG   GLU  35          3HG       GLU  35   8.534  -3.192   4.911
  289    H    PHE  36           HN       PHE  36   9.984  -5.719   6.917
  290    HA   PHE  36           HA       PHE  36   9.200  -7.378   4.688
  291   1HB   PHE  36          2HB       PHE  36  11.506  -5.349   4.727
  292   2HB   PHE  36          3HB       PHE  36  11.484  -6.687   3.596
  293    HD1  PHE  36           HD1      PHE  36   9.045  -6.880   2.358
  294    HD2  PHE  36           HD2      PHE  36  10.820  -3.334   3.869
  295    HE1  PHE  36           HE1      PHE  36   7.668  -5.512   0.767
  296    HE2  PHE  36           HE2      PHE  36   9.443  -1.966   2.277
  297    HZ   PHE  36           HZ       PHE  36   7.883  -3.072   0.745
  298    HA   PRO  37           HA       PRO  37  11.715  -9.590   7.652
  299   1HB   PRO  37          2HB       PRO  37  10.286 -11.919   7.602
  300   2HB   PRO  37          3HB       PRO  37   9.968 -10.624   8.739
  301   1HG   PRO  37          2HG       PRO  37   8.433 -11.398   6.335
  302   2HG   PRO  37          3HG       PRO  37   7.923 -10.415   7.693
  303   1HD   PRO  37          2HD       PRO  37   8.677  -9.482   5.088
  304   2HD   PRO  37          3HD       PRO  37   8.280  -8.495   6.480
  305    H    SER  38           HN       SER  38  10.715 -10.320   4.448
  306    HA   SER  38           HA       SER  38  12.294 -12.542   4.049
  307   1HB   SER  38          2HB       SER  38  12.086 -10.697   1.737
  308   2HB   SER  38          3HB       SER  38  11.586 -12.370   1.879
  309    HG   SER  38           HG       SER  38   9.724 -11.587   3.162
  310    H    LEU  39           HN       LEU  39  13.048  -9.068   4.166
  311    HA   LEU  39           HA       LEU  39  15.562  -9.261   2.883
  312   1HB   LEU  39          2HB       LEU  39  13.859  -7.250   3.895
  313   2HB   LEU  39          3HB       LEU  39  15.384  -7.072   4.739
  314    HG   LEU  39           HG       LEU  39  14.911  -6.983   1.752
  315   1HD1  LEU  39          1HD1      LEU  39  14.647  -4.991   3.575
  316   2HD1  LEU  39          2HD1      LEU  39  16.366  -4.820   3.144
  317   3HD1  LEU  39          3HD1      LEU  39  15.119  -4.746   1.876
  318   1HD2  LEU  39          1HD2      LEU  39  16.928  -8.103   1.781
  319   2HD2  LEU  39          2HD2      LEU  39  17.455  -6.403   1.774
  320   3HD2  LEU  39          3HD2      LEU  39  17.463  -7.331   3.293
  321    H    LEU  40           HN       LEU  40  14.348 -10.120   6.041
  322    HA   LEU  40           HA       LEU  40  16.854  -9.868   7.380
  323   1HB   LEU  40          2HB       LEU  40  14.340 -11.368   8.128
  324   2HB   LEU  40          3HB       LEU  40  15.706 -11.076   9.185
  325    HG   LEU  40           HG       LEU  40  13.961  -8.918   7.965
  326   1HD1  LEU  40          1HD1      LEU  40  13.344  -8.662  10.489
  327   2HD1  LEU  40          2HD1      LEU  40  12.539  -9.899   9.493
  328   3HD1  LEU  40          3HD1      LEU  40  13.860 -10.362  10.594
  329   1HD2  LEU  40          1HD2      LEU  40  16.138  -8.719  10.065
  330   2HD2  LEU  40          2HD2      LEU  40  16.255  -8.166   8.377
  331   3HD2  LEU  40          3HD2      LEU  40  15.102  -7.391   9.489
  332    H    LYS  41           HN       LYS  41  15.256 -12.255   5.333
  333    HA   LYS  41           HA       LYS  41  16.812 -14.460   6.211
  334   1HB   LYS  41          2HB       LYS  41  14.970 -13.908   3.898
  335   2HB   LYS  41          3HB       LYS  41  15.962 -15.352   3.900
  336   1HG   LYS  41          2HG       LYS  41  13.613 -15.573   4.941
  337   2HG   LYS  41          3HG       LYS  41  14.946 -16.202   5.888
  338   1HD   LYS  41          2HD       LYS  41  14.965 -14.267   7.338
  339   2HD   LYS  41          3HD       LYS  41  13.922 -13.357   6.262
  340   1HE   LYS  41          2HE       LYS  41  13.013 -15.950   7.585
  341   2HE   LYS  41          3HE       LYS  41  12.815 -14.391   8.361
  342   1HZ   LYS  41          1HZ       LYS  41  11.631 -13.684   6.328
  343   2HZ   LYS  41          2HZ       LYS  41  11.683 -15.223   5.784
  344   3HZ   LYS  41          3HZ       LYS  41  10.869 -14.869   7.154
  345    H    GLY  42           HN       GLY  42  17.151 -11.891   3.745
  346   1HA   GLY  42          1HA       GLY  42  19.070 -12.815   2.088
  347   2HA   GLY  42          2HA       GLY  42  19.017 -11.171   2.690
  348    H    MET  43           HN       MET  43  21.490 -12.222   2.074
  349    HA   MET  43           HA       MET  43  22.648 -13.478   4.327
  350   1HB   MET  43          2HB       MET  43  23.885 -12.036   1.915
  351   2HB   MET  43          3HB       MET  43  24.789 -13.040   3.031
  352   1HG   MET  43          2HG       MET  43  24.246 -14.861   1.789
  353   2HG   MET  43          3HG       MET  43  22.562 -14.624   2.212
  354   1HE   MET  43          1HE       MET  43  21.788 -14.974  -1.454
  355   2HE   MET  43          2HE       MET  43  22.464 -15.972  -0.145
  356   3HE   MET  43          3HE       MET  43  21.050 -14.936   0.165
  357    H    SER  44           HN       SER  44  21.530 -10.354   3.884
  358    HA   SER  44           HA       SER  44  23.745  -9.097   5.233
  359   1HB   SER  44          2HB       SER  44  21.137  -8.058   4.058
  360   2HB   SER  44          3HB       SER  44  22.201  -7.033   5.001
  361    HG   SER  44           HG       SER  44  22.501  -7.032   2.587
  362    H    THR  45           HN       THR  45  23.771  -9.750   7.396
  363    HA   THR  45           HA       THR  45  21.400 -10.200   8.880
  364    HB   THR  45           HB       THR  45  23.040 -10.436  10.749
  365    HG1  THR  45           HG1      THR  45  25.202  -9.704  10.293
  366   1HG2  THR  45          1HG2      THR  45  23.287 -12.453   9.602
  367   2HG2  THR  45          2HG2      THR  45  23.608 -11.643   8.050
  368   3HG2  THR  45          3HG2      THR  45  24.896 -11.767   9.272
  369    H    LEU  46           HN       LEU  46  21.065  -9.022  11.072
  370    HA   LEU  46           HA       LEU  46  20.128  -6.506  10.522
  371   1HB   LEU  46          2HB       LEU  46  19.866  -8.231  12.540
  372   2HB   LEU  46          3HB       LEU  46  21.006  -7.134  13.294
  373    HG   LEU  46           HG       LEU  46  19.055  -6.192  13.992
  374   1HD1  LEU  46          1HD1      LEU  46  20.317  -4.524  12.636
  375   2HD1  LEU  46          2HD1      LEU  46  19.232  -4.877  11.269
  376   3HD1  LEU  46          3HD1      LEU  46  18.576  -4.183  12.771
  377   1HD2  LEU  46          1HD2      LEU  46  16.953  -6.119  12.647
  378   2HD2  LEU  46          2HD2      LEU  46  17.780  -7.069  11.390
  379   3HD2  LEU  46          3HD2      LEU  46  17.534  -7.761  13.011
  380    H    ASP  47           HN       ASP  47  23.074  -7.252  12.524
  381    HA   ASP  47           HA       ASP  47  23.991  -4.769  12.812
  382   1HB   ASP  47          2HB       ASP  47  25.095  -7.448  12.857
  383   2HB   ASP  47          3HB       ASP  47  26.272  -6.384  12.113
  384    H    GLU  48           HN       GLU  48  24.690  -7.032  10.044
  385    HA   GLU  48           HA       GLU  48  26.328  -5.373   8.625
  386   1HB   GLU  48          2HB       GLU  48  24.845  -7.832   8.175
  387   2HB   GLU  48          3HB       GLU  48  24.768  -6.835   6.735
  388   1HG   GLU  48          2HG       GLU  48  27.400  -6.520   7.265
  389   2HG   GLU  48          3HG       GLU  48  27.173  -8.056   8.077
  390    H    LEU  49           HN       LEU  49  22.722  -5.666   8.541
  391    HA   LEU  49           HA       LEU  49  22.328  -3.846   6.462
  392   1HB   LEU  49          2HB       LEU  49  20.786  -5.549   7.915
  393   2HB   LEU  49          3HB       LEU  49  20.273  -4.008   8.573
  394    HG   LEU  49           HG       LEU  49  20.247  -3.579   5.820
  395   1HD1  LEU  49          1HD1      LEU  49  20.291  -5.642   4.913
  396   2HD1  LEU  49          2HD1      LEU  49  19.759  -6.438   6.414
  397   3HD1  LEU  49          3HD1      LEU  49  18.567  -5.642   5.358
  398   1HD2  LEU  49          1HD2      LEU  49  18.545  -3.308   7.974
  399   2HD2  LEU  49          2HD2      LEU  49  18.192  -2.850   6.291
  400   3HD2  LEU  49          3HD2      LEU  49  17.672  -4.436   6.909
  401    H    PHE  50           HN       PHE  50  22.496  -3.426  10.048
  402    HA   PHE  50           HA       PHE  50  21.831  -0.755  10.127
  403   1HB   PHE  50          2HB       PHE  50  22.229  -2.483  12.011
  404   2HB   PHE  50          3HB       PHE  50  23.951  -2.282  11.752
  405    HD1  PHE  50           HD1      PHE  50  21.005  -0.021  12.224
  406    HD2  PHE  50           HD2      PHE  50  25.000  -0.959  13.306
  407    HE1  PHE  50           HE1      PHE  50  21.022   1.906  13.832
  408    HE2  PHE  50           HE2      PHE  50  25.017   0.968  14.914
  409    HZ   PHE  50           HZ       PHE  50  23.028   2.378  15.157
  410    H    GLU  51           HN       GLU  51  25.116  -2.282   9.848
  411    HA   GLU  51           HA       GLU  51  26.449   0.156   9.742
  412   1HB   GLU  51          2HB       GLU  51  27.117  -2.601   9.740
  413   2HB   GLU  51          3HB       GLU  51  27.833  -1.956   8.277
  414   1HG   GLU  51          2HG       GLU  51  28.428   0.025  10.152
  415   2HG   GLU  51          3HG       GLU  51  28.545  -1.439  11.107
  416    H    GLU  52           HN       GLU  52  25.064  -1.999   7.214
  417    HA   GLU  52           HA       GLU  52  26.191  -0.693   5.050
  418   1HB   GLU  52          2HB       GLU  52  25.165  -2.913   4.869
  419   2HB   GLU  52          3HB       GLU  52  23.592  -2.268   5.297
  420   1HG   GLU  52          2HG       GLU  52  23.249  -1.319   3.208
  421   2HG   GLU  52          3HG       GLU  52  24.946  -0.954   2.970
  422    H    LEU  53           HN       LEU  53  22.907  -0.334   6.570
  423    HA   LEU  53           HA       LEU  53  21.969   1.658   4.926
  424   1HB   LEU  53          2HB       LEU  53  21.435   1.288   7.877
  425   2HB   LEU  53          3HB       LEU  53  20.442   2.193   6.751
  426    HG   LEU  53           HG       LEU  53  20.960  -0.666   6.085
  427   1HD1  LEU  53          1HD1      LEU  53  20.574  -0.776   8.501
  428   2HD1  LEU  53          2HD1      LEU  53  19.066   0.150   8.307
  429   3HD1  LEU  53          3HD1      LEU  53  19.213  -1.472   7.589
  430   1HD2  LEU  53          1HD2      LEU  53  19.585   0.956   4.708
  431   2HD2  LEU  53          2HD2      LEU  53  18.797  -0.583   5.132
  432   3HD2  LEU  53          3HD2      LEU  53  18.378   0.904   6.016
  433    H    ASP  54           HN       ASP  54  23.640   2.055   8.133
  434    HA   ASP  54           HA       ASP  54  23.808   4.825   7.834
  435   1HB   ASP  54          2HB       ASP  54  23.943   3.756  10.033
  436   2HB   ASP  54          3HB       ASP  54  25.354   2.835   9.554
  437    H    LYS  55           HN       LYS  55  25.968   6.050   7.670
  438    HA   LYS  55           HA       LYS  55  28.234   4.691   6.641
  439   1HB   LYS  55          2HB       LYS  55  26.698   4.626   4.658
  440   2HB   LYS  55          3HB       LYS  55  26.696   6.378   4.647
  441   1HG   LYS  55          2HG       LYS  55  29.417   5.194   4.784
  442   2HG   LYS  55          3HG       LYS  55  28.540   4.770   3.327
  443   1HD   LYS  55          2HD       LYS  55  28.107   7.164   2.850
  444   2HD   LYS  55          3HD       LYS  55  28.884   7.628   4.351
  445   1HE   LYS  55          2HE       LYS  55  30.855   7.725   3.231
  446   2HE   LYS  55          3HE       LYS  55  30.789   5.983   3.055
  447   1HZ   LYS  55          1HZ       LYS  55  30.954   6.973   0.927
  448   2HZ   LYS  55          2HZ       LYS  55  29.448   6.351   1.048
  449   3HZ   LYS  55          3HZ       LYS  55  29.680   7.961   1.189
  450    H    ASN  56           HN       ASN  56  26.358   7.754   6.951
  451    HA   ASN  56           HA       ASN  56  28.439   9.495   6.797
  452   1HB   ASN  56          2HB       ASN  56  26.945  10.846   8.536
  453   2HB   ASN  56          3HB       ASN  56  26.322  10.524   6.930
  454   1HD2  ASN  56          1HD2      ASN  56  24.201  10.489   7.417
  455   2HD2  ASN  56          2HD2      ASN  56  23.426   9.300   8.408
  456    H    GLY  57           HN       GLY  57  27.384   7.313   9.417
  457   1HA   GLY  57          1HA       GLY  57  28.726   6.548  11.131
  458   2HA   GLY  57          2HA       GLY  57  29.830   7.889  10.897
  459    H    ASP  58           HN       ASP  58  26.309   7.420  11.710
  460    HA   ASP  58           HA       ASP  58  26.760   9.317  13.876
  461   1HB   ASP  58          2HB       ASP  58  24.161   9.753  13.448
  462   2HB   ASP  58          3HB       ASP  58  25.382  10.621  12.540
  463    H    GLY  59           HN       GLY  59  24.545   6.781  12.481
  464   1HA   GLY  59          1HA       GLY  59  24.283   4.740  13.787
  465   2HA   GLY  59          2HA       GLY  59  24.150   5.737  15.222
  466    H    GLU  60           HN       GLU  60  22.691   7.343  12.577
  467    HA   GLU  60           HA       GLU  60  20.100   6.283  13.401
  468   1HB   GLU  60          2HB       GLU  60  19.185   8.551  12.838
  469   2HB   GLU  60          3HB       GLU  60  20.336   8.580  14.159
  470   1HG   GLU  60          2HG       GLU  60  22.148   9.212  12.499
  471   2HG   GLU  60          3HG       GLU  60  20.925   9.297  11.248
  472    H    VAL  61           HN       VAL  61  18.931   5.271  11.823
  473    HA   VAL  61           HA       VAL  61  19.905   5.542   9.089
  474    HB   VAL  61           HB       VAL  61  18.166   3.551  10.538
  475   1HG1  VAL  61          1HG1      VAL  61  18.106   4.242   7.722
  476   2HG1  VAL  61          2HG1      VAL  61  18.655   2.565   7.954
  477   3HG1  VAL  61          3HG1      VAL  61  17.096   3.093   8.633
  478   1HG2  VAL  61          1HG2      VAL  61  20.772   3.570  10.590
  479   2HG2  VAL  61          2HG2      VAL  61  19.918   2.041  10.272
  480   3HG2  VAL  61          3HG2      VAL  61  20.640   2.954   8.925
  481    H    SER  62           HN       SER  62  18.924   7.881   9.395
  482    HA   SER  62           HA       SER  62  16.283   8.350   9.591
  483   1HB   SER  62          2HB       SER  62  17.186  10.087   7.534
  484   2HB   SER  62          3HB       SER  62  17.110  10.422   9.252
  485    HG   SER  62           HG       SER  62  19.337   9.220   7.838
  486    H    PHE  63           HN       PHE  63  14.939   9.306   7.516
  487    HA   PHE  63           HA       PHE  63  14.163   7.074   6.063
  488   1HB   PHE  63          2HB       PHE  63  12.961   9.322   6.613
  489   2HB   PHE  63          3HB       PHE  63  13.904  10.048   5.326
  490    HD1  PHE  63           HD1      PHE  63  12.856  10.266   3.293
  491    HD2  PHE  63           HD2      PHE  63  11.730   7.042   5.813
  492    HE1  PHE  63           HE1      PHE  63  11.115   9.570   1.624
  493    HE2  PHE  63           HE2      PHE  63   9.989   6.346   4.144
  494    HZ   PHE  63           HZ       PHE  63   9.702   7.618   2.070
  495    H    GLU  64           HN       GLU  64  16.850   9.238   5.609
  496    HA   GLU  64           HA       GLU  64  16.988   9.119   2.825
  497   1HB   GLU  64          2HB       GLU  64  19.486   9.352   4.491
  498   2HB   GLU  64          3HB       GLU  64  19.022  10.248   3.058
  499   1HG   GLU  64          2HG       GLU  64  18.128  10.657   5.920
  500   2HG   GLU  64          3HG       GLU  64  18.747  11.839   4.785
  501    H    GLU  65           HN       GLU  65  18.856   7.322   5.384
  502    HA   GLU  65           HA       GLU  65  20.159   5.667   3.613
  503   1HB   GLU  65          2HB       GLU  65  19.367   5.211   6.522
  504   2HB   GLU  65          3HB       GLU  65  20.481   4.181   5.645
  505   1HG   GLU  65          2HG       GLU  65  22.053   6.011   5.321
  506   2HG   GLU  65          3HG       GLU  65  20.894   7.192   5.899
  507    H    PHE  66           HN       PHE  66  16.861   5.599   4.884
  508    HA   PHE  66           HA       PHE  66  16.289   2.907   4.522
  509   1HB   PHE  66          2HB       PHE  66  14.977   4.923   5.601
  510   2HB   PHE  66          3HB       PHE  66  14.453   5.306   3.973
  511    HD1  PHE  66           HD1      PHE  66  12.290   4.663   3.562
  512    HD2  PHE  66           HD2      PHE  66  14.709   2.166   5.995
  513    HE1  PHE  66           HE1      PHE  66  10.386   3.044   3.794
  514    HE2  PHE  66           HE2      PHE  66  12.805   0.546   6.226
  515    HZ   PHE  66           HZ       PHE  66  10.666   1.005   5.123
  516    H    GLN  67           HN       GLN  67  16.247   5.689   2.236
  517    HA   GLN  67           HA       GLN  67  14.930   4.389   0.188
  518   1HB   GLN  67          2HB       GLN  67  17.097   6.503  -0.145
  519   2HB   GLN  67          3HB       GLN  67  15.769   6.172  -1.239
  520   1HG   GLN  67          2HG       GLN  67  14.232   6.696   0.839
  521   2HG   GLN  67          3HG       GLN  67  15.665   7.446   1.514
  522   1HE2  GLN  67          1HE2      GLN  67  13.829   7.294  -1.534
  523   2HE2  GLN  67          2HE2      GLN  67  13.936   8.974  -1.940
  524    H    VAL  68           HN       VAL  68  18.023   3.788   1.563
  525    HA   VAL  68           HA       VAL  68  19.296   2.886  -0.835
  526    HB   VAL  68           HB       VAL  68  20.005   2.352   2.054
  527   1HG1  VAL  68          1HG1      VAL  68  21.744   2.428  -0.435
  528   2HG1  VAL  68          2HG1      VAL  68  22.274   2.056   1.223
  529   3HG1  VAL  68          3HG1      VAL  68  21.168   0.950   0.373
  530   1HG2  VAL  68          1HG2      VAL  68  19.664   4.830   1.275
  531   2HG2  VAL  68          2HG2      VAL  68  21.115   4.382   2.203
  532   3HG2  VAL  68          3HG2      VAL  68  21.214   4.581   0.436
  533    H    LEU  69           HN       LEU  69  17.411   1.464   1.868
  534    HA   LEU  69           HA       LEU  69  17.894  -1.210   0.973
  535   1HB   LEU  69          2HB       LEU  69  17.299  -0.179   3.347
  536   2HB   LEU  69          3HB       LEU  69  15.660  -0.496   2.812
  537    HG   LEU  69           HG       LEU  69  16.307  -2.885   2.411
  538   1HD1  LEU  69          1HD1      LEU  69  18.376  -3.709   3.523
  539   2HD1  LEU  69          2HD1      LEU  69  18.680  -2.681   2.102
  540   3HD1  LEU  69          3HD1      LEU  69  18.886  -2.018   3.741
  541   1HD2  LEU  69          1HD2      LEU  69  16.161  -3.542   4.721
  542   2HD2  LEU  69          2HD2      LEU  69  16.739  -1.947   5.258
  543   3HD2  LEU  69          3HD2      LEU  69  15.153  -2.097   4.466
  544    H    VAL  70           HN       VAL  70  15.499   1.358   0.426
  545    HA   VAL  70           HA       VAL  70  13.377  -0.089  -0.505
  546    HB   VAL  70           HB       VAL  70  14.540   2.599  -1.065
  547   1HG1  VAL  70          1HG1      VAL  70  12.751   3.155  -2.638
  548   2HG1  VAL  70          2HG1      VAL  70  13.763   1.839  -3.279
  549   3HG1  VAL  70          3HG1      VAL  70  12.163   1.476  -2.588
  550   1HG2  VAL  70          1HG2      VAL  70  11.700   1.983  -0.283
  551   2HG2  VAL  70          2HG2      VAL  70  13.008   1.844   0.916
  552   3HG2  VAL  70          3HG2      VAL  70  12.703   3.400   0.107
  553    H    LYS  71           HN       LYS  71  16.591   0.288  -1.880
  554    HA   LYS  71           HA       LYS  71  15.867  -0.368  -4.540
  555   1HB   LYS  71          2HB       LYS  71  18.095   0.649  -3.298
  556   2HB   LYS  71          3HB       LYS  71  18.612  -0.986  -3.657
  557   1HG   LYS  71          2HG       LYS  71  17.417  -0.382  -6.033
  558   2HG   LYS  71          3HG       LYS  71  17.881   1.234  -5.539
  559   1HD   LYS  71          2HD       LYS  71  19.953   0.774  -6.348
  560   2HD   LYS  71          3HD       LYS  71  20.171  -0.282  -4.967
  561   1HE   LYS  71          2HE       LYS  71  19.787  -2.218  -6.198
  562   2HE   LYS  71          3HE       LYS  71  18.652  -1.439  -7.282
  563   1HZ   LYS  71          1HZ       LYS  71  21.365  -0.492  -7.429
  564   2HZ   LYS  71          2HZ       LYS  71  21.123  -2.019  -7.955
  565   3HZ   LYS  71          3HZ       LYS  71  20.296  -0.783  -8.629
  566    H    LYS  72           HN       LYS  72  16.980  -2.223  -1.658
  567    HA   LYS  72           HA       LYS  72  17.128  -4.676  -3.066
  568   1HB   LYS  72          2HB       LYS  72  17.018  -4.007  -0.113
  569   2HB   LYS  72          3HB       LYS  72  17.243  -5.629  -0.737
  570   1HG   LYS  72          2HG       LYS  72  19.045  -3.282  -1.488
  571   2HG   LYS  72          3HG       LYS  72  19.396  -4.377  -0.165
  572   1HD   LYS  72          2HD       LYS  72  18.945  -6.211  -2.133
  573   2HD   LYS  72          3HD       LYS  72  19.493  -4.873  -3.124
  574   1HE   LYS  72          2HE       LYS  72  21.013  -5.979  -0.712
  575   2HE   LYS  72          3HE       LYS  72  21.369  -6.380  -2.380
  576   1HZ   LYS  72          1HZ       LYS  72  22.624  -4.482  -1.272
  577   2HZ   LYS  72          2HZ       LYS  72  22.089  -4.257  -2.798
  578   3HZ   LYS  72          3HZ       LYS  72  21.286  -3.586  -1.545
  579    H    ILE  73           HN       ILE  73  14.580  -2.872  -1.347
  580    HA   ILE  73           HA       ILE  73  12.790  -5.092  -1.282
  581    HB   ILE  73           HB       ILE  73  12.409  -2.131  -0.843
  582   1HG1  ILE  73          2HG1      ILE  73  12.276  -4.203   1.314
  583   2HG1  ILE  73          3HG1      ILE  73  13.852  -3.730   0.713
  584   1HG2  ILE  73          1HG2      ILE  73  10.310  -3.133  -1.579
  585   2HG2  ILE  73          2HG2      ILE  73  10.466  -4.402  -0.341
  586   3HG2  ILE  73          3HG2      ILE  73  10.244  -2.705   0.147
  587   1HD1  ILE  73          1HD1      ILE  73  11.956  -2.217   2.389
  588   2HD1  ILE  73          2HD1      ILE  73  13.707  -1.985   2.166
  589   3HD1  ILE  73          3HD1      ILE  73  12.560  -1.273   1.006
  590    H    SER  74           HN       SER  74  14.002  -3.112  -3.764
  591    HA   SER  74           HA       SER  74  11.535  -3.114  -5.242
  592   1HB   SER  74          2HB       SER  74  14.098  -1.695  -5.354
  593   2HB   SER  74          3HB       SER  74  13.635  -2.283  -6.939
  594    HG   SER  74           HG       SER  74  12.501  -0.253  -5.385
  595    H    GLN  75           HN       GLN  75  14.826  -4.604  -5.306
  596    HA   GLN  75           HA       GLN  75  14.353  -6.010  -7.688
  597   1HB   GLN  75          2HB       GLN  75  16.554  -5.473  -6.063
  598   2HB   GLN  75          3HB       GLN  75  16.331  -7.197  -5.840
  599   1HG   GLN  75          2HG       GLN  75  16.747  -7.694  -8.089
  600   2HG   GLN  75          3HG       GLN  75  16.173  -6.138  -8.655
  601   1HE2  GLN  75          1HE2      GLN  75  17.490  -4.250  -7.532
  602   2HE2  GLN  75          2HE2      GLN  75  19.209  -4.367  -7.702
  Start of MODEL   18
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   2.904   0.695  -1.127
    3   1HB   LYS   1          2HB       LYS   1   1.887  -2.136  -1.488
    4   2HB   LYS   1          3HB       LYS   1   3.112  -1.408  -2.507
    5   1HG   LYS   1          2HG       LYS   1   4.705  -1.321  -0.785
    6   2HG   LYS   1          3HG       LYS   1   3.495  -1.249   0.481
    7   1HD   LYS   1          2HD       LYS   1   2.973  -3.607   0.248
    8   2HD   LYS   1          3HD       LYS   1   3.881  -3.731  -1.246
    9   1HE   LYS   1          2HE       LYS   1   5.373  -2.776   1.189
   10   2HE   LYS   1          3HE       LYS   1   4.919  -4.468   1.144
   11   1HZ   LYS   1          1HZ       LYS   1   7.099  -3.594   0.037
   12   2HZ   LYS   1          2HZ       LYS   1   6.275  -4.853  -0.596
   13   3HZ   LYS   1          3HZ       LYS   1   6.115  -3.364  -1.246
   14    H    SER   2           HN       SER   2   2.671   0.211  -3.758
   15    HA   SER   2           HA       SER   2   0.472   1.864  -4.421
   16   1HB   SER   2          2HB       SER   2   2.908   0.828  -5.728
   17   2HB   SER   2          3HB       SER   2   1.545   0.919  -6.826
   18    HG   SER   2           HG       SER   2   1.385   3.125  -6.533
   19    HA   PRO   3           HA       PRO   3  -2.315  -1.259  -5.611
   20   1HB   PRO   3          2HB       PRO   3  -3.881   0.046  -7.432
   21   2HB   PRO   3          3HB       PRO   3  -4.073   0.226  -5.699
   22   1HG   PRO   3          2HG       PRO   3  -2.878   2.111  -7.637
   23   2HG   PRO   3          3HG       PRO   3  -3.460   2.427  -6.014
   24   1HD   PRO   3          2HD       PRO   3  -0.724   2.174  -6.837
   25   2HD   PRO   3          3HD       PRO   3  -1.312   2.373  -5.198
   26    H    GLU   4           HN       GLU   4  -0.719   0.406  -8.239
   27    HA   GLU   4           HA       GLU   4  -1.352  -1.432 -10.188
   28   1HB   GLU   4          2HB       GLU   4   0.148   0.919 -10.006
   29   2HB   GLU   4          3HB       GLU   4   1.353  -0.278 -10.439
   30   1HG   GLU   4          2HG       GLU   4  -1.245  -0.384 -11.944
   31   2HG   GLU   4          3HG       GLU   4  -0.202   0.984 -12.279
   32    H    GLU   5           HN       GLU   5   1.144  -1.446  -7.634
   33    HA   GLU   5           HA       GLU   5   2.664  -3.514  -8.728
   34   1HB   GLU   5          2HB       GLU   5   2.521  -2.003  -6.201
   35   2HB   GLU   5          3HB       GLU   5   3.011  -3.667  -5.954
   36   1HG   GLU   5          2HG       GLU   5   4.468  -2.861  -8.233
   37   2HG   GLU   5          3HG       GLU   5   4.500  -1.452  -7.191
   38    H    LEU   6           HN       LEU   6  -0.282  -3.400  -6.724
   39    HA   LEU   6           HA       LEU   6  -0.226  -6.043  -5.822
   40   1HB   LEU   6          2HB       LEU   6  -2.211  -3.861  -6.063
   41   2HB   LEU   6          3HB       LEU   6  -2.863  -5.483  -5.948
   42    HG   LEU   6           HG       LEU   6  -0.851  -4.412  -3.963
   43   1HD1  LEU   6          1HD1      LEU   6  -3.708  -3.767  -4.242
   44   2HD1  LEU   6          2HD1      LEU   6  -3.232  -4.342  -2.626
   45   3HD1  LEU   6          3HD1      LEU   6  -2.416  -2.933  -3.345
   46   1HD2  LEU   6          1HD2      LEU   6  -2.888  -6.446  -3.239
   47   2HD2  LEU   6          2HD2      LEU   6  -1.603  -6.962  -4.358
   48   3HD2  LEU   6          3HD2      LEU   6  -1.179  -6.300  -2.761
   49    H    LYS   7           HN       LYS   7  -1.345  -4.527  -8.873
   50    HA   LYS   7           HA       LYS   7  -2.615  -6.855  -9.842
   51   1HB   LYS   7          2HB       LYS   7  -2.591  -4.228 -10.550
   52   2HB   LYS   7          3HB       LYS   7  -1.534  -4.890 -11.781
   53   1HG   LYS   7          2HG       LYS   7  -4.270  -6.069 -11.112
   54   2HG   LYS   7          3HG       LYS   7  -4.019  -4.881 -12.375
   55   1HD   LYS   7          2HD       LYS   7  -2.045  -6.876 -12.832
   56   2HD   LYS   7          3HD       LYS   7  -3.502  -7.760 -12.425
   57   1HE   LYS   7          2HE       LYS   7  -3.909  -7.484 -14.686
   58   2HE   LYS   7          3HE       LYS   7  -4.621  -5.985 -14.124
   59   1HZ   LYS   7          1HZ       LYS   7  -1.803  -6.189 -14.910
   60   2HZ   LYS   7          2HZ       LYS   7  -2.987  -5.783 -15.960
   61   3HZ   LYS   7          3HZ       LYS   7  -2.674  -4.828 -14.673
   62    H    GLY   8           HN       GLY   8   0.633  -5.361 -10.471
   63   1HA   GLY   8          1HA       GLY   8   1.584  -7.304 -12.216
   64   2HA   GLY   8          2HA       GLY   8   2.557  -6.270 -11.189
   65    H    ILE   9           HN       ILE   9   2.116  -7.009  -8.623
   66    HA   ILE   9           HA       ILE   9   3.559  -9.342  -8.344
   67    HB   ILE   9           HB       ILE   9   1.941  -7.595  -6.560
   68   1HG1  ILE   9          2HG1      ILE   9   4.826  -8.524  -6.612
   69   2HG1  ILE   9          3HG1      ILE   9   4.217  -6.959  -7.109
   70   1HG2  ILE   9          1HG2      ILE   9   2.527 -10.449  -6.021
   71   2HG2  ILE   9          2HG2      ILE   9   2.930  -9.302  -4.721
   72   3HG2  ILE   9          3HG2      ILE   9   1.269  -9.380  -5.356
   73   1HD1  ILE   9          1HD1      ILE   9   3.219  -6.884  -4.643
   74   2HD1  ILE   9          2HD1      ILE   9   4.482  -8.097  -4.327
   75   3HD1  ILE   9          3HD1      ILE   9   4.929  -6.485  -4.934
   76    H    PHE  10           HN       PHE  10  -0.014  -8.793  -8.146
   77    HA   PHE  10           HA       PHE  10  -0.781 -11.304  -7.412
   78   1HB   PHE  10          2HB       PHE  10  -2.440  -9.579  -7.619
   79   2HB   PHE  10          3HB       PHE  10  -1.853  -9.080  -9.193
   80    HD1  PHE  10           HD1      PHE  10  -4.065 -11.333  -7.400
   81    HD2  PHE  10           HD2      PHE  10  -2.469 -10.362 -11.210
   82    HE1  PHE  10           HE1      PHE  10  -5.871 -12.685  -8.501
   83    HE2  PHE  10           HE2      PHE  10  -4.274 -11.713 -12.311
   84    HZ   PHE  10           HZ       PHE  10  -5.954 -12.859 -10.944
   85    H    GLU  11           HN       GLU  11  -0.364 -10.063 -10.807
   86    HA   GLU  11           HA       GLU  11  -0.949 -12.496 -11.988
   87   1HB   GLU  11          2HB       GLU  11   0.015  -9.865 -12.800
   88   2HB   GLU  11          3HB       GLU  11   0.847 -11.116 -13.702
   89   1HG   GLU  11          2HG       GLU  11  -1.919 -11.881 -13.578
   90   2HG   GLU  11          3HG       GLU  11  -1.882 -10.181 -14.001
   91    H    LYS  12           HN       LYS  12   2.081 -11.110 -10.688
   92    HA   LYS  12           HA       LYS  12   3.861 -12.894 -11.867
   93   1HB   LYS  12          2HB       LYS  12   4.213 -10.693 -10.488
   94   2HB   LYS  12          3HB       LYS  12   4.278 -11.770  -9.108
   95   1HG   LYS  12          2HG       LYS  12   6.094 -13.082 -10.188
   96   2HG   LYS  12          3HG       LYS  12   6.005 -12.064 -11.612
   97   1HD   LYS  12          2HD       LYS  12   6.476 -10.065 -10.020
   98   2HD   LYS  12          3HD       LYS  12   6.893 -11.263  -8.811
   99   1HE   LYS  12          2HE       LYS  12   8.528 -12.262 -10.543
  100   2HE   LYS  12          3HE       LYS  12   8.235 -10.834 -11.516
  101   1HZ   LYS  12          1HZ       LYS  12   9.582  -9.692 -10.224
  102   2HZ   LYS  12          2HZ       LYS  12   8.789 -10.111  -8.860
  103   3HZ   LYS  12          3HZ       LYS  12   9.984 -11.064  -9.435
  104    H    TYR  13           HN       TYR  13   1.551 -13.247  -9.214
  105    HA   TYR  13           HA       TYR  13   2.770 -15.777  -8.430
  106   1HB   TYR  13          2HB       TYR  13   0.742 -13.749  -7.442
  107   2HB   TYR  13          3HB       TYR  13   0.475 -15.404  -6.931
  108    HD1  TYR  13           HD1      TYR  13   2.914 -12.601  -6.833
  109    HD2  TYR  13           HD2      TYR  13   1.789 -16.394  -5.204
  110    HE1  TYR  13           HE1      TYR  13   4.597 -12.300  -4.952
  111    HE2  TYR  13           HE2      TYR  13   3.476 -16.080  -3.328
  112    HH   TYR  13           HH       TYR  13   5.665 -14.760  -3.080
  113    H    ALA  14           HN       ALA  14  -0.183 -14.397  -9.951
  114    HA   ALA  14           HA       ALA  14  -1.608 -16.827 -10.003
  115   1HB   ALA  14          1HB       ALA  14  -1.966 -14.619 -12.028
  116   2HB   ALA  14          2HB       ALA  14  -3.196 -15.609 -11.206
  117   3HB   ALA  14          3HB       ALA  14  -2.348 -14.322 -10.315
  118    H    ALA  15           HN       ALA  15   0.983 -15.430 -11.962
  119    HA   ALA  15           HA       ALA  15   0.509 -17.216 -14.168
  120   1HB   ALA  15          1HB       ALA  15   2.772 -16.203 -14.879
  121   2HB   ALA  15          2HB       ALA  15   1.389 -15.091 -14.744
  122   3HB   ALA  15          3HB       ALA  15   2.611 -15.153 -13.451
  123    H    LYS  16           HN       LYS  16   2.100 -17.277 -11.069
  124    HA   LYS  16           HA       LYS  16   4.234 -18.951 -11.573
  125   1HB   LYS  16          2HB       LYS  16   3.012 -17.791  -9.351
  126   2HB   LYS  16          3HB       LYS  16   2.878 -19.512  -9.047
  127   1HG   LYS  16          2HG       LYS  16   5.385 -19.672  -9.694
  128   2HG   LYS  16          3HG       LYS  16   5.417 -17.922  -9.605
  129   1HD   LYS  16          2HD       LYS  16   5.152 -17.885  -7.293
  130   2HD   LYS  16          3HD       LYS  16   4.193 -19.351  -7.266
  131   1HE   LYS  16          2HE       LYS  16   6.146 -20.237  -6.404
  132   2HE   LYS  16          3HE       LYS  16   6.521 -20.444  -8.103
  133   1HZ   LYS  16          1HZ       LYS  16   8.153 -18.997  -7.910
  134   2HZ   LYS  16          2HZ       LYS  16   7.195 -17.852  -7.248
  135   3HZ   LYS  16          3HZ       LYS  16   7.919 -18.962  -6.294
  136    H    GLU  17           HN       GLU  17   0.977 -19.971 -10.311
  137    HA   GLU  17           HA       GLU  17   1.440 -22.464 -11.756
  138   1HB   GLU  17          2HB       GLU  17   0.213 -21.938  -9.036
  139   2HB   GLU  17          3HB       GLU  17  -0.211 -23.386  -9.928
  140   1HG   GLU  17          2HG       GLU  17   2.605 -23.250 -10.128
  141   2HG   GLU  17          3HG       GLU  17   2.267 -22.754  -8.481
  142    H    GLY  18           HN       GLY  18  -0.122 -23.096 -13.222
  143   1HA   GLY  18          1HA       GLY  18  -2.018 -23.065 -14.430
  144   2HA   GLY  18          2HA       GLY  18  -2.852 -22.441 -13.021
  145    H    ASP  19           HN       ASP  19  -3.902 -21.392 -15.171
  146    HA   ASP  19           HA       ASP  19  -2.603 -19.382 -16.479
  147   1HB   ASP  19          2HB       ASP  19  -5.081 -20.460 -16.612
  148   2HB   ASP  19          3HB       ASP  19  -5.498 -19.003 -15.734
  149    HA   PRO  20           HA       PRO  20  -2.381 -16.318 -13.333
  150   1HB   PRO  20          2HB       PRO  20  -1.650 -14.161 -14.843
  151   2HB   PRO  20          3HB       PRO  20  -0.511 -15.368 -14.282
  152   1HG   PRO  20          2HG       PRO  20  -1.619 -14.986 -16.996
  153   2HG   PRO  20          3HG       PRO  20  -0.194 -15.882 -16.508
  154   1HD   PRO  20          2HD       PRO  20  -2.744 -16.975 -17.237
  155   2HD   PRO  20          3HD       PRO  20  -1.356 -17.862 -16.639
  156    H    ASN  21           HN       ASN  21  -4.716 -16.473 -15.659
  157    HA   ASN  21           HA       ASN  21  -5.940 -14.001 -14.874
  158   1HB   ASN  21          2HB       ASN  21  -7.164 -16.209 -16.595
  159   2HB   ASN  21          3HB       ASN  21  -7.597 -14.511 -16.585
  160   1HD2  ASN  21          1HD2      ASN  21  -4.805 -13.637 -16.339
  161   2HD2  ASN  21          2HD2      ASN  21  -4.077 -13.814 -17.901
  162    H    GLN  22           HN       GLN  22  -5.518 -16.833 -13.320
  163    HA   GLN  22           HA       GLN  22  -7.965 -16.564 -11.882
  164   1HB   GLN  22          2HB       GLN  22  -8.119 -19.267 -12.134
  165   2HB   GLN  22          3HB       GLN  22  -9.031 -18.155 -13.134
  166   1HG   GLN  22          2HG       GLN  22  -7.354 -18.263 -14.913
  167   2HG   GLN  22          3HG       GLN  22  -6.257 -19.174 -13.894
  168   1HE2  GLN  22          1HE2      GLN  22  -6.092 -21.070 -14.859
  169   2HE2  GLN  22          2HE2      GLN  22  -7.393 -22.142 -15.257
  170    H    LEU  23           HN       LEU  23  -7.385 -16.659  -9.756
  171    HA   LEU  23           HA       LEU  23  -4.796 -17.709  -9.091
  172   1HB   LEU  23          2HB       LEU  23  -6.963 -16.261  -7.590
  173   2HB   LEU  23          3HB       LEU  23  -5.592 -16.967  -6.758
  174    HG   LEU  23           HG       LEU  23  -5.617 -14.437  -7.536
  175   1HD1  LEU  23          1HD1      LEU  23  -3.006 -14.783  -7.906
  176   2HD1  LEU  23          2HD1      LEU  23  -3.776 -14.980  -6.313
  177   3HD1  LEU  23          3HD1      LEU  23  -3.396 -16.411  -7.301
  178   1HD2  LEU  23          1HD2      LEU  23  -4.230 -14.265  -9.672
  179   2HD2  LEU  23          2HD2      LEU  23  -4.752 -15.933 -10.010
  180   3HD2  LEU  23          3HD2      LEU  23  -5.961 -14.638  -9.850
  181    H    SER  24           HN       SER  24  -4.640 -19.142  -7.028
  182    HA   SER  24           HA       SER  24  -6.847 -21.001  -6.909
  183   1HB   SER  24          2HB       SER  24  -3.982 -21.927  -7.392
  184   2HB   SER  24          3HB       SER  24  -5.387 -22.958  -7.215
  185    HG   SER  24           HG       SER  24  -4.553 -21.396  -9.426
  186    H    LYS  25           HN       LYS  25  -6.308 -22.724  -5.069
  187    HA   LYS  25           HA       LYS  25  -5.912 -21.315  -2.718
  188   1HB   LYS  25          2HB       LYS  25  -7.139 -23.484  -3.021
  189   2HB   LYS  25          3HB       LYS  25  -5.594 -24.300  -3.143
  190   1HG   LYS  25          2HG       LYS  25  -5.217 -22.817  -0.842
  191   2HG   LYS  25          3HG       LYS  25  -6.938 -23.133  -0.751
  192   1HD   LYS  25          2HD       LYS  25  -4.962 -25.369  -1.344
  193   2HD   LYS  25          3HD       LYS  25  -5.307 -24.882   0.304
  194   1HE   LYS  25          2HE       LYS  25  -7.351 -25.904   0.298
  195   2HE   LYS  25          3HE       LYS  25  -7.775 -25.241  -1.268
  196   1HZ   LYS  25          1HZ       LYS  25  -5.767 -27.324  -1.213
  197   2HZ   LYS  25          2HZ       LYS  25  -7.312 -27.769  -0.928
  198   3HZ   LYS  25          3HZ       LYS  25  -6.923 -27.023  -2.327
  199    H    GLU  26           HN       GLU  26  -3.671 -23.696  -4.315
  200    HA   GLU  26           HA       GLU  26  -1.588 -23.226  -2.582
  201   1HB   GLU  26          2HB       GLU  26  -2.076 -24.773  -4.921
  202   2HB   GLU  26          3HB       GLU  26  -0.623 -23.853  -5.257
  203   1HG   GLU  26          2HG       GLU  26  -0.908 -25.250  -2.584
  204   2HG   GLU  26          3HG       GLU  26  -0.463 -26.186  -3.997
  205    H    GLU  27           HN       GLU  27  -2.489 -21.634  -5.690
  206    HA   GLU  27           HA       GLU  27  -0.199 -20.125  -5.955
  207   1HB   GLU  27          2HB       GLU  27  -2.972 -20.074  -7.029
  208   2HB   GLU  27          3HB       GLU  27  -2.149 -18.528  -7.076
  209   1HG   GLU  27          2HG       GLU  27  -0.130 -20.066  -8.020
  210   2HG   GLU  27          3HG       GLU  27  -1.468 -21.091  -8.501
  211    H    LEU  28           HN       LEU  28  -3.414 -19.196  -4.522
  212    HA   LEU  28           HA       LEU  28  -2.631 -16.669  -3.688
  213   1HB   LEU  28          2HB       LEU  28  -4.947 -17.848  -3.847
  214   2HB   LEU  28          3HB       LEU  28  -4.628 -18.334  -2.194
  215    HG   LEU  28           HG       LEU  28  -4.958 -16.254  -1.355
  216   1HD1  LEU  28          1HD1      LEU  28  -3.045 -15.207  -2.369
  217   2HD1  LEU  28          2HD1      LEU  28  -3.878 -15.097  -3.938
  218   3HD1  LEU  28          3HD1      LEU  28  -4.454 -14.135  -2.556
  219   1HD2  LEU  28          1HD2      LEU  28  -6.780 -15.114  -2.438
  220   2HD2  LEU  28          2HD2      LEU  28  -6.386 -15.872  -3.999
  221   3HD2  LEU  28          3HD2      LEU  28  -6.986 -16.869  -2.653
  222    H    LYS  29           HN       LYS  29  -2.442 -19.878  -2.048
  223    HA   LYS  29           HA       LYS  29  -1.727 -19.164   0.445
  224   1HB   LYS  29          2HB       LYS  29  -2.016 -21.470  -0.310
  225   2HB   LYS  29          3HB       LYS  29  -0.540 -21.382  -1.250
  226   1HG   LYS  29          2HG       LYS  29   0.835 -21.482   0.622
  227   2HG   LYS  29          3HG       LYS  29  -0.307 -20.636   1.647
  228   1HD   LYS  29          2HD       LYS  29  -0.486 -22.797   2.513
  229   2HD   LYS  29          3HD       LYS  29  -1.789 -22.818   1.341
  230   1HE   LYS  29          2HE       LYS  29   0.320 -23.597  -0.252
  231   2HE   LYS  29          3HE       LYS  29   0.831 -24.254   1.290
  232   1HZ   LYS  29          1HZ       LYS  29  -1.918 -24.675   0.452
  233   2HZ   LYS  29          2HZ       LYS  29  -0.746 -25.575  -0.242
  234   3HZ   LYS  29          3HZ       LYS  29  -0.961 -25.623   1.376
  235    H    LEU  30           HN       LEU  30   0.589 -19.521  -2.335
  236    HA   LEU  30           HA       LEU  30   2.831 -18.677  -0.980
  237   1HB   LEU  30          2HB       LEU  30   2.139 -18.262  -3.891
  238   2HB   LEU  30          3HB       LEU  30   3.744 -18.178  -3.192
  239    HG   LEU  30           HG       LEU  30   2.034 -20.562  -3.767
  240   1HD1  LEU  30          1HD1      LEU  30   3.660 -20.193  -5.398
  241   2HD1  LEU  30          2HD1      LEU  30   4.904 -19.755  -4.203
  242   3HD1  LEU  30          3HD1      LEU  30   4.377 -21.448  -4.359
  243   1HD2  LEU  30          1HD2      LEU  30   4.074 -20.438  -1.534
  244   2HD2  LEU  30          2HD2      LEU  30   2.355 -20.886  -1.424
  245   3HD2  LEU  30          3HD2      LEU  30   3.499 -21.949  -2.279
  246    H    LEU  31           HN       LEU  31   0.588 -16.683  -3.033
  247    HA   LEU  31           HA       LEU  31   1.774 -14.259  -2.597
  248   1HB   LEU  31          2HB       LEU  31  -0.231 -15.031  -4.073
  249   2HB   LEU  31          3HB       LEU  31  -1.208 -14.544  -2.703
  250    HG   LEU  31           HG       LEU  31   0.685 -12.455  -3.355
  251   1HD1  LEU  31          1HD1      LEU  31   0.794 -12.646  -5.577
  252   2HD1  LEU  31          2HD1      LEU  31  -0.532 -13.832  -5.635
  253   3HD1  LEU  31          3HD1      LEU  31  -0.898 -12.091  -5.579
  254   1HD2  LEU  31          1HD2      LEU  31  -2.276 -12.765  -3.034
  255   2HD2  LEU  31          2HD2      LEU  31  -1.124 -11.752  -2.130
  256   3HD2  LEU  31          3HD2      LEU  31  -1.628 -11.280  -3.771
  257    H    LEU  32           HN       LEU  32  -1.089 -15.537  -0.750
  258    HA   LEU  32           HA       LEU  32  -1.152 -13.606   1.168
  259   1HB   LEU  32          2HB       LEU  32  -1.715 -16.547   1.564
  260   2HB   LEU  32          3HB       LEU  32  -2.315 -15.228   2.550
  261    HG   LEU  32           HG       LEU  32  -2.955 -15.473  -0.395
  262   1HD1  LEU  32          1HD1      LEU  32  -5.257 -16.238   0.739
  263   2HD1  LEU  32          2HD1      LEU  32  -3.998 -17.387   0.224
  264   3HD1  LEU  32          3HD1      LEU  32  -4.120 -16.907   1.934
  265   1HD2  LEU  32          1HD2      LEU  32  -3.753 -13.422  -0.053
  266   2HD2  LEU  32          2HD2      LEU  32  -5.037 -14.194   0.908
  267   3HD2  LEU  32          3HD2      LEU  32  -3.583 -13.558   1.713
  268    H    GLN  33           HN       GLN  33   1.272 -16.076   0.635
  269    HA   GLN  33           HA       GLN  33   2.229 -16.164   3.265
  270   1HB   GLN  33          2HB       GLN  33   2.691 -17.596   0.965
  271   2HB   GLN  33          3HB       GLN  33   4.161 -16.645   1.047
  272   1HG   GLN  33          2HG       GLN  33   4.361 -17.388   3.508
  273   2HG   GLN  33          3HG       GLN  33   3.059 -18.516   3.188
  274   1HE2  GLN  33          1HE2      GLN  33   3.362 -20.268   1.850
  275   2HE2  GLN  33          2HE2      GLN  33   4.921 -20.830   1.345
  276    H    THR  34           HN       THR  34   3.556 -14.539   0.285
  277    HA   THR  34           HA       THR  34   5.263 -12.898   1.957
  278    HB   THR  34           HB       THR  34   5.038 -13.741  -0.888
  279    HG1  THR  34           HG1      THR  34   6.751 -14.343   0.609
  280   1HG2  THR  34          1HG2      THR  34   4.821 -11.419  -1.461
  281   2HG2  THR  34          2HG2      THR  34   5.820 -10.906  -0.080
  282   3HG2  THR  34          3HG2      THR  34   6.577 -11.710  -1.476
  283    H    GLU  35           HN       GLU  35   2.515 -12.429  -0.352
  284    HA   GLU  35           HA       GLU  35   2.361  -9.749  -0.253
  285   1HB   GLU  35          2HB       GLU  35   0.894 -10.986  -1.697
  286   2HB   GLU  35          3HB       GLU  35   0.172 -11.855  -0.358
  287   1HG   GLU  35          2HG       GLU  35  -1.424 -10.170  -0.971
  288   2HG   GLU  35          3HG       GLU  35  -0.689  -9.604   0.516
  289    H    PHE  36           HN       PHE  36   0.541 -11.996   1.964
  290    HA   PHE  36           HA       PHE  36   0.962 -10.123   4.122
  291   1HB   PHE  36          2HB       PHE  36  -1.731 -10.907   2.873
  292   2HB   PHE  36          3HB       PHE  36  -1.639 -10.325   4.524
  293    HD1  PHE  36           HD1      PHE  36  -2.782  -9.240   1.657
  294    HD2  PHE  36           HD2      PHE  36   0.323  -8.160   4.340
  295    HE1  PHE  36           HE1      PHE  36  -2.890  -6.873   0.829
  296    HE2  PHE  36           HE2      PHE  36   0.214  -5.793   3.512
  297    HZ   PHE  36           HZ       PHE  36  -1.391  -5.178   1.767
  298    HA   PRO  37           HA       PRO  37   1.073 -14.373   5.514
  299   1HB   PRO  37          2HB       PRO  37   3.192 -14.092   7.216
  300   2HB   PRO  37          3HB       PRO  37   3.367 -14.569   5.538
  301   1HG   PRO  37          2HG       PRO  37   3.955 -11.958   6.793
  302   2HG   PRO  37          3HG       PRO  37   4.506 -12.584   5.252
  303   1HD   PRO  37          2HD       PRO  37   2.439 -10.642   5.675
  304   2HD   PRO  37          3HD       PRO  37   2.911 -11.354   4.145
  305    H    SER  38           HN       SER  38   0.777 -11.379   7.127
  306    HA   SER  38           HA       SER  38   0.237 -12.470   9.651
  307   1HB   SER  38          2HB       SER  38   0.868 -10.030   8.962
  308   2HB   SER  38          3HB       SER  38  -0.841  -9.817   8.641
  309    HG   SER  38           HG       SER  38   0.216  -9.396  10.935
  310    H    LEU  39           HN       LEU  39  -1.656 -11.886   6.703
  311    HA   LEU  39           HA       LEU  39  -4.199 -12.014   7.933
  312   1HB   LEU  39          2HB       LEU  39  -3.095 -11.574   5.347
  313   2HB   LEU  39          3HB       LEU  39  -4.278 -12.860   5.209
  314    HG   LEU  39           HG       LEU  39  -5.028 -10.415   4.859
  315   1HD1  LEU  39          1HD1      LEU  39  -6.892 -11.597   6.812
  316   2HD1  LEU  39          2HD1      LEU  39  -7.136 -11.144   5.108
  317   3HD1  LEU  39          3HD1      LEU  39  -6.364 -12.695   5.515
  318   1HD2  LEU  39          1HD2      LEU  39  -3.972 -10.098   7.406
  319   2HD2  LEU  39          2HD2      LEU  39  -5.023  -8.953   6.539
  320   3HD2  LEU  39          3HD2      LEU  39  -5.732 -10.129   7.671
  321    H    LEU  40           HN       LEU  40  -1.749 -14.365   7.135
  322    HA   LEU  40           HA       LEU  40  -3.546 -16.565   6.874
  323   1HB   LEU  40          2HB       LEU  40  -0.561 -16.371   7.280
  324   2HB   LEU  40          3HB       LEU  40  -1.420 -17.886   7.082
  325    HG   LEU  40           HG       LEU  40  -1.392 -15.650   5.036
  326   1HD1  LEU  40          1HD1      LEU  40   0.001 -17.525   3.798
  327   2HD1  LEU  40          2HD1      LEU  40   0.779 -16.352   4.889
  328   3HD1  LEU  40          3HD1      LEU  40   0.410 -17.995   5.466
  329   1HD2  LEU  40          1HD2      LEU  40  -2.707 -18.334   5.158
  330   2HD2  LEU  40          2HD2      LEU  40  -3.310 -16.788   4.515
  331   3HD2  LEU  40          3HD2      LEU  40  -2.117 -17.731   3.590
  332    H    LYS  41           HN       LYS  41  -2.007 -14.795   9.507
  333    HA   LYS  41           HA       LYS  41  -2.254 -16.880  11.419
  334   1HB   LYS  41          2HB       LYS  41  -1.253 -15.427  12.859
  335   2HB   LYS  41          3HB       LYS  41  -0.765 -14.690  11.346
  336   1HG   LYS  41          2HG       LYS  41  -1.634 -12.804  12.361
  337   2HG   LYS  41          3HG       LYS  41  -3.114 -13.397  11.633
  338   1HD   LYS  41          2HD       LYS  41  -3.099 -14.814  14.005
  339   2HD   LYS  41          3HD       LYS  41  -2.308 -13.332  14.502
  340   1HE   LYS  41          2HE       LYS  41  -4.234 -12.106  14.334
  341   2HE   LYS  41          3HE       LYS  41  -4.667 -12.824  12.796
  342   1HZ   LYS  41          1HZ       LYS  41  -6.207 -13.841  14.006
  343   2HZ   LYS  41          2HZ       LYS  41  -5.020 -14.856  14.482
  344   3HZ   LYS  41          3HZ       LYS  41  -5.447 -13.597  15.431
  345    H    GLY  42           HN       GLY  42  -4.356 -14.315  10.135
  346   1HA   GLY  42          1HA       GLY  42  -6.243 -13.930  12.011
  347   2HA   GLY  42          2HA       GLY  42  -6.605 -14.117  10.307
  348    H    MET  43           HN       MET  43  -8.499 -14.894  12.206
  349    HA   MET  43           HA       MET  43  -8.229 -17.601  12.897
  350   1HB   MET  43          2HB       MET  43 -10.709 -15.814  12.606
  351   2HB   MET  43          3HB       MET  43 -10.698 -17.361  13.428
  352   1HG   MET  43          2HG       MET  43  -8.734 -15.209  14.273
  353   2HG   MET  43          3HG       MET  43 -10.395 -15.125  14.823
  354   1HE   MET  43          1HE       MET  43  -9.062 -15.769  17.731
  355   2HE   MET  43          2HE       MET  43  -7.534 -16.566  17.285
  356   3HE   MET  43          3HE       MET  43  -8.060 -15.101  16.420
  357    H    SER  44           HN       SER  44  -8.576 -16.175   9.880
  358    HA   SER  44           HA       SER  44 -10.389 -18.177   8.874
  359   1HB   SER  44          2HB       SER  44  -8.981 -15.831   7.528
  360   2HB   SER  44          3HB       SER  44 -10.063 -16.925   6.690
  361    HG   SER  44           HG       SER  44 -10.945 -15.608   9.086
  362    H    THR  45           HN       THR  45  -9.325 -20.171   8.807
  363    HA   THR  45           HA       THR  45  -6.596 -20.472   8.240
  364    HB   THR  45           HB       THR  45  -7.287 -22.890   8.010
  365    HG1  THR  45           HG1      THR  45  -9.396 -23.147   7.393
  366   1HG2  THR  45          1HG2      THR  45  -8.495 -21.205  10.241
  367   2HG2  THR  45          2HG2      THR  45  -8.771 -22.962  10.180
  368   3HG2  THR  45          3HG2      THR  45  -7.115 -22.326  10.327
  369    H    LEU  46           HN       LEU  46  -5.800 -21.894   6.338
  370    HA   LEU  46           HA       LEU  46  -5.952 -20.391   4.052
  371   1HB   LEU  46          2HB       LEU  46  -4.361 -22.313   4.868
  372   2HB   LEU  46          3HB       LEU  46  -5.425 -23.333   3.921
  373    HG   LEU  46           HG       LEU  46  -3.294 -22.452   2.811
  374   1HD1  LEU  46          1HD1      LEU  46  -5.362 -21.646   0.932
  375   2HD1  LEU  46          2HD1      LEU  46  -4.264 -23.047   0.900
  376   3HD1  LEU  46          3HD1      LEU  46  -5.795 -23.137   1.804
  377   1HD2  LEU  46          1HD2      LEU  46  -3.190 -20.262   1.982
  378   2HD2  LEU  46          2HD2      LEU  46  -4.906 -19.947   2.337
  379   3HD2  LEU  46          3HD2      LEU  46  -3.732 -20.080   3.668
  380    H    ASP  47           HN       ASP  47  -7.497 -23.654   4.513
  381    HA   ASP  47           HA       ASP  47  -8.922 -23.743   2.272
  382   1HB   ASP  47          2HB       ASP  47  -9.270 -24.769   5.036
  383   2HB   ASP  47          3HB       ASP  47 -10.771 -24.689   4.136
  384    H    GLU  48           HN       GLU  48  -9.920 -22.196   5.413
  385    HA   GLU  48           HA       GLU  48 -12.405 -21.369   4.642
  386   1HB   GLU  48          2HB       GLU  48 -10.536 -20.838   6.804
  387   2HB   GLU  48          3HB       GLU  48 -11.336 -19.347   6.347
  388   1HG   GLU  48          2HG       GLU  48 -13.512 -20.951   6.348
  389   2HG   GLU  48          3HG       GLU  48 -12.527 -21.880   7.460
  390    H    LEU  49           HN       LEU  49  -9.211 -19.710   4.283
  391    HA   LEU  49           HA       LEU  49 -10.284 -17.357   3.178
  392   1HB   LEU  49          2HB       LEU  49  -7.857 -18.183   4.120
  393   2HB   LEU  49          3HB       LEU  49  -7.557 -18.134   2.394
  394    HG   LEU  49           HG       LEU  49  -8.749 -15.733   2.679
  395   1HD1  LEU  49          1HD1      LEU  49  -8.814 -14.895   4.737
  396   2HD1  LEU  49          2HD1      LEU  49  -8.474 -16.536   5.337
  397   3HD1  LEU  49          3HD1      LEU  49  -7.137 -15.392   5.068
  398   1HD2  LEU  49          1HD2      LEU  49  -6.007 -16.722   2.535
  399   2HD2  LEU  49          2HD2      LEU  49  -6.794 -15.378   1.672
  400   3HD2  LEU  49          3HD2      LEU  49  -6.123 -15.119   3.301
  401    H    PHE  50           HN       PHE  50  -9.107 -20.458   1.783
  402    HA   PHE  50           HA       PHE  50  -9.160 -19.673  -0.878
  403   1HB   PHE  50          2HB       PHE  50  -8.205 -21.795   0.191
  404   2HB   PHE  50          3HB       PHE  50  -9.842 -22.362   0.457
  405    HD1  PHE  50           HD1      PHE  50  -8.668 -20.624  -2.591
  406    HD2  PHE  50           HD2      PHE  50  -9.768 -24.332  -0.846
  407    HE1  PHE  50           HE1      PHE  50  -8.668 -21.692  -4.862
  408    HE2  PHE  50           HE2      PHE  50  -9.767 -25.401  -3.117
  409    HZ   PHE  50           HZ       PHE  50  -9.218 -24.068  -5.098
  410    H    GLU  51           HN       GLU  51 -11.699 -21.376   1.093
  411    HA   GLU  51           HA       GLU  51 -13.543 -21.309  -1.022
  412   1HB   GLU  51          2HB       GLU  51 -15.122 -22.206   0.589
  413   2HB   GLU  51          3HB       GLU  51 -13.566 -22.963   0.869
  414   1HG   GLU  51          2HG       GLU  51 -14.252 -22.378   3.050
  415   2HG   GLU  51          3HG       GLU  51 -13.172 -21.065   2.625
  416    H    GLU  52           HN       GLU  52 -12.892 -19.235   1.844
  417    HA   GLU  52           HA       GLU  52 -15.184 -17.697   1.636
  418   1HB   GLU  52          2HB       GLU  52 -13.761 -17.705   3.638
  419   2HB   GLU  52          3HB       GLU  52 -12.424 -17.015   2.738
  420   1HG   GLU  52          2HG       GLU  52 -14.213 -15.097   2.181
  421   2HG   GLU  52          3HG       GLU  52 -14.992 -15.698   3.631
  422    H    LEU  53           HN       LEU  53 -11.804 -17.018   0.466
  423    HA   LEU  53           HA       LEU  53 -12.383 -14.641  -0.809
  424   1HB   LEU  53          2HB       LEU  53 -10.331 -16.735  -1.540
  425   2HB   LEU  53          3HB       LEU  53 -10.335 -15.073  -2.093
  426    HG   LEU  53           HG       LEU  53 -10.316 -15.617   0.857
  427   1HD1  LEU  53          1HD1      LEU  53  -7.626 -15.312  -0.142
  428   2HD1  LEU  53          2HD1      LEU  53  -8.312 -16.566   0.919
  429   3HD1  LEU  53          3HD1      LEU  53  -8.395 -16.752  -0.850
  430   1HD2  LEU  53          1HD2      LEU  53  -9.163 -13.518   0.982
  431   2HD2  LEU  53          2HD2      LEU  53  -8.965 -13.462  -0.786
  432   3HD2  LEU  53          3HD2      LEU  53 -10.587 -13.316  -0.067
  433    H    ASP  54           HN       ASP  54 -12.247 -17.983  -2.236
  434    HA   ASP  54           HA       ASP  54 -13.210 -17.101  -4.703
  435   1HB   ASP  54          2HB       ASP  54 -11.994 -19.342  -3.924
  436   2HB   ASP  54          3HB       ASP  54 -13.630 -19.922  -3.683
  437    H    LYS  55           HN       LYS  55 -15.094 -15.777  -3.736
  438    HA   LYS  55           HA       LYS  55 -17.234 -17.125  -2.481
  439   1HB   LYS  55          2HB       LYS  55 -16.468 -14.512  -2.800
  440   2HB   LYS  55          3HB       LYS  55 -17.825 -14.607  -3.904
  441   1HG   LYS  55          2HG       LYS  55 -18.147 -15.847  -1.173
  442   2HG   LYS  55          3HG       LYS  55 -18.165 -14.098  -1.282
  443   1HD   LYS  55          2HD       LYS  55 -20.102 -14.066  -2.650
  444   2HD   LYS  55          3HD       LYS  55 -19.873 -15.717  -3.190
  445   1HE   LYS  55          2HE       LYS  55 -20.278 -16.421  -0.723
  446   2HE   LYS  55          3HE       LYS  55 -20.826 -14.778  -0.452
  447   1HZ   LYS  55          1HZ       LYS  55 -21.940 -16.602  -2.469
  448   2HZ   LYS  55          2HZ       LYS  55 -22.627 -16.258  -1.029
  449   3HZ   LYS  55          3HZ       LYS  55 -22.469 -15.089  -2.158
  450    H    ASN  56           HN       ASN  56 -16.121 -16.882  -5.772
  451    HA   ASN  56           HA       ASN  56 -18.690 -17.303  -6.908
  452   1HB   ASN  56          2HB       ASN  56 -17.393 -17.610  -9.034
  453   2HB   ASN  56          3HB       ASN  56 -16.914 -16.149  -8.193
  454   1HD2  ASN  56          1HD2      ASN  56 -15.126 -16.775  -9.847
  455   2HD2  ASN  56          2HD2      ASN  56 -13.760 -17.618  -9.196
  456    H    GLY  57           HN       GLY  57 -18.626 -19.339  -8.661
  457   1HA   GLY  57          1HA       GLY  57 -17.838 -21.715  -7.083
  458   2HA   GLY  57          2HA       GLY  57 -19.277 -21.608  -8.077
  459    H    ASP  58           HN       ASP  58 -15.782 -20.721  -8.587
  460    HA   ASP  58           HA       ASP  58 -15.898 -22.424 -10.951
  461   1HB   ASP  58          2HB       ASP  58 -14.099 -19.988 -10.715
  462   2HB   ASP  58          3HB       ASP  58 -14.561 -20.850 -12.169
  463    H    GLY  59           HN       GLY  59 -13.682 -20.646  -8.659
  464   1HA   GLY  59          1HA       GLY  59 -12.325 -22.217  -7.255
  465   2HA   GLY  59          2HA       GLY  59 -11.837 -22.955  -8.768
  466    H    GLU  60           HN       GLU  60 -12.274 -19.765  -9.591
  467    HA   GLU  60           HA       GLU  60  -9.478 -19.191  -8.991
  468   1HB   GLU  60          2HB       GLU  60  -9.437 -17.845 -11.047
  469   2HB   GLU  60          3HB       GLU  60  -9.963 -19.478 -11.406
  470   1HG   GLU  60          2HG       GLU  60 -12.384 -18.258 -10.866
  471   2HG   GLU  60          3HG       GLU  60 -11.486 -16.919 -11.555
  472    H    VAL  61           HN       VAL  61  -9.048 -17.449  -7.692
  473    HA   VAL  61           HA       VAL  61 -11.254 -15.939  -6.688
  474    HB   VAL  61           HB       VAL  61  -8.342 -16.229  -6.156
  475   1HG1  VAL  61          1HG1      VAL  61  -8.261 -14.278  -4.702
  476   2HG1  VAL  61          2HG1      VAL  61  -8.639 -13.778  -6.368
  477   3HG1  VAL  61          3HG1      VAL  61  -9.930 -13.845  -5.145
  478   1HG2  VAL  61          1HG2      VAL  61  -9.061 -16.675  -3.927
  479   2HG2  VAL  61          2HG2      VAL  61 -10.676 -15.994  -4.237
  480   3HG2  VAL  61          3HG2      VAL  61 -10.193 -17.525  -5.006
  481    H    SER  62           HN       SER  62  -8.189 -15.061  -8.444
  482    HA   SER  62           HA       SER  62  -7.745 -13.485  -9.868
  483   1HB   SER  62          2HB       SER  62 -10.227 -12.368 -10.704
  484   2HB   SER  62          3HB       SER  62  -9.231 -13.525 -11.564
  485    HG   SER  62           HG       SER  62 -11.551 -13.953  -9.978
  486    H    PHE  63           HN       PHE  63  -7.730 -11.052 -10.139
  487    HA   PHE  63           HA       PHE  63  -7.585  -9.741  -7.769
  488   1HB   PHE  63          2HB       PHE  63  -6.818  -9.098 -10.163
  489   2HB   PHE  63          3HB       PHE  63  -8.466  -8.594 -10.484
  490    HD1  PHE  63           HD1      PHE  63  -8.366  -6.290 -10.741
  491    HD2  PHE  63           HD2      PHE  63  -6.380  -8.069  -7.440
  492    HE1  PHE  63           HE1      PHE  63  -7.847  -4.012  -9.825
  493    HE2  PHE  63           HE2      PHE  63  -5.861  -5.790  -6.524
  494    HZ   PHE  63           HZ       PHE  63  -6.601  -3.789  -7.727
  495    H    GLU  64           HN       GLU  64 -10.452 -10.264  -9.839
  496    HA   GLU  64           HA       GLU  64 -12.083  -8.323  -8.845
  497   1HB   GLU  64          2HB       GLU  64 -13.922 -10.187  -9.323
  498   2HB   GLU  64          3HB       GLU  64 -13.022  -9.456 -10.636
  499   1HG   GLU  64          2HG       GLU  64 -11.959 -11.410 -11.149
  500   2HG   GLU  64          3HG       GLU  64 -11.585 -11.750  -9.471
  501    H    GLU  65           HN       GLU  65 -11.784 -11.758  -7.675
  502    HA   GLU  65           HA       GLU  65 -13.398 -11.185  -5.422
  503   1HB   GLU  65          2HB       GLU  65 -11.642 -13.588  -6.087
  504   2HB   GLU  65          3HB       GLU  65 -12.753 -13.523  -4.734
  505   1HG   GLU  65          2HG       GLU  65 -14.651 -13.612  -6.094
  506   2HG   GLU  65          3HG       GLU  65 -13.858 -12.826  -7.445
  507    H    PHE  66           HN       PHE  66  -9.981 -10.987  -6.219
  508    HA   PHE  66           HA       PHE  66  -8.864 -11.306  -3.704
  509   1HB   PHE  66          2HB       PHE  66  -7.844 -11.018  -6.106
  510   2HB   PHE  66          3HB       PHE  66  -8.070  -9.294  -5.887
  511    HD1  PHE  66           HD1      PHE  66  -6.919  -8.207  -3.855
  512    HD2  PHE  66           HD2      PHE  66  -5.905 -12.058  -5.322
  513    HE1  PHE  66           HE1      PHE  66  -4.696  -8.062  -2.698
  514    HE2  PHE  66           HE2      PHE  66  -3.682 -11.913  -4.165
  515    HZ   PHE  66           HZ       PHE  66  -3.104  -9.917  -2.867
  516    H    GLN  67           HN       GLN  67 -10.480  -8.499  -5.244
  517    HA   GLN  67           HA       GLN  67  -9.609  -6.586  -3.456
  518   1HB   GLN  67          2HB       GLN  67 -12.236  -6.745  -4.999
  519   2HB   GLN  67          3HB       GLN  67 -11.623  -5.297  -4.226
  520   1HG   GLN  67          2HG       GLN  67  -9.440  -6.185  -5.756
  521   2HG   GLN  67          3HG       GLN  67 -10.818  -6.539  -6.779
  522   1HE2  GLN  67          1HE2      GLN  67  -9.304  -4.799  -7.855
  523   2HE2  GLN  67          2HE2      GLN  67  -9.850  -3.162  -7.710
  524    H    VAL  68           HN       VAL  68 -11.621  -9.320  -2.948
  525    HA   VAL  68           HA       VAL  68 -13.321  -8.180  -0.965
  526    HB   VAL  68           HB       VAL  68 -12.608 -11.067  -1.510
  527   1HG1  VAL  68          1HG1      VAL  68 -13.963 -11.545   0.194
  528   2HG1  VAL  68          2HG1      VAL  68 -14.276  -9.813   0.463
  529   3HG1  VAL  68          3HG1      VAL  68 -15.300 -10.738  -0.661
  530   1HG2  VAL  68          1HG2      VAL  68 -13.427  -9.811  -3.528
  531   2HG2  VAL  68          2HG2      VAL  68 -14.466 -11.167  -3.025
  532   3HG2  VAL  68          3HG2      VAL  68 -14.940  -9.494  -2.644
  533    H    LEU  69           HN       LEU  69 -10.142  -9.825  -1.057
  534    HA   LEU  69           HA       LEU  69 -10.020 -10.065   1.791
  535   1HB   LEU  69          2HB       LEU  69  -8.918 -11.508  -0.057
  536   2HB   LEU  69          3HB       LEU  69  -7.689 -10.258  -0.092
  537    HG   LEU  69           HG       LEU  69  -6.996 -10.704   2.123
  538   1HD1  LEU  69          1HD1      LEU  69  -9.680 -11.963   2.405
  539   2HD1  LEU  69          2HD1      LEU  69  -8.343 -12.638   3.367
  540   3HD1  LEU  69          3HD1      LEU  69  -8.772 -10.917   3.524
  541   1HD2  LEU  69          1HD2      LEU  69  -7.000 -13.422   1.989
  542   2HD2  LEU  69          2HD2      LEU  69  -7.348 -12.992   0.297
  543   3HD2  LEU  69          3HD2      LEU  69  -5.886 -12.361   1.093
  544    H    VAL  70           HN       VAL  70  -8.924  -7.765  -0.726
  545    HA   VAL  70           HA       VAL  70  -7.119  -6.299   0.711
  546    HB   VAL  70           HB       VAL  70  -9.051  -5.748  -1.494
  547   1HG1  VAL  70          1HG1      VAL  70  -7.920  -3.405  -1.615
  548   2HG1  VAL  70          2HG1      VAL  70  -9.293  -3.651  -0.508
  549   3HG1  VAL  70          3HG1      VAL  70  -7.629  -3.641   0.125
  550   1HG2  VAL  70          1HG2      VAL  70  -6.077  -5.224  -1.422
  551   2HG2  VAL  70          2HG2      VAL  70  -6.730  -6.859  -1.684
  552   3HG2  VAL  70          3HG2      VAL  70  -7.126  -5.549  -2.823
  553    H    LYS  71           HN       LYS  71 -10.569  -6.670   1.207
  554    HA   LYS  71           HA       LYS  71 -10.959  -4.233   2.599
  555   1HB   LYS  71          2HB       LYS  71 -12.587  -6.148   1.519
  556   2HB   LYS  71          3HB       LYS  71 -12.727  -6.516   3.226
  557   1HG   LYS  71          2HG       LYS  71 -12.939  -3.796   3.345
  558   2HG   LYS  71          3HG       LYS  71 -13.579  -4.058   1.735
  559   1HD   LYS  71          2HD       LYS  71 -15.501  -5.019   2.521
  560   2HD   LYS  71          3HD       LYS  71 -14.646  -5.989   3.703
  561   1HE   LYS  71          2HE       LYS  71 -15.277  -4.564   5.350
  562   2HE   LYS  71          3HE       LYS  71 -14.431  -3.251   4.555
  563   1HZ   LYS  71          1HZ       LYS  71 -16.659  -2.632   4.680
  564   2HZ   LYS  71          2HZ       LYS  71 -16.451  -3.065   3.120
  565   3HZ   LYS  71          3HZ       LYS  71 -17.213  -4.074   4.153
  566    H    LYS  72           HN       LYS  72 -10.105  -7.606   3.533
  567    HA   LYS  72           HA       LYS  72 -10.195  -7.057   6.310
  568   1HB   LYS  72          2HB       LYS  72  -8.983  -9.303   4.680
  569   2HB   LYS  72          3HB       LYS  72  -8.946  -9.260   6.431
  570   1HG   LYS  72          2HG       LYS  72 -11.521  -9.040   4.804
  571   2HG   LYS  72          3HG       LYS  72 -10.899 -10.559   5.419
  572   1HD   LYS  72          2HD       LYS  72 -10.816  -9.032   7.707
  573   2HD   LYS  72          3HD       LYS  72 -12.181  -8.296   6.891
  574   1HE   LYS  72          2HE       LYS  72 -12.916 -10.844   6.503
  575   2HE   LYS  72          3HE       LYS  72 -11.867 -11.137   7.876
  576   1HZ   LYS  72          1HZ       LYS  72 -13.511  -8.913   8.360
  577   2HZ   LYS  72          2HZ       LYS  72 -14.429 -10.198   7.943
  578   3HZ   LYS  72          3HZ       LYS  72 -13.396 -10.307   9.203
  579    H    ILE  73           HN       ILE  73  -7.595  -7.130   3.807
  580    HA   ILE  73           HA       ILE  73  -5.572  -6.503   5.715
  581    HB   ILE  73           HB       ILE  73  -5.514  -6.342   2.701
  582   1HG1  ILE  73          2HG1      ILE  73  -4.363  -8.683   4.116
  583   2HG1  ILE  73          3HG1      ILE  73  -6.112  -8.595   4.085
  584   1HG2  ILE  73          1HG2      ILE  73  -3.014  -7.079   3.797
  585   2HG2  ILE  73          2HG2      ILE  73  -3.449  -5.576   2.949
  586   3HG2  ILE  73          3HG2      ILE  73  -3.590  -5.671   4.721
  587   1HD1  ILE  73          1HD1      ILE  73  -6.228  -8.748   1.751
  588   2HD1  ILE  73          2HD1      ILE  73  -4.599  -8.068   1.524
  589   3HD1  ILE  73          3HD1      ILE  73  -4.793  -9.745   2.088
  590    H    SER  74           HN       SER  74  -8.140  -4.743   4.407
  591    HA   SER  74           HA       SER  74  -6.649  -2.289   4.221
  592   1HB   SER  74          2HB       SER  74  -9.427  -3.199   3.542
  593   2HB   SER  74          3HB       SER  74  -9.230  -1.502   3.932
  594    HG   SER  74           HG       SER  74  -8.928  -2.282   1.589
  595    H    GLN  75           HN       GLN  75  -8.926  -4.017   6.368
  596    HA   GLN  75           HA       GLN  75  -9.483  -1.793   7.986
  597   1HB   GLN  75          2HB       GLN  75 -10.528  -4.322   7.710
  598   2HB   GLN  75          3HB       GLN  75  -9.644  -4.504   9.212
  599   1HG   GLN  75          2HG       GLN  75 -11.661  -3.698  10.045
  600   2HG   GLN  75          3HG       GLN  75 -10.807  -2.182   9.831
  601   1HE2  GLN  75          1HE2      GLN  75 -12.530  -4.477   7.712
  602   2HE2  GLN  75          2HE2      GLN  75 -13.564  -3.324   6.937
  Start of MODEL   19
    1    H    LYS   1           HN       LYS   1   1.884   0.000   0.829
    2    HA   LYS   1           HA       LYS   1   1.965   0.988  -1.692
    3   1HB   LYS   1          2HB       LYS   1   3.708  -0.540   0.055
    4   2HB   LYS   1          3HB       LYS   1   3.944  -1.007  -1.617
    5   1HG   LYS   1          2HG       LYS   1   4.218   1.395  -2.255
    6   2HG   LYS   1          3HG       LYS   1   3.970   1.869  -0.586
    7   1HD   LYS   1          2HD       LYS   1   6.007   0.775   0.133
    8   2HD   LYS   1          3HD       LYS   1   6.175  -0.074  -1.391
    9   1HE   LYS   1          2HE       LYS   1   7.555   1.633  -2.010
   10   2HE   LYS   1          3HE       LYS   1   6.094   2.575  -2.233
   11   1HZ   LYS   1          1HZ       LYS   1   6.519   3.747  -0.412
   12   2HZ   LYS   1          2HZ       LYS   1   6.994   2.461   0.474
   13   3HZ   LYS   1          3HZ       LYS   1   8.049   3.191  -0.535
   14    H    SER   2           HN       SER   2   1.090  -2.319  -0.638
   15    HA   SER   2           HA       SER   2   1.052  -3.289  -3.302
   16   1HB   SER   2          2HB       SER   2   0.679  -4.348  -0.591
   17   2HB   SER   2          3HB       SER   2  -0.505  -5.013  -1.698
   18    HG   SER   2           HG       SER   2   1.225  -5.685  -3.103
   19    HA   PRO   3           HA       PRO   3  -3.084  -2.355  -4.284
   20   1HB   PRO   3          2HB       PRO   3  -3.924  -4.506  -5.746
   21   2HB   PRO   3          3HB       PRO   3  -2.906  -3.239  -6.403
   22   1HG   PRO   3          2HG       PRO   3  -2.163  -5.987  -5.603
   23   2HG   PRO   3          3HG       PRO   3  -1.291  -4.869  -6.633
   24   1HD   PRO   3          2HD       PRO   3  -0.693  -5.509  -3.902
   25   2HD   PRO   3          3HD       PRO   3   0.106  -4.308  -4.896
   26    H    GLU   4           HN       GLU   4  -2.859  -5.672  -3.118
   27    HA   GLU   4           HA       GLU   4  -5.498  -5.873  -2.384
   28   1HB   GLU   4          2HB       GLU   4  -3.131  -7.426  -2.157
   29   2HB   GLU   4          3HB       GLU   4  -3.757  -7.294  -0.525
   30   1HG   GLU   4          2HG       GLU   4  -6.030  -7.765  -2.182
   31   2HG   GLU   4          3HG       GLU   4  -4.789  -8.857  -2.764
   32    H    GLU   5           HN       GLU   5  -2.722  -4.322  -0.776
   33    HA   GLU   5           HA       GLU   5  -3.909  -4.129   1.743
   34   1HB   GLU   5          2HB       GLU   5  -1.485  -3.210   0.406
   35   2HB   GLU   5          3HB       GLU   5  -2.135  -1.934   1.417
   36   1HG   GLU   5          2HG       GLU   5  -2.408  -4.201   3.036
   37   2HG   GLU   5          3HG       GLU   5  -0.898  -4.506   2.200
   38    H    LEU   6           HN       LEU   6  -4.013  -2.114  -1.214
   39    HA   LEU   6           HA       LEU   6  -5.094   0.184  -0.100
   40   1HB   LEU   6          2HB       LEU   6  -4.932  -1.055  -2.786
   41   2HB   LEU   6          3HB       LEU   6  -6.165   0.172  -2.571
   42    HG   LEU   6           HG       LEU   6  -3.227   0.584  -1.951
   43   1HD1  LEU   6          1HD1      LEU   6  -2.809   1.186  -4.066
   44   2HD1  LEU   6          2HD1      LEU   6  -4.270   0.250  -4.461
   45   3HD1  LEU   6          3HD1      LEU   6  -4.374   2.014  -4.247
   46   1HD2  LEU   6          1HD2      LEU   6  -4.000   2.339  -0.812
   47   2HD2  LEU   6          2HD2      LEU   6  -4.382   3.049  -2.399
   48   3HD2  LEU   6          3HD2      LEU   6  -5.638   2.174  -1.490
   49    H    LYS   7           HN       LYS   7  -6.582  -2.926  -1.065
   50    HA   LYS   7           HA       LYS   7  -9.242  -2.023  -0.856
   51   1HB   LYS   7          2HB       LYS   7  -8.041  -4.236  -1.855
   52   2HB   LYS   7          3HB       LYS   7  -8.624  -4.881  -0.334
   53   1HG   LYS   7          2HG       LYS   7 -10.800  -3.368  -1.255
   54   2HG   LYS   7          3HG       LYS   7 -10.147  -4.059  -2.727
   55   1HD   LYS   7          2HD       LYS   7 -10.386  -5.923  -0.390
   56   2HD   LYS   7          3HD       LYS   7 -11.894  -5.381  -1.099
   57   1HE   LYS   7          2HE       LYS   7 -11.400  -7.318  -2.359
   58   2HE   LYS   7          3HE       LYS   7 -10.825  -6.030  -3.399
   59   1HZ   LYS   7          1HZ       LYS   7  -8.977  -7.256  -3.351
   60   2HZ   LYS   7          2HZ       LYS   7  -8.674  -6.485  -1.944
   61   3HZ   LYS   7          3HZ       LYS   7  -9.319  -7.985  -1.931
   62    H    GLY   8           HN       GLY   8  -7.144  -3.937   1.413
   63   1HA   GLY   8          1HA       GLY   8  -8.944  -4.037   3.530
   64   2HA   GLY   8          2HA       GLY   8  -7.198  -4.140   3.649
   65    H    ILE   9           HN       ILE   9  -6.235  -1.682   2.912
   66    HA   ILE   9           HA       ILE   9  -6.639  -0.142   5.162
   67    HB   ILE   9           HB       ILE   9  -5.321   0.163   2.538
   68   1HG1  ILE   9          2HG1      ILE   9  -4.511   0.627   5.421
   69   2HG1  ILE   9          3HG1      ILE   9  -4.122  -0.763   4.428
   70   1HG2  ILE   9          1HG2      ILE   9  -6.547   2.261   2.601
   71   2HG2  ILE   9          2HG2      ILE   9  -5.970   2.575   4.255
   72   3HG2  ILE   9          3HG2      ILE   9  -4.815   2.543   2.900
   73   1HD1  ILE   9          1HD1      ILE   9  -3.185   2.108   4.005
   74   2HD1  ILE   9          2HD1      ILE   9  -2.187   0.697   4.432
   75   3HD1  ILE   9          3HD1      ILE   9  -2.929   0.807   2.818
   76    H    PHE  10           HN       PHE  10  -8.058   0.218   1.845
   77    HA   PHE  10           HA       PHE  10  -9.480   2.506   2.260
   78   1HB   PHE  10          2HB       PHE  10  -9.333   1.374   0.087
   79   2HB   PHE  10          3HB       PHE  10 -10.005  -0.106   0.742
   80    HD1  PHE  10           HD1      PHE  10 -10.736   3.053  -0.806
   81    HD2  PHE  10           HD2      PHE  10 -12.443  -0.151   1.391
   82    HE1  PHE  10           HE1      PHE  10 -13.025   3.761  -1.552
   83    HE2  PHE  10           HE2      PHE  10 -14.732   0.557   0.645
   84    HZ   PHE  10           HZ       PHE  10 -14.996   2.504  -0.818
   85    H    GLU  11           HN       GLU  11 -10.637  -0.901   2.802
   86    HA   GLU  11           HA       GLU  11 -13.108  -0.129   3.775
   87   1HB   GLU  11          2HB       GLU  11 -11.588  -2.575   3.441
   88   2HB   GLU  11          3HB       GLU  11 -12.361  -2.597   5.014
   89   1HG   GLU  11          2HG       GLU  11 -14.467  -1.697   3.585
   90   2HG   GLU  11          3HG       GLU  11 -13.620  -2.501   2.278
   91    H    LYS  12           HN       LYS  12  -9.948  -0.711   5.397
   92    HA   LYS  12           HA       LYS  12 -10.894  -0.594   8.019
   93   1HB   LYS  12          2HB       LYS  12  -8.663  -1.444   7.233
   94   2HB   LYS  12          3HB       LYS  12  -8.158   0.217   6.998
   95   1HG   LYS  12          2HG       LYS  12  -9.005   0.516   9.512
   96   2HG   LYS  12          3HG       LYS  12  -8.793  -1.222   9.582
   97   1HD   LYS  12          2HD       LYS  12  -6.442  -1.059   9.025
   98   2HD   LYS  12          3HD       LYS  12  -6.595   0.623   8.559
   99   1HE   LYS  12          2HE       LYS  12  -7.533   0.200  11.312
  100   2HE   LYS  12          3HE       LYS  12  -5.886  -0.364  11.113
  101   1HZ   LYS  12          1HZ       LYS  12  -6.478   2.141  11.556
  102   2HZ   LYS  12          2HZ       LYS  12  -5.160   1.703  10.697
  103   3HZ   LYS  12          3HZ       LYS  12  -6.514   2.187   9.924
  104    H    TYR  13           HN       TYR  13 -10.561   1.843   5.548
  105    HA   TYR  13           HA       TYR  13 -10.570   3.985   7.529
  106   1HB   TYR  13          2HB       TYR  13  -9.945   3.490   4.638
  107   2HB   TYR  13          3HB       TYR  13 -10.797   4.999   4.898
  108    HD1  TYR  13           HD1      TYR  13  -7.626   3.309   5.080
  109    HD2  TYR  13           HD2      TYR  13  -9.799   6.693   6.540
  110    HE1  TYR  13           HE1      TYR  13  -5.444   4.435   5.737
  111    HE2  TYR  13           HE2      TYR  13  -7.609   7.808   7.192
  112    HH   TYR  13           HH       TYR  13  -4.549   6.080   6.899
  113    H    ALA  14           HN       ALA  14 -12.549   2.620   4.824
  114    HA   ALA  14           HA       ALA  14 -14.612   4.525   5.087
  115   1HB   ALA  14          1HB       ALA  14 -14.521   3.440   3.019
  116   2HB   ALA  14          2HB       ALA  14 -14.258   1.840   3.755
  117   3HB   ALA  14          3HB       ALA  14 -15.868   2.597   3.821
  118    H    ALA  15           HN       ALA  15 -13.538   2.060   7.167
  119    HA   ALA  15           HA       ALA  15 -16.165   1.331   8.124
  120   1HB   ALA  15          1HB       ALA  15 -14.222  -0.263   7.984
  121   2HB   ALA  15          2HB       ALA  15 -13.410   0.691   9.248
  122   3HB   ALA  15          3HB       ALA  15 -14.940  -0.144   9.608
  123    H    LYS  16           HN       LYS  16 -13.763   3.806   8.625
  124    HA   LYS  16           HA       LYS  16 -14.067   4.350  11.310
  125   1HB   LYS  16          2HB       LYS  16 -13.190   5.820   8.892
  126   2HB   LYS  16          3HB       LYS  16 -13.706   6.825  10.231
  127   1HG   LYS  16          2HG       LYS  16 -11.485   6.515  10.834
  128   2HG   LYS  16          3HG       LYS  16 -12.194   5.145  11.665
  129   1HD   LYS  16          2HD       LYS  16 -11.758   3.911   9.325
  130   2HD   LYS  16          3HD       LYS  16 -10.575   5.186   9.114
  131   1HE   LYS  16          2HE       LYS  16 -10.117   4.338  11.748
  132   2HE   LYS  16          3HE       LYS  16 -10.504   2.844  10.917
  133   1HZ   LYS  16          1HZ       LYS  16  -8.204   4.471  10.673
  134   2HZ   LYS  16          2HZ       LYS  16  -8.429   2.921  10.210
  135   3HZ   LYS  16          3HZ       LYS  16  -8.855   4.141   9.212
  136    H    GLU  17           HN       GLU  17 -15.770   6.098   8.612
  137    HA   GLU  17           HA       GLU  17 -18.016   6.319  10.462
  138   1HB   GLU  17          2HB       GLU  17 -16.809   8.360   8.576
  139   2HB   GLU  17          3HB       GLU  17 -18.495   8.482   9.036
  140   1HG   GLU  17          2HG       GLU  17 -17.155   8.002  11.474
  141   2HG   GLU  17          3HG       GLU  17 -16.088   9.092  10.611
  142    H    GLY  18           HN       GLY  18 -19.993   5.601   9.712
  143   1HA   GLY  18          1HA       GLY  18 -21.570   4.850   8.287
  144   2HA   GLY  18          2HA       GLY  18 -20.699   5.592   6.960
  145    H    ASP  19           HN       ASP  19 -21.755   3.315   6.183
  146    HA   ASP  19           HA       ASP  19 -20.607   0.956   6.873
  147   1HB   ASP  19          2HB       ASP  19 -22.509   1.641   5.129
  148   2HB   ASP  19          3HB       ASP  19 -21.199   1.566   3.967
  149    HA   PRO  20           HA       PRO  20 -16.572   1.295   5.174
  150   1HB   PRO  20          2HB       PRO  20 -15.829  -1.334   5.112
  151   2HB   PRO  20          3HB       PRO  20 -15.763  -0.353   6.563
  152   1HG   PRO  20          2HG       PRO  20 -17.712  -2.452   5.833
  153   2HG   PRO  20          3HG       PRO  20 -17.370  -1.773   7.411
  154   1HD   PRO  20          2HD       PRO  20 -19.628  -1.185   5.743
  155   2HD   PRO  20          3HD       PRO  20 -19.225  -0.422   7.268
  156    H    ASN  21           HN       ASN  21 -19.155   0.186   3.513
  157    HA   ASN  21           HA       ASN  21 -17.600  -0.624   1.234
  158   1HB   ASN  21          2HB       ASN  21 -20.568  -0.528   1.901
  159   2HB   ASN  21          3HB       ASN  21 -20.060  -0.736   0.237
  160   1HD2  ASN  21          1HD2      ASN  21 -21.049  -2.338   2.858
  161   2HD2  ASN  21          2HD2      ASN  21 -20.281  -3.877   2.658
  162    H    GLN  22           HN       GLN  22 -19.739   2.015   2.431
  163    HA   GLN  22           HA       GLN  22 -19.205   3.465  -0.037
  164   1HB   GLN  22          2HB       GLN  22 -21.123   4.972   1.103
  165   2HB   GLN  22          3HB       GLN  22 -21.498   3.581   0.105
  166   1HG   GLN  22          2HG       GLN  22 -21.788   2.153   2.057
  167   2HG   GLN  22          3HG       GLN  22 -21.137   3.379   3.127
  168   1HE2  G