*HEADER    ELECTRON TRANSPORT                      28-FEB-05   1YZC              
*TITLE     THE SOLUTION STRUCTURE OF A REDESIGNED APOCYTOCHROME B562             
*TITLE    2 (RD-APOCYT B562) WITH THE N- AND A PART OF THE C-TERMINAL            
*TITLE    3 HELICES UNFOLDED                                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: EDESIGNED APO-CYTOCHROME B562;                             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 MUTATION: YES                                                        
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) PLYSS CELLS;                     
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: ET17B                                     
*KEYWDS    FOLDING INTERMEDIATES, NATIVE-STATE HYDROGEN EXCHANGE,                
*KEYWDS   2 PROTEIN ENGINEERING, PROTEIN STRUCTURE, NMR, STRUCTURAL              
*KEYWDS   3 GENOMICS, PSI, PROTEIN STRUCTURE INITIATIVE, BERKELEY                
*KEYWDS   4 STRUCTURAL GENOMICS CENTER, BSGC                                     
*EXPDTA    NMR, 10 STRUCTURES                                                    
*AUTHOR    H.FENG, Z.ZHOU, Y.BAI, BERKELEY STRUCTURAL GENOMICS CENTER            
*AUTHOR   2 (BSGC)                                                               
*REVDAT   1   28-MAR-06 1YZC    0                                                

!
! A1
assign (resid   1 and name   HA ) (resid   2 and name   HN )  2.5  0.7  0.4 ! A.362  at 5.38e+06

! D2
assign (resid   2 and name   HA ) (resid   2 and name   HN )  2.5  0.7  0.4 !
assign (resid   2 and name  HB1 ) (resid   2 and name   HN )  4.0  2.2  1.0 ! A.363  at 1.50e+06
assign (resid   2 and name  HB2 ) (resid   2 and name   HN )  3.5  1.2  0.5 ! A.364  at 3.35e+06
assign (resid   2 and name  HB2 ) (resid   3 and name   HN )  4.0  2.2  1.0 ! A.144  at 2.82e+06
assign (resid   2 and name   HN ) (resid   3 and name HD2# )  4.0  2.2  1.5 ! A.365  at 1.81e+06
assign (resid   2 and name   HA ) (resid   3 and name   HN )  2.5  0.7  0.4 ! A.141  at 7.85e+06
assign (resid   2 and name  HB1 ) (resid   3 and name   HN )  3.5  1.2  0.5 ! A.143  at 3.71e+06

! L3
assign (resid   3 and name   HA ) (resid   3 and name   HN )  2.5  0.7  0.4 !
assign (resid   3 and name HD2# ) (resid   3 and name   HN )  2.5  0.7  0.9 ! A.149  at 6.69e+06
assign (resid   3 and name HD1# ) (resid   3 and name   HN )  4.0  2.2  1.5 ! A.148  at 1.12e+06
assign (resid   3 and name   HG ) (resid   3 and name   HN )  2.5  0.7  0.4 ! A.147  at 1.81e+07
assign (resid   3 and name   HN ) (resid   4 and name   HN )  2.5  0.7  0.4 ! A.2030 at 7.47e+07
assign (resid   3 and name HD2# ) (resid   4 and name   HN )  4.0  2.2  1.5 ! A.309  at 1.76e+06
assign (resid   3 and name   HN ) (resid   4 and name  HG# )  2.5  0.7  0.9 ! A.145  at 5.22e+06
assign (resid   3 and name   HN ) (resid   4 and name  HB# )  4.0  2.2  1.5 ! A.146  at 1.15e+06
assign (resid   3 and name   HG ) (resid   4 and name   HN )  4.0  2.2  1.0 ! A.307  at 3.00e+06
assign (resid   3 and name  HB2 ) (resid   4 and name   HN )  3.5  1.2  0.5 ! A.308  at 3.29e+06
assign (resid   3 and name  HB2 ) (resid   6 and name HD22 )  3.5  1.2  0.5 ! A.788  at 3.81e+06

! E4
assign (resid   4 and name   HA ) (resid   4 and name   HN )  2.5  0.7  0.4 !
assign (resid   4 and name  HB# ) (resid   4 and name   HN )  2.5  0.7  0.9 ! A.306  at 2.68e+07
assign (resid   4 and name  HG# ) (resid   4 and name   HN )  2.5  0.7  0.9 ! A.305  at 9.92e+06
assign (resid   4 and name   HA ) (resid   5 and name   HN )  3.5  1.2  0.5 ! A.2049 at 4.58e+06
assign (resid   4 and name  HG# ) (resid   5 and name   HN )  4.0  2.2  1.5 ! A.296  at 2.19e+06
assign (resid   4 and name  HB# ) (resid   5 and name   HN )  3.5  1.2  1.0 ! A.297  at 4.45e+06
assign (resid   4 and name   HN ) (resid   5 and name   HN )  4.0  2.2  1.0 ! A.302  at 5.47e+06

! D5
assign (resid   5 and name   HA ) (resid   5 and name   HN )  2.5  0.7  0.4 !
assign (resid   5 and name  HB1 ) (resid   5 and name   HN )  2.5  0.7  0.4 ! A.2050 at 7.25e+06
assign (resid   5 and name  HB2 ) (resid   5 and name   HN )  3.5  0.7  0.5 ! A.2051 at 6.75e+06

! N6
assign (resid   6 and name   HA ) (resid   6 and name   HN )  2.5  0.7  0.4 !
assign (resid   6 and name  HB2 ) (resid   6 and name   HN )  2.5  0.7  0.5 ! A.481  at 1.23e+07
assign (resid   6 and name  HB2 ) (resid   6 and name HD21 )  2.5  0.7  0.4 ! A.771  at 5.49e+06
assign (resid   6 and name  HB2 ) (resid   6 and name HD22 )  3.5  1.2  0.5 ! A.772  at 4.46e+06
assign (resid   6 and name   HA ) (resid   7 and name   HN )  2.5  0.7  0.4 ! A.2076 at 1.34e+07

! D7
assign (resid   7 and name   HA ) (resid   7 and name   HN )  2.5  0.7  0.4 !
assign (resid   7 and name  HB# ) (resid   7 and name   HN )  2.5  0.7  0.9 ! A.417  at 1.95e+07
assign (resid   7 and name  HB# ) (resid   8 and name   HN )  3.5  1.2  1.0 ! A.2046 at 3.23e+06
assign (resid   7 and name   HN ) (resid   9 and name   HN )  2.5  0.7  0.4 ! A.302  at 1.47e+07

! E8
assign (resid   8 and name   HA ) (resid   8 and name   HN )  2.5  0.7  0.4 !
assign (resid   8 and name  HB2 ) (resid   8 and name   HN )  3.0  0.7  0.5 ! A.271  at 1.76e+07
assign (resid   8 and name  HB1 ) (resid   8 and name   HN )  3.5  0.7  0.5 ! A.270  at 7.65e+06
assign (resid   8 and name  HG# ) (resid   8 and name   HN )  2.5  0.7  0.9 ! A.269  at 9.41e+06
assign (resid   8 and name   HN ) (resid   9 and name   HN )  2.5  0.7  0.4 ! A.2044 at 1.55e+07
assign (resid   8 and name  HB1 ) (resid   9 and name   HN )  4.0  2.2  1.0 ! A.767  at 2.85e+06
assign (resid   8 and name  HB2 ) (resid   9 and name   HN )  3.5  1.2  0.5 ! A.766  at 3.23e+06
assign (resid   8 and name  HG# ) (resid   9 and name   HN )  4.0  2.2  1.5 ! A.765  at 1.71e+06
assign (resid   8 and name  HB1 ) (resid  10 and name   HN )  4.0  2.2  1.0 ! A.844  at 1.79e+06
assign (resid   8 and name  HB2 ) (resid  10 and name   HN )  4.0  2.2  1.0 ! A.843  at 1.55e+06

! T9
assign (resid   9 and name   HA ) (resid   9 and name   HN )  2.5  0.7  0.4 !
assign (resid   9 and name HG2# ) (resid   9 and name   HN )  2.5  0.7  0.9 ! A.768  at 8.10e+06
assign (resid   9 and name   HB ) (resid   9 and name   HN )  2.5  0.7  0.4 ! A.763  at 1.43e+07
assign (resid   9 and name HG2# ) (resid  10 and name   HN )  3.5  1.2  1.0 ! A.845  at 4.00e+06
assign (resid   9 and name   HA ) (resid  10 and name   HN )  2.5  0.7  0.4 ! A.840  at 1.51e+07
assign (resid   9 and name   HN ) (resid  10 and name   HN )  2.5  0.7  0.4 ! A.839  at 7.41e+06
assign (resid   9 and name HG2# ) (resid  11 and name   HN )  4.0  2.2  1.5 ! A.564  at 2.48e+06
assign (resid   9 and name   HN ) (resid  11 and name  HB1 )  4.0  2.2  1.0 ! A.764  at 1.58e+06

! G10
assign (resid  10 and name  HA# ) (resid  10 and name   HN )  2.5  0.7  0.4 !
assign (resid  10 and name   HA ) (resid  11 and name   HN )  2.5  0.7  0.4 ! A.2127 at 8.72e+06
assign (resid  10 and name   HN ) (resid  11 and name  HB1 )  4.0  2.2  1.0 ! A.842  at 1.23e+06
assign (resid  10 and name   HN ) (resid  11 and name   HN )  2.5  0.7  0.4 ! A.839  at 7.41e+06

! N11
assign (resid  11 and name   HA ) (resid  11 and name   HN )  2.5  0.7  0.4 !
assign (resid  11 and name  HB1 ) (resid  11 and name   HN )  2.5  0.7  0.4 ! A.563  at 1.63e+07
assign (resid  11 and name  HB1 ) (resid  11 and name HD21 )  3.5  1.2  0.5 ! A.771  at 3.49e+06
assign (resid  11 and name  HB2 ) (resid  11 and name HD21 )  2.5  0.7  0.4 ! A.771  at 5.49e+06
assign (resid  11 and name  HB2 ) (resid  11 and name HD22 )  3.5  1.2  0.5 ! A.772  at 4.46e+06
assign (resid  11 and name   HA ) (resid  12 and name   HN )  3.5  0.7  0.4 ! A.266  at 1.70e+07
assign (resid  11 and name   HN ) (resid  12 and name   HN )  3.5  1.2  0.5 ! A.302  at 3.07e+06
assign (resid  11 and name   HN ) (resid  13 and name   HN )  3.5  1.2  0.5 ! A.485  at 3.31e+06

! D12
assign (resid  12 and name   HA ) (resid  12 and name   HN )  2.5  0.7  0.4 !
assign (resid  12 and name  HB2 ) (resid  12 and name   HN )  2.5  0.7  0.4 ! A.372  at 5.91e+06
assign (resid  12 and name  HB1 ) (resid  12 and name   HN )  3.5  1.2  0.5 ! A.372  at 4.91e+06
assign (resid  12 and name   HN ) (resid  13 and name   HN )  2.5  0.7  0.4 ! A.2102 at 1.49e+07
assign (resid  12 and name   HA ) (resid  14 and name   HN )  4.0  2.2  1.0 ! A.894  at 1.59e+06

! N13
assign (resid  13 and  name  HA ) (resid  13 and name   HN )  2.5  0.7  0.4 !
assign (resid  13 and name  HB# ) (resid  13 and name   HN )  2.5  0.7  0.9 ! A.2104 at 1.21e+07
assign (resid  13 and name  HB1 ) (resid  13 and name   HN )  3.5  0.7  0.4 ! A.488  at 1.23e+07
assign (resid  13 and name  HB1 ) (resid  13 and name HD22 )  3.5  1.2  0.5 ! A.790  at 4.21e+06
assign (resid  13 and name  HB2 ) (resid  13 and name HD21 )  3.5  1.2  0.5 ! A.771  at 3.49e+06
assign (resid  13 and name  HB1 ) (resid  13 and name HD21 )  2.5  0.7  0.4 ! A.771  at 5.49e+06
assign (resid  13 and name  HB1 ) (resid  14 and name   HN )  3.5  1.2  0.5 ! A.896  at 3.29e+06
assign (resid  13 and name   HN ) (resid  14 and name   HN )  2.5  0.7  0.4 ! A.892  at 3.08e+08
assign (resid  13 and name   HA ) (resid  14 and name   HN )  3.0  0.7  0.5 ! A.894  at 4.59e+06
assign (resid  13 and name HD21 ) (resid  15 and name  HG# )  4.0  2.2  1.5 ! A.791  at 2.85e+06

! G14
assign (resid  14 and name   HA ) (resid  14 and name   HN )  2.5  0.7  0.4 !
assign (resid  14 and name   HN ) (resid  15 and name  HB# )  4.0  2.2  1.5 ! A.897  at 1.96e+06
assign (resid  14 and name   HN ) (resid  15 and name   HN )  2.5  0.7  0.4 ! A.893  at 1.05e+07
assign (resid  14 and name  HA# ) (resid  15 and name   HN )  2.5  0.7  0.9 ! A.341  at 1.76e+07

! K15
assign (resid  15 and name   HA ) (resid  15 and name   HN )  2.5  0.7  0.4 !
assign (resid  15 and name  HB# ) (resid  15 and name   HN )  2.5  0.7  0.9 ! A.400  at 1.57e+07
assign (resid  15 and name  HG# ) (resid  15 and name   HN )  2.5  0.7  0.9 ! A.401  at 1.07e+07
assign (resid  15 and name  HD# ) (resid  15 and name   HN )  2.5  0.7  0.9 ! A.399  at 6.74e+06
assign (resid  15 and name   HN ) (resid  16 and name   HN )  2.5  0.7  0.4 ! A.866  at 5.83e+06
assign (resid  15 and name   HA ) (resid  16 and name   HN )  3.5  0.7  0.5 ! A.867  at 5.30e+06
assign (resid  15 and name  HB# ) (resid  16 and name   HN )  3.5  1.2  1.0 ! A.870  at 4.35e+06

! G16
assign (resid  16 and name  HA# ) (resid  16 and name   HN )  2.5  0.7  0.4 !
assign (resid  16 and name   HN ) (resid  17 and name   HN )  2.5  0.7  0.4 ! A.865  at 1.16e+07

! G17
assign (resid  17 and name  HA# ) (resid  17 and name   HN )  2.5  0.7  0.4 !
assign (resid  17 and name  HA# ) (resid  18 and name   HN )  2.5  0.7  0.9 ! A.2067 at 1.09e+07
assign (resid  17 and name   HN ) (resid  18 and name   HN )  2.5  0.7  0.4 ! A.302  at 1.47e+07
assign (resid  17 and name   HN ) (resid  19 and name   HN )  3.5  0.7  0.4 ! A.140  at 1.57e+07

! E18
assign (resid  18 and name   HA ) (resid  18 and name   HN )  2.5  0.7  0.4 !
assign (resid  18 and name  HB# ) (resid  18 and name   HN )  2.5  0.7  0.9 ! A.2068 at 2.07e+07
assign (resid  18 and name  HG# ) (resid  18 and name   HN )  3.5  0.7  0.9 ! A.305  at 9.92e+06
assign (resid  18 and name   HA ) (resid  19 and name   HN )  3.5  1.2  0.5 ! A.141  at 4.85e+06
assign (resid  18 and name  HG# ) (resid  20 and name   HN )  4.5  2.2  2.5 ! A.2005 at 5.24e+05
assign (resid  18 and name  HB# ) (resid  20 and name   HN )  4.5  2.2  2.5 ! A.2006 at 6.66e+05

! K19
assign (resid  19 and name   HA ) (resid  19 and name   HN )  2.5  0.7  0.4 !
assign (resid  19 and name  HG1 ) (resid  19 and name   HN )  4.0  2.2  1.0 ! A.147  at 1.81e+06
assign (resid  19 and name  HB# ) (resid  19 and name   HN )  3.5  1.2  1.0 ! A.171  at 3.50e+06
assign (resid  19 and name  HB# ) (resid  20 and name   HN )  2.5  0.7  0.9 ! A.21   at 9.93e+06
assign (resid  19 and name  HG1 ) (resid  21 and name   HN )  2.5  0.7  0.4 ! A.431  at 8.76e+06
assign (resid  19 and name  HG1 ) (resid  22 and name   HN )  3.5  1.2  0.9 ! A.450  at 4.85e+06

! A20
assign (resid  20 and name   HA ) (resid  20 and name   HN )  2.5  0.7  0.4 !
assign (resid  20 and name  HB# ) (resid  20 and name   HN )  2.5  0.7  0.9 ! A.23   at 3.84e+07
assign (resid  20 and name   HA ) (resid  21 and name   HN )  2.5  0.7  0.4 ! A.2080 at 2.25e+07
assign (resid  20 and name   HN ) (resid  21 and name  HB2 )  4.5  2.2  2.0 ! A.20   at 7.93e+05
assign (resid  20 and name  HB# ) (resid  21 and name   HN )  3.5  0.7  0.9 ! A.431  at 4.76e+06

! D21
assign (resid  21 and name   HA ) (resid  21 and name   HN )  2.5  0.7  0.4 !
assign (resid  21 and name  HB2 ) (resid  21 and name   HN )  2.5  0.7  0.4 ! A.429  at 5.83e+06
assign (resid  21 and name  HB1 ) (resid  21 and name   HN )  2.5  0.7  0.4 ! A.429  at 1.83e+07
assign (resid  21 and name   HN ) (resid  22 and name   HN )  2.5  0.7  0.4 ! A.440  at 5.94e+06
assign (resid  21 and name   HN ) (resid  23 and name   HN )  4.0  2.2  1.0 ! A.163  at 3.73e+06
assign (resid  21 and name   HN ) (resid  24 and name   HN )  4.0  2.2  1.0 ! A.419  at 1.99e+06

! N22
assign (resid  22 and name   HA ) (resid  22 and name   HN )  2.5  0.7  0.4 !
assign (resid  22 and name   HN ) (resid  22 and name HD21 )  4.0  2.2  1.0 ! A.826  at 1.24e+06
assign (resid  22 and name   HN ) (resid  22 and name HD22 )  4.5  2.2  2.0 ! A.827  at 5.57e+05
assign (resid  22 and name  HB2 ) (resid  22 and name   HN )  3.0  0.7  0.5 ! A.447  at 2.18e+07
assign (resid  22 and name  HB1 ) (resid  22 and name   HN )  3.5  1.2  0.5 ! A.447  at 5.08e+06
assign (resid  22 and name  HB2 ) (resid  22 and name HD22 )  3.5  1.2  0.5 ! A.814  at 3.21e+06
assign (resid  22 and name  HB1 ) (resid  22 and name HD22 )  4.0  2.2  1.0 ! A.814  at 2.21e+06
assign (resid  22 and name   HA ) (resid  22 and name HD22 )  4.5  2.2  2.0 ! A.811  at 8.88e+05
assign (resid  22 and name HD21 ) (resid  23 and name   HN )  4.0  2.2  1.0 ! A.828  at 1.39e+06
assign (resid  22 and name  HB1 ) (resid  23 and name   HN )  3.5  1.2  0.5 ! A.168  at 3.75e+06
assign (resid  22 and name   HA ) (resid  23 and name   HN )  3.5  1.2  0.5 ! A.166  at 4.07e+06
assign (resid  22 and name HD22 ) (resid  23 and name   HN )  4.5  2.2  2.0 ! A.829  at 7.55e+05
assign (resid  22 and name   HA ) (resid  24 and name   HN )  4.0  2.2  1.0 ! A.2077 at 1.07e+06
assign (resid  22 and name  HB1 ) (resid  24 and name   HN )  4.0  2.2  1.0 ! A.425  at 2.36e+06
assign (resid  22 and name   HN ) (resid  24 and name   HN )  4.0  2.2  1.0 ! A.442  at 1.60e+06
assign (resid  22 and name   HN ) (resid  25 and name  HB# )  3.5  1.2  1.0 ! A.448  at 3.91e+06
assign (resid  22 and name   HN ) (resid  25 and name   HN )  4.0  2.2  1.0 ! A.441  at 1.53e+06
assign (resid  22 and name  HB# ) (resid  25 and name   HN )  4.5  2.2  1.5 ! A.615  at 1.41e+06
assign (resid  22 and name   HA ) (resid  26 and name   HN )  4.5  2.2  2.0 ! A.200  at 6.03e+05
assign (resid  22 and name HD21 ) (resid  84 and name   HN )  3.5  1.0  0.5 ! A.830  at 5.44e+06

! A23
assign (resid  23 and name   HA ) (resid  23 and name   HN )  2.5  0.7  0.4 !
assign (resid  23 and name  HB# ) (resid  23 and name   HN )  2.5  0.7  0.9 ! A.2032 at 1.81e+07
assign (resid  23 and name   HA ) (resid  24 and name   HN )  3.5  0.7  0.5 ! A.2078 at 4.98e+06
assign (resid  23 and name  HB# ) (resid  24 and name   HN )  3.5  1.2  0.5 ! A.322  at 4.53e+06
assign (resid  23 and name   HN ) (resid  24 and name   HN )  3.5  1.2  0.5 ! A.318  at 4.76e+06
assign (resid  23 and name   HN ) (resid  25 and name  HB# )  4.0  2.2  1.5 ! A.169  at 1.81e+06
assign (resid  23 and name   HA ) (resid  26 and name   HN )  3.5  1.2  0.5 ! A.2039 at 3.83e+06
assign (resid  23 and name   HA ) (resid  27 and name   HN )  4.0  2.2  1.0 ! A.341  at 1.76e+06
assign (resid  23 and name   HN ) (resid  84 and name HG2# )  3.5  1.2  0.5 ! A.2301 at 5.05e+06*
assign (resid  23 and name   HN ) (resid  84 and name   HB )  4.0  2.2  1.0 ! A.2302 at 1.61e+06*

! A24
assign (resid  24 and name   HA ) (resid  24 and name   HN )  2.5  0.7  0.4 !
assign (resid  24 and name   HN ) (resid  25 and name  HB# )  4.0  2.2  1.5 ! A.426  at 1.89e+06
assign (resid  24 and name   HN ) (resid  25 and name   HN )  3.5  1.2  0.5 ! A.611  at 4.69e+06
assign (resid  24 and name   HN ) (resid  26 and name   HN )  4.0  2.2  1.0 ! A.199  at 2.22e+06
assign (resid  24 and name   HA ) (resid  27 and name   HN )  4.0  2.2  1.0 ! A.2059 at 2.45e+06
assign (resid  24 and name   HN ) (resid  84 and name HG2# )  4.0  2.2  1.0 ! A.428  at 2.78e+06

! Q25
assign (resid  25 and name   HA ) (resid  25 and name   HN )  2.5  0.7  0.4 !
assign (resid  25 and name HE21 ) (resid  25 and name   HN )  4.5  2.2  2.0 ! A.612  at 5.74e+05
assign (resid  25 and name  HG1 ) (resid  25 and name   HN )  3.5  0.7  0.6 ! A.616  at 5.11e+06
assign (resid  25 and name  HB# ) (resid  25 and name   HN )  2.5  0.7  0.9 ! A.617  at 2.09e+07
assign (resid  25 and name  HG2 ) (resid  25 and name   HN )  3.5  1.2  0.5 ! A.2134 at 3.88e+06
assign (resid  25 and name  HB# ) (resid  25 and name HE22 )  4.0  2.2  1.5 ! A.823  at 1.72e+06
assign (resid  25 and name  HB# ) (resid  25 and name HE21 )  3.5  0.7  0.9 ! A.822  at 5.19e+06
assign (resid  25 and name  HG2 ) (resid  25 and name HE21 )  3.5  0.7  0.4 ! A.796  at 6.49e+06
assign (resid  25 and name  HG2 ) (resid  25 and name HE22 )  3.5  1.2  0.5 ! A.797  at 4.83e+06
assign (resid  25 and name  HG1 ) (resid  25 and name HE22 )  3.5  1.2  0.5 ! A.797  at 4.83e+06
assign (resid  25 and name  HG1 ) (resid  25 and name HE21 )  3.5  1.2  0.5 ! A.821  at 4.15e+06
assign (resid  25 and name  HG1 ) (resid  26 and name   HN )  4.5  2.2  2.0 ! A.203  at 9.52e+05
assign (resid  25 and name  HG2 ) (resid  26 and name   HN )  4.5  2.2  2.0 ! A.204  at 8.70e+05
assign (resid  25 and name HE21 ) (resid  26 and name HG2# )  4.0  2.2  1.5 ! A.824  at 2.59e+06
assign (resid  25 and name   HA ) (resid  28 and name   HN )  3.5  1.2  0.5 ! A.288  at 5.35e+06
assign (resid  25 and name HE21 ) (resid  84 and name HG1# )  4.0  2.2  1.5 ! A.824  at 1.59e+06

! V26
assign (resid  26 and name   HA ) (resid  26 and name   HN )  2.5  0.7  0.4 !
assign (resid  26 and name   HB ) (resid  26 and name   HN )  2.5  0.7  0.4 ! A.206  at 2.06e+07
assign (resid  26 and name HG2# ) (resid  26 and name   HN )  2.5  0.7  0.9 ! A.208  at 1.04e+07
assign (resid  26 and name HG1# ) (resid  26 and name   HN )  3.5  0.7  0.9 ! A.208  at 4.74e+06
assign (resid  26 and name   HN ) (resid  27 and name  HB# )  4.5  2.2  2.5 ! A.2040 at 8.64e+05
assign (resid  26 and name   HA ) (resid  27 and name   HN )  4.0  2.2  1.0 ! A.2060 at 2.35e+06
assign (resid  26 and name   HB ) (resid  27 and name   HN )  2.5  0.7  0.4 ! A.2061 at 6.75e+06
assign (resid  26 and name HG2# ) (resid  27 and name   HN )  4.0  2.2  1.5 ! A.351  at 1.90e+06
assign (resid  26 and name HG1# ) (resid  27 and name   HN )  4.0  2.2  1.5 ! A.351  at 2.90e+06
assign (resid  26 and name HG2# ) (resid  88 and name   HN )  4.0  2.2  1.5 ! A.576  at 1.55e+06

! K27
assign (resid  27 and name   HA ) (resid  27 and name   HN )  2.5  0.7  0.4 !
assign (resid  27 and name  HD# ) (resid  27 and name   HN )  2.5  0.7  0.9 ! A.347  at 8.33e+06
assign (resid  27 and name  HE1 ) (resid  27 and name   HN )  4.0  2.2  1.0 ! A.343  at 2.29e+06
assign (resid  27 and name  HB# ) (resid  27 and name   HN )  2.5  0.7  0.9 ! A.345  at 9.21e+06
assign (resid  27 and name  HG# ) (resid  27 and name   HN )  3.5  1.2  1.0 ! A.350  at 3.22e+06
assign (resid  27 and name   HA ) (resid  28 and name   HN )  4.0  2.2  1.0 ! A.294  at 1.84e+06
assign (resid  27 and name  HB# ) (resid  28 and name   HN )  3.5  1.2  1.0 ! A.291  at 4.60e+06
assign (resid  27 and name   HN ) (resid  28 and name   HN )  2.5  0.7  0.4 ! A.285  at 6.58e+06
assign (resid  27 and name  HG# ) (resid  28 and name   HN )  4.0  2.2  1.5 ! A.292  at 2.23e+06
assign (resid  27 and name   HA ) (resid  29 and name   HN )  4.0  2.2  1.0 ! A.237  at 1.70e+06
assign (resid  27 and name   HN ) (resid  29 and name   HN )  4.0  2.2  1.0 ! A.340  at 2.68e+06
assign (resid  27 and name   HA ) (resid  30 and name   HN )  4.5  2.2  2.0 ! A.2114 at 9.47e+05

! D28
assign (resid  28 and name   HA ) (resid  28 and name   HN )  2.5  0.7  0.4 !
assign (resid  28 and name  HB# ) (resid  28 and name   HN )  2.5  0.7  0.9 ! A.289  at 1.15e+07
assign (resid  28 and name  HB# ) (resid  29 and name   HN )  2.5  0.7  0.9 ! A.238  at 1.19e+07
assign (resid  28 and name   HN ) (resid  29 and name   HN )  2.5  0.7  0.4 ! A.285  at 6.58e+06

! A29
assign (resid  29 and name   HA ) (resid  29 and name   HN )  2.5  0.7  0.4 !
assign (resid  29 and name  HB# ) (resid  29 and name   HN )  2.5  0.7  0.9 ! A.240  at 2.61e+07
assign (resid  29 and name  HB# ) (resid  30 and name   HN )  2.5  0.7  0.9 ! A.521  at 8.63e+06
assign (resid  29 and name   HN ) (resid  30 and name   HN )  2.5  0.7  0.4 ! A.514  at 6.04e+06
assign (resid  29 and name  HB# ) (resid  31 and name   HN )  4.0  2.2  1.5 ! A.654  at 1.56e+06
assign (resid  29 and name   HN ) (resid  32 and name   HN )  4.0  2.2  1.0 ! A.92   at 1.64e+06
assign (resid  29 and name   HA ) (resid  33 and name   HN )  3.5  1.2  0.5 ! A.288  at 3.35e+06

! L30
assign (resid  30 and name   HA ) (resid  30 and name   HN )  2.5  0.7  0.4 !
assign (resid  30 and name HD2# ) (resid  30 and name   HN )  3.5  1.2  1.0 ! A.525  at 4.60e+06
assign (resid  30 and name  HB2 ) (resid  30 and name   HN )  3.5  1.2  0.5 ! A.522  at 4.59e+06
assign (resid  30 and name HD1# ) (resid  30 and name   HN )  2.5  0.7  0.9 ! A.524  at 9.44e+06
assign (resid  30 and name  HB1 ) (resid  30 and name   HN )  3.5  0.7  0.4 ! A.518  at 5.13e+06
assign (resid  30 and name   HG ) (resid  30 and name   HN )  2.5  0.7  0.4 ! A.520  at 5.87e+06
assign (resid  30 and name   HN ) (resid  31 and name   HN )  4.0  2.2  1.0 ! A.643  at 2.25e+06
assign (resid  30 and name  HB1 ) (resid  31 and name   HN )  4.0  2.2  1.0 ! A.2141 at 2.24e+06
assign (resid  30 and name   HG ) (resid  31 and name   HN )  4.0  2.2  1.0 ! A.2142 at 2.02e+06
assign (resid  30 and name HD2# ) (resid  31 and name   HN )  4.5  2.2  2.5 ! A.657  at 7.30e+05
assign (resid  30 and name HD1# ) (resid  31 and name   HN )  4.0  2.2  1.5 ! A.656  at 1.07e+06
assign (resid  30 and name  HB# ) (resid  32 and name   HN )  4.0  2.2  1.5 ! A.98   at 1.27e+06
assign (resid  30 and name HD2# ) (resid  33 and name   HN )  4.0  2.2  1.5 ! A.2047 at 2.47e+06
assign (resid  30 and name   HA ) (resid  33 and name   HN )  3.5  1.2  0.5 ! A.288  at 3.35e+06
assign (resid  30 and name   HN ) (resid  33 and name  HE# )  4.0  2.2  1.5 ! A.482  at 1.30e+06
assign (resid  30 and name   HA ) (resid  34 and name   HN )  4.0  2.2  1.0 ! A.114  at 1.67e+06
assign (resid  30 and name HD2# ) (resid  75 and name   HN )  4.0  2.2  1.5 ! A.38   at 2.50e+06
assign (resid  30 and name HD1# ) (resid  75 and name   HN )  4.0  2.2  1.5 ! A.37   at 1.20e+06
assign (resid  30 and name HD2# ) (resid  91 and name   HN )  4.0  2.2  1.5 ! A.316  at 1.54e+06

! T31
assign (resid  31 and name   HA ) (resid  31 and name   HN )  2.5  0.7  0.4 !
assign (resid  31 and name HG2# ) (resid  31 and name   HN )  3.5  1.2  1.0 ! A.655  at 3.69e+06
assign (resid  31 and name   HB ) (resid  31 and name   HN )  4.0  2.2  1.0 ! A.653  at 2.86e+06
assign (resid  31 and name HG2# ) (resid  32 and name   HN )  3.5  1.2  1.0 ! A.101  at 4.31e+06
assign (resid  31 and name   HB ) (resid  32 and name   HN )  4.0  2.2  1.0 ! A.97   at 1.53e+06
assign (resid  31 and name   HN ) (resid  32 and name   HN )  4.0  2.2  1.0 ! A.651  at 2.84e+06
assign (resid  31 and name   HA ) (resid  32 and name   HN )  3.5  0.7  0.5 ! A.94   at 5.08e+06
assign (resid  31 and name   HB ) (resid  34 and name   HN )  4.0  1.2  1.0 ! A.115  at 3.09e+06
assign (resid  31 and name   HB ) (resid  35 and name   HN )  4.0  2.2  1.0 ! A.471  at 1.33e+06
assign (resid  31 and name   HN ) (resid  72 and name HG2# )  4.0  2.2  1.5 ! A.656  at 2.07e+06
assign (resid  31 and name   HN ) (resid  76 and name HD1# )  4.0  2.2  1.0 ! A.2403 at 2.87e+06*

! K32
assign (resid  32 and name   HA ) (resid  32 and name   HN )  2.5  0.7  0.4 !
assign (resid  32 and name  HD# ) (resid  32 and name   HN )  3.5  0.7  0.9 ! A.100  at 5.02e+06
assign (resid  32 and name  HG# ) (resid  32 and name   HN )  3.5  1.2  1.0 ! A.2019 at 3.29e+06
assign (resid  32 and name  HB2 ) (resid  32 and name   HN )  2.5  0.7  0.4 ! A.99   at 8.60e+06
assign (resid  32 and name  HB1 ) (resid  32 and name   HN )  2.5  0.7  0.4 ! A.99   at 7.60e+06
assign (resid  32 and name  HB1 ) (resid  33 and name   HN )  2.5  0.7  0.4 ! A.291  at 5.60e+06
assign (resid  32 and name   HA ) (resid  33 and name   HN )  3.5  1.2  0.5 ! A.288  at 3.35e+06
assign (resid  32 and name   HN ) (resid  33 and name   HN )  2.5  0.7  0.4 ! A.285  at 6.58e+06
assign (resid  32 and name  HG1 ) (resid  33 and name   HN )  4.0  2.2  1.0 ! A.293  at 1.48e+06
assign (resid  32 and name  HD1 ) (resid  33 and name   HN )  4.0  2.2  1.0 ! A.292  at 3.23e+06
assign (resid  32 and name  HD1 ) (resid  34 and name   HN )  4.0  2.2  1.0 ! A.122  at 3.39e+06
assign (resid  32 and name   HA ) (resid  34 and name   HN )  4.0  2.2  1.0 ! A.114  at 1.57e+06
assign (resid  32 and name   HN ) (resid  35 and name   HN )  4.0  2.2  1.0 ! A.93   at 1.11e+06

! M33
assign (resid  33 and name   HA ) (resid  33 and name   HN )  2.5  0.7  0.4 !
assign (resid  33 and name  HB# ) (resid  33 and name   HN )  4.0  2.2  1.5 ! A.290  at 2.37e+06
assign (resid  33 and name  HG2 ) (resid  33 and name   HN )  2.5  0.7  0.4 ! A.289  at 5.15e+06
assign (resid  33 and name  HG1 ) (resid  33 and name   HN )  2.5  0.7  0.4 ! A.289  at 1.15e+07
assign (resid  33 and name   HN ) (resid  34 and name   HN )  3.5  1.2  0.5 ! A.111  at 3.97e+06
assign (resid  33 and name  HG1 ) (resid  34 and name   HN )  4.0  2.2  1.0 ! A.116  at 1.26e+06
assign (resid  33 and name  HB# ) (resid  36 and name   HN )  4.0  2.2  1.5 ! A.466  at 1.35e+06
assign (resid  33 and name  HB# ) (resid  37 and name   HN )  4.0  2.2  1.5 ! A.105  at 1.13e+06
assign (resid  33 and name   HN ) (resid  72 and name HD1# )  4.0  2.2  1.0 ! A.2404 at 1.43e+06*

! R34
assign (resid  34 and name   HA ) (resid  34 and name   HN )  2.5  0.7  0.4 !
assign (resid  34 and name  HB# ) (resid  34 and name   HN )  2.5  0.7  0.9 ! A.119  at 5.43e+06
assign (resid  34 and name  HG# ) (resid  34 and name   HN )  3.5  0.7  0.9 ! A.121  at 5.36e+06
assign (resid  34 and name HH1# ) (resid  34 and name   HE )  3.5  1.2  1.0 ! A.2172 at 3.23e+06
assign (resid  34 and name  HG# ) (resid  34 and name   HE )  4.5  2.2  2.5 ! A.2175 at 1.00e+06
assign (resid  34 and name   HN ) (resid  35 and name   HN )  4.0  2.2  1.0 ! A.470  at 2.24e+06
assign (resid  34 and name  HB# ) (resid  35 and name   HN )  2.5  0.7  0.9 ! A.2099 at 6.34e+06
assign (resid  34 and name  HG2 ) (resid  35 and name   HN )  2.5  0.7  0.4 ! A.2100 at 6.93e+06
assign (resid  34 and name   HN ) (resid  35 and name  HB# )  4.0  2.2  1.5 ! A.123  at 2.13e+06
assign (resid  34 and name   HN ) (resid  36 and name   HN )  4.5  2.2  2.0 ! A.112  at 7.84e+05
assign (resid  34 and name   HE ) (resid  38 and name HD1# )  3.5  1.2  1.0 ! A.2176 at 3.27e+06
assign (resid  34 and name   HN ) (resid  72 and name HD1# )  4.0  2.2  1.5 ! A.124  at 2.71e+06
assign (resid  34 and name   HN ) (resid  72 and name HG12 )  3.5  1.2  0.5 ! A.124  at 4.71e+06

! A35
assign (resid  35 and name   HA ) (resid  35 and name   HN )  2.5  0.7  0.4 !
assign (resid  35 and name   HN ) (resid  36 and name   HN )  2.5  0.7  0.4 ! A.461  at 7.14e+06
assign (resid  35 and name   HA ) (resid  37 and name   HN )  4.0  2.2  1.0 ! A.2023 at 2.93e+06
assign (resid  35 and name   HN ) (resid  37 and name   HN )  4.0  2.2  1.0 ! A.102  at 1.89e+06
assign (resid  35 and name   HN ) (resid  38 and name HD1# )  4.0  2.2  1.5 ! A.2101 at 1.49e+06
assign (resid  35 and name  HB# ) (resid  38 and name   HN )  3.5  1.2  1.0 ! A.667  at 3.95e+06
assign (resid  35 and name   HN ) (resid  38 and name   HN )  4.5  2.2  2.0 ! A.659  at 8.79e+05
assign (resid  35 and name   HA ) (resid  39 and name   HN )  4.0  2.2  1.0 ! A.464  at 2.19e+06

! A36
assign (resid  36 and name   HA ) (resid  36 and name   HN )  2.5  0.7  0.4 !
assign (resid  36 and name  HB# ) (resid  36 and name   HN )  2.5  0.7  0.9 ! A.469  at 3.54e+07
assign (resid  36 and name   HN ) (resid  37 and name   HN )  2.5  0.7  0.4 ! A.2021 at 1.01e+07
assign (resid  36 and name  HB# ) (resid  37 and name   HN )  2.5  0.7  0.9 ! A.107  at 3.06e+07
assign (resid  36 and name  HB# ) (resid  38 and name   HN )  3.5  1.2  1.0 ! A.667  at 3.95e+06
assign (resid  36 and name  HB# ) (resid  40 and name   HN )  3.5  0.7  0.9 ! A.71   at 5.43e+06
assign (resid  36 and name   HA ) (resid  40 and name   HN )  3.5  1.2  0.5 ! A.67   at 4.19e+06

! A37
assign (resid  37 and name   HA ) (resid  37 and name   HN )  2.5  0.7  0.4 !
assign (resid  37 and name  HB# ) (resid  37 and name   HN )  2.5  0.7  0.9 ! A.107  at 1.06e+07
assign (resid  37 and name   HN ) (resid  38 and name   HN )  3.5  1.2  0.5 ! A.2143 at 3.79e+06
assign (resid  37 and name   HA ) (resid  38 and name   HN )  4.0  2.2  1.0 ! A.2145 at 1.97e+06
assign (resid  37 and name   HN ) (resid  40 and name  HB# )  4.0  2.2  1.5 ! A.108  at 2.13e+06
assign (resid  37 and name   HA ) (resid  41 and name   HN )  4.0  2.2  1.0 ! A.687  at 1.21e+06
assign (resid  37 and name   HN ) (resid  68 and name HD2# )  4.0  2.2  1.5 ! A.109  at 1.29e+06
assign (resid  37 and name   HN ) (resid  68 and name  HB1 )  4.0  2.2  1.0 ! A.106  at 2.95e+06

! L38
assign (resid  38 and name   HA ) (resid  38 and name   HN )  2.5  0.7  0.4 !
assign (resid  38 and name HD2# ) (resid  38 and name   HN )  3.5  1.2  1.0 ! A.668  at 3.12e+06
assign (resid  38 and name HD1# ) (resid  38 and name   HN )  3.5  1.2  1.0 ! A.668  at 3.12e+06
assign (resid  38 and name   HG ) (resid  38 and name   HN )  2.5  0.7  0.4 ! A.666  at 6.98e+06
assign (resid  38 and name  HB2 ) (resid  38 and name   HN )  2.5  0.7  0.4 ! A.666  at 5.98e+06
assign (resid  38 and name HD2# ) (resid  39 and name   HN )  3.5  1.2  1.0 ! A.476  at 3.41e+06
assign (resid  38 and name  HB2 ) (resid  39 and name   HN )  2.5  0.7  0.4 ! A.2094 at 1.07e+07
assign (resid  38 and name HD1# ) (resid  39 and name   HN )  3.5  1.2  1.0 ! A.2096 at 3.27e+06
assign (resid  38 and name   HA ) (resid  39 and name   HN )  4.0  2.2  1.0 ! A.464  at 2.19e+06
assign (resid  38 and name  HB1 ) (resid  39 and name   HN )  3.5  1.2  0.5 ! A.467  at 3.91e+06
assign (resid  38 and name  HB1 ) (resid  40 and name   HN )  4.5  2.2  2.0 ! A.2017 at 8.25e+05
assign (resid  38 and name   HN ) (resid  41 and name  HB# )  4.0  2.2  1.5 ! A.664  at 2.96e+06
assign (resid  38 and name  HB1 ) (resid  41 and name   HN )  4.0  2.2  1.0 ! A.2152 at 1.16e+06
assign (resid  38 and name HD2# ) (resid  41 and name HE22 )  2.5  0.7  0.9 ! A.780  at 6.04e+06
assign (resid  38 and name  HB2 ) (resid  41 and name HE21 )  4.0  2.2  1.0 ! A.778  at 1.71e+06
assign (resid  38 and name HD2# ) (resid  41 and name HE21 )  3.5  1.2  1.0 ! A.779  at 4.03e+06

! D39
assign (resid  39 and name   HA ) (resid  39 and name   HN )  2.5  0.7  0.4 !
assign (resid  39 and name  HB2 ) (resid  39 and name   HN )  2.5  0.7  0.4 ! A.475  at 7.86e+06
assign (resid  39 and name  HB1 ) (resid  39 and name   HN )  2.5  0.7  0.4 ! A.475  at 9.86e+06
assign (resid  39 and name   HA ) (resid  40 and name   HN )  4.0  2.2  1.0 ! A.66   at 2.97e+06
assign (resid  39 and name   HN ) (resid  40 and name  HB# )  4.0  2.2  1.5 ! A.2095 at 2.36e+06
assign (resid  39 and name  HB2 ) (resid  40 and name   HN )  3.5  1.2  0.5 ! A.69   at 3.57e+06
assign (resid  39 and name  HB1 ) (resid  40 and name   HN )  2.5  0.7  0.4 ! A.69   at 5.57e+06
assign (resid  39 and name   HN ) (resid  41 and name   HN )  4.0  2.2  1.0 ! A.473  at 1.45e+06
assign (resid  39 and name  HB2 ) (resid  41 and name   HN )  4.5  2.2  2.0 ! A.2151 at 4.10e+05
assign (resid  39 and name   HA ) (resid  42 and name   HN )  4.5  2.2  2.0 ! A.742  at 6.38e+05

! A40
assign (resid  40 and name   HA ) (resid  40 and name   HN )  2.5  0.7  0.4 !
assign (resid  40 and name  HB# ) (resid  40 and name   HN )  2.5  0.7  0.9 ! A.73   at 2.09e+07
assign (resid  40 and name   HN ) (resid  41 and name  HB# )  4.5  2.2  2.5 ! A.2016 at 7.69e+05
assign (resid  40 and name   HN ) (resid  41 and name   HN )  2.5  0.7  0.4 ! A.64   at 6.73e+06
assign (resid  40 and name  HB# ) (resid  41 and name   HN )  3.5  1.2  1.0 ! A.692  at 4.30e+06
assign (resid  40 and name   HN ) (resid  42 and name   HN )  4.5  2.2  2.0 ! A.740  at 9.96e+05
assign (resid  40 and name   HA ) (resid  43 and name   HN )  4.0  2.2  1.0 ! A.87   at 2.65e+06
assign (resid  40 and name   HN ) (resid  44 and name HG2# )  4.5  2.2  2.5 ! A.74   at 6.90e+05
assign (resid  40 and name   HN ) (resid  46 and name  HG1 )  4.0  2.2  1.0 ! A.70   at 1.01e+06

! Q41
assign (resid  41 and name   HA ) (resid  41 and name   HN )  2.5  0.7  0.4 !
assign (resid  41 and name  HB# ) (resid  41 and name   HN )  2.5  0.7  0.9 ! A.691  at 5.29e+06
assign (resid  41 and name  HB# ) (resid  41 and name HE22 )  4.0  2.2  1.5 ! A.777  at 1.30e+06
assign (resid  41 and name  HB# ) (resid  41 and name HE21 )  3.5  1.2  1.0 ! A.776  at 3.68e+06
assign (resid  41 and name  HG2 ) (resid  41 and name   HN )  4.0  2.2  1.0 ! A.690  at 1.06e+06
assign (resid  41 and name  HG1 ) (resid  41 and name   HN )  4.0  2.2  1.0 ! A.690  at 1.06e+06
assign (resid  41 and name   HN ) (resid  42 and name   HN )  3.5  0.7  0.5 ! A.741  at 5.15e+06
assign (resid  41 and name  HB# ) (resid  42 and name   HN )  4.0  2.2  1.5 ! A.2165 at 2.65e+06
assign (resid  41 and name   HA ) (resid  42 and name   HN )  4.0  2.2  1.0 ! A.745  at 1.03e+06
assign (resid  41 and name   HN ) (resid  43 and name   HN )  3.5  0.7  0.5 ! A.83   at 3.62e+06
assign (resid  41 and name   HA ) (resid  43 and name   HN )  4.0  2.2  1.0 ! A.87   at 2.65e+06

! K42
assign (resid  42 and name   HA ) (resid  42 and name   HN )  2.5  0.7  0.4 !
assign (resid  42 and name  HG# ) (resid  42 and name   HN )  4.0  2.2  1.5 ! A.2166 at 1.41e+06
assign (resid  42 and name  HD1 ) (resid  42 and name   HN )  3.5  1.2  0.5 ! A.748  at 3.61e+06
assign (resid  42 and name  HB1 ) (resid  42 and name   HN )  3.5  1.2  0.5 ! A.746  at 4.60e+06
assign (resid  42 and name   HN ) (resid  43 and name   HN )  3.5  1.2  0.5 ! A.741  at 4.15e+06
assign (resid  42 and name   HN ) (resid  43 and name  HB# )  4.0  2.2  1.5 ! A.749  at 2.91e+06
assign (resid  42 and name  HB2 ) (resid  43 and name   HN )  4.0  2.2  1.0 ! A.88   at 2.21e+06
assign (resid  42 and name  HB1 ) (resid  43 and name   HN )  4.0  2.2  1.0 ! A.88   at 2.21e+06
assign (resid  42 and name   HA ) (resid  43 and name   HN )  3.5  1.2  0.5 ! A.86   at 3.73e+06

! A43
assign (resid  43 and name   HA ) (resid  43 and name   HN )  2.5  0.7  0.4 !
assign (resid  43 and name  HB# ) (resid  43 and name   HN )  2.5  0.7  0.9 ! A.89   at 1.69e+07
assign (resid  43 and name   HN ) (resid  44 and name   HN )  3.5  1.2  0.5 ! A.631  at 3.04e+06
assign (resid  43 and name   HA ) (resid  44 and name   HN )  3.5  1.2  0.5 ! A.632  at 4.82e+06
assign (resid  43 and name   HN ) (resid  44 and name   HA )  4.0  1.2  1.0 ! A.86   at 2.73e+06
assign (resid  43 and name   HN ) (resid  44 and name   HB )  4.0  2.2  1.0 ! A.87   at 2.65e+06
assign (resid  43 and name  HB# ) (resid  44 and name   HN )  2.5  0.7  0.9 ! A.618  at 2.39e+07
assign (resid  43 and name   HN ) (resid  45 and name  HG2 )  4.0  2.2  1.0 ! A.88   at 2.21e+06
assign (resid  43 and name   HN ) (resid  45 and name   HA )  3.5  1.2  0.5 ! A.86   at 3.73e+06
assign (resid  43 and name   HN ) (resid  46 and name  HD1 )  4.0  2.2  1.0 ! A.87   at 2.65e+06

! T44
assign (resid  44 and name   HA ) (resid  44 and name   HN )  2.5  0.7  0.4 !
assign (resid  44 and name   HB ) (resid  44 and name   HN )  2.5  0.7  0.4 ! A.633  at 1.99e+07
assign (resid  44 and name HG2# ) (resid  44 and name   HN )  3.5  0.7  0.9 ! A.2135 at 5.00e+06

! P45
assign (resid  45 and name  HB1 ) (resid  48 and name   HN )  4.0  2.2  1.0 ! A.535  at 1.33e+06

! P46
assign (resid  46 and name  HD# ) (resid  47 and name   HN )  4.0  2.2  1.5 ! A.2160 at 2.44e+06
assign (resid  46 and name  HG2 ) (resid  47 and name   HN )  3.5  1.2  0.5 ! A.718  at 3.72e+06
assign (resid  46 and name  HB1 ) (resid  47 and name   HN )  3.5  1.2  0.5 ! A.717  at 4.71e+06
assign (resid  46 and name  HD# ) (resid  48 and name   HN )  4.0  2.2  1.5 ! A.2119 at 1.38e+06
assign (resid  46 and name  HG2 ) (resid  48 and name   HN )  4.0  2.2  1.0 ! A.536  at 2.09e+06

! K47
assign (resid  47 and name   HA ) (resid  47 and name   HN )  2.5  0.7  0.4 !
assign (resid  47 and name  HG1 ) (resid  47 and name   HN )  2.5  0.7  0.4 ! A.722  at 9.10e+06
assign (resid  47 and name  HB2 ) (resid  47 and name   HN )  3.5  0.7  0.6 ! A.720  at 2.02e+07
assign (resid  47 and name  HD# ) (resid  47 and name   HN )  4.0  2.2  1.5 ! A.2161 at 2.32e+06
assign (resid  47 and name   HA ) (resid  48 and name   HN )  3.5  1.2  0.5 ! A.2118 at 4.16e+06
assign (resid  47 and name  HB# ) (resid  48 and name   HN )  3.5  1.2  1.0 ! A.2120 at 3.04e+06
assign (resid  47 and name   HN ) (resid  48 and name   HN )  4.0  2.2  1.0 ! A.533  at 2.69e+06
assign (resid  47 and name   HN ) (resid  49 and name   HN )  4.5  2.2  2.0 ! A.714  at 9.57e+05
assign (resid  47 and name   HA ) (resid  49 and name   HN )  4.0  2.2  1.0 ! A.387  at 1.06e+06
assign (resid  47 and name  HD1 ) (resid 102 and name HD22 )  4.0  2.2  1.0 ! A.794  at 1.55e+06

! L48
assign (resid  48 and name   HA ) (resid  48 and name   HN )  2.5  0.7  0.4 !
assign (resid  48 and name  HB2 ) (resid  48 and name   HN )  2.5  0.7  0.4 ! A.539  at 7.99e+06
assign (resid  48 and name  HB1 ) (resid  48 and name   HN )  3.5  1.2  0.5 ! A.538  at 3.62e+06
assign (resid  48 and name   HG ) (resid  48 and name   HN )  3.5  1.2  0.5 ! A.2121 at 3.76e+06
assign (resid  48 and name HD1# ) (resid  48 and name   HN )  4.5  2.2  2.5 ! A.2122 at 8.65e+05
assign (resid  48 and name HD2# ) (resid  48 and name   HN )  4.0  2.2  1.5 ! A.2123 at 2.39e+06
assign (resid  48 and name   HN ) (resid  49 and name   HN )  3.5  1.0  0.5 ! A.534  at 5.44e+06
assign (resid  48 and name   HN ) (resid  50 and name   HN )  4.5  2.2  2.0 ! A.693  at 6.77e+05
assign (resid  48 and name   HA ) (resid  50 and name   HN )  4.0  2.2  1.0 ! A.696  at 1.68e+06
assign (resid  48 and name  HB1 ) (resid  50 and name   HN )  4.0  2.2  1.0 ! A.700  at 1.36e+06
assign (resid  48 and name  HB1 ) (resid  52 and name   HN )  4.0  2.2  1.0 ! A.641  at 2.79e+06

! E49
assign (resid  49 and name   HA ) (resid  49 and name   HN )  2.5  0.7  0.4 !
assign (resid  49 and name  HG# ) (resid  49 and name   HN )  4.0  2.2  1.5 ! A.436  at 2.11e+06
assign (resid  49 and name  HB# ) (resid  49 and name   HN )  2.5  0.7  0.9 ! A.437  at 8.59e+06
assign (resid  49 and name  HB# ) (resid  50 and name   HN )  3.5  1.2  1.0 ! A.699  at 4.81e+06
assign (resid  49 and name   HN ) (resid  50 and name   HN )  2.5  0.7  0.4 ! A.694  at 6.24e+06
assign (resid  49 and name   HN ) (resid  50 and name   HA )  4.0  2.2  2.0 ! A.433  at 3.03e+06
assign (resid  49 and name  HG# ) (resid  50 and name   HN )  4.0  2.2  1.5 ! A.698  at 2.85e+06
assign (resid  49 and name   HN ) (resid  51 and name   HN )  3.5  1.2  0.5 ! A.458  at 3.96e+06

! D50
assign (resid  50 and name   HA ) (resid  50 and name   HN )  2.5  0.7  0.4 !
assign (resid  50 and name  HB2 ) (resid  50 and name   HN )  4.5  2.2  2.0 ! A.697  at 5.47e+00
assign (resid  50 and name  HB1 ) (resid  50 and name   HN )  3.5  0.7  0.4 ! A.697  at 1.07e+07
assign (resid  50 and name   HN ) (resid  51 and name  HB2 )  3.5  1.2  0.5 ! A.2156 at 3.25e+06
assign (resid  50 and name  HB2 ) (resid  51 and name   HN )  4.0  2.2  1.0 ! A.390  at 1.79e+06
assign (resid  50 and name  HB1 ) (resid  51 and name   HN )  4.0  2.2  1.0 ! A.390  at 2.79e+06
assign (resid  50 and name   HN ) (resid  51 and name   HN )  2.5  0.7  0.4 ! A.694  at 7.24e+06
assign (resid  50 and name   HA ) (resid  51 and name   HN )  3.5  1.2  0.5 ! A.433  at 3.93e+06
assign (resid  50 and name   HN ) (resid  51 and name  HG1 )  4.0  2.2  1.0 ! A.701  at 2.79e+06

! K51
assign (resid  51 and name   HA ) (resid  51 and name   HN )  2.5  0.7  0.4 !
assign (resid  51 and name  HB# ) (resid  51 and name   HN )  3.5  1.2  1.0 ! A.2086 at 3.89e+06
assign (resid  51 and name  HD# ) (resid  51 and name   HN )  4.0  2.2  1.5 ! A.2087 at 1.58e+06
assign (resid  51 and name  HG# ) (resid  51 and name   HN )  3.5  1.2  1.0 ! A.459  at 3.25e+06
assign (resid  51 and name   HN ) (resid  52 and name   HN )  4.0  2.2  1.0 ! A.634  at 1.62e+06
assign (resid  51 and name   HN ) (resid  52 and name  HB2 )  3.5  1.2  0.5 ! A.388  at 3.08e+06
assign (resid  51 and name  HG# ) (resid  52 and name   HN )  4.0  2.2  1.5 ! A.642  at 2.31e+06
assign (resid  51 and name  HB# ) (resid  52 and name   HN )  2.5  0.7  0.9 ! A.640  at 5.82e+06
assign (resid  51 and name   HA ) (resid  52 and name   HN )  3.5  1.2  0.5 ! A.636  at 5.39e+06
assign (resid  51 and name  HD# ) (resid  57 and name   HN )  4.5  2.2  2.5 ! A.711  at 6.78e+05
assign (resid  51 and name  HG2 ) (resid  57 and name   HN )  4.5  2.2  2.0 ! A.712  at 5.80e+05

! S52
assign (resid  52 and name   HA ) (resid  52 and name   HN )  2.5  0.7  0.4 !
assign (resid  52 and name  HB2 ) (resid  52 and name   HN )  2.5  0.7  0.4 ! A.639  at 8.03e+06
assign (resid  52 and name  HB1 ) (resid  52 and name   HN )  3.5  1.5  0.5 ! A.638  at 4.43e+06
assign (resid  52 and name  HB2 ) (resid  54 and name   HN )  4.0  2.2  1.0 ! A.2168 at 2.55e+06

! P53
assign (resid  53 and name  HD1 ) (resid  54 and name   HN )  4.0  2.2  1.0 ! A.755  at 2.20e+06
assign (resid  53 and name  HB1 ) (resid  54 and name   HN )  4.0  2.2  1.0 ! A.759  at 1.14e+06
assign (resid  53 and name  HG1 ) (resid  54 and name   HN )  4.0  2.2  1.0 ! A.760  at 1.29e+06

! D54
assign (resid  54 and name   HA ) (resid  54 and name   HN )  2.5  0.7  0.4 !
assign (resid  54 and name  HB1 ) (resid  54 and name   HN )  3.5  1.2  0.5 ! A.756  at 3.01e+06
assign (resid  54 and name  HB2 ) (resid  54 and name   HN )  3.5  1.2  0.5 ! A.758  at 4.15e+06
assign (resid  54 and name   HN ) (resid  55 and name   HN )  3.5  1.2  0.5 ! A.2167 at 4.14e+06
assign (resid  54 and name  HB2 ) (resid  55 and name   HN )  4.5  2.2  2.0 ! A.2146 at 8.96e+05
assign (resid  54 and name   HA ) (resid  55 and name   HN )  3.5  1.2  0.5 ! A.669  at 5.39e+06
assign (resid  54 and name  HB1 ) (resid  55 and name   HN )  4.0  2.2  1.0 ! A.663  at 1.59e+06
assign (resid  54 and name   HN ) (resid  55 and name  HB2 )  4.0  2.2  1.0 ! A.753  at 2.51e+06
assign (resid  54 and name   HN ) (resid  57 and name   HN )  4.5  2.2  2.0 ! A.751  at 7.36e+05
assign (resid  54 and name   HN ) (resid  57 and name  HB1 )  3.5  1.2  0.5 ! A.760  at 3.29e+06

! S55
assign (resid  51 and name   HA ) (resid  51 and name   HN )  2.5  0.7  0.4 !
assign (resid  55 and name  HB1 ) (resid  55 and name   HN )  3.5  1.2  0.5 ! A.672  at 3.99e+06
assign (resid  55 and name   HA ) (resid  57 and name   HN )  4.5  2.2  2.0 ! A.704  at 8.34e+05

! P56
assign (resid  56 and name  HD1 ) (resid  57 and name   HN )  4.0  2.2  1.0 ! A.707  at 1.86e+06
assign (resid  56 and name  HG2 ) (resid  57 and name   HN )  4.0  2.2  1.0 ! A.2159 at 1.01e+06
assign (resid  56 and name   HA ) (resid  59 and name   HN )  4.0  2.2  1.0 ! A.275  at 1.51e+06
assign (resid  56 and name  HB1 ) (resid  60 and name   HN )  4.5  2.2  2.0 ! A.452  at 6.25e+05
assign (resid  56 and name  HB2 ) (resid  60 and name   HN )  3.5  1.2  0.5 ! A.449  at 3.37e+06
assign (resid  56 and name   HA ) (resid  60 and name   HN )  4.0  2.2  1.0 ! A.445  at 1.86e+06

! E57
assign (resid  57 and name   HA ) (resid  57 and name   HN )  2.5  0.7  0.4 !
assign (resid  57 and name  HG# ) (resid  57 and name   HN )  4.0  2.2  1.5 ! A.708  at 2.75e+06
assign (resid  57 and name  HB1 ) (resid  57 and name   HN )  2.5  0.7  0.6 ! A.710  at 6.54e+06
assign (resid  57 and name  HB2 ) (resid  57 and name   HN )  3.5  0.7  0.4 ! A.710  at 6.54e+06
assign (resid  57 and name   HN ) (resid  58 and name   HN )  4.0  2.2  1.0 ! A.703  at 1.68e+06
assign (resid  57 and name  HB# ) (resid  58 and name   HN )  3.5  1.2  1.0 ! A.2073 at 4.69e+06
assign (resid  57 and name  HG# ) (resid  58 and name   HN )  4.5  2.2  2.5 ! A.411  at 7.35e+05
assign (resid  57 and name   HA ) (resid  58 and name   HN )  4.0  2.2  1.0 ! A.407  at 2.20e+06
assign (resid  57 and name   HN ) (resid  59 and name   HN )  4.5  2.2  2.0 ! A.702  at 8.71e+05
assign (resid  57 and name   HA ) (resid  60 and name   HN )  4.0  2.2  1.0 ! A.446  at 2.03e+06

! M58
assign (resid  58 and name   HA ) (resid  58 and name   HN )  2.5  0.7  0.4 !
assign (resid  58 and name  HB2 ) (resid  58 and name   HN )  2.5  0.7  0.4 ! A.415  at 5.78e+06
assign (resid  58 and name  HB1 ) (resid  58 and name   HN )  4.0  2.2  1.0 ! A.413  at 2.71e+06
assign (resid  58 and name  HG1 ) (resid  58 and name   HN )  4.0  2.2  1.0 ! A.410  at 1.63e+06
assign (resid  58 and name   HA ) (resid  59 and name   HN )  4.0  2.2  1.0 ! A.274  at 1.79e+06
assign (resid  58 and name  HB1 ) (resid  59 and name   HN )  3.5  1.2  0.5 ! A.279  at 3.57e+06
assign (resid  58 and name   HN ) (resid  59 and name   HA )  4.5  2.2  2.0 ! A.408  at 8.76e+05
assign (resid  58 and name   HN ) (resid  59 and name  HG# )  4.5  2.2  2.5 ! A.2074 at 7.61e+05
assign (resid  58 and name   HN ) (resid  59 and name   HN )  3.5  1.2  0.5 ! A.403  at 4.30e+06
assign (resid  58 and name  HB2 ) (resid  59 and name   HN )  4.5  2.2  2.0 ! A.278  at 8.07e+05
assign (resid  58 and name   HA ) (resid  61 and name   HN )  4.0  2.2  1.0 ! A.194  at 1.87e+06

! K59
assign (resid  59 and name   HA ) (resid  59 and name   HN )  2.5  0.7  0.4 !
assign (resid  59 and name  HG1 ) (resid  59 and name   HN )  4.0  2.2  1.0 ! A.283  at 2.73e+06
assign (resid  59 and name  HB1 ) (resid  59 and name   HN )  3.5  1.2  0.5 ! A.281  at 3.11e+06
assign (resid  59 and name  HB2 ) (resid  59 and name   HN )  3.5  1.2  0.5 ! A.281  at 5.11e+06
assign (resid  59 and name  HD1 ) (resid  59 and name   HN )  3.5  1.2  0.5 ! A.282  at 4.11e+06
assign (resid  59 and name  HD2 ) (resid  59 and name   HN )  3.5  1.2  0.5 ! A.282  at 3.11e+06
assign (resid  59 and name  HD# ) (resid  60 and name   HN )  4.0  2.2  1.5 ! A.2082 at 2.04e+06
assign (resid  59 and name  HG# ) (resid  60 and name   HN )  3.5  1.2  1.0 ! A.2083 at 4.42e+06
assign (resid  59 and name  HB# ) (resid  60 and name   HN )  3.5  1.2  1.0 ! A.449  at 3.37e+06
assign (resid  59 and name   HA ) (resid  60 and name   HN )  4.0  2.2  1.0 ! A.446  at 2.03e+06
assign (resid  59 and name   HA ) (resid  61 and name   HN )  3.5  1.2  0.5 ! A.177  at 4.26e+06
assign (resid  59 and name   HN ) (resid  61 and name   HN )  4.0  2.2  1.0 ! A.193  at 1.90e+06
assign (resid  59 and name   HN ) (resid  62 and name   HN )  4.0  2.2  1.0 ! A.549  at 1.49e+06
assign (resid  59 and name  HD1 ) (resid  63 and name   HN )  4.5  2.2  2.0 ! A.560  at 1.01e+06

! D60
assign (resid  60 and name   HA ) (resid  60 and name   HN )  2.5  0.7  0.4 !
assign (resid  60 and name  HB2 ) (resid  60 and name   HN )  3.5  0.7  0.5 ! A.2081 at 5.45e+06
assign (resid  60 and name  HB1 ) (resid  60 and name   HN )  2.5  0.7  0.4 ! A.447  at 1.58e+07
assign (resid  60 and name   HN ) (resid  61 and name   HN )  3.5  1.2  0.5 ! A.442  at 4.60e+06
assign (resid  60 and name   HN ) (resid  61 and name  HB1 )  4.5  2.2  2.0 ! A.451  at 7.96e+05
assign (resid  60 and name  HD1 ) (resid  64 and name   HN )  4.5  2.2  2.0 ! A.2199 at 6.72e+05

! F61
assign (resid  61 and name   HA ) (resid  61 and name   HN )  2.5  0.7  0.4 !
assign (resid  61 and name  HD# ) (resid  61 and name   HN )  3.5  1.2  1.0 ! A.2035 at 3.02e+06
assign (resid  61 and name  HB2 ) (resid  61 and name   HN )  2.5  0.7  0.4 ! A.197  at 5.22e+06
assign (resid  61 and name  HB1 ) (resid  61 and name   HN )  2.5  0.7  0.4 ! A.197  at 7.22e+06
assign (resid  61 and name  HB# ) (resid  62 and name   HN )  3.5  1.2  1.0 ! A.2139 at 4.31e+06
assign (resid  61 and name  HD1 ) (resid  62 and name   HE )  4.0  2.2  1.0 ! A.2186 at 1.32e+06
assign (resid  61 and name  HE1 ) (resid  62 and name   HE )  4.0  2.2  1.0 ! A.2187 at 1.88e+06
assign (resid  61 and name   HN ) (resid  62 and name   HA )  4.0  2.2  1.0 ! A.177  at 2.26e+06
assign (resid  61 and name   HN ) (resid  62 and name  HG1 )  4.0  2.2  1.0 ! A.179  at 2.22e+06
assign (resid  61 and name   HN ) (resid  62 and name   HN )  3.5  1.2  0.5 ! A.550  at 4.40e+06
assign (resid  61 and name  HD1 ) (resid  62 and name   HN )  4.0  2.2  1.0 ! A.602  at 2.17e+06
assign (resid  61 and name   HA ) (resid  66 and name   HN )  4.5  2.2  1.5 ! A.357  at 1.05e+06

! R62
assign (resid  62 and name   HA ) (resid  62 and name   HN )  2.5  0.7  0.4 !
assign (resid  62 and name  HB# ) (resid  62 and name   HN )  2.5  0.7  0.9 ! A.648  at 5.19e+06
assign (resid  62 and name  HG1 ) (resid  62 and name   HN )  4.0  2.2  1.0 ! A.2140 at 2.47e+06
assign (resid  62 and name  HG2 ) (resid  62 and name   HN )  4.0  2.2  1.0 ! A.649  at 2.38e+06
assign (resid  62 and name HH1# ) (resid  62 and name   HE )  3.5  1.2  1.0 ! A.2184 at 4.92e+06
assign (resid  62 and name HH2# ) (resid  62 and name   HE )  3.5  1.2  1.0 ! A.2185 at 4.73e+06
assign (resid  62 and name   HN ) (resid  62 and name   HE )  4.0  2.2  1.0 ! A.2188 at 1.23e+06
assign (resid  62 and name  HG1 ) (resid  62 and name   HE )  4.0  2.2  1.0 ! A.2190 at 2.47e+06
assign (resid  62 and name  HB# ) (resid  62 and name   HE )  3.5  0.7  0.9 ! A.2191 at 5.05e+06
assign (resid  62 and name  HG2 ) (resid  62 and name   HE )  3.5  1.2  0.5 ! A.2192 at 3.01e+06
assign (resid  62 and name  HB# ) (resid  63 and name   HN )  3.5  1.2  1.0 ! A.2125 at 3.02e+06
assign (resid  62 and name  HG2 ) (resid  63 and name   HN )  4.0  2.2  1.0 ! A.2126 at 1.44e+06
assign (resid  62 and name   HN ) (resid  63 and name   HN )  2.5  0.7  0.4 ! A.548  at 2.94e+07
assign (resid  62 and name   HA ) (resid  65 and name   HN )  4.5  2.2  2.0 ! A.2128 at 7.23e+05
assign (resid  62 and name   HN ) (resid  65 and name   HN )  4.5  2.2  2.0 ! A.644  at 6.34e+05

! H63
assign (resid  63 and name   HA ) (resid  63 and name   HN )  2.5  0.7  0.4 !
assign (resid  63 and name  HD2 ) (resid  63 and name   HN )  4.5  2.2  2.0 ! A.2124 at 8.05e+05
assign (resid  63 and name  HB1 ) (resid  63 and name   HN )  2.5  0.7  0.4 ! A.558  at 7.17e+06
assign (resid  63 and name  HB2 ) (resid  63 and name   HN )  2.5  0.7  0.4 ! A.558  at 6.17e+06
assign (resid  63 and name   HN ) (resid  64 and name   HN )  3.5  1.2  0.5 ! A.551  at 4.64e+06
assign (resid  63 and name  HB# ) (resid  64 and name   HN )  2.5  0.7  0.9 ! A.2198 at 5.29e+06
assign (resid  63 and name   HN ) (resid  65 and name   HN )  4.5  2.2  2.0 ! A.555  at 8.15e+05
assign (resid  63 and name   HN ) (resid  66 and name   HN )  4.5  2.2  2.0 ! A.352  at 6.38e+05
assign (resid  63 and name  HB# ) (resid  66 and name   HN )  4.5  2.2  2.5 ! A.358  at 7.66e+05
assign (resid  63 and name   HA ) (resid  66 and name   HN )  4.0  2.2  1.0 ! A.355  at 1.97e+06
assign (resid  63 and name  HD2 ) (resid  67 and name   HN )  4.5  2.2  2.0 ! A.386  at 6.82e+05

! G64
assign (resid  64 and name  HA# ) (resid  64 and name   HN )  2.5  0.7  0.4 !
assign (resid  64 and name   HN ) (resid  65 and name   HN )  4.0  2.2  1.0 ! A.2196 at 2.56e+06
assign (resid  64 and name  HA1 ) (resid  65 and name   HN )  4.0  2.2  1.0 ! A.585  at 1.34e+06
assign (resid  64 and name  HA# ) (resid  67 and name   HN )  3.5  1.2  1.0 ! A.388  at 3.08e+06

! F65
assign (resid  65 and name   HA ) (resid  65 and name   HN )  2.5  0.7  0.4 !
assign (resid  65 and name  HB# ) (resid  65 and name   HN )  4.5  2.2  2.5 ! A.2129 at 9.74e+05
assign (resid  65 and name  HD1 ) (resid  65 and name   HN )  4.5  2.2  2.0 ! A.581  at 7.78e+05
assign (resid  65 and name   HN ) (resid  66 and name   HA )  4.5  2.2  2.0 ! A.582  at 5.70e+05
assign (resid  65 and name   HN ) (resid  66 and name  HB1 )  4.0  2.2  1.0 ! A.586  at 3.00e+06
assign (resid  65 and name   HN ) (resid  66 and name   HN )  4.0  2.2  1.0 ! A.580  at 2.67e+06
assign (resid  65 and name   HN ) (resid  67 and name   HB )  4.5  2.2  2.0 ! A.587  at 6.80e+05
assign (resid  65 and name   HN ) (resid  67 and name   HN )  4.0  2.2  1.0 ! A.354  at 1.81e+06
assign (resid  65 and name   HA ) (resid  67 and name   HN )  4.5  2.2  2.0 ! A.387  at 6.06e+05
assign (resid  65 and name   HN ) (resid  68 and name   HN )  4.0  2.2  1.0 ! A.129  at 1.34e+06
assign (resid  65 and name   HN ) (resid  68 and name HD1# )  4.5  2.2  2.5 ! A.589  at 9.27e+05
assign (resid  65 and name   HN ) (resid  68 and name  HB2 )  4.0  2.2  1.0 ! A.588  at 1.05e+06
assign (resid  65 and name   HN ) (resid  69 and name   HN )  4.5  2.2  2.0 ! A.2112 at 7.17e+05
assign (resid  65 and name   HA ) (resid  69 and name   HN )  4.0  2.2  1.0 ! A.503  at 1.14e+06

! D66
assign (resid  66 and name   HA ) (resid  66 and name   HN )  2.5  0.7  0.4 !
assign (resid  66 and name  HB2 ) (resid  66 and name   HN )  2.5  0.7  0.4 ! A.359  at 5.51e+06
assign (resid  66 and name  HB1 ) (resid  66 and name   HN )  3.5  1.2  0.5 ! A.359  at 4.51e+06
assign (resid  66 and name   HN ) (resid  67 and name   HB )  4.0  2.2  1.0 ! A.2062 at 1.34e+06
assign (resid  66 and name   HN ) (resid  67 and name HG11 )  4.0  2.2  1.0 ! A.2064 at 1.78e+06
assign (resid  66 and name   HA ) (resid  67 and name   HN )  4.0  2.2  1.0 ! A.2071 at 2.62e+06
assign (resid  66 and name  HB2 ) (resid  67 and name   HN )  4.0  2.2  1.0 ! A.390  at 1.79e+06
assign (resid  66 and name  HB1 ) (resid  67 and name   HN )  3.5  1.2  0.5 ! A.390  at 3.79e+06
assign (resid  66 and name   HN ) (resid  68 and name  HB2 )  4.5  2.2  2.0 ! A.2063 at 7.38e+05
assign (resid  66 and name   HN ) (resid  68 and name   HN )  4.0  2.2  1.0 ! A.353  at 1.90e+06
assign (resid  66 and name   HA ) (resid  69 and name   HN )  4.0  2.2  1.0 ! A.502  at 1.17e+06
assign (resid  66 and name   HN ) (resid  69 and name   HB )  4.5  2.2  2.0 ! A.360  at 6.97e+05

! I67
assign (resid  67 and name   HA ) (resid  67 and name   HN )  2.5  0.7  0.4 !
assign (resid  67 and name HD1# ) (resid  67 and name   HN )  3.5  1.2  1.0 ! A.2072 at 3.66e+06
assign (resid  67 and name HG11 ) (resid  67 and name   HN )  3.5  1.2  0.5 ! A.393  at 4.06e+06
assign (resid  67 and name HG12 ) (resid  67 and name   HN )  3.5  1.2  0.5 ! A.395  at 4.28e+06
assign (resid  67 and name HG2# ) (resid  67 and name   HN )  3.5  1.2  1.0 ! A.396  at 3.08e+06
assign (resid  67 and name   HB ) (resid  67 and name   HN )  2.5  0.7  0.4 ! A.392  at 7.07e+06
assign (resid  67 and name   HA ) (resid  68 and name   HN )  4.5  2.2  2.0 ! A.132  at 9.55e+05
assign (resid  67 and name   HB ) (resid  68 and name   HN )  3.5  1.2  0.5 ! A.2029 at 3.53e+06
assign (resid  67 and name   HN ) (resid  68 and name   HN )  3.5  1.2  0.5 ! A.353  at 3.21e+06
assign (resid  67 and name   HN ) (resid  68 and name  HB# )  4.5  2.2  2.5 ! A.361  at 8.93e+05
assign (resid  67 and name   HA ) (resid  69 and name   HN )  4.5  2.2  2.0 ! A.505  at 5.64e+05
assign (resid  67 and name   HA ) (resid  70 and name   HN )  4.0  2.2  1.0 ! A.2193 at 1.38e+06
assign (resid  67 and name   HN ) (resid  70 and name   HN )  4.0  2.2  1.0 ! A.919  at 1.37e+06
assign (resid  67 and name HG2# ) (resid  71 and name HE21 )  2.5  0.7  0.9 ! A.887  at 5.28e+06
assign (resid  67 and name HG2# ) (resid  71 and name HE22 )  2.5  0.7  0.9 ! A.888  at 5.28e+06
assign (resid  67 and name   HA ) (resid  71 and name HE21 )  4.5  2.2  2.0 ! A.877  at 5.54e+05
assign (resid  67 and name HG2# ) (resid  71 and name   HN )  3.5  1.2  1.0 ! A.232  at 3.84e+06
assign (resid  67 and name HG2# ) (resid  98 and name   HN )  4.0  2.2  1.5 ! A.864  at 1.34e+06

! L68
assign (resid  68 and name   HA ) (resid  68 and name   HN )  2.5  0.7  0.4 !
assign (resid  68 and name  HB1 ) (resid  68 and name   HN )  3.5  1.2  0.5 ! A.133  at 3.95e+06
assign (resid  68 and name  HB2 ) (resid  68 and name   HN )  3.5  1.2  0.5 ! A.134  at 5.49e+06
assign (resid  68 and name HD2# ) (resid  68 and name   HN )  4.0  2.2  1.5 ! A.138  at 2.73e+06
assign (resid  68 and name HD1# ) (resid  68 and name   HN )  3.5  1.2  1.0 ! A.136  at 4.74e+06
assign (resid  68 and name   HG ) (resid  68 and name   HN )  4.5  2.2  2.0 ! A.135  at 6.32e+05
assign (resid  68 and name   HN ) (resid  69 and name   HN )  4.0  2.2  1.0 ! A.125  at 1.98e+06
assign (resid  68 and name  HB2 ) (resid  69 and name   HN )  4.0  2.2  1.0 ! A.509  at 2.90e+06
assign (resid  68 and name   HA ) (resid  69 and name   HN )  4.0  2.2  1.0 ! A.503  at 1.14e+06
assign (resid  68 and name  HB1 ) (resid  69 and name   HN )  4.0  2.2  1.0 ! A.508  at 2.08e+06
assign (resid  68 and name  HB2 ) (resid  70 and name   HN )  4.5  2.2  2.0 ! A.926  at 6.88e+05
assign (resid  68 and name   HN ) (resid  70 and name   HN )  4.5  2.2  2.0 ! A.126  at 7.45e+05
assign (resid  68 and name   HA ) (resid  70 and name   HN )  4.5  2.2  2.0 ! A.920  at 6.16e+05
assign (resid  68 and name   HN ) (resid  71 and name HE21 )  2.5  0.7  0.4 ! A.873  at 4.68e+07
assign (resid  68 and name HD1# ) (resid  71 and name HE22 )  4.5  2.2  2.5 ! A.886  at 9.24e+05
assign (resid  68 and name HD1# ) (resid  71 and name HE21 )  4.0  2.2  1.5 ! A.885  at 1.03e+06
assign (resid  68 and name   HG ) (resid  71 and name HE22 )  4.5  2.2  2.0 ! A.884  at 6.60e+05
assign (resid  68 and name  HB2 ) (resid  72 and name   HN )  4.5  2.2  2.0 ! A.61   at 1.25e+06

! V69
assign (resid  69 and name   HA ) (resid  69 and name   HN )  2.5  0.7  0.4 !
assign (resid  69 and name   HB ) (resid  69 and name   HN )  3.5  1.2  0.5 ! A.507  at 4.42e+06
assign (resid  69 and name HG1# ) (resid  69 and name   HN )  3.5  1.2  1.0 ! A.511  at 3.29e+06
assign (resid  69 and name HG2# ) (resid  69 and name   HN )  4.5  2.2  2.5 ! A.512  at 9.14e+05
assign (resid  69 and name   HN ) (resid  70 and name   HN )  4.0  2.2  1.0 ! A.917  at 2.67e+06
assign (resid  69 and name HG2# ) (resid  70 and name   HN )  4.0  2.2  1.5 ! A.928  at 1.09e+06
assign (resid  69 and name   HA ) (resid  70 and name   HN )  4.0  2.2  1.0 ! A.2194 at 1.38e+06
assign (resid  69 and name HG1# ) (resid  70 and name   HN )  3.5  1.2  1.0 ! A.927  at 3.07e+06
assign (resid  69 and name   HN ) (resid  70 and name  HA# )  4.5  2.2  2.5 ! A.504  at 9.29e+05
assign (resid  69 and name   HB ) (resid  70 and name   HN )  4.0  2.2  1.0 ! A.924  at 2.47e+06
assign (resid  69 and name HG1# ) (resid  73 and name   HN )  4.0  2.2  1.5 ! A.192  at 1.63e+06
assign (resid  69 and name   HA ) (resid  73 and name   HN )  4.0  2.2  1.0 ! A.186  at 1.75e+06

! G70
assign (resid  70 and name  HA# ) (resid  70 and name   HN )  2.5  0.7  0.4 !
assign (resid  70 and name   HN ) (resid  71 and name   HN )  2.5  0.7  0.4 ! A.918  at 2.11e+07
assign (resid  70 and name  HA# ) (resid  71 and name   HN )  3.5  1.2  1.0 ! A.228  at 4.12e+06
assign (resid  70 and name   HN ) (resid  71 and name   HA )  4.5  2.2  2.0 ! A.920  at 6.16e+05
assign (resid  70 and name   HN ) (resid  71 and name  HG1 )  4.5  2.2  2.0 ! A.923  at 1.00e+06
assign (resid  70 and name   HN ) (resid  72 and name   HB )  4.5  2.2  2.0 ! A.925  at 7.64e+05
assign (resid  70 and name  HA# ) (resid  73 and name   HN )  4.0  2.2  1.5 ! A.185  at 1.65e+06
assign (resid  70 and name   HN ) (resid  73 and name  HB1 )  4.5  2.2  2.0 ! A.922  at 7.74e+05
assign (resid  70 and name  HA# ) (resid  74 and name   HN )  4.0  2.2  1.5 ! A.157  at 1.10e+06

! Q71
assign (resid  71 and name   HA ) (resid  71 and name   HN )  2.5  0.7  0.4 !
assign (resid  71 and name HE21 ) (resid  71 and name   HN )  4.5  2.2  2.0 ! A.244  at 5.55e+05
assign (resid  71 and name  HB# ) (resid  71 and name   HN )  2.5  0.7  0.9 ! A.247  at 5.90e+06
assign (resid  71 and name  HG1 ) (resid  71 and name   HN )  2.5  0.7  0.4 ! A.246  at 6.71e+06
assign (resid  71 and name   HN ) (resid  71 and name HE22 )  4.5  2.2  2.0 ! A.872  at 5.52e+05
assign (resid  71 and name  HB# ) (resid  71 and name HE21 )  4.0  2.2  1.5 ! A.882  at 1.10e+06
assign (resid  71 and name  HB# ) (resid  71 and name HE22 )  4.5  2.2  2.5 ! A.883  at 8.52e+05
assign (resid  71 and name  HG1 ) (resid  71 and name HE22 )  4.0  2.2  1.0 ! A.879  at 1.97e+06
assign (resid  71 and name  HG2 ) (resid  71 and name HE22 )  4.0  2.2  1.0 ! A.881  at 2.47e+06
assign (resid  71 and name  HG2 ) (resid  71 and name HE21 )  3.5  1.2  0.5 ! A.880  at 3.62e+06
assign (resid  71 and name  HG1 ) (resid  71 and name HE21 )  4.0  2.2  1.0 ! A.878  at 2.98e+06
assign (resid  71 and name  HG1 ) (resid  72 and name   HN )  4.5  2.2  2.0 ! A.58   at 6.76e+05
assign (resid  71 and name  HG2 ) (resid  72 and name   HN )  4.0  2.2  1.0 ! A.2013 at 1.10e+06
assign (resid  71 and name   HN ) (resid  72 and name   HN )  2.5  0.7  0.4 ! A.223  at 5.29e+06
assign (resid  71 and name   HA ) (resid  72 and name   HN )  4.5  2.2  2.0 ! A.55   at 9.52e+05
assign (resid  71 and name   HN ) (resid  72 and name HG11 )  3.5  1.2  0.5 ! A.248  at 3.66e+06
assign (resid  71 and name HE21 ) (resid  72 and name HG11 )  4.0  2.2  1.0 ! A.885  at 1.03e+06
assign (resid  71 and name   HN ) (resid  73 and name   HN )  4.0  2.2  1.0 ! A.183  at 1.25e+06
assign (resid  71 and name   HA ) (resid  74 and name   HN )  2.5  0.7  0.4 ! A.156  at 5.39e+06
assign (resid  71 and name   HN ) (resid  74 and name   HN )  4.0  2.2  1.0 ! A.152  at 1.46e+06
assign (resid  71 and name  HB# ) (resid  75 and name   HN )  4.0  2.2  1.5 ! A.34   at 1.03e+06
assign (resid  71 and name HE22 ) (resid  94 and name HD2# )  4.5  2.2  2.5 ! A.886  at 9.24e+05
assign (resid  71 and name HE21 ) (resid  94 and name HD1# )  4.0  2.2  1.5 ! A.885  at 1.03e+06
assign (resid  71 and name HE21 ) (resid  94 and name HD2# )  4.0  2.2  1.5 ! A.885  at 1.03e+06
assign (resid  71 and name HE22 ) (resid  97 and name HG2# )  4.5  2.2  2.5 ! A.884  at 6.60e+05

! I72
assign (resid  72 and name   HA ) (resid  72 and name   HN )  2.5  0.7  0.4 !
assign (resid  72 and name   HB ) (resid  72 and name   HN )  2.5  0.7  0.4 ! A.60   at 6.02e+06
assign (resid  72 and name HG2# ) (resid  72 and name   HN )  4.0  2.2  1.5 ! A.2014 at 2.30e+06
assign (resid  72 and name HD1# ) (resid  72 and name   HN )  3.5  1.2  1.0 ! A.2015 at 3.32e+06
assign (resid  72 and name HG11 ) (resid  72 and name   HN )  2.5  0.7  0.4 ! A.62   at 5.23e+06
assign (resid  72 and name   HN ) (resid  73 and name   HN )  4.0  2.2  1.0 ! A.181  at 2.45e+06
assign (resid  72 and name HD1# ) (resid  73 and name   HN )  4.0  2.2  1.5 ! A.2034 at 1.86e+06
assign (resid  72 and name   HB ) (resid  73 and name   HN )  3.5  1.2  0.5 ! A.190  at 4.25e+06
assign (resid  72 and name HG2# ) (resid  73 and name   HN )  4.0  2.2  1.5 ! A.192  at 1.63e+06
assign (resid  72 and name HG11 ) (resid  73 and name   HN )  4.0  2.2  1.0 ! A.192  at 1.63e+06
assign (resid  72 and name   HA ) (resid  73 and name   HN )  4.0  2.2  1.0 ! A.186  at 1.75e+06
assign (resid  72 and name HG2# ) (resid  74 and name   HN )  4.0  2.2  1.5 ! A.2031 at 2.14e+06
assign (resid  72 and name   HB ) (resid  74 and name   HN )  4.0  2.2  1.0 ! A.161  at 2.89e+06
assign (resid  72 and name   HA ) (resid  75 and name   HN )  4.5  2.2  2.0 ! A.31   at 8.29e+05
assign (resid  72 and name   HN ) (resid  75 and name   HN )  4.5  2.2  2.0 ! A.25   at 5.59e+05

! D73
assign (resid  73 and name   HA ) (resid  73 and name   HN )  2.5  0.7  0.4 !
assign (resid  73 and name  HB2 ) (resid  73 and name   HN )  3.5  1.2  0.5 ! A.189  at 4.32e+06
assign (resid  73 and name  HB1 ) (resid  73 and name   HN )  3.5  1.2  0.5 ! A.187  at 4.36e+06
assign (resid  73 and name   HN ) (resid  74 and name   HN )  3.5  1.2  0.5 ! A.182  at 3.38e+06
assign (resid  73 and name   HA ) (resid  74 and name   HN )  4.0  2.2  1.0 ! A.2030 at 1.09e+06
assign (resid  73 and name   HA ) (resid  75 and name   HN )  4.0  2.2  1.0 ! A.28   at 1.46e+06
assign (resid  73 and name   HN ) (resid  76 and name  HB2 )  4.5  2.2  2.0 ! A.191  at 7.15e+05
assign (resid  73 and name   HA ) (resid  76 and name   HN )  4.0  2.2  1.0 ! A.325  at 1.94e+06

! D74
assign (resid  74 and name   HA ) (resid  74 and name   HN )  2.5  0.7  0.4 !
assign (resid  74 and name  HB1 ) (resid  74 and name   HN )  3.5  0.7  0.5 ! A.159  at 5.33e+06
assign (resid  74 and name  HB2 ) (resid  74 and name   HN )  2.5  0.7  0.4 ! A.160  at 1.17e+07
assign (resid  74 and name  HB2 ) (resid  75 and name   HN )  4.0  2.2  1.0 ! A.33   at 2.85e+06
assign (resid  74 and name   HN ) (resid  75 and name   HN )  2.5  0.7  0.4 ! A.153  at 7.72e+06
assign (resid  74 and name   HA ) (resid  75 and name   HN )  4.0  2.2  1.0 ! A.28   at 1.46e+06
assign (resid  74 and name  HB1 ) (resid  75 and name   HN )  3.5  1.2  0.5 ! A.32   at 3.10e+06
assign (resid  74 and name   HN ) (resid  75 and name  HB# )  3.5  1.2  1.0 ! A.162  at 3.80e+06
assign (resid  74 and name   HN ) (resid  76 and name   HN )  4.0  2.2  1.0 ! A.151  at 1.06e+06
assign (resid  74 and name  HB1 ) (resid  76 and name   HN )  4.5  2.2  2.0 ! A.328  at 6.23e+05
assign (resid  74 and name   HA ) (resid  77 and name   HN )  3.5  1.2  0.5 ! A.2052 at 3.93e+06

! A75
assign (resid  75 and name   HA ) (resid  75 and name   HN )  2.5  0.7  0.4 !
assign (resid  75 and name  HB# ) (resid  75 and name   HN )  2.5  0.7  0.9 ! A.36   at 1.09e+07
assign (resid  75 and name   HN ) (resid  76 and name   HN )  3.5  1.2  0.5 ! A.324  at 3.03e+06
assign (resid  75 and name   HN ) (resid  76 and name  HB1 )  4.0  2.2  1.0 ! A.34   at 1.53e+06
assign (resid  75 and name   HA ) (resid  76 and name   HN )  4.0  2.2  1.0 ! A.326  at 1.08e+06
assign (resid  75 and name   HN ) (resid  77 and name   HN )  4.5  2.2  2.0 ! A.2007 at 5.54e+05
assign (resid  75 and name  HB# ) (resid  78 and name   HN )  4.0  2.2  1.5 ! A.628  at 1.24e+06
assign (resid  75 and name  HB# ) (resid  79 and name   HN )  3.5  1.2  1.0 ! A.2065 at 3.02e+06
assign (resid  75 and name   HN ) (resid  94 and name HD1# )  4.0  2.2  1.5 ! A.37   at 1.20e+06

! L76
assign (resid  76 and name   HA ) (resid  76 and name   HN )  2.5  0.7  0.4 !
assign (resid  76 and name HD1# ) (resid  76 and name   HN )  4.0  1.2  0.9 ! A.337  at 4.65e+06
assign (resid  76 and name   HG ) (resid  76 and name   HN )  4.5  2.2  2.0 ! A.332  at 6.76e+05
assign (resid  76 and name  HB1 ) (resid  76 and name   HN )  3.5  1.2  0.5 ! A.330  at 4.07e+06
assign (resid  76 and name  HB2 ) (resid  76 and name   HN )  2.5  0.7  0.4 ! A.334  at 5.65e+06
assign (resid  76 and name HD2# ) (resid  76 and name   HN )  4.0  2.2  1.5 ! A.338  at 2.00e+06
assign (resid  76 and name  HB2 ) (resid  77 and name   HN )  3.5  1.2  0.5 ! A.2055 at 4.65e+06
assign (resid  76 and name HD2# ) (resid  77 and name   HN )  2.5  0.7  0.9 ! A.241  at 5.47e+06
assign (resid  76 and name   HA ) (resid  77 and name   HN )  4.0  2.2  1.0 ! A.237  at 1.70e+06
assign (resid  76 and name   HN ) (resid  77 and name   HN )  4.0  2.2  1.0 ! A.323  at 2.75e+06
assign (resid  76 and name   HN ) (resid  77 and name  HG1 )  4.0  2.2  1.0 ! A.335  at 1.02e+06
assign (resid  76 and name   HN ) (resid  78 and name   HN )  4.5  2.2  2.0 ! A.619  at 6.30e+05
assign (resid  76 and name   HA ) (resid  79 and name   HN )  4.0  2.2  1.0 ! A.2062 at 1.46e+06
assign (resid  76 and name HD2# ) (resid  80 and name   HN )  4.0  2.2  1.5 ! A.609  at 1.51e+06
assign (resid  76 and name   HA ) (resid  80 and name   HN )  3.5  1.2  0.5 ! A.2132 at 5.43e+06
assign (resid  76 and name HD2# ) (resid  80 and name HD22 )  4.0  2.2  1.5 ! A.819  at 2.92e+06
assign (resid  76 and name HD2# ) (resid  80 and name HD21 )  4.0  2.2  1.5 ! A.818  at 2.69e+06
assign (resid  76 and name   HG ) (resid  80 and name   HN )  4.0  2.2  1.0 ! A.560  at 2.02e+06

! K77
assign (resid  77 and name   HA ) (resid  77 and name   HN )  2.5  0.7  0.4 !
assign (resid  77 and name  HB1 ) (resid  77 and name   HN )  2.5  0.7  0.4 ! A.300  at 1.71e+07
assign (resid  77 and name  HD# ) (resid  77 and name   HN )  4.0  2.2  1.5 ! A.2054 at 2.93e+06
assign (resid  77 and name  HG# ) (resid  77 and name   HN )  3.5  1.2  1.0 ! A.2056 at 4.64e+06
assign (resid  77 and name   HN ) (resid  78 and name   HN )  3.5  1.2  0.5 ! A.620  at 4.82e+06
assign (resid  77 and name  HE1 ) (resid  78 and name   HN )  4.5  2.2  2.0 ! A.624  at 6.38e+05
assign (resid  77 and name  HD1 ) (resid  78 and name   HN )  3.5  1.2  0.5 ! A.628  at 4.24e+06
assign (resid  77 and name   HA ) (resid  80 and name   HN )  3.5  1.2  0.5 ! A.2131 at 3.82e+06
assign (resid  77 and name  HB1 ) (resid  80 and name HD21 )  4.0  2.2  1.0 ! A.817  at 1.07e+06
assign (resid  77 and name   HA ) (resid  80 and name HD22 )  4.0  2.2  1.0 ! A.812  at 1.55e+06
assign (resid  77 and name   HA ) (resid  81 and name   HN )  4.0  2.2  1.0 ! A.595  at 2.00e+06

! L78
assign (resid  78 and name   HA ) (resid  78 and name   HN )  2.5  0.7  0.4 !
assign (resid  78 and name  HB1 ) (resid  78 and name   HN )  2.5  0.7  0.4 ! A.627  at 6.01e+06
assign (resid  78 and name  HB2 ) (resid  78 and name   HN )  4.0  2.2  1.0 ! A.2138 at 1.16e+06
assign (resid  78 and name HD2# ) (resid  78 and name   HN )  3.5  1.2  1.0 ! A.630  at 4.82e+06
assign (resid  78 and name HD1# ) (resid  78 and name   HN )  4.0  2.2  1.5 ! A.630  at 1.82e+06
assign (resid  78 and name   HA ) (resid  79 and name   HN )  3.0  0.7  0.5 ! A.2063 at 5.76e+06
assign (resid  78 and name  HB# ) (resid  79 and name   HN )  3.5  1.2  1.0 ! A.2064 at 3.83e+06
assign (resid  78 and name HD1# ) (resid  79 and name   HN )  3.5  1.2  1.0 ! A.2068 at 4.45e+06
assign (resid  78 and name   HN ) (resid  79 and name   HN )  3.5  1.2  0.5 ! A.620  at 4.82e+06
assign (resid  78 and name HD1# ) (resid  81 and name   HN )  4.5  2.2  2.5 ! A.2130 at 6.01e+05
assign (resid  78 and name   HN ) (resid  81 and name  HB1 )  4.0  2.2  1.0 ! A.625  at 2.51e+06
assign (resid  78 and name   HA ) (resid  81 and name   HN )  4.0  2.2  1.0 ! A.595  at 2.00e+06
assign (resid  78 and name   HN ) (resid  81 and name   HN )  4.5  2.2  2.0 ! A.621  at 6.36e+05
assign (resid  78 and name HD1# ) (resid  83 and name   HN )  4.0  2.2  1.5 ! A.16   at 2.04e+06
assign (resid  78 and name HD1# ) (resid  86 and name   HN )  4.0  2.2  1.5 ! A.222  at 1.63e+06
assign (resid  78 and name HD1# ) (resid  87 and name   HN )  3.5  1.2  1.0 ! A.51   at 3.87e+06
assign (resid  78 and name HD1# ) (resid  90 and name   HN )  3.5  1.2  1.0 ! A.232  at 3.84e+06

! A79
assign (resid  79 and name   HA ) (resid  79 and name   HN )  2.5  0.7  0.4 !
assign (resid  79 and name  HB# ) (resid  79 and name   HN )  2.5  0.7  0.9 ! A.2066 at 1.31e+07
assign (resid  79 and name   HN ) (resid  80 and name   HN )  3.5  1.2  0.5 ! A.550  at 4.40e+06
assign (resid  79 and name  HB# ) (resid  80 and name   HN )  2.5  0.7  0.9 ! A.608  at 5.86e+06
assign (resid  79 and name   HA ) (resid  81 and name   HN )  4.5  2.2  2.0 ! A.596  at 9.00e+05
assign (resid  79 and name  HB# ) (resid  81 and name   HN )  4.0  2.2  1.5 ! A.600  at 1.53e+06
assign (resid  79 and name  HB# ) (resid  82 and name   HN )  4.0  2.2  1.5 ! A.2177 at 1.31e+06
assign (resid  79 and name  HB# ) (resid  87 and name   HN )  4.5  2.2  2.5 ! A.50   at 7.52e+05
assign (resid  79 and name   HN ) (resid  87 and name  HB# )  2.5  0.7  0.9 ! A.322  at 4.53e+07

! N80
assign (resid  80 and name   HA ) (resid  80 and name   HN )  2.5  0.7  0.4 !
assign (resid  80 and name HD22 ) (resid  80 and name   HN )  4.5  2.2  2.0 ! A.603  at 6.86e+05
assign (resid  80 and name HD21 ) (resid  80 and name   HN )  4.0  2.2  1.0 ! A.601  at 1.44e+06
assign (resid  80 and name  HB2 ) (resid  80 and name   HN )  2.5  0.7  0.4 ! A.605  at 6.82e+06
assign (resid  80 and name  HB1 ) (resid  80 and name   HN )  3.5  0.7  0.5 ! A.605  at 4.82e+06
assign (resid  80 and name  HB2 ) (resid  80 and name HD22 )  3.5  1.2  0.5 ! A.814  at 3.21e+06
assign (resid  80 and name  HB1 ) (resid  80 and name HD22 )  3.5  1.2  0.5 ! A.814  at 3.21e+06
assign (resid  80 and name  HB1 ) (resid  80 and name HD21 )  2.5  0.7  0.4 ! A.813  at 8.61e+06
assign (resid  80 and name  HB2 ) (resid  80 and name HD21 )  2.5  0.7  0.4 ! A.813  at 8.61e+06
assign (resid  80 and name   HA ) (resid  80 and name HD22 )  4.5  2.2  2.0 ! A.811  at 8.88e+05
assign (resid  80 and name   HN ) (resid  81 and name   HN )  3.5  1.2  0.5 ! A.551  at 4.64e+06
assign (resid  80 and name HD21 ) (resid  81 and name   HN )  4.5  2.2  2.0 ! A.592  at 5.59e+05
assign (resid  80 and name  HB1 ) (resid  81 and name   HN )  4.0  2.2  1.0 ! A.597  at 2.56e+06
assign (resid  80 and name  HB1 ) (resid  82 and name   HN )  4.5  2.2  2.0 ! A.912  at 7.21e+05

! E81
assign (resid  81 and name   HA ) (resid  81 and name   HN )  2.5  0.7  0.4 !
assign (resid  81 and name  HB1 ) (resid  81 and name   HN )  2.5  0.7  0.4 ! A.599  at 6.22e+06
assign (resid  81 and name  HB2 ) (resid  81 and name   HN )  2.5  0.7  0.4 ! A.599  at 5.22e+06
assign (resid  81 and name  HG# ) (resid  81 and name   HN )  3.5  1.2  1.0 ! A.598  at 4.16e+06
assign (resid  81 and name   HN ) (resid  82 and name   HN )  3.5  1.2  0.5 ! A.908  at 4.68e+06
assign (resid  81 and name   HN ) (resid  82 and name  HA2 )  4.5  2.2  2.0 ! A.596  at 9.00e+05
assign (resid  81 and name  HG# ) (resid  82 and name   HN )  4.5  2.2  2.5 ! A.913  at 9.29e+05
assign (resid  81 and name  HB2 ) (resid  82 and name   HN )  4.0  2.2  1.0 ! A.914  at 1.60e+06
assign (resid  81 and name  HB1 ) (resid  82 and name   HN )  4.0  2.2  1.0 ! A.914  at 1.60e+06
!assign (resid  81 and name  HB# ) (resid  83 and name   HN )  4.0  2.2  1.5 ! A.12   at 2.75e+06

! G82
assign (resid  82 and name  HA# ) (resid  82 and name   HN )  2.5  0.7  0.4 !
assign (resid  82 and name  HA1 ) (resid  83 and name   HN )  4.0  2.2  1.0 ! A.9    at 2.86e+06
assign (resid  82 and name   HN ) (resid  83 and name   HN )  3.5  1.2  0.9 ! A.907  at 3.90e+06
assign (resid  82 and name   HN ) (resid  83 and name  HB2 )  4.5  2.2  2.0 ! A.916  at 6.26e+05
assign (resid  82 and name  HA2 ) (resid  83 and name   HN )  3.5  1.2  0.5 ! A.10   at 3.36e+06

! K83
assign (resid  83 and name   HA ) (resid  83 and name   HN )  2.5  0.7  0.4 !
assign (resid  83 and name  HD# ) (resid  83 and name   HN )  4.0  2.2  1.5 ! A.2004 at 2.53e+06
assign (resid  83 and name  HG1 ) (resid  83 and name   HN )  4.0  2.2  1.0 ! A.15   at 2.98e+06
assign (resid  83 and name  HG2 ) (resid  83 and name   HN )  4.0  2.2  1.0 ! A.15   at 2.98e+06
assign (resid  83 and name  HB# ) (resid  83 and name   HN )  3.5  1.2  1.0 ! A.14   at 4.01e+06
assign (resid  83 and name   HN ) (resid  84 and name   HN )  4.5  2.2  2.0 ! A.375  at 8.41e+05
assign (resid  83 and name   HA ) (resid  84 and name   HN )  2.5  0.7  0.4 ! A.377  at 8.02e+06
assign (resid  83 and name  HB# ) (resid  84 and name   HN )  4.0  2.2  1.5 ! A.382  at 1.66e+06
assign (resid  83 and name  HG# ) (resid  84 and name   HN )  4.0  2.2  1.5 ! A.383  at 2.11e+06
assign (resid  83 and name   HA ) (resid  85 and name   HN )  4.5  2.2  2.0 ! A.252  at 8.82e+05
assign (resid  83 and name HB## ) (resid  85 and name   HN )  3.5  1.2  1.0 ! A.2043 at 3.89e+06
assign (resid  83 and name   HN ) (resid  86 and name  HG1 )  4.5  2.2  2.0 ! A.11   at 8.59e+05
assign (resid  83 and name  HB1 ) (resid  86 and name   HN )  3.5  1.2  0.5 ! A.220  at 4.89e+06
assign (resid  83 and name   HN ) (resid  86 and name  HB2 )  3.5  1.2  0.5 ! A.13   at 3.59e+06
assign (resid  83 and name   HN ) (resid  87 and name   HN )  4.5  2.2  2.0 ! A.41   at 7.34e+05
assign (resid  83 and name  HG1 ) (resid  87 and name   HN )  4.5  2.2  2.0 ! A.50   at 7.52e+05

! V84
assign (resid  84 and name   HA ) (resid  84 and name   HN )  2.5  0.7  0.4 !
assign (resid  84 and name   HB ) (resid  84 and name   HN )  2.5  0.7  0.4 ! A.381  at 8.32e+06
assign (resid  84 and name HG1# ) (resid  84 and name   HN )  3.5  1.2  1.0 ! A.384  at 4.12e+06
assign (resid  84 and name HG2# ) (resid  84 and name   HN )  3.5  1.2  1.0 ! A.2071 at 3.56e+06
assign (resid  84 and name   HA ) (resid  85 and name   HN )  4.0  2.2  1.0 ! A.255  at 1.35e+06
assign (resid  84 and name   HN ) (resid  85 and name  HG# )  4.0  2.2  1.5 ! A.2070 at 1.94e+06
assign (resid  84 and name   HN ) (resid  85 and name   HN )  3.5  1.2  0.5 ! A.374  at 3.86e+06
assign (resid  84 and name HG1# ) (resid  85 and name   HN )  3.5  1.2  1.0 ! A.264  at 4.37e+06
assign (resid  84 and name   HN ) (resid  85 and name   HA )  4.5  2.2  2.0 ! A.378  at 6.50e+05
assign (resid  84 and name   HN ) (resid  86 and name   HN )  4.5  2.2  2.0 ! A.373  at 9.40e+05
assign (resid  84 and name   HN ) (resid  86 and name  HG1 )  4.5  2.2  2.0 ! A.380  at 5.51e+05
assign (resid  84 and name   HA ) (resid  87 and name   HN )  4.0  2.2  1.0 ! A.45   at 1.70e+06
assign (resid  84 and name HG1# ) (resid  88 and name   HN )  3.5  1.2  1.0 ! A.576  at 3.55e+06

! K85
assign (resid  85 and name   HA ) (resid  85 and name   HN )  2.5  0.7  0.4 !
assign (resid  85 and name  HD# ) (resid  85 and name   HN )  3.5  1.2  1.0 ! A.261  at 4.92e+06
assign (resid  85 and name  HB# ) (resid  85 and name   HN )  2.5  0.7  0.9 ! A.259  at 7.02e+06
assign (resid  85 and name  HG# ) (resid  85 and name   HN )  3.5  0.7  0.9 ! A.263  at 4.81e+06
assign (resid  85 and name   HN ) (resid  86 and name   HN )  3.5  1.2  0.5 ! A.209  at 4.06e+06
assign (resid  85 and name  HG# ) (resid  86 and name   HN )  3.5  1.2  1.0 ! A.221  at 3.51e+06
assign (resid  85 and name   HN ) (resid  87 and name   HN )  4.5  2.2  2.0 ! A.2042 at 3.48e+05
assign (resid  85 and name   HN ) (resid  88 and name  HG2 )  4.5  2.2  2.0 ! A.257  at 7.56e+05
assign (resid  85 and name   HA ) (resid  88 and name   HN )  4.0  2.2  1.0 ! A.569  at 1.23e+06

! E86
assign (resid  86 and name   HA ) (resid  86 and name   HN )  2.5  0.7  0.4 !
assign (resid  86 and name  HB1 ) (resid  86 and name   HN )  3.5  1.2  0.5 ! A.217  at 3.70e+06
assign (resid  86 and name  HB2 ) (resid  86 and name   HN )  2.5  0.7  0.4 ! A.219  at 5.14e+06
assign (resid  86 and name  HG2 ) (resid  86 and name   HN )  4.0  2.2  1.0 ! A.216  at 2.90e+06
assign (resid  86 and name  HG1 ) (resid  86 and name   HN )  4.0  2.2  1.0 ! A.214  at 2.12e+06
assign (resid  86 and name   HN ) (resid  87 and name   HN )  3.5  1.2  0.5 ! A.210  at 3.39e+06
assign (resid  86 and name  HG2 ) (resid  87 and name   HN )  3.5  1.2  0.5 ! A.47   at 4.04e+06
assign (resid  86 and name  HB2 ) (resid  87 and name   HN )  3.5  1.2  0.5 ! A.48   at 3.67e+06
assign (resid  86 and name  HG1 ) (resid  87 and name   HN )  4.5  2.2  2.0 ! A.46   at 6.70e+05
assign (resid  86 and name  HB1 ) (resid  87 and name   HN )  3.5  1.2  0.5 ! A.47   at 4.04e+06
assign (resid  86 and name   HA ) (resid  89 and name   HN )  3.5  1.2  0.5 ! A.177  at 3.26e+06
assign (resid  86 and name   HA ) (resid  90 and name   HN )  4.0  2.2  1.0 ! A.228  at 2.12e+06

! A87
assign (resid  87 and name   HA ) (resid  87 and name   HN )  2.5  0.7  0.4 !
assign (resid  87 and name  HB# ) (resid  87 and name   HN )  2.5  0.7  0.9 ! A.49   at 1.53e+07
assign (resid  87 and name   HN ) (resid  88 and name   HN )  3.5  1.2  0.5 ! A.566  at 3.37e+06
assign (resid  87 and name  HB# ) (resid  88 and name   HN )  2.5  0.7  0.9 ! A.575  at 7.55e+06
assign (resid  87 and name   HA ) (resid  88 and name   HN )  3.5  1.2  0.5 ! A.569  at 3.23e+06
assign (resid  87 and name   HN ) (resid  89 and name   HN )  4.0  2.2  1.0 ! A.42   at 1.53e+06
assign (resid  87 and name   HN ) (resid  90 and name   HN )  4.5  2.2  2.0 ! A.2009 at 7.79e+05
assign (resid  87 and name   HA ) (resid  90 and name   HN )  3.5  1.2  0.5 ! A.228  at 3.12e+06

! Q88
assign (resid  88 and name   HA ) (resid  88 and name   HN )  2.5  0.7  0.4 !
assign (resid  88 and name  HG1 ) (resid  88 and name   HN )  4.0  2.2  1.0 ! A.572  at 2.61e+06
assign (resid  88 and name  HG2 ) (resid  88 and name   HN )  3.5  1.2  0.5 ! A.573  at 4.54e+06
assign (resid  88 and name HE21 ) (resid  88 and name   HN )  4.5  2.2  2.0 ! A.568  at 6.96e+05
assign (resid  88 and name  HB# ) (resid  88 and name   HN )  2.5  0.7  0.9 ! A.574  at 5.69e+06
assign (resid  88 and name  HG1 ) (resid  88 and name HE21 )  3.5  1.2  0.5 ! A.821  at 3.15e+06
assign (resid  88 and name  HG1 ) (resid  88 and name HE22 )  4.0  2.2  1.0 ! A.834  at 2.76e+06
assign (resid  88 and name  HG2 ) (resid  88 and name HE22 )  3.5  1.2  0.5 ! A.834  at 3.76e+06
assign (resid  88 and name  HG2 ) (resid  89 and name   HN )  4.0  2.2  1.0 ! A.2033 at 1.19e+06
assign (resid  88 and name HE21 ) (resid  89 and name   HN )  4.5  2.2  2.0 ! A.175  at 6.73e+05
assign (resid  88 and name   HN ) (resid  89 and name   HN )  3.5  1.2  0.5 ! A.567  at 4.24e+06
assign (resid  88 and name HE22 ) (resid  89 and name  HB# )  4.0  2.2  1.5 ! A.836  at 1.98e+06
assign (resid  88 and name  HG1 ) (resid  89 and name   HN )  3.5  1.2  0.5 ! A.178  at 4.76e+06
assign (resid  88 and name   HA ) (resid  89 and name   HN )  3.5  1.2  0.5 ! A.177  at 3.26e+06
assign (resid  88 and name  HB# ) (resid  89 and name   HN )  3.5  1.2  1.0 ! A.179  at 3.22e+06
assign (resid  88 and name   HA ) (resid  90 and name   HN )  4.0  2.2  1.0 ! A.228  at 2.12e+06
assign (resid  88 and name  HB# ) (resid  91 and name   HN )  4.0  2.2  1.5 ! A.2059 at 2.60e+06
assign (resid  88 and name HE21 ) (resid  91 and name  HB# )  2.5  0.7  0.9 ! A.837  at 5.38e+06
assign (resid  88 and name  HG1 ) (resid  91 and name   HN )  4.5  2.2  2.0 ! A.256  at 9.37e+05
assign (resid  88 and name HE21 ) (resid  92 and name   HN )  4.5  2.2  2.0 ! A.676  at 5.69e+05
assign (resid  88 and name HE22 ) (resid  92 and name  HB# )  4.0  2.2  1.5 ! A.835  at 2.60e+06
assign (resid  88 and name HE22 ) (resid  92 and name  HG1 )  4.5  2.2  2.0 ! A.833  at 6.51e+05

! A89
assign (resid  89 and name   HA ) (resid  89 and name   HN )  2.5  0.7  0.4 !
assign (resid  89 and name  HB# ) (resid  89 and name   HN )  2.5  0.7  0.9 ! A.180  at 2.75e+07
assign (resid  89 and name   HN ) (resid  91 and name   HN )  4.0  2.2  1.0 ! A.173  at 1.67e+06
assign (resid  89 and name   HA ) (resid  92 and name   HN )  3.5  1.2  0.5 ! A.677  at 3.59e+06

! A90
assign (resid  90 and name   HA ) (resid  90 and name   HN )  2.5  0.7  0.4 !
assign (resid  90 and name  HB# ) (resid  90 and name   HN )  2.5  0.7  0.9 ! A.231  at 3.16e+07
assign (resid  90 and name   HN ) (resid  91 and name   HN )  3.5  1.2  0.5 ! A.310  at 4.54e+06
assign (resid  90 and name   HA ) (resid  91 and name   HN )  3.5  1.2  0.5 ! A.312  at 3.86e+06
assign (resid  90 and name   HN ) (resid  92 and name   HN )  4.0  2.2  1.0 ! A.2147 at 1.21e+06
assign (resid  90 and name   HA ) (resid  92 and name   HN )  4.0  2.2  1.0 ! A.677  at 1.59e+06
assign (resid  90 and name  HB# ) (resid  93 and name HE22 )  3.5  1.2  1.0 ! A.799  at 3.50e+06
assign (resid  90 and name   HN ) (resid  93 and name   HN )  4.0  2.2  1.0 ! A.225  at 2.18e+06
assign (resid  90 and name  HB# ) (resid  93 and name   HN )  4.0  2.2  1.5 ! A.472  at 1.56e+06
assign (resid  90 and name  HB# ) (resid  93 and name HE21 )  3.5  1.2  1.0 ! A.798  at 4.75e+06

! A91
assign (resid  91 and name   HA ) (resid  91 and name   HN )  2.5  0.7  0.4 !
assign (resid  91 and name  HB# ) (resid  91 and name   HN )  2.5  0.7  0.9 ! A.2061 at 1.71e+07
assign (resid  91 and name   HN ) (resid  92 and name  HB# )  4.0  2.2  1.5 ! A.314  at 2.60e+06
assign (resid  91 and name   HN ) (resid  92 and name   HN )  3.5  1.2  0.5 ! A.673  at 4.46e+06
assign (resid  91 and name  HB# ) (resid  92 and name   HN )  2.5  0.7  0.9 ! A.683  at 1.14e+07
assign (resid  91 and name   HN ) (resid  93 and name   HN )  4.0  2.2  1.0 ! A.311  at 1.10e+06
assign (resid  91 and name   HN ) (resid  94 and name HD1# )  3.5  1.2  1.0 ! A.315  at 3.15e+06
assign (resid  91 and name   HA ) (resid  94 and name   HN )  3.5  1.2  0.5 ! A.2089 at 4.65e+06

! E92
assign (resid  92 and name   HA ) (resid  92 and name   HN )  2.5  0.7  0.4 !
assign (resid  92 and name  HB# ) (resid  92 and name   HN )  2.5  0.7  0.9 ! A.681  at 1.86e+07
assign (resid  92 and name  HG2 ) (resid  92 and name   HN )  2.5  0.7  0.4 ! A.679  at 7.10e+06
assign (resid  92 and name  HG1 ) (resid  92 and name   HN )  2.5  0.7  0.4 ! A.679  at 5.10e+06
assign (resid  92 and name  HB# ) (resid  93 and name   HN )  2.5  0.7  0.9 ! A.2115 at 6.95e+06
assign (resid  92 and name   HN ) (resid  93 and name   HN )  2.5  0.7  0.4 ! A.675  at 7.52e+06
assign (resid  92 and name   HN ) (resid  94 and name  HB2 )  4.0  2.2  1.0 ! A.682  at 1.18e+06
assign (resid  92 and name   HA ) (resid  95 and name   HN )  3.5  1.2  0.5 ! A.2105 at 3.57e+06
assign (resid  92 and name  HB# ) (resid  95 and name   HN )  4.0  2.2  1.5 ! A.2106 at 2.16e+06
assign (resid  92 and name  HG# ) (resid  95 and name   HN )  4.0  2.2  1.0 ! A.2107 at 3.62e+06

! Q93
assign (resid  93 and name   HA ) (resid  93 and name   HN )  2.5  0.7  0.4 !
assign (resid  93 and name HE21 ) (resid  93 and name   HN )  4.0  2.2  1.0 ! A.527  at 1.11e+06
assign (resid  93 and name  HB# ) (resid  93 and name   HN )  2.5  0.7  0.9 ! A.531  at 1.67e+07
assign (resid  93 and name  HG# ) (resid  93 and name   HN )  2.5  0.7  0.9 ! A.530  at 6.69e+06
assign (resid  93 and name  HG# ) (resid  93 and name HE21 )  2.5  0.7  0.9 ! A.796  at 6.49e+06
assign (resid  93 and name  HG# ) (resid  93 and name HE22 )  3.5  1.2  1.0 ! A.797  at 4.83e+06
assign (resid  93 and name  HG# ) (resid  94 and name   HN )  4.0  2.2  1.5 ! A.2090 at 1.52e+06
assign (resid  93 and name   HN ) (resid  94 and name HD2# )  4.5  2.2  2.5 ! A.532  at 6.53e+05
assign (resid  93 and name   HN ) (resid  94 and name  HB# )  4.0  2.2  1.5 ! A.2116 at 1.45e+06
assign (resid  93 and name HE21 ) (resid  94 and name   HN )  4.5  2.2  2.0 ! A.795  at 7.03e+05
assign (resid  93 and name  HB# ) (resid  94 and name   HN )  2.5  0.7  0.9 ! A.426  at 7.89e+06
assign (resid  93 and name   HN ) (resid  94 and name   HN )  2.5  0.7  0.4 ! A.526  at 6.27e+06
assign (resid  93 and name   HA ) (resid  96 and name   HN )  3.5  1.2  0.5 ! A.805  at 4.60e+06
assign (resid  93 and name  HB# ) (resid  96 and name   HN )  4.5  2.2  2.5 ! A.806  at 9.30e+05

! L94
assign (resid  94 and name   HA ) (resid  94 and name   HN )  2.5  0.7  0.4 !
assign (resid  94 and name   HG ) (resid  94 and name   HN )  2.5  0.7  0.4 ! A.2091 at 7.49e+06
assign (resid  94 and name  HB2 ) (resid  94 and name   HN )  3.0  0.7  0.5 ! A.2092 at 4.73e+06
assign (resid  94 and name HD1# ) (resid  94 and name   HN )  3.5  1.2  1.0 ! A.2093 at 3.52e+06
assign (resid  94 and name  HB1 ) (resid  94 and name   HN )  3.5  1.2  0.5 ! A.456  at 5.45e+06
assign (resid  94 and name HD1# ) (resid  95 and name   HN )  4.5  2.2  2.5 ! A.2108 at 7.49e+05
assign (resid  94 and name   HN ) (resid  95 and name   HN )  2.5  0.7  0.4 ! A.489  at 6.82e+06
assign (resid  94 and name  HB2 ) (resid  96 and name   HN )  4.5  2.2  1.5 ! A.2170 at 1.27e+06
assign (resid  94 and name   HG ) (resid  97 and name   HN )  4.5  2.2  2.0 ! A.2162 at 7.41e+05
assign (resid  94 and name HD2# ) (resid  97 and name   HN )  4.5  2.2  2.5 ! A.732  at 5.74e+05
assign (resid  94 and name HD1# ) (resid  97 and name   HN )  4.5  2.2  2.5 ! A.2164 at 3.56e+05
assign (resid  94 and name  HB1 ) (resid  97 and name   HN )  4.0  2.2  1.0 ! A.729  at 2.45e+06
!assign (resid  94 and name  HB2 ) (resid  98 and name   HN )  4.5  2.2  2.0 ! A.2171 at 9.85e+05
!assign (resid  94 and name  HB1 ) (resid  98 and name   HN )  4.0  2.2  1.0 ! A.861  at 1.09e+06
!assign (resid  94 and name HD2# ) (resid  98 and name   HN )  4.5  2.2  2.5 ! A.863  at 9.50e+05

! K95
assign (resid  95 and name   HA ) (resid  95 and name   HN )  2.5  0.7  0.4 !
assign (resid  95 and name  HD1 ) (resid  95 and name   HN )  4.0  2.2  1.0 ! A.497  at 2.64e+06
assign (resid  95 and name  HB2 ) (resid  95 and name   HN )  2.5  0.7  0.4 ! A.495  at 1.55e+07
assign (resid  95 and name  HG1 ) (resid  96 and name   HN )  4.0  2.2  1.0 ! A.2169 at 1.05e+06
assign (resid  95 and name  HB1 ) (resid  96 and name   HN )  3.5  1.2  0.5 ! A.807  at 3.11e+06
assign (resid  95 and name  HB2 ) (resid  96 and name   HN )  3.5  1.2  0.5 ! A.807  at 5.11e+06
assign (resid  95 and name   HN ) (resid  96 and name   HN )  3.5  1.2  0.5 ! A.802  at 4.84e+06
assign (resid  95 and name   HA ) (resid  96 and name   HN )  3.5  1.2  0.5 ! A.805  at 3.60e+06
assign (resid  95 and name  HD# ) (resid  97 and name   HN )  4.0  2.2  1.5 ! A.2163 at 1.06e+06
assign (resid  95 and name   HN ) (resid  97 and name   HN )  4.0  2.2  1.0 ! A.725  at 1.18e+06

! T96
assign (resid  96 and name   HA ) (resid  96 and name   HN )  2.5  0.7  0.4 !
assign (resid  96 and name HG2# ) (resid  96 and name   HN )  2.5  0.7  0.9 ! A.809  at 9.30e+06
assign (resid  96 and name   HB ) (resid  96 and name   HN )  2.5  0.7  0.4 ! A.804  at 1.44e+07
assign (resid  96 and name   HN ) (resid  97 and name   HN )  2.5  0.7  0.4 ! A.724  at 1.09e+07

! T97
assign (resid  97 and name   HA ) (resid  97 and name   HN )  2.5  0.7  0.4 !
assign (resid  97 and name HG2# ) (resid  97 and name   HN )  2.5  0.7  0.9 ! A.731  at 1.53e+07
assign (resid  97 and name   HB ) (resid  97 and name   HN )  2.5  0.7  0.4 ! A.726  at 1.24e+07
assign (resid  97 and name   HN ) (resid  98 and name  HA# )  4.0  2.2  1.5 ! A.727  at 2.86e+06
assign (resid  97 and name   HN ) (resid  98 and name  HA1 )  4.0  2.2  1.0 ! A.728  at 2.86e+06
assign (resid  97 and name   HN ) (resid  98 and name  HA2 )  4.0  2.2  1.0 ! A.728  at 2.86e+06
assign (resid  97 and name   HN ) (resid  98 and name   HN )  2.5  0.7  0.4 ! A.857  at 1.10e+07
assign (resid  97 and name   HA ) (resid  98 and name   HN )  3.5  1.2  0.5 ! A.859  at 4.91e+06
assign (resid  97 and name   HB ) (resid  98 and name   HN )  2.5  0.7  0.4 ! A.859  at 8.91e+06
assign (resid  97 and name HG2# ) (resid  98 and name   HN )  2.5  0.7  0.9 ! A.862  at 5.76e+06

! G98
assign (resid  98 and name  HA# ) (resid  98 and name   HN )  2.5  0.7  0.4 !
assign (resid  98 and name   HN ) (resid  99 and name   HN )  3.5  0.7  0.6 ! A.857  at 5.07e+06

! R99
assign (resid  99 and name   HA ) (resid  99 and name   HN )  2.5  0.7  0.4 !
assign (resid  99 and name HH2# ) (resid  99 and name   HE )  4.0  2.2  1.5 ! A.2179 at 2.33e+06
assign (resid  99 and name HH1# ) (resid  99 and name   HE )  4.0  2.2  1.5 ! A.2180 at 2.84e+06
assign (resid  99 and name  HG# ) (resid  99 and name   HE )  4.0  2.2  1.5 ! A.2182 at 1.94e+06
assign (resid  99 and name  HG# ) (resid  99 and name   HN )  4.0  2.2  1.5 ! A.456  at 2.45e+06
assign (resid  99 and name  HB# ) (resid  99 and name   HN )  2.5  0.7  0.9 ! A.456  at 1.25e+07
assign (resid  99 and name   HN ) (resid 100 and name   HN )  3.5  1.2  0.9 ! A.419  at 4.99e+06
assign (resid  99 and name  HG# ) (resid 100 and name   HN )  3.5  1.2  1.0 ! A.79   at 4.80e+06
assign (resid  99 and name  HB# ) (resid 100 and name   HN )  2.5  0.7  0.9 ! A.79   at 6.80e+06

! A100
assign (resid 100 and name   HA ) (resid 100 and name   HN )  2.5  0.7  0.4 !
assign (resid 100 and name  HB# ) (resid 100 and name   HN )  2.5  0.7  0.9 ! A.80   at 2.46e+07
assign (resid 100 and name  HB# ) (resid 101 and name   HN )  2.5  0.7  0.9 ! A.905  at 1.12e+07
assign (resid 100 and name   HN ) (resid 101 and name  HA1 )  4.0  2.2  1.0 ! A.78   at 1.45e+06
assign (resid 100 and name   HN ) (resid 101 and name  HA2 )  4.0  2.2  1.0 ! A.78   at 1.45e+06
assign (resid 100 and name   HN ) (resid 101 and name   HN )  2.5  0.7  0.4 ! A.898  at 1.44e+08
assign (resid 100 and name   HA ) (resid 101 and name   HN )  3.5  1.2  0.5 ! A.900  at 6.42e+06

! G101
assign (resid 101 and name   HA ) (resid 101 and name   HN )  2.5  0.7  0.4 !
assign (resid 101 and name  HA2 ) (resid 102 and name   HN )  3.5  1.2  0.5 ! A.543  at 4.82e+06
assign (resid 101 and name   HN ) (resid 102 and name   HN )  2.5  0.7  0.4 ! A.898  at 1.44e+06
!assign (resid 101 and name   HN ) (resid 103 and name  HB1 )  4.0  2.2  1.0 ! A.903  at 1.09e+06

! N102
assign (resid 102 and name   HA ) (resid 102 and name   HN )  2.5  0.7  0.4 !
assign (resid 102 and name  HB2 ) (resid 102 and name   HN )  2.5  0.7  0.4 ! A.544  at 1.21e+07
assign (resid 102 and name  HB1 ) (resid 102 and name   HN )  3.5  1.2  0.5 ! A.544  at 5.21e+06
assign (resid 102 and name  HB2 ) (resid 102 and name HD21 )  3.5  1.2  0.5 ! A.771  at 3.49e+06
assign (resid 102 and name  HB1 ) (resid 102 and name HD21 )  2.5  0.7  0.4 ! A.771  at 5.49e+06
assign (resid 102 and name  HB1 ) (resid 102 and name HD22 )  3.5  1.2  0.5 ! A.772  at 4.46e+06
assign (resid 102 and name   HA ) (resid 102 and name HD21 )  4.0  2.2  1.0 ! A.789  at 1.44e+06
assign (resid 102 and name   HA ) (resid 103 and name   HN )  3.0  0.7  0.6 ! A.266  at 1.10e+07
assign (resid 102 and name   HN ) (resid 103 and name   HN )  3.5  0.7  0.4 ! A.302  at 1.07e+07

! Q103
assign (resid 103 and name   HA ) (resid 103 and name   HN )  2.5  0.7  0.4 !
assign (resid 103 and name   HN ) (resid 103 and name HE21 )  4.5  2.2  2.0 ! A.781  at 8.11e+05
assign (resid 103 and name  HG1 ) (resid 103 and name   HN )  4.0  2.2  1.0 ! A.269  at 2.41e+06
assign (resid 103 and name  HG2 ) (resid 103 and name   HN )  3.5  1.2  0.9 ! A.269  at 3.41e+06
assign (resid 103 and name  HB1 ) (resid 103 and name   HN )  3.0  0.7  0.6 ! A.306  at 1.28e+07
assign (resid 103 and name  HB2 ) (resid 103 and name   HN )  2.5  0.7  0.4 ! A.306  at 1.18e+07
assign (resid 103 and name  HG2 ) (resid 103 and name HE21 )  2.5  0.7  0.4 ! A.783  at 5.08e+06
assign (resid 103 and name  HB1 ) (resid 103 and name HE21 )  4.0  2.2  1.0 ! A.784  at 1.11e+06
assign (resid 103 and name  HB1 ) (resid 104 and name   HN )  2.5  0.7  0.4 ! A.146  at 1.15e+07
assign (resid 103 and name HE21 ) (resid 104 and name  HB2 )  4.0  2.2  1.0 ! A.785  at 1.74e+06

! K104
assign (resid 104 and name   HA ) (resid 104 and name   HN )  2.5  0.7  0.4 !
assign (resid 104 and name  HG# ) (resid 104 and name   HN )  4.0  2.2  1.5 ! A.147  at 1.81e+06
assign (resid 104 and name  HB1 ) (resid 104 and name   HN )  2.5  0.7  0.4 ! A.171  at 1.50e+07
assign (resid 104 and name  HB2 ) (resid 104 and name   HN )  3.5  0.7  0.4 ! A.171  at 1.00e+07
assign (resid 104 and name   HA ) (resid 105 and name   HN )  3.5  0.7  0.5 ! A.847  at 5.55e+06

! G105
assign (resid 105 and name  HA# ) (resid 105 and name   HN )  2.5  0.7  .0.4 !
assign (resid 105 and name   HN ) (resid 106 and name   HN )  4.0  2.2  1.0 ! A.846  at 2.59e+06

! G106
assign (resid 106 and name  HA1 ) (resid 106 and name   HN )  4.5  2.2  2.0 !
assign (resid 106 and name  HA2 ) (resid 106 and name   HN )  2.5  0.7  0.4 !

!@ END_XPLR_NOE_FILE
! pck2xplr.nawk Table; Input File: c3g_cnoeC.PCK
!   Date: Tue Aug 31 14:43:06 EDT 2004
!   Path: /home/fengh/My_xplor/Gd7_c3g
!
!@ BEGIN_XPLR_PCK_SUM
! LBL   File-Name                   All   Intra  Seq.  Short   Long
! A   c3g_cnoeC.PCK                 297   110     89     73     25
!    Total                          297   110     89     73     25

!@ END_XPLR_PCK_SUM
!@ BEGIN_XPLR_NOE_FILE
!
! A1

! D2
assign (resid   2 and name   HA ) (resid   3 and name   HN )  3.5  1.2  0.5 ! A.588  at 1.03e+07
assign (resid   2 and name   HA ) (resid   3 and name  HB2 )  4.5  2.2  2.0 ! A.12   at 3.22e+06

! L3
assign (resid   3 and name   HA ) (resid   3 and name   HG )  4.0  2.2  1.0 ! A.292  at 9.05e+06

! E4

! D5

! N6

! D7
assign (resid   7 and name    ? ) (resid  88 and name   HA )  4.5  2.2  2.0 ! A.0    at 5.67e+01

! E8
assign (resid   8 and name  HB2 ) (resid   9 and name   HA )  4.0  2.2  1.0 ! A.694  at 5.78e+06

! T9

! G10

! N11

! D12

! N13
assign (resid  13 and name   HA ) (resid  15 and name  HG# )  4.0  2.2  1.5 ! A.10   at 5.97e+06

! G14

! K15
assign (resid  15 and name  HG# ) (resid  15 and name  HE# )  3.5  1.2  1.5 ! A.704  at 1.92e+07
assign (resid  15 and name  HG# ) (resid  15 and name   HA )  3.5  1.2  1.0 ! A.705  at 1.27e+07
assign (resid  15 and name  HD# ) (resid  15 and name   HA )  4.5  2.2  2.5 ! A.48   at 5.30e+06

! G16

! G17
assign (resid  17 and name  HA# ) (resid  18 and name   HA )  3.5  1.2  0.9 ! A.8    at 2.27e+07

! E18

! K19
assign (resid  19 and name  HD# ) (resid  19 and name   HA )  4.0  2.2  1.5 ! A.48   at 6.30e+06
assign (resid  19 and name  HG1 ) (resid  20 and name   HA )  3.5  1.2  0.5 ! A.54   at 1.39e+07
assign (resid  19 and name  HG1 ) (resid  21 and name   HA )  4.0  2.2  1.0 ! A.333  at 8.88e+06
assign (resid  19 and name  HG1 ) (resid  21 and name  HB2 )  2.5  0.7  0.4 ! A.332  at 2.11e+07

! A20
assign (resid  20 and name   HA ) (resid  25 and name  HB# )  4.5  2.2  2.5 ! A.241  at 5.21e+06
assign (resid  20 and name   HA ) (resid  25 and name  HG2 )  2.5  0.7  0.4 ! A.53   at 2.18e+07

! D21
assign (resid  21 and name   HA ) (resid  25 and name  HG2 )  4.5  2.2  2.0 ! A.211  at 5.47e+06
assign (resid  21 and name   HA ) (resid  25 and name  HB# )  4.5  2.2  1.5 ! A.17   at 9.14e+06
assign (resid  21 and name  HB1 ) (resid  25 and name  HB# )  4.0  2.2  1.5 ! A.177  at 8.01e+06

! N22
assign (resid  22 and name   HA ) (resid  25 and name  HB# )  4.5  2.2  2.5 ! A.240  at 5.37e+06
assign (resid  22 and name   HA ) (resid  84 and name HG2# )  4.5  2.2  2.5 ! A.21   at 2.59e+06

! A23
assign (resid  23 and name   HA ) (resid  26 and name   HA )  4.0  2.2  1.0 ! A.100  at 6.54e+06
assign (resid  23 and name   HA ) (resid  26 and name   HB )  3.5  1.2  0.5 ! A.239  at 1.16e+07
assign (resid  23 and name   HA ) (resid  26 and name HG2# )  2.5  0.7  0.9 ! A.378  at 2.69e+07

! A24

! Q25
assign (resid  25 and name   HA ) (resid  25 and name  HG2 )  3.5  1.2  1.0 ! A.210  at 2.46e+07
assign (resid  25 and name   HA ) (resid  28 and name  HB# )  3.5  1.2  1.0 ! A.78   at 1.72e+07
assign (resid  25 and name   HA ) (resid  29 and name  HB# )  3.5  0.7  0.9 ! A.307  at 2.28e+07
assign (resid  25 and name  HG2 ) (resid  29 and name  HB# )  4.0  2.2  1.5 ! A.309  at 6.74e+06
assign (resid  25 and name  HG2 ) (resid  84 and name HG1# )  4.0  2.2  1.5 ! A2401  at 1.30e+06*

! V26
assign (resid  26 and name   HA ) (resid  26 and name HG1# )  4.0  2.2  1.5 ! A.507  at 6.04e+06
assign (resid  26 and name HG2# ) (resid  26 and name   HA )  2.5  0.7  0.9 ! A.108  at 3.26e+07
assign (resid  26 and name HG1# ) (resid  27 and name   HA )  4.5  2.2  2.5 ! A.531  at 4.94e+06
assign (resid  26 and name   HA ) (resid  29 and name  HB# )  4.5  2.2  2.5 ! A.506  at 2.95e+06
assign (resid  26 and name HG2# ) (resid  30 and name   HG )  4.5  2.2  2.5 ! A.285  at 4.95e+06
assign (resid  26 and name HG1# ) (resid  79 and name  HB# )  3.5  1.2  0.5 ! A.286  at 1.07e+07
assign (resid  26 and name HG1# ) (resid  87 and name  HB# )  4.0  2.2  1.5 ! A.287  at 6.98e+06
assign (resid  26 and name HG2# ) (resid  84 and name   HA )  4.5  2.2  2.5 ! A.377  at 3.30e+06
assign (resid  26 and name   HB ) (resid  84 and name   HA )  4.0  2.2  1.5 ! A.2402 at 5.86e+06*

! K27
assign (resid  27 and name   HA ) (resid  27 and name  HG# )  4.5  2.2  2.5 ! A.530  at 3.38e+06
assign (resid  27 and name   HA ) (resid  28 and name   HA )  4.0  2.2  1.0 ! A.560  at 1.28e+07
assign (resid  27 and name   HA ) (resid  30 and name   HG )  4.5  2.2  2.0 ! A.127  at 4.32e+06
assign (resid  27 and name   HA ) (resid  76 and name  HB2 )  4.5  2.2  2.0 ! A.315  at 3.55e+06
assign (resid  27 and name   HA ) (resid  76 and name HD1# )  4.0  2.2  1.0 ! A.2403 at 3.86e+06*

! D28
assign (resid  28 and name   HA ) (resid  31 and name   HB )  3.5  1.2  0.5 ! A.560  at 1.08e+07

! A29
assign (resid  29 and name   HN ) (resid  30 and name   HA )  4.0  2.2  1.0 ! A.553  at 8.58e+06
assign (resid  29 and name   HA ) (resid  30 and name   HG )  4.0  2.2  1.0 ! A.585  at 6.98e+06

! L30
assign (resid  30 and name   HA ) (resid  30 and name  HB2 )  2.5  0.7  0.4 ! A.710  at 2.64e+07
assign (resid  30 and name  HB# ) (resid  30 and name   HG )  2.5  0.7  0.4 ! A.711  at 2.77e+07
assign (resid  30 and name  HB# ) (resid  30 and name   HA )  2.5  0.7  0.4 ! A.712  at 2.25e+07
assign (resid  30 and name   HG ) (resid  30 and name   HA )  4.0  2.2  1.0 ! A.80   at 6.62e+06
assign (resid  30 and name   HA ) (resid  30 and name HD1# )  3.5  1.2  1.0 ! A.353  at 1.12e+07
assign (resid  30 and name   HA ) (resid  72 and name HG2# )  4.5  2.2  2.5 ! A.81   at 3.97e+06
assign (resid  30 and name HD1# ) (resid  75 and name  HB# )  4.0  2.2  2.0 ! A.302  at 6.56e+06
assign (resid  30 and name   HN ) (resid  76 and name   HA )  4.5  2.2  1.5 ! A.545  at 7.96e+06
assign (resid  30 and name HD1# ) (resid  76 and name  HB2 )  2.5  0.7  0.9 ! A.302  at 2.56e+07

! T31

! K32
assign (resid  32 and name   HA ) (resid  32 and name  HD# )  3.5  1.2  1.0 ! A.526  at 1.01e+07
assign (resid  32 and name   HA ) (resid  32 and name  HG# )  4.0  2.2  1.5 ! A.527  at 9.05e+06
assign (resid  32 and name  HE1 ) (resid  32 and name  HG1 )  3.5  1.2  0.5 ! A.326  at 1.55e+07
assign (resid  32 and name  HD1 ) (resid  32 and name   HA )  3.5  1.2  0.5 ! A.86   at 1.32e+07

! M33
assign (resid  33 and name  HB1 ) (resid  68 and name HD1# )  3.5  1.2  1.0 ! A.674  at 1.72e+07

! R34
assign (resid  34 and name  HD1 ) (resid  34 and name  HB# )  3.5  1.2  1.0 ! A.258  at 1.67e+07
assign (resid  34 and name  HD1 ) (resid  34 and name HH1# )  3.5  1.2  1.0 ! A.633  at 1.48e+07
assign (resid  34 and name  HD1 ) (resid  34 and name   HA )  4.5  2.2  2.0 ! A.635  at 3.65e+06
assign (resid  34 and name  HD2 ) (resid  34 and name  HB# )  4.5  2.2  2.5 ! A.637  at 5.27e+06
assign (resid  34 and name  HD2 ) (resid  34 and name HH1# )  4.0  2.2  1.5 ! A.640  at 7.59e+06
assign (resid  34 and name  HD1 ) (resid  38 and name HD1# )  4.0  2.2  1.5 ! A.156  at 8.68e+06
assign (resid  34 and name   HA ) (resid  68 and name  HB1 )  3.5  1.2  1.0 ! A.278  at 2.23e+07
assign (resid  34 and name  HD2 ) (resid  72 and name HD1# )  4.0  2.2  1.5 ! A.642  at 7.86e+06
assign (resid  34 and name  HD1 ) (resid  72 and name HG2# )  4.0  2.2  1.5 ! A.354  at 8.70e+06

! A35
assign (resid  35 and name   HA ) (resid  38 and name  HB1 )  4.5  2.2  2.0 ! A.87   at 4.32e+06

! A36
assign (resid  36 and name   HA ) (resid  39 and name  HB1 )  3.5  1.2  0.5 ! A.186  at 1.30e+07

! A37
assign (resid  37 and name   HA ) (resid  40 and name  HB# )  3.5  1.2  1.0 ! A.722  at 1.06e+07
assign (resid  37 and name  HB# ) (resid  68 and name  HB1 )  4.5  2.2  2.5 ! A.281  at 4.11e+06
assign (resid  37 and name  HB# ) (resid  68 and name HD2# )  4.5  2.2  3.0 ! A.382  at 4.78e+06

! L38
assign (resid  38 and name   HA ) (resid  38 and name   HG )  4.0  2.2  1.0 ! A.566  at 7.65e+06
assign (resid  38 and name   HA ) (resid  38 and name HD1# )  3.5  1.2  1.0 ! A.567  at 1.37e+07
assign (resid  38 and name  HB1 ) (resid  38 and name HD2# )  3.5  1.2  1.0 ! A.381  at 1.48e+07
assign (resid  38 and name HD2# ) (resid  38 and name  HB2 )  2.5  0.7  0.9 ! A.336  at 4.57e+07
assign (resid  38 and name   HA ) (resid  39 and name   HN )  4.0  2.2  1.0 ! A.568  at 7.38e+06
assign (resid  38 and name   HA ) (resid  41 and name  HG2 )  4.0  2.2  1.0 ! A.562  at 7.94e+06
assign (resid  38 and name   HA ) (resid  41 and name  HB2 )  3.5  1.2  0.5 ! A.563  at 1.48e+07

! D39
assign (resid  39 and name  HB1 ) (resid  40 and name   HA )  3.5  1.2  0.5 ! A.104  at 1.74e+07
assign (resid  39 and name  HB1 ) (resid  43 and name  HB# )  4.5  2.2  2.5 ! A.187  at 4.46e+06

! A40
assign (resid  40 and name  HB# ) (resid  41 and name   HN )  4.0  2.2  1.5 ! A.720  at 8.26e+06
assign (resid  40 and name  HB# ) (resid  42 and name   HN )  4.5  2.2  2.5 ! A.721  at 5.47e+06

! Q41
assign (resid  41 and name  HB# ) (resid  42 and name   HN )  4.0  2.2  1.5 ! A.666  at 5.52e+06
assign (resid  41 and name  HG# ) (resid  42 and name   HN )  4.0  2.2  1.5 ! A.667  at 8.74e+06
assign (resid  41 and name  HG1 ) (resid  42 and name  HD1 )  4.5  2.2  2.0 ! A.297  at 4.07e+06
assign (resid  41 and name  HG2 ) (resid  42 and name  HD1 )  4.5  2.2  2.0 ! A.297  at 4.07e+06
assign (resid  41 and name   HA ) (resid  48 and name HD1# )  2.5  0.7  0.9 ! A.106  at 2.11e+07

! K42
assign (resid  42 and name   HA ) (resid  42 and name  HE1 )  4.5  2.2  2.0 ! A.167  at 3.49e+06
assign (resid  42 and name  HG# ) (resid  42 and name  HE# )  3.5  1.2  1.5 ! A.707  at 1.43e+07
assign (resid  42 and name  HG# ) (resid  42 and name   HA )  4.0  2.2  1.5 ! A.708  at 7.50e+06
assign (resid  42 and name   HA ) (resid  43 and name   HN )  4.0  2.2  1.0 ! A.572  at 6.30e+06
assign (resid  42 and name  HB1 ) (resid  43 and name   HN )  4.5  2.2  2.0 ! A.673  at 5.23e+06

! A43
!assign (resid  43 and name   HA ) (resid  44 and name   HN )  2.5  0.7  0.4 ! A.600  at 3.70e+07
assign (resid  43 and name   HA ) (resid  44 and name   HA )  4.0  2.2  1.0 ! A.85   at 5.87e+06

! T44
assign (resid  44 and name   HA ) (resid  44 and name HG2# )  4.5  2.2  2.5 ! A.528  at 5.33e+06
assign (resid  44 and name   HA ) (resid  45 and name  HB2 )  4.0  2.2  1.0 ! A.271  at 6.66e+06
assign (resid  44 and name   HA ) (resid  45 and name  HD1 )  3.5  1.2  0.5 ! A.601  at 1.50e+07
assign (resid  44 and name HG2# ) (resid  46 and name  HG1 )  3.5  1.2  1.0 ! A.204  at 1.72e+07

! P45
assign (resid  45 and name   HA ) (resid  45 and name  HG# )  4.5  2.2  2.5 ! A.509  at 4.27e+06

! P46
assign (resid  46 and name  HG2 ) (resid  46 and name   HA )  4.0  2.2  1.0 ! A.62   at 7.62e+06
assign (resid  46 and name  HB1 ) (resid  46 and name  HD1 )  4.0  2.2  1.0 ! A.126  at 9.93e+06
assign (resid  46 and name   HA ) (resid  47 and name   HN )  4.5  2.2  2.0 ! A.508  at 5.15e+06
assign (resid  46 and name   HA ) (resid  47 and name   HA )  4.5  2.2  2.0 ! A.128  at 2.67e+06
assign (resid  46 and name  HG1 ) (resid  48 and name HD1# )  4.5  2.2  2.5 ! A.216  at 5.29e+06

! K47
assign (resid  47 and name  HG1 ) (resid  47 and name   HA )  4.0  2.2  1.0 ! A.69   at 7.39e+06

! L48
assign (resid  48 and name   HA ) (resid  48 and name   HG )  4.5  2.2  2.0 ! A.556  at 5.24e+06
assign (resid  48 and name   HA ) (resid  49 and name  HB1 )  4.0  2.2  1.0 ! A.554  at 5.86e+06

! E49
assign (resid  49 and name  HB# ) (resid  50 and name  HB2 )  4.0  2.2  1.5 ! A.173  at 6.51e+06

! D50
assign (resid  50 and name   HA ) (resid  51 and name  HG1 )  4.0  2.2  1.0 ! A.333  at 5.88e+06

! K51
assign (resid  51 and name   HA ) (resid  51 and name  HD# )  3.5  1.2  1.0 ! A.591  at 1.18e+07
assign (resid  51 and name   HA ) (resid  51 and name  HG# )  3.5  1.2  1.0 ! A.592  at 1.14e+07
assign (resid  51 and name  HG2 ) (resid  51 and name   HA )  4.0  2.2  1.0 ! A.27   at 8.79e+06
assign (resid  51 and name   HA ) (resid  52 and name  HB2 )  4.5  2.2  2.0 ! A.115  at 3.56e+06
assign (resid  51 and name   HA ) (resid  52 and name   HN )  3.5  1.2  0.5 ! A.593  at 1.37e+07

! S52
assign (resid  52 and name   HN ) (resid  53 and name  HD1 )  4.5  2.2  2.0 ! A.604  at 3.71e+06
assign (resid  52 and name   HA ) (resid  53 and name  HG1 )  3.5  1.2  0.5 ! A.680  at 1.02e+07

! P53
assign (resid  53 and name   HA ) (resid  53 and name  HD1 )  4.5  2.2  2.0 ! A.125  at 2.63e+06

! D54

! S55
assign (resid  55 and name   HA ) (resid  56 and name  HD1 )  3.5  0.7  0.4 ! A.94   at 2.04e+07
assign (resid  55 and name   HN ) (resid  56 and name  HD1 )  4.5  2.2  2.0 ! A.602  at 3.73e+06
assign (resid  55 and name  HB1 ) (resid  56 and name  HD1 )  4.0  2.2  1.0 ! A.120  at 6.47e+06

! P56
assign (resid  56 and name  HG1 ) (resid  56 and name   HA )  3.5  1.2  0.5 ! A.677  at 1.22e+07
assign (resid  56 and name   HA ) (resid  56 and name  HG2 )  4.5  2.2  2.0 ! A.250  at 4.03e+06
assign (resid  56 and name  HD1 ) (resid  57 and name   HN )  4.0  2.2  1.0 ! A.603  at 6.31e+06
assign (resid  56 and name  HB2 ) (resid  57 and name   HN )  4.5  2.2  2.0 ! A.689  at 5.08e+06
assign (resid  56 and name  HB1 ) (resid  59 and name  HG1 )  3.5  1.2  0.5 ! A.203  at 1.13e+07
assign (resid  56 and name  HB1 ) (resid  60 and name  HB1 )  4.0  2.2  1.0 ! A.172  at 8.36e+06
assign (resid  56 and name  HB2 ) (resid 105 and name  HA1 )  3.5  1.2  0.5 ! A.272  at 1.15e+07

! E57
assign (resid  57 and name   HA ) (resid  57 and name  HG# )  3.5  1.2  1.0 ! A.521  at 1.53e+07
assign (resid  57 and name  HG1 ) (resid  57 and name   HA )  3.5  1.2  0.5 ! A.669  at 1.11e+07

! M58
assign (resid  58 and name   HA ) (resid  61 and name  HB# )  4.5  2.2  2.5 ! A.653  at 2.92e+06
assign (resid  58 and name   HA ) (resid  61 and name  HB1 )  4.5  2.2  2.0 ! A.2    at 3.42e+06
assign (resid  58 and name  HG2 ) (resid  62 and name  HD2 )  4.5  2.2  2.0 ! A.184  at 5.21e+06

! K59
assign (resid  59 and name   HA ) (resid  59 and name  HE# )  3.5  1.2  1.0 ! A.170  at 1.01e+07
assign (resid  59 and name   HA ) (resid  59 and name  HD1 )  4.0  2.2  1.0 ! A.303  at 7.38e+06
assign (resid  59 and name   HA ) (resid  59 and name  HD2 )  4.0  2.2  1.0 ! A.303  at 6.38e+06
assign (resid  59 and name  HE1 ) (resid  59 and name  HB1 )  2.5  0.7  0.4 ! A.274  at 6.08e+06
assign (resid  59 and name  HE1 ) (resid  59 and name  HB2 )  3.5  0.7  0.4 ! A.274  at 6.08e+06

! D60
assign (resid  60 and name   HA ) (resid  61 and name   HN )  4.5  2.2  2.0 ! A.558  at 3.97e+06
assign (resid  60 and name   HA ) (resid  63 and name   HN )  4.5  2.2  2.0 ! A.557  at 5.16e+06
assign (resid  60 and name   HA ) (resid  63 and name  HB1 )  3.5  1.2  0.5 ! A.559  at 1.08e+07
assign (resid  60 and name  HB1 ) (resid  64 and name  HA1 )  4.0  2.2  1.0 ! A.610  at 6.45e+06
assign (resid  60 and name  HB2 ) (resid  64 and name  HA1 )  4.5  2.2  2.0 ! A.611  at 5.25e+06

! F61
assign (resid  61 and name  HB# ) (resid  61 and name  HD# )  4.5  2.2  3.0 ! A.651  at 4.09e+06
assign (resid  61 and name  HB# ) (resid  61 and name  HE# )  4.0  2.2  2.0 ! A.652  at 7.35e+06
assign (resid  61 and name  HD# ) (resid  62 and name   HA )  4.5  2.2  2.5 ! A.515  at 4.25e+06
assign (resid  61 and name  HE# ) (resid  62 and name   HA )  4.5  2.2  2.5 ! A.516  at 3.41e+06
assign (resid  61 and name   HN ) (resid  62 and name   HA )  4.0  2.2  1.0 ! A.517  at 8.56e+06
assign (resid  61 and name  HB# ) (resid  62 and name   HN )  4.5  2.2  2.5 ! A.655  at 5.41e+06
assign (resid  61 and name  HB1 ) (resid  62 and name  HG1 )  4.5  2.2  2.0 ! A.151  at 4.32e+06
!assign (resid  61 and name  HB# ) (resid  67 and name HD1# )  4.5  2.2  3.0 ! A.384  at 4.79e+06

! R62
assign (resid  62 and name  HD1 ) (resid  62 and name HH2# )  4.0  2.2  1.5 ! A.615  at 8.25e+06
assign (resid  62 and name  HD1 ) (resid  62 and name HH1# )  4.0  2.2  1.5 ! A.616  at 9.22e+06
assign (resid  62 and name  HD2 ) (resid  62 and name HH1# )  3.5  1.2  1.0 ! A.619  at 1.06e+07
assign (resid  62 and name  HD2 ) (resid  62 and name HH2# )  3.5  1.2  1.0 ! A.620  at 1.03e+07
assign (resid  62 and name  HD2 ) (resid  62 and name  HB# )  3.5  1.2  1.0 ! A.622  at 1.58e+07
assign (resid  62 and name  HD1 ) (resid  62 and name  HB# )  3.5  1.2  1.0 ! A.625  at 1.27e+07
assign (resid  62 and name   HA ) (resid  62 and name  HD# )  4.5  2.2  2.5 ! A.143  at 4.48e+06
assign (resid  62 and name  HD2 ) (resid  62 and name   HA )  4.5  2.2  2.0 ! A.102  at 5.00e+06
assign (resid  62 and name  HD1 ) (resid  62 and name   HA )  4.5  2.2  2.0 ! A.102  at 5.00e+06
assign (resid  62 and name   HA ) (resid  63 and name   HN )  4.0  2.2  1.0 ! A.518  at 9.17e+06
assign (resid  62 and name   HA ) (resid  63 and name   HA )  4.5  2.2  2.0 ! A.14   at 4.61e+06
assign (resid  62 and name   HA ) (resid  65 and name  HD2 )  4.5  2.2  2.0 ! A.514  at 4.19e+06

! H63
assign (resid  63 and name   HA ) (resid  64 and name   HN )  4.5  2.2  2.0 ! A.539  at 3.55e+06
assign (resid  63 and name   HN ) (resid  64 and name  HA1 )  4.5  2.2  2.0 ! A.607  at 3.63e+06
assign (resid  63 and name  HB# ) (resid  64 and name   HN )  4.5  2.2  2.5 ! A.697  at 3.31e+06
assign (resid  63 and name   HA ) (resid  66 and name   HN )  4.5  2.2  2.0 ! A.540  at 4.48e+06

! G64
assign (resid  64 and name  HA1 ) (resid  65 and name   HN )  4.0  2.2  1.0 ! A.608  at 5.98e+06
assign (resid  64 and name  HA1 ) (resid  67 and name   HN )  4.5  2.2  2.0 ! A.609  at 3.92e+06
assign (resid  64 and name  HA1 ) (resid  67 and name HG11 )  4.5  2.2  2.0 ! A.351  at 2.58e+06
assign (resid  64 and name  HA1 ) (resid  67 and name   HB )  4.5  2.2  2.0 ! A.289  at 3.23e+06
assign (resid  64 and name  HA# ) (resid  67 and name   HB )  4.5  2.2  2.5 ! A.121  at 4.62e+06
assign (resid  64 and name  HA1 ) (resid  68 and name  HB2 )  4.5  2.2  2.0 ! A.304  at 2.72e+06
assign (resid  64 and name  HA1 ) (resid  68 and name HD1# )  4.5  2.2  2.5 ! A.371  at 3.79e+06
assign (resid  64 and name  HA# ) (resid  68 and name HD1# )  2.5  0.7  1.4 ! A.106  at 2.11e+07

! F65
assign (resid  65 and name  HB# ) (resid  66 and name   HA )  4.0  2.2  1.5 ! A.541  at 6.38e+06
assign (resid  65 and name  HB2 ) (resid  68 and name  HB2 )  4.5  2.2  2.0 ! A.306  at 3.15e+06
assign (resid  65 and name   HA ) (resid  68 and name  HB2 )  3.5  1.2  0.5 ! A.51   at 1.43e+07

! D66

! I67
assign (resid  67 and name   HA ) (resid  67 and name HG12 )  4.5  2.2  2.0 ! A.511  at 4.99e+06
assign (resid  67 and name   HA ) (resid  67 and name HG2# )  4.5  2.2  2.5 ! A.512  at 5.18e+06
assign (resid  67 and name   HB ) (resid  68 and name   HA )  4.0  2.2  1.0 ! A.549  at 6.76e+06
assign (resid  67 and name   HA ) (resid  68 and name   HA )  4.5  2.2  2.0 ! A.550  at 3.72e+06
assign (resid  67 and name   HB ) (resid  68 and name   HN )  4.0  2.2  1.0 ! A.660  at 7.41e+06
assign (resid  67 and name HG2# ) (resid  68 and name   HN )  4.5  2.2  2.5 ! A.726  at 4.18e+06

! L68
assign (resid  68 and name   HA ) (resid  68 and name HD2# )  4.0  2.2  1.5 ! A.552  at 6.85e+06
assign (resid  68 and name  HB2 ) (resid  68 and name HD1# )  2.5  0.7  0.9 ! A.372  at 2.64e+07
assign (resid  68 and name   HA ) (resid  68 and name HD1# )  4.0  2.2  1.5 ! A.367  at 6.70e+06
assign (resid  68 and name   HG ) (resid  72 and name HD1# )  4.0  2.2  1.5 ! A.700  at 8.16e+06

! V69

! G70
assign (resid  70 and name  HA# ) (resid  71 and name  HB1 )  4.5  2.2  2.5 ! A.191  at 5.43e+06
assign (resid  70 and name  HA# ) (resid  73 and name  HB1 )  4.0  2.2  1.5 ! A.605  at 6.42e+06

! Q71
assign (resid  71 and name   HA ) (resid  71 and name  HG1 )  4.0  2.2  1.0 ! A.190  at 9.97e+06
assign (resid  71 and name  HG2 ) (resid  71 and name   HA )  3.5  1.2  0.6 ! A.73   at 3.75e+07
assign (resid  71 and name   HA ) (resid  74 and name  HB1 )  4.0  2.2  1.0 ! A.538  at 6.35e+06
assign (resid  71 and name   HA ) (resid  74 and name  HB2 )  2.5  0.7  0.4 ! A.72   at 2.01e+07
assign (resid  71 and name  HG1 ) (resid  94 and name HD2# )  4.0  2.2  1.5 ! A.364  at 6.39e+06
assign (resid  71 and name  HB# ) (resid  94 and name HD1# )  2.5  0.7  1.4 ! A.237  at 3.47e+07

! I72
assign (resid  72 and name   HA ) (resid  72 and name HG2# )  4.5  2.2  2.5 ! A.352  at 3.21e+06
assign (resid  72 and name   HB ) (resid  72 and name HD1# )  4.0  2.2  1.5 ! A.657  at 7.65e+06
assign (resid  72 and name   HA ) (resid  73 and name   HA )  4.0  2.2  1.0 ! A.569  at 9.32e+06
assign (resid  72 and name   HN ) (resid  73 and name  HB1 )  4.0  2.2  1.0 ! A.654  at 8.35e+06
assign (resid  72 and name   HB ) (resid  73 and name   HN )  4.5  2.2  2.0 ! A.659  at 3.78e+06
assign (resid  72 and name HG2# ) (resid  76 and name  HB2 )  3.5  1.2  1.0 ! A.320  at 1.28e+07
assign (resid  72 and name   HA ) (resid  94 and name HD1# )  4.0  2.2  1.5 ! A.136  at 6.97e+06

! D73
assign (resid  73 and name   HA ) (resid  76 and name HD1# )  4.0  2.2  1.5 ! A.373  at 7.40e+06
assign (resid  73 and name   HA ) (resid  76 and name  HB1 )  4.5  2.2  2.0 ! A.646  at 3.88e+06
assign (resid  73 and name   HA ) (resid  77 and name   HN )  4.5  2.2  2.0 ! A.571  at 5.29e+06

! D74
assign (resid  74 and name  HB2 ) (resid  75 and name   HA )  3.5  1.2  0.5 ! A.584  at 1.05e+07
assign (resid  74 and name  HB2 ) (resid  77 and name  HG1 )  4.5  2.2  2.0 ! A.194  at 3.87e+06
assign (resid  74 and name  HB2 ) (resid  77 and name  HD2 )  4.5  2.2  1.5 ! A.193  at 9.23e+06

! A75
assign (resid  75 and name   HN ) (resid  76 and name   HA )  4.0  2.2  1.0 ! A.543  at 7.33e+06
assign (resid  75 and name   HA ) (resid  78 and name HD2# )  3.5  1.2  1.0 ! A.383  at 1.72e+07
assign (resid  75 and name   HA ) (resid  94 and name HD1# )  4.0  2.2  1.0 ! A.2405 at 7.20e+06*
assign (resid  75 and name  HB# ) (resid  94 and name HD1# )  3.5  1.2  1.0 ! A.2406 at 1.74e+07*

! L76
assign (resid  76 and name   HA ) (resid  76 and name   HG )  4.5  2.2  2.0 ! A.300  at 3.75e+06
assign (resid  76 and name  HB1 ) (resid  76 and name HD1# )  3.5  1.2  1.0 ! A.374  at 1.15e+07
assign (resid  76 and name  HB2 ) (resid  76 and name HD1# )  2.5  0.7  0.9 ! A.375  at 2.51e+07
assign (resid  76 and name   HA ) (resid  77 and name   HN )  4.0  2.2  1.0 ! A.544  at 6.94e+06
assign (resid  76 and name  HB1 ) (resid  77 and name   HA )  4.5  2.2  2.0 ! A.91   at 4.21e+06
assign (resid  76 and name  HB1 ) (resid  77 and name   HN )  4.0  2.2  1.0 ! A.647  at 6.58e+06
assign (resid  76 and name   HG ) (resid  77 and name   HA )  4.0  2.2  1.0 ! A.90   at 6.39e+06

! K77
assign (resid  77 and name  HE1 ) (resid  77 and name  HB1 )  3.5  1.2  0.9 ! A.274  at 2.08e+07
assign (resid  77 and name  HE1 ) (resid  78 and name HD2# )  2.5  0.7  0.9 ! A.385  at 3.17e+07
assign (resid  77 and name   HA ) (resid  80 and name   HN )  4.0  2.2  1.0 ! A.523  at 6.82e+06
assign (resid  77 and name   HA ) (resid  80 and name  HB1 )  3.5  1.2  0.5 ! A.92   at 1.76e+07
assign (resid  77 and name  HE1 ) (resid  81 and name  HG2 )  4.0  2.2  1.0 ! A.164  at 6.29e+06

! L78
assign (resid  78 and name   HA ) (resid  78 and name HD2# )  3.5  1.2  1.0 ! A.576  at 1.56e+07
assign (resid  78 and name  HB2 ) (resid  78 and name HD2# )  3.5  1.2  1.0 ! A.386  at 2.00e+07
assign (resid  78 and name HD1# ) (resid  79 and name   HA )  4.5  2.2  2.5 ! A.587  at 4.75e+06
assign (resid  78 and name  HB1 ) (resid  87 and name  HB# )  4.0  2.2  1.5 ! A.284  at 5.98e+06
assign (resid  78 and name HD1# ) (resid  87 and name  HB# )  2.5  0.7  1.4 ! A.298  at 3.29e+07
assign (resid  78 and name  HB2 ) (resid  90 and name  HB# )  3.5  1.2  0.9 ! A.2407 at 1.75e+07*

! A79
assign (resid  79 and name  HB# ) (resid  80 and name  HB2 )  4.0  2.2  1.5 ! A.348  at 9.74e+06
assign (resid  79 and name   HA ) (resid  87 and name  HB# )  4.0  2.2  1.5 ! A.321  at 9.06e+06

! N80

! E81
assign (resid  81 and name   HA ) (resid  81 and name  HG# )  3.5  1.2  1.0 ! A.582  at 1.65e+07

! G82
assign (resid  82 and name  HA1 ) (resid  83 and name   HN )  4.5  2.2  2.0 ! A.613  at 4.73e+06
assign (resid  82 and name  HA2 ) (resid  83 and name   HN )  4.0  2.2  1.0 ! A.614  at 5.75e+06

! K83
assign (resid  83 and name   HA ) (resid  83 and name  HD# )  4.0  2.2  1.5 ! A.596  at 6.56e+06
assign (resid  83 and name   HA ) (resid  83 and name  HG# )  3.5  1.2  1.0 ! A.597  at 1.06e+07
assign (resid  83 and name  HD1 ) (resid  83 and name   HA )  4.0  1.2  1.5 ! A.11   at 1.62e+07
assign (resid  83 and name   HA ) (resid  84 and name HG2# )  4.0  2.2  1.5 ! A.598  at 6.94e+06
assign (resid  83 and name  HB# ) (resid  85 and name   HN )  4.0  2.2  1.5 ! A.693  at 5.76e+06
assign (resid  83 and name  HB1 ) (resid  86 and name  HG2 )  4.0  2.2  1.0 ! A.226  at 6.12e+06
assign (resid  83 and name  HB# ) (resid  86 and name   HN )  4.0  2.2  1.5 ! A.692  at 6.23e+06

! V84
assign (resid  84 and name   HB ) (resid  84 and name   HN )  3.5  1.2  0.5 ! A.681  at 1.55e+07
assign (resid  84 and name   HA ) (resid  85 and name   HA )  4.0  2.2  1.0 ! A.519  at 7.35e+06

! K85
assign (resid  85 and name   HA ) (resid  85 and name  HE# )  4.5  2.2  2.5 ! A.158  at 4.40e+06
assign (resid  85 and name  HE1 ) (resid  85 and name  HG# )  3.5  1.2  1.0 ! A.326  at 1.55e+07
assign (resid  85 and name   HA ) (resid  86 and name   HN )  4.0  2.2  1.0 ! A.522  at 5.55e+06
assign (resid  85 and name  HG# ) (resid  86 and name  HG2 )  4.5  2.2  2.5 ! A.662  at 4.45e+06
assign (resid  85 and name  HG# ) (resid  86 and name  HG1 )  4.5  2.2  2.5 ! A.665  at 4.78e+06
assign (resid  85 and name  HG# ) (resid  88 and name  HG2 )  4.5  2.2  2.5 ! A.327  at 5.11e+06
assign (resid  85 and name  HG# ) (resid  88 and name  HG1 )  3.5  1.2  1.0 ! A.670  at 1.32e+07

! E86
assign (resid  86 and name  HG2 ) (resid  86 and name   HA )  3.5  1.2  0.5 ! A.109  at 1.40e+07
assign (resid  86 and name  HG2 ) (resid  87 and name   HN )  4.5  2.2  2.0 ! A.663  at 4.46e+06
assign (resid  86 and name  HG1 ) (resid  87 and name   HN )  4.5  2.2  2.0 ! A.664  at 3.08e+06

! A87
assign (resid  87 and name  HB# ) (resid  88 and name   HA )  4.0  2.2  1.5 ! A.534  at 6.79e+06

! Q88
assign (resid  88 and name   HA ) (resid  88 and name  HG2 )  3.5  1.2  0.5 ! A.532  at 1.27e+07
assign (resid  88 and name   HA ) (resid  88 and name  HG1 )  3.5  1.2  0.5 ! A.200  at 1.57e+07

! A89
assign (resid  89 and name   HA ) (resid  92 and name  HB# )  4.0  2.2  1.5 ! A.234  at 6.36e+06

! A90
assign (resid  90 and name  HB# ) (resid  93 and name  HB# )  4.0  2.2  2.0 ! A.314  at 6.16e+06
assign (resid  90 and name   HA ) (resid  93 and name  HG# )  3.5  1.2  1.0 ! A.202  at 1.46e+07
assign (resid  90 and name   HA ) (resid  93 and name  HB# )  3.5  1.2  1.0 ! A.234  at 1.36e+07

! A91
assign (resid  91 and name  HB# ) (resid  92 and name  HG2 )  3.5  1.2  1.0 ! A.342  at 1.85e+07
assign (resid  91 and name   HA ) (resid  94 and name  HB1 )  4.5  2.2  2.0 ! A.124  at 5.00e+06

! E92
assign (resid  92 and name   HA ) (resid  92 and name  HG2 )  3.5  1.2  0.5 ! A.223  at 1.38e+07
assign (resid  92 and name   HA ) (resid  93 and name   HN )  4.0  2.2  1.0 ! A.537  at 5.94e+06
assign (resid  92 and name   HN ) (resid  93 and name  HG2 )  3.5  0.7  0.9 ! A.671  at 2.22e+07
assign (resid  92 and name   HN ) (resid  93 and name  HB# )  4.5  2.2  2.5 ! A.699  at 4.65e+06

! Q93
assign (resid  93 and name  HB# ) (resid  94 and name  HB2 )  4.5  2.2  2.5 ! A.343  at 3.76e+06
assign (resid  93 and name  HB# ) (resid  94 and name HD2# )  4.0  2.2  2.0 ! A.698  at 9.06e+06

! L94
assign (resid  94 and name  HB1 ) (resid  94 and name HD1# )  3.5  1.2  1.0 ! A.368  at 1.57e+07
assign (resid  94 and name HD1# ) (resid  94 and name   HA )  4.5  2.2  2.5 ! A.57   at 5.00e+06
assign (resid  94 and name  HB1 ) (resid  98 and name  HA2 )  3.5  1.2  0.5 ! A.282  at 1.90e+07

! K95
assign (resid  95 and name  HG1 ) (resid  95 and name   HA )  4.0  2.2  1.0 ! A.69   at 6.39e+06

! T96
assign (resid  96 and name   HA ) (resid  96 and name HG2# )  4.0  2.2  1.5 ! A.513  at 8.96e+06

! T97
assign (resid  97 and name   HA ) (resid  97 and name HG2# )  3.5  1.2  1.0 ! A.345  at 1.04e+07

! G98

! R99
assign (resid  99 and name  HD# ) (resid  99 and name HH1# )  3.5  1.2  1.5 ! A.628  at 1.04e+07
assign (resid  99 and name  HD# ) (resid  99 and name HH2# )  4.0  2.2  2.0 ! A.629  at 9.07e+06
assign (resid  99 and name  HD# ) (resid  99 and name   HN )  4.5  2.2  2.5 ! A.630  at 5.07e+06
assign (resid  99 and name  HD# ) (resid 100 and name   HN )  4.5  2.2  2.5 ! A.631  at 4.19e+06

! A100

! G101

! N102
assign (resid 102 and name  HB# ) (resid 103 and name   HA )  4.0  2.2  1.5 ! A.575  at 7.65e+06
assign (resid 102 and name  HB1 ) (resid 103 and name  HB2 )  3.5  1.2  0.9 ! A.251  at 1.08e+07

! Q103
assign (resid 103 and name   HA ) (resid 103 and name  HG# )  4.0  2.2  1.5 ! A.219  at 9.34e+06
assign (resid 103 and name   HA ) (resid 103 and name  HG1 )  2.5  0.7  0.4 ! A.220  at 2.03e+07
assign (resid 103 and name  HG2 ) (resid 104 and name   HA )  3.5  1.2  0.5 ! A.574  at 1.01e+07
assign (resid 103 and name  HB1 ) (resid 104 and name   HA )  3.5  1.2  0.5 ! A.245  at 1.19e+07
assign (resid 103 and name   HA ) (resid 106 and name  HA1 )  3.5  1.2  0.5 ! A.49   at 1.32e+07

! K104
assign (resid 104 and name  HG# ) (resid 104 and name  HE# )  3.5  1.2  1.5 ! A.706  at 1.59e+07
assign (resid 104 and name   HA ) (resid 105 and name   HN )  4.0  2.2  1.0 ! A.573  at 9.79e+06
assign (resid 104 and name  HG2 ) (resid 105 and name  HA1 )  2.5  0.7  0.4 ! A.331  at 2.15e+07

! G105

! G106


!@ END_XPLR_NOE_FILE
! pck2xplr.nawk Table; Input File: c3g_noesyC.PCK
!   Date: Tue Aug 31 14:54:32 EDT 2004
!   Path: /home/fengh/My_xplor/Gd7_c3g
!
!@ BEGIN_XPLR_PCK_SUM
! LBL   File-Name                   All   Intra  Seq.  Short   Long
! A   c3g_noesyC.PCK                105    61      9     23     12
!    Total                          105    61      9     23     12

!@ END_XPLR_PCK_SUM
!@ BEGIN_XPLR_NOE_FILE
!
! A1

! D2

! L3
assign (resid   3 and name HD2# ) (resid   3 and name  HB1 )  4.0  2.2  1.5 ! A.618  at 2.12e+05

! E4

! D5

! N6

! D7

! E8

! T9

! G10

! N11

! D12

! N13

! G14

! K15

! G16

! G17

! E18

! K19

! A20

! D21

! N22
assign (resid  22 and name  HB1 ) (resid  22 and name HD21 )  4.0  2.2  1.0 ! A.44   at 2.51e+05
assign (resid  22 and name HD21 ) (resid  84 and name   HA )  3.5  1.2  0.5 ! A.43   at 3.76e+05

! A23

! A24

! Q25

! V26
assign (resid  26 and name   HA ) (resid  26 and name HG1# )  2.5  0.7  0.9 ! A.780  at 3.64e+06
assign (resid  26 and name HG2# ) (resid  84 and name HG1# )  4.5  2.2  3.0 ! A.764  at 8.80e+07

! K27
assign (resid  27 and name  HD# ) (resid  27 and name   HA )  3.5  1.2  1.0 ! A.307  at 4.78e+05
assign (resid  27 and name   HA ) (resid  30 and name HD2# )  3.5  1.2  1.0 ! A.860  at 5.17e+05

! D28

! A29

! L30
assign (resid  30 and name HD2# ) (resid  72 and name   HA )  2.5  0.7  0.9 ! A.346  at 7.09e+05

! T31
assign (resid  31 and name   HA ) (resid  31 and name HG2# )  2.5  0.7  0.9 ! A.734  at 4.02e+06
assign (resid  31 and name   HB ) (resid  34 and name  HD1 )  4.0  2.2  1.0 ! A.304  at 2.45e+05

! K32
assign (resid  32 and name   HA ) (resid  32 and name  HZ# )  4.0  2.2  1.5 ! A.119  at 2.26e+05
assign (resid  32 and name  HD1 ) (resid  32 and name  HZ# )  3.5  1.2  1.0 ! A.120  at 3.70e+05
assign (resid  32 and name  HG1 ) (resid  32 and name  HZ# )  2.5  0.7  0.9 ! A.121  at 7.52e+05

! M33

! R34
assign (resid  34 and name   HE ) (resid  34 and name  HB# )  4.0  2.2  1.5 ! A.536  at 2.56e+05
assign (resid  34 and name   HA ) (resid  34 and name  HD1 )  4.0  2.2  1.0 ! A.378  at 3.48e+05
assign (resid  34 and name   HA ) (resid  34 and name  HD2 )  4.0  2.2  1.0 ! A.425  at 2.63e+05
assign (resid  34 and name  HD1 ) (resid  34 and name  HB# )  3.5  1.2  1.0 ! A.538  at 4.60e+05
assign (resid  34 and name   HE ) (resid  38 and name HD1# )  3.5  1.2  1.0 ! A.823  at 5.27e+05
assign (resid  34 and name   HE ) (resid  69 and name HG1# )  3.5  1.2  1.0 ! A.741  at 3.84e+05
assign (resid  34 and name  HD2 ) (resid  69 and name HG1# )  3.5  1.2  1.0 ! A.750  at 4.94e+05

! A35

! A36

! A37

! L38
assign (resid  38 and name   HA ) (resid  38 and name   HG )  4.0  2.2  1.0 ! A.607  at 3.34e+05
assign (resid  38 and name HD2# ) (resid  61 and name  HE2 )  4.0  2.2  1.5 ! A.42   at 2.19e+05
assign (resid  38 and name HD2# ) (resid  65 and name  HD2 )  4.0  2.2  1.5 ! A.143  at 1.60e+05

! D39

! A40

! Q41

! K42
assign (resid  42 and name  HG1 ) (resid  61 and name   HZ )  4.0  2.2  1.0 ! A.687  at 1.97e+05
assign (resid  42 and name  HG1 ) (resid  61 and name  HE1 )  3.5  1.2  0.5 ! A.41   at 3.72e+05

! A43

! T44

! P45

! P46

! K47

! L48

! E49
assign (resid  49 and name   HA ) (resid  50 and name  HB2 )  4.0  2.2  1.0 ! A.435  at 3.23e+05

! D50

! K51
assign (resid  51 and name   HA ) (resid  51 and name  HD# )  3.5  0.7  0.9 ! A.639  at 8.05e+05
assign (resid  51 and name   HA ) (resid  52 and name  HB1 )  4.0  2.2  1.0 ! A.236  at 1.55e+05
assign (resid  51 and name   HA ) (resid  54 and name  HB1 )  2.5  0.7  0.4 ! A.432  at 9.57e+05

! S52

! P53
assign (resid  53 and name   HA ) (resid  53 and name  HD1 )  3.5  1.2  0.5 ! A.299  at 4.66e+05
assign (resid  53 and name  HD1 ) (resid  53 and name  HB1 )  4.0  2.2  1.0 ! A.479  at 1.98e+05

! D54
assign (resid  54 and name   HA ) (resid  55 and name   HA )  4.0  2.2  1.0 ! A.168  at 2.22e+05

! S55

! P56
assign (resid  56 and name   HA ) (resid  56 and name  HG1 )  2.5  0.7  0.4 ! A.476  at 8.15e+05
assign (resid  56 and name  HB1 ) (resid 104 and name  HE1 )  2.5  0.7  0.4 ! A.459  at 1.70e+06

! E57
assign (resid  57 and name   HA ) (resid  57 and name  HG# )  2.5  0.7  0.9 ! A.451  at 1.53e+06

! M58
assign (resid  58 and name   HA ) (resid  61 and name  HE1 )  4.0  2.2  1.0 ! A.172  at 2.13e+05
assign (resid  58 and name   HA ) (resid  61 and name  HD1 )  4.0  2.2  1.0 ! A.173  at 2.28e+05

! K59
assign (resid  59 and name  HE1 ) (resid  59 and name  HG1 )  3.5  0.7  0.5 ! A.722  at 9.44e+05

! D60

! F61
assign (resid  61 and name  HE1 ) (resid  61 and name  HB1 )  4.0  2.2  1.0 ! A.359  at 1.88e+05
assign (resid  61 and name  HD1 ) (resid  61 and name  HB1 )  2.5  0.7  0.4 ! A.355  at 7.79e+05
assign (resid  61 and name  HD2 ) (resid  61 and name  HB2 )  2.5  0.7  0.4 ! A.355  at 7.79e+05
assign (resid  61 and name   HA ) (resid  61 and name  HD2 )  2.5  0.7  0.4 ! A.95   at 1.29e+06
assign (resid  61 and name   HA ) (resid  61 and name  HE2 )  4.0  2.2  1.0 ! A.48   at 3.15e+05
assign (resid  61 and name  HD2 ) (resid  65 and name  HD1 )  4.0  2.2  1.0 ! A.83   at 2.81e+05
assign (resid  61 and name   HZ ) (resid  65 and name  HD1 )  4.0  2.2  1.0 ! A.72   at 1.75e+05
assign (resid  61 and name  HD2 ) (resid  65 and name  HE1 )  4.0  2.2  1.0 ! A.94   at 3.33e+05
assign (resid  61 and name  HB2 ) (resid  65 and name  HD1 )  4.0  2.2  1.5 ! A.130  at 1.70e+05
assign (resid  61 and name  HE2 ) (resid  65 and name  HD2 )  4.0  2.2  1.0 ! A.34   at 3.14e+05
assign (resid  61 and name  HD2 ) (resid  65 and name  HB1 )  4.0  2.2  1.0 ! A.88   at 2.41e+05

! R62
assign (resid  62 and name   HE ) (resid  62 and name HH1# )  4.0  2.2  1.5 ! A.113  at 3.20e+05
assign (resid  62 and name   HA ) (resid  62 and name  HD2 )  3.5  1.2  0.5 ! A.368  at 5.44e+05
assign (resid  62 and name   HA ) (resid  62 and name  HD1 )  3.5  1.2  0.5 ! A.361  at 4.85e+05
assign (resid  62 and name   HA ) (resid  62 and name  HG1 )  3.5  0.7  0.5 ! A.485  at 7.17e+05
assign (resid  62 and name  HB# ) (resid  62 and name  HD1 )  2.5  0.7  0.9 ! A.364  at 5.84e+05
assign (resid  62 and name  HG2 ) (resid  62 and name   HE )  4.0  2.2  1.0 ! A.52   at 2.22e+05
assign (resid  62 and name   HA ) (resid  65 and name  HD1 )  2.5  0.7  0.4 ! A.129  at 8.87e+05

! H63
assign (resid  63 and name   HA ) (resid  63 and name  HD2 )  3.5  1.2  0.5 ! A.76   at 4.47e+05
assign (resid  63 and name  HD2 ) (resid  67 and name HG11 )  4.0  2.2  1.0 ! A.79   at 2.38e+05

! G64

! F65
assign (resid  65 and name  HD2 ) (resid  65 and name   HZ )  4.0  2.2  1.0 ! A.116  at 3.23e+05
assign (resid  65 and name  HD1 ) (resid  65 and name  HB2 )  4.0  2.2  1.0 ! A.410  at 1.98e+05
assign (resid  65 and name   HA ) (resid  65 and name  HD2 )  3.5  1.0  0.5 ! A.128  at 1.20e+05
assign (resid  65 and name  HD2 ) (resid  69 and name HG1# )  4.0  2.2  1.5 ! A.744  at 1.75e+05
assign (resid  65 and name  HE2 ) (resid  69 and name HG1# )  4.0  2.2  1.5 ! A.745  at 3.31e+05
assign (resid  65 and name  HD2 ) (resid  69 and name   HB )  3.5  0.7  0.5 ! A.137  at 6.74e+05

! D66
assign (resid  66 and name   HA ) (resid  67 and name HG11 )  4.0  2.2  1.0 ! A.740  at 2.45e+05
assign (resid  66 and name   HA ) (resid  69 and name HG1# )  2.5  0.7  0.9 ! A.746  at 5.72e+05

! I67
assign (resid  67 and name   HA ) (resid  67 and name HG2# )  2.5  0.7  0.9 ! A.858  at 1.29e+06
assign (resid  67 and name   HA ) (resid  67 and name HG12 )  2.5  0.7  0.4 ! A.807  at 1.10e+06
assign (resid  67 and name HG11 ) (resid  67 and name   HA )  2.5  0.7  0.4 ! A.330  at 5.62e+05
assign (resid  67 and name   HA ) (resid  70 and name  HA# )  4.0  2.2  1.5 ! A.281  at 3.47e+05

! L68
assign (resid  68 and name   HA ) (resid  68 and name HD2# )  2.5  0.7  0.9 ! A.856  at 1.84e+06

! V69
assign (resid  69 and name   HA ) (resid  69 and name HG2# )  2.5  0.7  0.9 ! A.853  at 6.27e+05
assign (resid  69 and name   HA ) (resid  69 and name HG1# )  2.5  0.7  0.9 ! A.748  at 7.65e+05

! G70

! Q71

! I72
assign (resid  72 and name   HA ) (resid  72 and name HG11 )  3.5  1.2  0.5 ! A.657  at 4.57e+05
assign (resid  72 and name   HA ) (resid  72 and name HG2# )  2.5  0.7  0.9 ! A.768  at 9.77e+05

! D73

! D74

! A75

! L76
assign (resid  76 and name   HG ) (resid  76 and name   HA )  4.0  2.2  1.0 ! A.288  at 3.27e+05
assign (resid  76 and name HD2# ) (resid  76 and name   HA )  2.5  0.7  0.9 ! A.292  at 6.59e+05
assign (resid  76 and name HD2# ) (resid  76 and name  HB1 )  2.5  0.7  0.9 ! A.549  at 1.16e+06
assign (resid  76 and name   HA ) (resid  79 and name   HA )  4.0  2.2  1.0 ! A.334  at 2.08e+05

! K77

! L78
assign (resid  78 and name  HB1 ) (resid  79 and name   HA )  4.0  2.2  1.0 ! A.589  at 2.56e+05
assign (resid  78 and name HD1# ) (resid  79 and name   HA )  3.5  1.2  1.0 ! A.841  at 4.21e+05
assign (resid  78 and name HD1# ) (resid  82 and name  HA2 )  2.5  0.7  0.9 ! A.328  at 1.27e+06

! A79
assign (resid  79 and name   HA ) (resid  82 and name  HA2 )  4.0  2.2  1.0 ! A.327  at 3.10e+05
assign (resid  79 and name   HA ) (resid  84 and name   HA )  3.5  1.2  0.5 ! A.374  at 5.27e+05
assign (resid  79 and name   HA ) (resid  87 and name  HB# )  2.5  0.7  0.9 ! A.337  at 6.29e+05

! N80
assign (resid  80 and name   HA ) (resid  80 and name HD21 )  3.5  1.2  0.5 ! A.58   at 3.65e+05

! E81

! G82

! K83
assign (resid  83 and name   HA ) (resid  83 and name  HD1 )  4.0  2.2  1.0 ! A.628  at 3.12e+05
assign (resid  83 and name  HD1 ) (resid  84 and name   HA )  4.5  2.2  2.0 ! A.629  at 1.35e+05

! V84
assign (resid  84 and name   HA ) (resid  84 and name HG1# )  2.5  0.7  0.9 ! A.760  at 1.75e+06
assign (resid  84 and name   HA ) (resid  84 and name HG2# )  2.5  0.7  0.9 ! A.821  at 1.24e+06
assign (resid  84 and name   HA ) (resid  85 and name   HA )  4.0  2.2  1.0 ! A.373  at 2.59e+05
assign (resid  84 and name   HA ) (resid  87 and name  HB# )  2.5  0.7  0.9 ! A.679  at 1.08e+06

! K85

! E86

! A87

! Q88
assign (resid  88 and name HE22 ) (resid  89 and name  HB# )  4.0  2.2  1.5 ! A.672  at 3.21e+05

! A89

! A90

! A91

! E92

! Q93

! L94

! K95

! T96

! T97

! G98

! R99
assign (resid  99 and name   HE ) (resid  99 and name HH2# )  2.5  0.7  0.9 ! A.165  at 2.41e+06
assign (resid  99 and name   HA ) (resid  99 and name   HE )  4.0  2.2  1.0 ! A.110  at 2.20e+05

! A100

! G101

! N102

! Q103

! K104

! G105

! G106


!@ END_XPLR_NOE_FILE
! make_hbonds.nawk Table !   Date: Sun Aug 29 11:19:39 EDT 2004
!   Path: /home/fengh/My_xplor/Gd7_c3g
!

! alpha helices phi constraints
assign (resid  23 and name c)  (resid  24 and name n)
       (resid  24 and name ca) (resid  24 and name c)  1.0 -100.0 40.0 2
assign (resid  24 and name c)  (resid  25 and name n)
       (resid  25 and name ca) (resid  25 and name c)  1.0 -100.0 40.0 2
assign (resid  25 and name c)  (resid  26 and name n)
       (resid  26 and name ca) (resid  26 and name c)  1.0 -100.0 40.0 2
assign (resid  26 and name c)  (resid  27 and name n)
       (resid  27 and name ca) (resid  27 and name c)  1.0 -100.0 40.0 2
assign (resid  27 and name c)  (resid  28 and name n)
       (resid  28 and name ca) (resid  28 and name c)  1.0 -100.0 40.0 2
assign (resid  28 and name c)  (resid  29 and name n)
       (resid  29 and name ca) (resid  29 and name c)  1.0 -100.0 40.0 2
assign (resid  29 and name c)  (resid  30 and name n)
       (resid  30 and name ca) (resid  30 and name c)  1.0 -100.0 40.0 2
assign (resid  30 and name c)  (resid  31 and name n)
       (resid  31 and name ca) (resid  31 and name c)  1.0 -100.0 40.0 2
assign (resid  31 and name c)  (resid  32 and name n)
       (resid  32 and name ca) (resid  32 and name c)  1.0 -100.0 40.0 2
assign (resid  32 and name c)  (resid  33 and name n)
       (resid  33 and name ca) (resid  33 and name c)  1.0 -100.0 40.0 2
assign (resid  33 and name c)  (resid  34 and name n)
       (resid  34 and name ca) (resid  34 and name c)  1.0 -100.0 40.0 2
assign (resid  34 and name c)  (resid  35 and name n)
       (resid  35 and name ca) (resid  35 and name c)  1.0 -100.0 40.0 2
assign (resid  35 and name c)  (resid  36 and name n)
       (resid  36 and name ca) (resid  36 and name c)  1.0 -100.0 40.0 2
assign (resid  36 and name c)  (resid  37 and name n)
       (resid  37 and name ca) (resid  37 and name c)  1.0 -100.0 40.0 2
assign (resid  37 and name c)  (resid  38 and name n)
       (resid  38 and name ca) (resid  38 and name c)  1.0 -100.0 40.0 2
assign (resid  38 and name c)  (resid  39 and name n)
       (resid  39 and name ca) (resid  39 and name c)  1.0 -100.0 40.0 2
assign (resid  39 and name c)  (resid  40 and name n)
       (resid  40 and name ca) (resid  40 and name c)  1.0 -100.0 40.0 2
assign (resid  40 and name c)  (resid  41 and name n)
       (resid  41 and name ca) (resid  41 and name c)  1.0 -100.0 40.0 2
assign (resid  60 and name c)  (resid  61 and name n)
       (resid  61 and name ca) (resid  61 and name c)  1.0 -100.0 40.0 2
assign (resid  61 and name c)  (resid  62 and name n)
       (resid  62 and name ca) (resid  62 and name c)  1.0 -100.0 40.0 2
assign (resid  62 and name c)  (resid  63 and name n)
       (resid  63 and name ca) (resid  63 and name c)  1.0 -100.0 40.0 2
assign (resid  63 and name c)  (resid  64 and name n)
       (resid  64 and name ca) (resid  64 and name c)  1.0 -100.0 40.0 2
assign (resid  64 and name c)  (resid  65 and name n)
       (resid  65 and name ca) (resid  65 and name c)  1.0 -100.0 40.0 2
assign (resid  65 and name c)  (resid  66 and name n)
       (resid  66 and name ca) (resid  66 and name c)  1.0 -100.0 40.0 2
assign (resid  66 and name c)  (resid  67 and name n)
       (resid  67 and name ca) (resid  67 and name c)  1.0 -100.0 40.0 2
assign (resid  67 and name c)  (resid  68 and name n)
       (resid  68 and name ca) (resid  68 and name c)  1.0 -100.0 40.0 2
assign (resid  68 and name c)  (resid  69 and name n)
       (resid  69 and name ca) (resid  69 and name c)  1.0 -100.0 40.0 2
assign (resid  69 and name c)  (resid  70 and name n)
       (resid  70 and name ca) (resid  70 and name c)  1.0 -100.0 40.0 2
assign (resid  70 and name c)  (resid  71 and name n)
       (resid  71 and name ca) (resid  71 and name c)  1.0 -100.0 40.0 2
assign (resid  71 and name c)  (resid  72 and name n)
       (resid  72 and name ca) (resid  72 and name c)  1.0 -100.0 40.0 2
assign (resid  72 and name c)  (resid  73 and name n)
       (resid  73 and name ca) (resid  73 and name c)  1.0 -100.0 40.0 2
assign (resid  73 and name c)  (resid  74 and name n)
       (resid  74 and name ca) (resid  74 and name c)  1.0 -100.0 40.0 2
assign (resid  74 and name c)  (resid  75 and name n)
       (resid  75 and name ca) (resid  75 and name c)  1.0 -100.0 40.0 2
assign (resid  75 and name c)  (resid  76 and name n)
       (resid  76 and name ca) (resid  76 and name c)  1.0 -100.0 40.0 2
assign (resid  76 and name c)  (resid  77 and name n)
       (resid  77 and name ca) (resid  77 and name c)  1.0 -100.0 40.0 2
assign (resid  77 and name c)  (resid  78 and name n)
       (resid  78 and name ca) (resid  78 and name c)  1.0 -100.0 40.0 2
assign (resid  78 and name c)  (resid  79 and name n)
       (resid  79 and name ca) (resid  79 and name c)  1.0 -100.0 40.0 2
assign (resid  79 and name c)  (resid  80 and name n)
       (resid  80 and name ca) (resid  80 and name c)  1.0 -100.0 40.0 2
assign (resid  80 and name c)  (resid  81 and name n)
       (resid  81 and name ca) (resid  81 and name c)  1.0 -100.0 40.0 2
assign (resid  81 and name c)  (resid  82 and name n)
       (resid  82 and name ca) (resid  82 and name c)  1.0 -100.0 40.0 2
assign (resid  82 and name c)  (resid  83 and name n)
       (resid  83 and name ca) (resid  83 and name c)  1.0 -100.0 40.0 2
assign (resid  83 and name c)  (resid  84 and name n)
       (resid  84 and name ca) (resid  84 and name c)  1.0 -100.0 40.0 2
assign (resid  84 and name c)  (resid  85 and name n)
       (resid  85 and name ca) (resid  85 and name c)  1.0 -100.0 40.0 2
assign (resid  85 and name c)  (resid  86 and name n)
       (resid  86 and name ca) (resid  86 and name c)  1.0 -100.0 40.0 2
assign (resid  86 and name c)  (resid  87 and name n)
       (resid  87 and name ca) (resid  87 and name c)  1.0 -100.0 40.0 2
assign (resid  87 and name c)  (resid  88 and name n)
       (resid  88 and name ca) (resid  88 and name c)  1.0 -100.0 40.0 2
assign (resid  88 and name c)  (resid  89 and name n)
       (resid  89 and name ca) (resid  89 and name c)  1.0 -100.0 40.0 2
assign (resid  89 and name c)  (resid  90 and name n)
       (resid  90 and name ca) (resid  90 and name c)  1.0 -100.0 40.0 2
assign (resid  90 and name c)  (resid  91 and name n)
       (resid  91 and name ca) (resid  91 and name c)  1.0 -100.0 40.0 2
assign (resid  91 and name c)  (resid  92 and name n)
       (resid  92 and name ca) (resid  92 and name c)  1.0 -100.0 40.0 2
assign (resid  92 and name c)  (resid  93 and name n)
       (resid  93 and name ca) (resid  93 and name c)  1.0 -100.0 40.0 2
assign (resid  93 and name c)  (resid  94 and name n)
       (resid  94 and name ca) (resid  94 and name c)  1.0 -100.0 40.0 2
assign (resid  94 and name c)  (resid  95 and name n)
       (resid  95 and name ca) (resid  95 and name c)  1.0 -100.0 40.0 2
assign (resid  95 and name c)  (resid  96 and name n)
       (resid  96 and name ca) (resid  96 and name c)  1.0 -100.0 40.0 2
assign (resid  96 and name c)  (resid  97 and name n)
       (resid  97 and name ca) (resid  97 and name c)  1.0 -100.0 40.0 2


!!   D2 
assign ( resid 1 and name c ) ( resid 2 and name n )
       ( resid 2 and name ca) ( resid 2 and name c )
       ( resid 3 and name n )                           53.97 40.65

!!   L3 
assign ( resid 2 and name c ) ( resid 3 and name n )
       ( resid 3 and name ca) ( resid 3 and name c )
       ( resid 4 and name n )                           55.28 41.95

!!   E4
assign ( resid 3 and name c ) ( resid 4 and name n )
       ( resid 4 and name ca) ( resid 4 and name c )
       ( resid 5 and name n )                           55.85 29.34

!!   D5
assign ( resid 4 and name c ) ( resid 5 and name n )
       ( resid 5 and name ca) ( resid 5 and name c )
       ( resid 6 and name n )                           53.72 40.12

!!   N6
assign ( resid 5 and name c ) ( resid 6 and name n )
       ( resid 6 and name ca) ( resid 6 and name c )
       ( resid 7 and name n )                           53.01 38.82

!!   D7
assign ( resid 6 and name c ) ( resid 7 and name n )
       ( resid 7 and name ca) ( resid 7 and name c )
       ( resid 8 and name n )                           54.06 40.21

!!   E8
assign ( resid 7 and name c ) ( resid 8 and name n )
       ( resid 8 and name ca) ( resid 8 and name c )
       ( resid 9 and name n )                           56.41 28.91

!!   T9
assign ( resid 8 and name c ) ( resid 9 and name n )
       ( resid 9 and name ca) ( resid 9 and name c )
       ( resid 10 and name n )                          62.23 69.35

!!   G10
assign ( resid 9 and name c ) ( resid 10 and name n )
       ( resid 10 and name ca) ( resid 10 and name c )
       ( resid 11 and name n )                          45.18 0.000

!!   N11
assign ( resid 10 and name c ) ( resid 11 and name n )
       ( resid 11 and name ca) ( resid 11 and name c )
       ( resid 12 and name n )                           52.93 38.69

!!   D12
assign ( resid 11 and name c ) ( resid 12 and name n )
       ( resid 12 and name ca) ( resid 12 and name c )
       ( resid 13 and name n )                           54.06 40.34

!!   N13
assign ( resid 12 and name c ) ( resid 13 and name n )
       ( resid 13 and name ca) ( resid 13 and name c )
       ( resid 14 and name n )                           53.28 38.21

!!   G14
assign ( resid 13 and name c ) ( resid 14 and name n )
       ( resid 14 and name ca) ( resid 14 and name c )
       ( resid 15 and name n )                           45.43 0.000

!!   K15
assign ( resid 14 and name c ) ( resid 15 and name n )
       ( resid 15 and name ca) ( resid 15 and name c )
       ( resid 16 and name n )                           56.15 32.49

!!   G16
assign ( resid 15 and name c ) ( resid 16 and name n )
       ( resid 16 and name ca) ( resid 16 and name c )
       ( resid 17 and name n )                           45.26 0.000

!!   G17
assign ( resid 16 and name c ) ( resid 17 and name n )
       ( resid 17 and name ca) ( resid 17 and name c )
       ( resid 18 and name n )                           44.93 0.000

!!   E18
assign ( resid 17 and name c ) ( resid 18 and name n )
       ( resid 18 and name ca) ( resid 18 and name c )
       ( resid 19 and name n )                           56.49 29.15

!!   K19
assign ( resid 18 and name c ) ( resid 19 and name n )
       ( resid 19 and name ca) ( resid 19 and name c )
       ( resid 20 and name n )                           56.15 32.66

!!   A20
assign ( resid 19 and name c ) ( resid 20 and name n )
       ( resid 20 and name ca) ( resid 20 and name c )
       ( resid 21 and name n )                           52.59 18.99

!!   D21
assign ( resid 20 and name c ) ( resid 21 and name n )
       ( resid 21 and name ca) ( resid 21 and name c )
       ( resid 22 and name n )                           53.71 40.47

!!   N22
assign ( resid 21 and name c ) ( resid 22 and name n )
       ( resid 22 and name ca) ( resid 22 and name c )
       ( resid 23 and name n )                           54.23 38.21

!!   A23
assign ( resid 22 and name c ) ( resid 23 and name n )
       ( resid 23 and name ca) ( resid 23 and name c )
       ( resid 24 and name n )                           54.41 18.38

!!   A24
assign ( resid 23 and name c ) ( resid 24 and name n )
       ( resid 24 and name ca) ( resid 24 and name c )
       ( resid 25 and name n )                           55.27 18.03

!!   Q25
assign ( resid 24 and name c ) ( resid 25 and name n )
       ( resid 25 and name ca) ( resid 25 and name c )
       ( resid 26 and name n )                           58.93 28.21

!!   V26
assign ( resid 25 and name c ) ( resid 26 and name n )
       ( resid 26 and name ca) ( resid 26 and name c )
       ( resid 27 and name n )                           64.85 31.08

!!   K27
assign ( resid 26 and name c ) ( resid 27 and name n )
       ( resid 27 and name ca) ( resid 27 and name c )
       ( resid 28 and name n )                           59.89 32.64

!!   D28
assign ( resid 27 and name c ) ( resid 28 and name n )
       ( resid 28 and name ca) ( resid 28 and name c )
       ( resid 29 and name n )                           57.45 41.08

!!   A29
assign ( resid 28 and name c ) ( resid 29 and name n )
       ( resid 29 and name ca) ( resid 29 and name c )
       ( resid 30 and name n )                           55.27 17.31

!!   L30
assign ( resid 29 and name c ) ( resid 30 and name n )
       ( resid 30 and name ca) ( resid 30 and name c )
       ( resid 31 and name n )                           57.62 42.13

!!   T31
assign ( resid 30 and name c ) ( resid 31 and name n )
       ( resid 31 and name ca) ( resid 31 and name c )
       ( resid 32 and name n )                           67.02 68.22

!!   K32
assign ( resid 31 and name c ) ( resid 32 and name n )
       ( resid 32 and name ca) ( resid 32 and name c )
       ( resid 33 and name n )                           60.23 31.69

!!   M33
assign ( resid 32 and name c ) ( resid 33 and name n )
       ( resid 33 and name ca) ( resid 33 and name c )
       ( resid 34 and name n )                           59.36 32.55

!!   R34
assign ( resid 33 and name c ) ( resid 34 and name n )
       ( resid 34 and name ca) ( resid 34 and name c )
       ( resid 35 and name n )                           59.80 30.47

!!   A35
assign ( resid 34 and name c ) ( resid 35 and name n )
       ( resid 35 and name ca) ( resid 35 and name c )
       ( resid 36 and name n )                           54.84 17.55

!!   A36
assign ( resid 35 and name c ) ( resid 36 and name n )
       ( resid 36 and name ca) ( resid 36 and name c )
       ( resid 37 and name n )                           54.67 17.59

!!   A37
assign ( resid 36 and name c ) ( resid 37 and name n )
       ( resid 37 and name ca) ( resid 37 and name c )
       ( resid 38 and name n )                           54.76 18.03

!!   L38
assign ( resid 37 and name c ) ( resid 38 and name n )
       ( resid 38 and name ca) ( resid 38 and name c )
       ( resid 39 and name n )                           57.45 41.08

!!   D39
assign ( resid 38 and name c ) ( resid 39 and name n )
       ( resid 39 and name ca) ( resid 39 and name c )
       ( resid 40 and name n )                           57.02 39.95 

!!   A40
assign ( resid 39 and name c ) ( resid 40 and name n )
       ( resid 40 and name ca) ( resid 40 and name c )
       ( resid 41 and name n )                           54.49 18.03

!!   Q41
assign ( resid 40 and name c ) ( resid 41 and name n )
       ( resid 41 and name ca) ( resid 41 and name c )
       ( resid 42 and name n )                           57.37 28.82

!!   K42
assign ( resid 41 and name c ) ( resid 42 and name n )
       ( resid 42 and name ca) ( resid 42 and name c )
       ( resid 43 and name n )                           56.41 32.91

!!   A43
assign ( resid 42 and name c ) ( resid 43 and name n )
       ( resid 43 and name ca) ( resid 43 and name c )
       ( resid 44 and name n )                           50.93 18.37

!!   T44
assign ( resid 43 and name c ) ( resid 44 and name n )
       ( resid 44 and name ca) ( resid 44 and name c )
       ( resid 45 and name n )                           59.75 69.01

!!   P45
assign ( resid 44 and name c ) ( resid 45 and name n )
       ( resid 45 and name ca) ( resid 45 and name c )
       ( resid 46 and name n )                           64.97 31.67

!!   P46
assign ( resid 45 and name c ) ( resid 46 and name n )
       ( resid 46 and name ca) ( resid 46 and name c )
       ( resid 47 and name n )                           64.76 31.78

!!   K47
assign ( resid 46 and name c ) ( resid 47 and name n )
       ( resid 47 and name ca) ( resid 47 and name c )
       ( resid 48 and name n )                           57.42 31.51

!!   L48
assign ( resid 47 and name c ) ( resid 48 and name n )
       ( resid 48 and name ca) ( resid 48 and name c )
       ( resid 49 and name n )                           56.84 41.86

!!   E49
assign ( resid 48 and name c ) ( resid 49 and name n )   
       ( resid 49 and name ca) ( resid 49 and name c )   
       ( resid 50 and name n )                           58.32 28.73

!!   D50
assign ( resid 49 and name c ) ( resid 50 and name n )
       ( resid 50 and name ca) ( resid 50 and name c )
       ( resid 51 and name n )                           53.01 39.69

!!   K51
assign ( resid 50 and name c ) ( resid 51 and name n )
       ( resid 51 and name ca) ( resid 51 and name c )
       ( resid 52 and name n )                           53.88 32.46

!!   S52
assign ( resid 51 and name c ) ( resid 52 and name n )
       ( resid 52 and name ca) ( resid 52 and name c )
       ( resid 53 and name n )                           55.88 62.57

!!   P53
assign ( resid 52 and name c ) ( resid 53 and name n )
       ( resid 53 and name ca) ( resid 53 and name c )
       ( resid 54 and name n )                           64.85 31.62

!!   D54
assign ( resid 53 and name c ) ( resid 54 and name n )
       ( resid 54 and name ca) ( resid 54 and name c )
       ( resid 55 and name n )                           52.93 40.37

!!   S55
assign ( resid 54 and name c ) ( resid 55 and name n )
       ( resid 55 and name ca) ( resid 55 and name c )
       ( resid 56 and name n )                           56.33 62.48

!!   P56
assign ( resid 55 and name c ) ( resid 56 and name n )
       ( resid 56 and name ca) ( resid 56 and name c )
       ( resid 57 and name n )                           65.11 31.34

!!   E57
assign ( resid 56 and name c ) ( resid 57 and name n )
       ( resid 57 and name ca) ( resid 57 and name c )
       ( resid 58 and name n )                           60.06 28.76

!!   M58
assign ( resid 57 and name c ) ( resid 58 and name n )
       ( resid 58 and name ca) ( resid 58 and name c )
       ( resid 59 and name n )                           56.15 30.55

!!   K59
assign ( resid 58 and name c ) ( resid 59 and name n )
       ( resid 59 and name ca) ( resid 59 and name c )
       ( resid 60 and name n )                           59.97 31.86

!!   D60
assign ( resid 59 and name c ) ( resid 60 and name n )
       ( resid 60 and name ca) ( resid 60 and name c )
       ( resid 61 and name n )                           57.07 40.38

!!   F61
assign ( resid 60 and name c ) ( resid 61 and name n )
       ( resid 61 and name ca) ( resid 61 and name c )
       ( resid 62 and name n )                           60.65 39.18

!!   R62
assign ( resid 61 and name c ) ( resid 62 and name n )
       ( resid 62 and name ca) ( resid 62 and name c )
       ( resid 63 and name n )                           60.23 30.12

!!   H63
assign ( resid 62 and name c ) ( resid 63 and name n )
       ( resid 63 and name ca) ( resid 63 and name c )
       ( resid 64 and name n )                           57.89 28.04

!!   G64
assign ( resid 63 and name c ) ( resid 64 and name n )
       ( resid 64 and name ca) ( resid 64 and name c )
       ( resid 65 and name n )                           46.84 0.00

!!   F65
assign ( resid 64 and name c ) ( resid 65 and name n )
       ( resid 65 and name ca) ( resid 65 and name c )
       ( resid 66 and name n )                           61.41 39.05

!!   D66
assign ( resid 65 and name c ) ( resid 66 and name n )
       ( resid 66 and name ca) ( resid 66 and name c )
       ( resid 67 and name n )                           57.63 41.95

!!   I67
assign ( resid 66 and name c ) ( resid 67 and name n )
       ( resid 67 and name ca) ( resid 67 and name c )
       ( resid 68 and name n )                           63.11 36.82

!!   L68
assign ( resid 67 and name c ) ( resid 68 and name n )
       ( resid 68 and name ca) ( resid 68 and name c )
       ( resid 69 and name n )                           57.54 41.43

!!   V69
assign ( resid 68 and name c ) ( resid 69 and name n )
       ( resid 69 and name ca) ( resid 69 and name c )
       ( resid 70 and name n )                           67.37 31.08

!!   G70
assign ( resid 69 and name c ) ( resid 70 and name n )
       ( resid 70 and name ca) ( resid 70 and name c )
       ( resid 71 and name n )                           47.27 0.00

!!   Q71
assign ( resid 70 and name c ) ( resid 71 and name n )
       ( resid 71 and name ca) ( resid 71 and name c )
       ( resid 72 and name n )                           58.93 28.47

!!   I72
assign ( resid 71 and name c ) ( resid 72 and name n )
       ( resid 72 and name ca) ( resid 72 and name c )
       ( resid 73 and name n )                           65.96 37.11

!!   D73
assign ( resid 72 and name c ) ( resid 73 and name n )
       ( resid 73 and name ca) ( resid 73 and name c )
       ( resid 74 and name n )                           57.11 38.47

!!   D74
assign ( resid 73 and name c ) ( resid 74 and name n )
       ( resid 74 and name ca) ( resid 74 and name c )
       ( resid 75 and name n )                           57.37 39.69

!!   A75
assign ( resid 74 and name c ) ( resid 75 and name n )
       ( resid 75 and name ca) ( resid 75 and name c )
       ( resid 76 and name n )                           55.02 18.21

!!   L76
assign ( resid 75 and name c ) ( resid 76 and name n )
       ( resid 76 and name ca) ( resid 76 and name c )
       ( resid 77 and name n )                           57.63 41.79

!!   K77
assign ( resid 76 and name c ) ( resid 77 and name n )
       ( resid 77 and name ca) ( resid 77 and name c )
       ( resid 78 and name n )                           59.89 31.51

!!   L78
assign ( resid 77 and name c ) ( resid 78 and name n )
       ( resid 78 and name ca) ( resid 78 and name c )
       ( resid 79 and name n )                           57.44 41.17

!!   A79
assign ( resid 78 and name c ) ( resid 79 and name n )
       ( resid 79 and name ca) ( resid 79 and name c )
       ( resid 80 and name n )                           55.28 17.07

!!   N80
assign ( resid 79 and name c ) ( resid 80 and name n )
       ( resid 80 and name ca) ( resid 80 and name c )
       ( resid 81 and name n )                           55.28 38.12

!!   E81
assign ( resid 80 and name c ) ( resid 81 and name n )
       ( resid 81 and name ca) ( resid 81 and name c )
       ( resid 82 and name n )                           55.45 28.90

!!   G82
assign ( resid 81 and name c ) ( resid 82 and name n )
       ( resid 82 and name ca) ( resid 82 and name c )
       ( resid 83 and name n )                           45.27 0.000

!!   K83
assign ( resid 82 and name c ) ( resid 83 and name n )
       ( resid 83 and name ca) ( resid 83 and name c )
       ( resid 84 and name n )                           54.49 29.61

!!   V84
assign ( resid 83 and name c ) ( resid 84 and name n )
       ( resid 84 and name ca) ( resid 84 and name c )
       ( resid 85 and name n )                           67.02 31.52

!!   K85
assign ( resid 84 and name c ) ( resid 85 and name n )
       ( resid 85 and name ca) ( resid 85 and name c )
       ( resid 86 and name n )                           59.62 31.25

!!   E86
assign ( resid 85 and name c ) ( resid 86 and name n )
       ( resid 86 and name ca) ( resid 86 and name c )
       ( resid 87 and name n )                           59.97 28.31

!!   A87
assign ( resid 86 and name c ) ( resid 87 and name n )
       ( resid 87 and name ca) ( resid 87 and name c )
       ( resid 88 and name n )                           55.19 18.64

!!   Q88
assign ( resid 87 and name c ) ( resid 88 and name n )
       ( resid 88 and name ca) ( resid 88 and name c )
       ( resid 89 and name n )                           58.93 28.04

!!   A89
assign ( resid 88 and name c ) ( resid 89 and name n )
       ( resid 89 and name ca) ( resid 89 and name c )
       ( resid 90 and name n )                           54.84 17.33

!!   A90
assign ( resid 89 and name c ) ( resid 90 and name n )
       ( resid 90 and name ca) ( resid 90 and name c )
       ( resid 91 and name n )                           54.23 17.16

!!   A91
assign ( resid 90 and name c ) ( resid 91 and name n )
       ( resid 91 and name ca) ( resid 91 and name c )
       ( resid 92 and name n )                           55.19 17.33

!!   E92
assign ( resid 91 and name c ) ( resid 92 and name n )
       ( resid 92 and name ca) ( resid 92 and name c )
       ( resid 93 and name n )                           58.49 28.65

!!   Q93
assign ( resid 92 and name c ) ( resid 93 and name n )
       ( resid 93 and name ca) ( resid 93 and name c )
       ( resid 94 and name n )                           57.71 27.86

!!   L94
assign ( resid 93 and name c ) ( resid 94 and name n )
       ( resid 94 and name ca) ( resid 94 and name c )
       ( resid 95 and name n )                           56.88 41.87

!!   K95
assign ( resid 94 and name c ) ( resid 95 and name n )
       ( resid 95 and name ca) ( resid 95 and name c )
       ( resid 96 and name n )                           57.88 32.65

!!   T96
assign ( resid 95 and name c ) ( resid 96 and name n )
       ( resid 96 and name ca) ( resid 96 and name c )
       ( resid 97 and name n )                           62.54 69.09

!!   T97
assign ( resid 96 and name c ) ( resid 97 and name n )
       ( resid 97 and name ca) ( resid 97 and name c )
       ( resid 98 and name n )                           62.50 69.44

!!   G98
assign ( resid 97 and name c ) ( resid 98 and name n )
       ( resid 98 and name ca) ( resid 98 and name c )
       ( resid 99 and name n )                           45.55 0.000

!!   R99
assign ( resid 98 and name c ) ( resid 99 and name n )
       ( resid 99 and name ca) ( resid 99 and name c )
       ( resid 100 and name n )                          55.62 30.65

!!   A100
assign ( resid  99 and name c ) ( resid 100 and name n )
       ( resid 100 and name ca) ( resid 100 and name c )
       ( resid 101 and name n )                          52.41 19.07

!!   G101
assign ( resid 100 and name c ) ( resid 101 and name n )
       ( resid 101 and name ca) ( resid 101 and name c )
       ( resid 102 and name n )                          45.36 0.000

!!   N102
assign ( resid 101 and name c ) ( resid 102 and name n )
       ( resid 102 and name ca) ( resid 102 and name c )
       ( resid 103 and name n )                          53.02 38.65

!!   Q103
assign ( resid 102 and name c ) ( resid 103 and name n )
       ( resid 103 and name ca) ( resid 103 and name c )
       ( resid 104 and name n )                          55.71 28.99

!!   K104
assign ( resid 103 and name c ) ( resid 104 and name n )
       ( resid 104 and name ca) ( resid 104 and name c )
       ( resid 105 and name n )                          56.41 32.73

!!   G105
assign ( resid 104 and name c ) ( resid 105 and name n )
       ( resid 105 and name ca) ( resid 105 and name c )
       ( resid 106 and name n )                          45.01 0.000



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   1          1HT       ALA   1 -24.511   2.248  20.653
    2   2H    ALA   1          2HT       ALA   1 -25.767   2.803  21.654
    3   3H    ALA   1          3HT       ALA   1 -25.754   1.192  21.115
    4    HA   ALA   1           HA       ALA   1 -24.218   2.459  23.250
    5   1HB   ALA   1          1HB       ALA   1 -24.501   0.077  24.141
    6   2HB   ALA   1          2HB       ALA   1 -25.521  -0.222  22.734
    7   3HB   ALA   1          3HB       ALA   1 -25.987   0.999  23.917
    8    H    ASP   2           H        ASP   2 -22.097   1.836  23.745
    9    HA   ASP   2           HA       ASP   2 -20.475   0.921  21.516
   10   1HB   ASP   2          2HB       ASP   2 -18.610   1.041  23.200
   11   2HB   ASP   2          1HB       ASP   2 -19.535   2.535  23.059
   12    H    LEU   3           H        LEU   3 -19.217  -1.035  21.459
   13    HA   LEU   3           HA       LEU   3 -20.561  -3.315  22.771
   14   1HB   LEU   3          2HB       LEU   3 -18.693  -4.526  21.278
   15   2HB   LEU   3          1HB       LEU   3 -20.181  -3.915  20.561
   16    HG   LEU   3           HG       LEU   3 -17.860  -2.011  20.775
   17   1HD1  LEU   3          1HD1      LEU   3 -17.027  -2.839  18.555
   18   2HD1  LEU   3          2HD1      LEU   3 -18.059  -4.256  18.750
   19   3HD1  LEU   3          3HD1      LEU   3 -16.743  -3.961  19.885
   20   1HD2  LEU   3          1HD2      LEU   3 -19.726  -2.468  18.438
   21   2HD2  LEU   3          2HD2      LEU   3 -18.861  -0.997  18.886
   22   3HD2  LEU   3          3HD2      LEU   3 -20.243  -1.532  19.840
   23    H    GLU   4           H        GLU   4 -17.090  -2.984  22.078
   24    HA   GLU   4           HA       GLU   4 -15.227  -3.339  23.452
   25   1HB   GLU   4          2HB       GLU   4 -16.945  -2.544  25.802
   26   2HB   GLU   4          1HB       GLU   4 -15.229  -2.229  25.533
   27   1HG   GLU   4          2HG       GLU   4 -16.027  -0.847  23.478
   28   2HG   GLU   4          1HG       GLU   4 -17.609  -0.887  24.256
   29    H    ASP   5           H        ASP   5 -15.227  -4.282  26.202
   30    HA   ASP   5           HA       ASP   5 -15.137  -6.348  27.269
   31   1HB   ASP   5          2HB       ASP   5 -17.238  -7.276  27.773
   32   2HB   ASP   5          1HB       ASP   5 -17.598  -5.587  27.429
   33    H    ASN   6           H        ASN   6 -14.398  -6.234  24.333
   34    HA   ASN   6           HA       ASN   6 -15.066  -8.984  23.445
   35   1HB   ASN   6          2HB       ASN   6 -13.302  -6.984  22.021
   36   2HB   ASN   6          1HB       ASN   6 -14.161  -8.362  21.330
   37   1HD2  ASN   6          1HD2      ASN   6 -14.333  -5.114  21.291
   38   2HD2  ASN   6          2HD2      ASN   6 -16.015  -4.887  21.244
   39    H    ASP   7           H        ASP   7 -13.550 -10.637  23.386
   40    HA   ASP   7           HA       ASP   7 -10.710 -10.058  23.948
   41   1HB   ASP   7          2HB       ASP   7 -12.418 -11.800  25.756
   42   2HB   ASP   7          1HB       ASP   7 -10.659 -11.686  25.835
   43    H    GLU   8           H        GLU   8 -13.270 -12.397  23.310
   44    HA   GLU   8           HA       GLU   8 -11.391 -14.430  22.349
   45   1HB   GLU   8          2HB       GLU   8 -13.788 -15.320  21.455
   46   2HB   GLU   8          1HB       GLU   8 -13.261 -15.547  23.117
   47   1HG   GLU   8          2HG       GLU   8 -14.510 -13.629  23.861
   48   2HG   GLU   8          1HG       GLU   8 -14.857 -13.141  22.202
   49    H    THR   9           H        THR   9 -11.811 -11.621  21.135
   50    HA   THR   9           HA       THR   9 -12.635 -12.286  18.380
   51    HB   THR   9           HB       THR   9 -13.351 -10.128  19.166
   52    HG1  THR   9           1HG      THR   9 -11.233  -9.137  17.776
   53   1HG2  THR   9          1HG2      THR   9 -10.450  -9.771  19.948
   54   2HG2  THR   9          2HG2      THR   9 -11.857  -9.777  21.012
   55   3HG2  THR   9          3HG2      THR   9 -11.605  -8.439  19.891
   56    H    GLY  10           H        GLY  10 -10.285 -13.591  19.492
   57   1HA   GLY  10          2HA       GLY  10  -8.158 -14.207  18.694
   58   2HA   GLY  10          1HA       GLY  10  -8.461 -13.178  17.293
   59    H    ASN  11           H        ASN  11  -7.963 -12.674  20.797
   60    HA   ASN  11           HA       ASN  11  -6.431 -10.215  20.228
   61   1HB   ASN  11          2HB       ASN  11  -6.479  -9.881  22.646
   62   2HB   ASN  11          1HB       ASN  11  -8.103 -10.280  22.087
   63   1HD2  ASN  11          1HD2      ASN  11  -6.180 -10.914  24.630
   64   2HD2  ASN  11          2HD2      ASN  11  -6.609 -12.522  24.963
   65    H    ASP  12           H        ASP  12  -5.784 -13.433  20.277
   66    HA   ASP  12           HA       ASP  12  -3.180 -13.246  21.675
   67   1HB   ASP  12          2HB       ASP  12  -4.694 -15.253  21.931
   68   2HB   ASP  12          1HB       ASP  12  -4.396 -15.616  20.231
   69    H    ASN  13           H        ASN  13  -4.333 -12.454  18.696
   70    HA   ASN  13           HA       ASN  13  -1.635 -12.575  17.522
   71   1HB   ASN  13          2HB       ASN  13  -2.453 -13.733  15.456
   72   2HB   ASN  13          1HB       ASN  13  -2.469 -14.769  16.884
   73   1HD2  ASN  13          1HD2      ASN  13  -4.187 -15.233  14.602
   74   2HD2  ASN  13          2HD2      ASN  13  -5.792 -15.000  15.106
   75    H    GLY  14           H        GLY  14  -5.032 -11.678  17.247
   76   1HA   GLY  14          2HA       GLY  14  -6.011  -9.766  16.293
   77   2HA   GLY  14          1HA       GLY  14  -4.401  -9.043  16.307
   78    H    LYS  15           H        LYS  15  -4.251 -11.976  14.693
   79    HA   LYS  15           HA       LYS  15  -5.163 -11.005  12.082
   80   1HB   LYS  15          2HB       LYS  15  -2.837 -11.352  11.080
   81   2HB   LYS  15          1HB       LYS  15  -3.084  -9.880  12.010
   82   1HG   LYS  15          2HG       LYS  15  -2.207 -11.913  13.864
   83   2HG   LYS  15          1HG       LYS  15  -1.140 -11.983  12.469
   84   1HD   LYS  15          2HD       LYS  15  -1.806  -9.386  13.881
   85   2HD   LYS  15          1HD       LYS  15  -0.429 -10.393  14.322
   86   1HE   LYS  15          2HE       LYS  15   0.640 -10.065  12.248
   87   2HE   LYS  15          1HE       LYS  15  -0.845  -9.533  11.460
   88   1HZ   LYS  15          1HZ       LYS  15  -0.229  -7.876  13.676
   89   2HZ   LYS  15          2HZ       LYS  15  -0.439  -7.454  12.044
   90   3HZ   LYS  15          3HZ       LYS  15   1.087  -7.942  12.608
   91    H    GLY  16           H        GLY  16  -2.527 -13.299  12.759
   92   1HA   GLY  16          2HA       GLY  16  -2.407 -15.606  12.321
   93   2HA   GLY  16          1HA       GLY  16  -4.093 -15.669  12.845
   94    H    GLY  17           H        GLY  17  -2.591 -14.002  10.078
   95   1HA   GLY  17          2HA       GLY  17  -3.821 -15.831   8.160
   96   2HA   GLY  17          1HA       GLY  17  -4.558 -14.227   8.203
   97    H    GLU  18           H        GLU  18  -1.150 -14.843   8.828
   98    HA   GLU  18           HA       GLU  18  -0.421 -12.950   6.703
   99   1HB   GLU  18          2HB       GLU  18   1.121 -14.500   8.793
  100   2HB   GLU  18          1HB       GLU  18   1.953 -13.626   7.505
  101   1HG   GLU  18          2HG       GLU  18   1.196 -11.532   8.249
  102   2HG   GLU  18          1HG       GLU  18  -0.145 -12.226   9.160
  103    H    LYS  19           H        LYS  19  -1.292 -16.081   6.783
  104    HA   LYS  19           HA       LYS  19  -0.918 -17.949   5.414
  105   1HB   LYS  19          2HB       LYS  19  -1.922 -16.272   3.865
  106   2HB   LYS  19          1HB       LYS  19  -0.299 -15.765   3.407
  107   1HG   LYS  19          2HG       LYS  19  -1.148 -17.351   1.761
  108   2HG   LYS  19          1HG       LYS  19   0.186 -18.084   2.648
  109   1HD   LYS  19          2HD       LYS  19  -1.193 -19.584   3.771
  110   2HD   LYS  19          1HD       LYS  19  -2.591 -18.513   3.709
  111   1HE   LYS  19          2HE       LYS  19  -1.556 -19.590   1.108
  112   2HE   LYS  19          1HE       LYS  19  -2.447 -20.686   2.163
  113   1HZ   LYS  19          1HZ       LYS  19  -4.290 -19.770   1.389
  114   2HZ   LYS  19          2HZ       LYS  19  -3.426 -18.573   0.548
  115   3HZ   LYS  19          3HZ       LYS  19  -3.865 -18.327   2.170
  116    H    ALA  20           H        ALA  20   1.469 -15.984   3.675
  117    HA   ALA  20           HA       ALA  20   3.791 -16.276   3.437
  118   1HB   ALA  20          1HB       ALA  20   5.029 -16.895   5.305
  119   2HB   ALA  20          2HB       ALA  20   3.905 -18.174   5.762
  120   3HB   ALA  20          3HB       ALA  20   3.498 -16.488   6.079
  121    H    ASP  21           H        ASP  21   1.856 -17.943   2.128
  122    HA   ASP  21           HA       ASP  21   2.907 -20.683   2.165
  123   1HB   ASP  21          2HB       ASP  21   0.513 -20.388   1.856
  124   2HB   ASP  21          1HB       ASP  21   0.786 -19.330   0.472
  125    H    ASN  22           H        ASN  22   2.113 -18.849  -0.733
  126    HA   ASN  22           HA       ASN  22   4.888 -18.662  -1.609
  127   1HB   ASN  22          2HB       ASN  22   4.067 -21.123  -1.957
  128   2HB   ASN  22          1HB       ASN  22   3.150 -20.442  -3.297
  129   1HD2  ASN  22          1HD2      ASN  22   5.106 -18.418  -4.054
  130   2HD2  ASN  22          2HD2      ASN  22   6.444 -19.233  -4.704
  131    H    ALA  23           H        ALA  23   4.423 -16.518  -2.074
  132    HA   ALA  23           HA       ALA  23   3.906 -14.786  -3.589
  133   1HB   ALA  23          1HB       ALA  23   3.237 -15.295  -5.749
  134   2HB   ALA  23          2HB       ALA  23   2.083 -16.521  -5.224
  135   3HB   ALA  23          3HB       ALA  23   3.806 -16.886  -5.249
  136    H    ALA  24           H        ALA  24   1.515 -16.851  -2.151
  137    HA   ALA  24           HA       ALA  24  -0.785 -15.190  -2.605
  138   1HB   ALA  24          1HB       ALA  24  -1.709 -16.357  -0.586
  139   2HB   ALA  24          2HB       ALA  24  -0.126 -17.093  -0.336
  140   3HB   ALA  24          3HB       ALA  24  -1.054 -17.473  -1.785
  141    H    GLN  25           H        GLN  25   1.490 -15.430   0.114
  142    HA   GLN  25           HA       GLN  25   0.436 -13.297   1.666
  143   1HB   GLN  25          2HB       GLN  25   2.346 -13.552   2.985
  144   2HB   GLN  25          1HB       GLN  25   2.258 -15.111   2.171
  145   1HG   GLN  25          2HG       GLN  25   4.513 -14.544   1.863
  146   2HG   GLN  25          1HG       GLN  25   3.789 -13.974   0.364
  147   1HE2  GLN  25          1HE2      GLN  25   5.876 -12.527   0.525
  148   2HE2  GLN  25          2HE2      GLN  25   5.700 -11.049   1.342
  149    H    VAL  26           H        VAL  26   2.417 -13.251  -1.212
  150    HA   VAL  26           HA       VAL  26   3.366 -10.541  -0.869
  151    HB   VAL  26           HB       VAL  26   3.073 -12.267  -3.343
  152   1HG1  VAL  26          1HG1      VAL  26   3.082  -9.999  -4.108
  153   2HG1  VAL  26          2HG1      VAL  26   4.742 -10.569  -4.276
  154   3HG1  VAL  26          3HG1      VAL  26   4.300  -9.532  -2.920
  155   1HG2  VAL  26          1HG2      VAL  26   5.493 -11.480  -1.689
  156   2HG2  VAL  26          2HG2      VAL  26   5.490 -12.552  -3.089
  157   3HG2  VAL  26          3HG2      VAL  26   4.678 -13.042  -1.600
  158    H    LYS  27           H        LYS  27   0.552 -12.003  -2.473
  159    HA   LYS  27           HA       LYS  27  -0.381  -9.579  -3.688
  160   1HB   LYS  27          2HB       LYS  27  -1.843 -12.086  -2.808
  161   2HB   LYS  27          1HB       LYS  27  -2.607 -10.783  -3.718
  162   1HG   LYS  27          2HG       LYS  27  -1.303 -11.174  -5.631
  163   2HG   LYS  27          1HG       LYS  27  -0.053 -12.026  -4.731
  164   1HD   LYS  27          2HD       LYS  27  -1.432 -13.574  -6.095
  165   2HD   LYS  27          1HD       LYS  27  -1.560 -13.919  -4.374
  166   1HE   LYS  27          2HE       LYS  27  -3.768 -13.940  -5.565
  167   2HE   LYS  27          1HE       LYS  27  -3.696 -12.779  -4.240
  168   1HZ   LYS  27          1HZ       LYS  27  -2.762 -11.589  -6.625
  169   2HZ   LYS  27          2HZ       LYS  27  -4.080 -11.136  -5.653
  170   3HZ   LYS  27          3HZ       LYS  27  -4.289 -12.274  -6.899
  171    H    ASP  28           H        ASP  28  -1.302 -11.151  -0.598
  172    HA   ASP  28           HA       ASP  28  -3.143  -9.157   0.238
  173   1HB   ASP  28          2HB       ASP  28  -1.260 -10.781   1.976
  174   2HB   ASP  28          1HB       ASP  28  -2.732  -9.973   2.517
  175    H    ALA  29           H        ALA  29   0.364  -9.302   0.348
  176    HA   ALA  29           HA       ALA  29   0.786  -7.024   2.043
  177   1HB   ALA  29          1HB       ALA  29   2.451  -8.889   1.351
  178   2HB   ALA  29          2HB       ALA  29   3.068  -7.237   1.455
  179   3HB   ALA  29          3HB       ALA  29   2.684  -7.937  -0.118
  180    H    LEU  30           H        LEU  30   0.860  -7.387  -1.509
  181    HA   LEU  30           HA       LEU  30   1.312  -4.645  -2.006
  182   1HB   LEU  30          2HB       LEU  30  -0.221  -6.607  -3.711
  183   2HB   LEU  30          1HB       LEU  30   0.468  -5.087  -4.265
  184    HG   LEU  30           HG       LEU  30   2.186  -7.192  -2.948
  185   1HD1  LEU  30          1HD1      LEU  30   1.225  -8.368  -4.808
  186   2HD1  LEU  30          2HD1      LEU  30   2.818  -7.832  -5.334
  187   3HD1  LEU  30          3HD1      LEU  30   1.374  -6.962  -5.857
  188   1HD2  LEU  30          1HD2      LEU  30   3.279  -5.075  -3.132
  189   2HD2  LEU  30          2HD2      LEU  30   2.689  -4.831  -4.774
  190   3HD2  LEU  30          3HD2      LEU  30   3.908  -6.061  -4.447
  191    H    THR  31           H        THR  31  -1.748  -6.441  -1.716
  192    HA   THR  31           HA       THR  31  -3.487  -4.234  -2.209
  193    HB   THR  31           HB       THR  31  -5.082  -5.612  -0.691
  194    HG1  THR  31           1HG      THR  31  -2.702  -7.079  -0.672
  195   1HG2  THR  31          1HG2      THR  31  -5.114  -5.747  -3.142
  196   2HG2  THR  31          2HG2      THR  31  -5.335  -7.348  -2.439
  197   3HG2  THR  31          3HG2      THR  31  -3.770  -6.888  -3.107
  198    H    LYS  32           H        LYS  32  -1.800  -5.290   0.712
  199    HA   LYS  32           HA       LYS  32  -3.152  -3.613   2.575
  200   1HB   LYS  32          2HB       LYS  32  -1.571  -5.428   3.216
  201   2HB   LYS  32          1HB       LYS  32  -0.236  -4.468   2.588
  202   1HG   LYS  32          2HG       LYS  32  -2.010  -3.103   4.578
  203   2HG   LYS  32          1HG       LYS  32  -1.008  -4.406   5.205
  204   1HD   LYS  32          2HD       LYS  32   0.991  -3.287   4.140
  205   2HD   LYS  32          1HD       LYS  32  -0.055  -1.920   3.752
  206   1HE   LYS  32          2HE       LYS  32   1.138  -1.522   5.866
  207   2HE   LYS  32          1HE       LYS  32  -0.598  -1.664   6.152
  208   1HZ   LYS  32          1HZ       LYS  32   1.047  -2.977   7.626
  209   2HZ   LYS  32          2HZ       LYS  32   1.116  -4.052   6.312
  210   3HZ   LYS  32          3HZ       LYS  32  -0.366  -3.739   7.081
  211    H    MET  33           H        MET  33  -0.163  -3.069   0.688
  212    HA   MET  33           HA       MET  33   0.223  -0.364   1.536
  213   1HB   MET  33          2HB       MET  33   0.950  -1.594  -1.140
  214   2HB   MET  33          1HB       MET  33   1.639  -0.120  -0.455
  215   1HG   MET  33          2HG       MET  33   2.250  -1.659   1.581
  216   2HG   MET  33          1HG       MET  33   2.019  -2.975   0.431
  217   1HE   MET  33          1HE       MET  33   5.743  -3.112   0.175
  218   2HE   MET  33          2HE       MET  33   4.213  -3.980   0.068
  219   3HE   MET  33          3HE       MET  33   4.633  -3.128   1.552
  220    H    ARG  34           H        ARG  34  -1.810  -1.753  -1.006
  221    HA   ARG  34           HA       ARG  34  -2.419   0.634  -2.426
  222   1HB   ARG  34          2HB       ARG  34  -3.128  -1.507  -3.314
  223   2HB   ARG  34          1HB       ARG  34  -4.119  -1.817  -1.896
  224   1HG   ARG  34          2HG       ARG  34  -5.662  -0.097  -2.460
  225   2HG   ARG  34          1HG       ARG  34  -4.578   0.574  -3.682
  226   1HD   ARG  34          2HD       ARG  34  -4.800  -1.562  -4.973
  227   2HD   ARG  34          1HD       ARG  34  -5.992  -2.108  -3.794
  228    HE   ARG  34           HE       ARG  34  -6.655   0.487  -4.940
  229   1HH1  ARG  34          1HH2      ARG  34  -6.747  -2.943  -5.297
  230   2HH1  ARG  34          2HH2      ARG  34  -8.138  -2.933  -6.329
  231   1HH2  ARG  34          1HH1      ARG  34  -8.478   0.518  -6.291
  232   2HH2  ARG  34          2HH1      ARG  34  -9.116  -0.977  -6.891
  233    H    ALA  35           H        ALA  35  -4.401  -0.880   0.156
  234    HA   ALA  35           HA       ALA  35  -6.189   1.318   0.403
  235   1HB   ALA  35          1HB       ALA  35  -6.618   0.404   2.718
  236   2HB   ALA  35          2HB       ALA  35  -5.316  -0.751   2.432
  237   3HB   ALA  35          3HB       ALA  35  -6.762  -0.784   1.423
  238    H    ALA  36           H        ALA  36  -2.961   0.848   1.686
  239    HA   ALA  36           HA       ALA  36  -3.012   2.802   3.757
  240   1HB   ALA  36          1HB       ALA  36  -0.665   2.265   1.929
  241   2HB   ALA  36          2HB       ALA  36  -1.129   1.175   3.237
  242   3HB   ALA  36          3HB       ALA  36  -0.621   2.824   3.601
  243    H    ALA  37           H        ALA  37  -2.209   3.122   0.291
  244    HA   ALA  37           HA       ALA  37  -1.642   5.911   0.355
  245   1HB   ALA  37          1HB       ALA  37  -1.294   4.178  -1.555
  246   2HB   ALA  37          2HB       ALA  37  -1.724   5.829  -2.000
  247   3HB   ALA  37          3HB       ALA  37  -2.954   4.565  -2.008
  248    H    LEU  38           H        LEU  38  -4.692   4.204  -0.431
  249    HA   LEU  38           HA       LEU  38  -6.214   6.635  -0.713
  250   1HB   LEU  38          2HB       LEU  38  -7.328   3.951   0.116
  251   2HB   LEU  38          1HB       LEU  38  -8.159   5.239  -0.749
  252    HG   LEU  38           HG       LEU  38  -5.784   3.688  -1.827
  253   1HD1  LEU  38          1HD1      LEU  38  -7.831   2.304  -1.615
  254   2HD1  LEU  38          2HD1      LEU  38  -7.424   2.608  -3.303
  255   3HD1  LEU  38          3HD1      LEU  38  -8.730   3.512  -2.533
  256   1HD2  LEU  38          1HD2      LEU  38  -6.665   4.787  -3.994
  257   2HD2  LEU  38          2HD2      LEU  38  -5.807   5.831  -2.860
  258   3HD2  LEU  38          3HD2      LEU  38  -7.568   5.868  -2.933
  259    H    ASP  39           H        ASP  39  -5.866   4.338   2.017
  260    HA   ASP  39           HA       ASP  39  -7.558   5.739   3.814
  261   1HB   ASP  39          2HB       ASP  39  -6.387   3.455   4.135
  262   2HB   ASP  39          1HB       ASP  39  -4.989   4.392   4.673
  263    H    ALA  40           H        ALA  40  -4.237   6.280   2.826
  264    HA   ALA  40           HA       ALA  40  -3.643   8.274   4.824
  265   1HB   ALA  40          1HB       ALA  40  -1.727   8.818   3.305
  266   2HB   ALA  40          2HB       ALA  40  -2.395   7.695   2.123
  267   3HB   ALA  40          3HB       ALA  40  -1.836   7.100   3.686
  268    H    GLN  41           H        GLN  41  -5.477   8.281   1.917
  269    HA   GLN  41           HA       GLN  41  -5.089  11.027   1.186
  270   1HB   GLN  41          2HB       GLN  41  -6.691  10.633  -0.472
  271   2HB   GLN  41          1HB       GLN  41  -6.078   9.013  -0.178
  272   1HG   GLN  41          2HG       GLN  41  -8.158   9.130   1.649
  273   2HG   GLN  41          1HG       GLN  41  -8.789  10.134   0.351
  274   1HE2  GLN  41          1HE2      GLN  41  -7.612   8.690  -1.894
  275   2HE2  GLN  41          2HE2      GLN  41  -8.355   7.170  -1.955
  276    H    LYS  42           H        LYS  42  -7.963  11.573   0.978
  277    HA   LYS  42           HA       LYS  42  -8.295  13.061   3.435
  278   1HB   LYS  42          2HB       LYS  42 -10.451  12.441   1.398
  279   2HB   LYS  42          1HB       LYS  42 -10.372  13.819   2.494
  280   1HG   LYS  42          2HG       LYS  42  -8.441  14.717   1.318
  281   2HG   LYS  42          1HG       LYS  42  -8.339  13.282   0.305
  282   1HD   LYS  42          2HD       LYS  42  -9.446  14.823  -1.079
  283   2HD   LYS  42          1HD       LYS  42 -10.765  13.865  -0.416
  284   1HE   LYS  42          2HE       LYS  42 -11.245  15.581   1.242
  285   2HE   LYS  42          1HE       LYS  42  -9.833  16.512   0.740
  286   1HZ   LYS  42          1HZ       LYS  42 -12.428  16.250  -0.528
  287   2HZ   LYS  42          2HZ       LYS  42 -11.097  16.220  -1.583
  288   3HZ   LYS  42          3HZ       LYS  42 -11.335  17.546  -0.547
  289    H    ALA  43           H        ALA  43  -7.904  10.594   4.361
  290    HA   ALA  43           HA       ALA  43 -10.590   9.796   5.399
  291   1HB   ALA  43          1HB       ALA  43  -8.555   7.750   4.490
  292   2HB   ALA  43          2HB       ALA  43  -9.877   8.295   3.459
  293   3HB   ALA  43          3HB       ALA  43 -10.227   7.468   4.977
  294    H    THR  44           H        THR  44  -7.100   9.107   5.608
  295    HA   THR  44           HA       THR  44  -7.280   9.346   8.579
  296    HB   THR  44           HB       THR  44  -5.487   7.391   7.112
  297    HG1  THR  44           1HG      THR  44  -7.445   6.253   8.549
  298   1HG2  THR  44          1HG2      THR  44  -5.189   6.426   9.328
  299   2HG2  THR  44          2HG2      THR  44  -6.364   7.552  10.008
  300   3HG2  THR  44          3HG2      THR  44  -4.821   8.149   9.397
  301    HA   PRO  45           HA       PRO  45  -4.497  12.407   6.131
  302   1HB   PRO  45          2HB       PRO  45  -5.254  13.601   8.793
  303   2HB   PRO  45          1HB       PRO  45  -4.964  14.417   7.241
  304   1HG   PRO  45          2HG       PRO  45  -7.447  13.857   8.113
  305   2HG   PRO  45          1HG       PRO  45  -7.020  13.833   6.392
  306   1HD   PRO  45          2HD       PRO  45  -7.710  11.564   8.139
  307   2HD   PRO  45          1HD       PRO  45  -7.591  11.613   6.366
  308    HA   PRO  46           HA       PRO  46  -1.343  10.202   8.750
  309   1HB   PRO  46          2HB       PRO  46   0.397  11.288   6.568
  310   2HB   PRO  46          1HB       PRO  46   0.318   9.643   7.231
  311   1HG   PRO  46          2HG       PRO  46  -0.717  10.258   4.841
  312   2HG   PRO  46          1HG       PRO  46  -1.472   9.054   5.906
  313   1HD   PRO  46          2HD       PRO  46  -2.340  11.854   5.305
  314   2HD   PRO  46          1HD       PRO  46  -3.323  10.425   5.685
  315    H    LYS  47           H        LYS  47  -0.400  13.197   7.029
  316    HA   LYS  47           HA       LYS  47  -0.001  14.567   9.611
  317   1HB   LYS  47          2HB       LYS  47   2.317  15.303   8.828
  318   2HB   LYS  47          1HB       LYS  47   2.192  13.628   9.361
  319   1HG   LYS  47          2HG       LYS  47   2.051  12.838   7.084
  320   2HG   LYS  47          1HG       LYS  47   1.939  14.482   6.465
  321   1HD   LYS  47          2HD       LYS  47   4.333  13.693   8.118
  322   2HD   LYS  47          1HD       LYS  47   4.259  13.208   6.427
  323   1HE   LYS  47          2HE       LYS  47   4.050  16.051   7.468
  324   2HE   LYS  47          1HE       LYS  47   5.433  15.349   6.631
  325   1HZ   LYS  47          1HZ       LYS  47   4.282  16.438   4.962
  326   2HZ   LYS  47          2HZ       LYS  47   2.758  15.987   5.564
  327   3HZ   LYS  47          3HZ       LYS  47   3.746  14.837   4.796
  328    H    LEU  48           H        LEU  48  -1.700  14.762   7.141
  329    HA   LEU  48           HA       LEU  48  -0.831  17.192   5.785
  330   1HB   LEU  48          2HB       LEU  48  -3.587  15.913   5.980
  331   2HB   LEU  48          1HB       LEU  48  -3.148  17.202   4.864
  332    HG   LEU  48           HG       LEU  48  -1.693  14.542   4.913
  333   1HD1  LEU  48          1HD1      LEU  48  -3.136  13.803   3.082
  334   2HD1  LEU  48          2HD1      LEU  48  -4.027  15.323   3.137
  335   3HD1  LEU  48          3HD1      LEU  48  -4.132  14.192   4.485
  336   1HD2  LEU  48          1HD2      LEU  48  -1.899  16.851   2.960
  337   2HD2  LEU  48          2HD2      LEU  48  -1.291  15.268   2.482
  338   3HD2  LEU  48          3HD2      LEU  48  -0.449  16.196   3.720
  339    H    GLU  49           H        GLU  49  -4.004  17.079   7.241
  340    HA   GLU  49           HA       GLU  49  -5.084  18.681   8.585
  341   1HB   GLU  49          2HB       GLU  49  -3.641  17.134  10.110
  342   2HB   GLU  49          1HB       GLU  49  -2.598  18.545  10.292
  343   1HG   GLU  49          2HG       GLU  49  -4.777  19.824  10.891
  344   2HG   GLU  49          1HG       GLU  49  -5.492  18.227  11.101
  345    H    ASP  50           H        ASP  50  -3.188  19.777   6.498
  346    HA   ASP  50           HA       ASP  50  -3.332  22.526   7.334
  347   1HB   ASP  50          2HB       ASP  50  -1.275  21.473   8.616
  348   2HB   ASP  50          1HB       ASP  50  -0.467  21.615   7.058
  349    H    LYS  51           H        LYS  51  -3.839  20.655   5.029
  350    HA   LYS  51           HA       LYS  51  -2.712  22.443   2.946
  351   1HB   LYS  51          2HB       LYS  51  -2.244  19.462   3.103
  352   2HB   LYS  51          1HB       LYS  51  -2.181  20.326   1.568
  353   1HG   LYS  51          2HG       LYS  51  -0.482  21.880   2.587
  354   2HG   LYS  51          1HG       LYS  51  -0.466  20.843   4.014
  355   1HD   LYS  51          2HD       LYS  51   0.182  18.919   2.578
  356   2HD   LYS  51          1HD       LYS  51   0.237  20.005   1.188
  357   1HE   LYS  51          2HE       LYS  51   2.492  19.812   2.002
  358   2HE   LYS  51          1HE       LYS  51   1.911  21.407   2.480
  359   1HZ   LYS  51          1HZ       LYS  51   3.060  20.108   4.261
  360   2HZ   LYS  51          2HZ       LYS  51   1.748  19.030   4.243
  361   3HZ   LYS  51          3HZ       LYS  51   1.508  20.658   4.667
  362    H    SER  52           H        SER  52  -4.612  19.370   3.160
  363    HA   SER  52           HA       SER  52  -6.679  18.887   2.097
  364   1HB   SER  52          2HB       SER  52  -6.947  21.183   3.596
  365   2HB   SER  52          1HB       SER  52  -7.487  21.748   2.025
  366    HG   SER  52           HG       SER  52  -9.287  20.812   2.607
  367    HA   PRO  53           HA       PRO  53  -6.574  19.824  -2.235
  368   1HB   PRO  53          2HB       PRO  53  -9.083  21.464  -2.171
  369   2HB   PRO  53          1HB       PRO  53  -8.698  20.034  -3.153
  370   1HG   PRO  53          2HG       PRO  53 -10.333  19.797  -1.107
  371   2HG   PRO  53          1HG       PRO  53  -9.083  18.567  -1.387
  372   1HD   PRO  53          2HD       PRO  53  -9.067  20.813   0.611
  373   2HD   PRO  53          1HD       PRO  53  -8.612  19.104   0.828
  374    H    ASP  54           H        ASP  54  -4.893  21.480  -1.043
  375    HA   ASP  54           HA       ASP  54  -5.299  24.161  -2.301
  376   1HB   ASP  54          2HB       ASP  54  -5.422  24.328   0.157
  377   2HB   ASP  54          1HB       ASP  54  -3.868  23.498   0.299
  378    H    SER  55           H        SER  55  -3.922  24.201  -4.025
  379    HA   SER  55           HA       SER  55  -1.845  24.310  -5.111
  380   1HB   SER  55          2HB       SER  55  -0.358  22.898  -2.933
  381   2HB   SER  55          1HB       SER  55   0.100  24.328  -3.858
  382    HG   SER  55           HG       SER  55  -0.429  25.230  -2.011
  383    HA   PRO  56           HA       PRO  56  -1.183  20.324  -6.997
  384   1HB   PRO  56          2HB       PRO  56   1.447  19.780  -5.649
  385   2HB   PRO  56          1HB       PRO  56   1.018  19.677  -7.370
  386   1HG   PRO  56          2HG       PRO  56   2.414  21.727  -6.488
  387   2HG   PRO  56          1HG       PRO  56   1.096  21.989  -7.649
  388   1HD   PRO  56          2HD       PRO  56   1.123  22.480  -4.684
  389   2HD   PRO  56          1HD       PRO  56   0.409  23.469  -5.983
  390    H    GLU  57           H        GLU  57  -1.496  20.517  -3.701
  391    HA   GLU  57           HA       GLU  57  -0.992  17.975  -2.643
  392   1HB   GLU  57          2HB       GLU  57  -1.919  19.694  -1.209
  393   2HB   GLU  57          1HB       GLU  57  -3.380  19.796  -2.192
  394   1HG   GLU  57          2HG       GLU  57  -3.683  18.494  -0.068
  395   2HG   GLU  57          1HG       GLU  57  -4.055  17.559  -1.513
  396    H    MET  58           H        MET  58  -3.637  19.018  -4.734
  397    HA   MET  58           HA       MET  58  -5.127  16.563  -4.710
  398   1HB   MET  58          2HB       MET  58  -4.930  18.868  -6.660
  399   2HB   MET  58          1HB       MET  58  -5.978  17.483  -6.965
  400   1HG   MET  58          2HG       MET  58  -7.407  18.005  -5.205
  401   2HG   MET  58          1HG       MET  58  -6.155  18.851  -4.297
  402   1HE   MET  58          1HE       MET  58  -9.327  19.568  -6.625
  403   2HE   MET  58          2HE       MET  58  -8.085  18.589  -7.400
  404   3HE   MET  58          3HE       MET  58  -8.411  20.213  -7.995
  405    H    LYS  59           H        LYS  59  -2.888  17.850  -7.222
  406    HA   LYS  59           HA       LYS  59  -2.902  15.464  -8.768
  407   1HB   LYS  59          2HB       LYS  59  -0.572  17.373  -8.612
  408   2HB   LYS  59          1HB       LYS  59  -1.076  16.383  -9.981
  409   1HG   LYS  59          2HG       LYS  59  -3.183  17.681 -10.133
  410   2HG   LYS  59          1HG       LYS  59  -2.647  18.680  -8.782
  411   1HD   LYS  59          2HD       LYS  59  -1.931  20.001 -10.549
  412   2HD   LYS  59          1HD       LYS  59  -0.491  19.017 -10.295
  413   1HE   LYS  59          2HE       LYS  59  -0.903  18.960 -12.647
  414   2HE   LYS  59          1HE       LYS  59  -1.461  17.405 -12.035
  415   1HZ   LYS  59          1HZ       LYS  59  -3.023  18.560 -13.579
  416   2HZ   LYS  59          2HZ       LYS  59  -3.242  19.747 -12.383
  417   3HZ   LYS  59          3HZ       LYS  59  -3.693  18.137 -12.080
  418    H    ASP  60           H        ASP  60  -0.339  16.572  -6.482
  419    HA   ASP  60           HA       ASP  60   1.268  14.263  -6.731
  420   1HB   ASP  60          2HB       ASP  60   1.915  16.248  -5.321
  421   2HB   ASP  60          1HB       ASP  60   0.750  15.691  -4.119
  422    H    PHE  61           H        PHE  61  -1.731  14.734  -4.935
  423    HA   PHE  61           HA       PHE  61  -1.593  12.203  -3.546
  424   1HB   PHE  61          2HB       PHE  61  -3.086  13.694  -2.534
  425   2HB   PHE  61          1HB       PHE  61  -3.699  14.285  -4.073
  426    HD1  PHE  61           1HD      PHE  61  -6.036  13.994  -3.701
  427    HD2  PHE  61           2HD      PHE  61  -3.335  10.710  -3.118
  428    HE1  PHE  61           1HE      PHE  61  -7.958  12.451  -3.536
  429    HE2  PHE  61           2HE      PHE  61  -5.260   9.150  -2.958
  430    HZ   PHE  61           HZ       PHE  61  -7.576  10.023  -3.162
  431    H    ARG  62           H        ARG  62  -3.410  13.388  -6.378
  432    HA   ARG  62           HA       ARG  62  -4.372  10.841  -7.146
  433   1HB   ARG  62          2HB       ARG  62  -3.833  13.308  -8.798
  434   2HB   ARG  62          1HB       ARG  62  -4.673  11.880  -9.404
  435   1HG   ARG  62          2HG       ARG  62  -6.164  12.271  -7.192
  436   2HG   ARG  62          1HG       ARG  62  -5.598  13.924  -7.405
  437   1HD   ARG  62          2HD       ARG  62  -6.335  13.556  -9.895
  438   2HD   ARG  62          1HD       ARG  62  -7.327  12.271  -9.216
  439    HE   ARG  62           HE       ARG  62  -7.604  14.812  -7.802
  440   1HH1  ARG  62          1HH2      ARG  62  -8.591  12.831 -10.443
  441   2HH1  ARG  62          2HH2      ARG  62 -10.148  13.573 -10.596
  442   1HH2  ARG  62          1HH1      ARG  62  -9.644  15.797  -7.986
  443   2HH2  ARG  62          2HH1      ARG  62 -10.745  15.246  -9.204
  444    H    HIS  63           H        HIS  63  -1.622  12.705  -8.460
  445    HA   HIS  63           HA       HIS  63  -0.600  10.530 -10.024
  446   1HB   HIS  63          2HB       HIS  63  -0.069  13.160  -9.959
  447   2HB   HIS  63          1HB       HIS  63   1.252  12.630  -8.924
  448    HD1  HIS  63           1HD      HIS  63   1.911  13.814 -11.661
  449    HD2  HIS  63           2HD      HIS  63   1.334   9.731 -11.042
  450    HE1  HIS  63           1HE      HIS  63   3.086  12.628 -13.565
  451    H    GLY  64           H        GLY  64  -0.449  11.239  -6.631
  452   1HA   GLY  64          2HA       GLY  64   1.969   9.676  -6.118
  453   2HA   GLY  64          1HA       GLY  64   0.887  10.329  -4.888
  454    H    PHE  65           H        PHE  65  -1.451   9.153  -5.127
  455    HA   PHE  65           HA       PHE  65  -0.956   6.422  -4.409
  456   1HB   PHE  65          2HB       PHE  65  -3.174   6.357  -3.760
  457   2HB   PHE  65          1HB       PHE  65  -2.995   8.102  -3.862
  458    HD1  PHE  65           1HD      PHE  65  -4.373   9.355  -5.340
  459    HD2  PHE  65           2HD      PHE  65  -4.042   5.110  -5.815
  460    HE1  PHE  65           1HE      PHE  65  -6.192   9.402  -7.026
  461    HE2  PHE  65           2HE      PHE  65  -5.850   5.152  -7.510
  462    HZ   PHE  65           HZ       PHE  65  -6.928   7.300  -8.114
  463    H    ASP  66           H        ASP  66  -1.397   7.970  -7.437
  464    HA   ASP  66           HA       ASP  66  -2.432   5.699  -8.905
  465   1HB   ASP  66          2HB       ASP  66  -2.607   7.950  -9.838
  466   2HB   ASP  66          1HB       ASP  66  -0.849   8.113  -9.828
  467    H    ILE  67           H        ILE  67   0.820   7.016  -8.375
  468    HA   ILE  67           HA       ILE  67   2.221   5.052  -9.894
  469    HB   ILE  67           HB       ILE  67   3.074   6.627  -7.447
  470   1HG1  ILE  67          2HG1      ILE  67   3.855   7.114 -10.328
  471   2HG1  ILE  67          1HG1      ILE  67   2.350   7.776  -9.682
  472   1HG2  ILE  67          1HG2      ILE  67   4.608   4.864  -9.368
  473   2HG2  ILE  67          2HG2      ILE  67   4.602   4.810  -7.606
  474   3HG2  ILE  67          3HG2      ILE  67   5.399   6.139  -8.442
  475   1HD1  ILE  67          1HD1      ILE  67   4.237   9.387  -9.494
  476   2HD1  ILE  67          2HD1      ILE  67   5.103   8.230  -8.483
  477   3HD1  ILE  67          3HD1      ILE  67   3.591   8.938  -7.915
  478    H    LEU  68           H        LEU  68   1.416   5.177  -6.423
  479    HA   LEU  68           HA       LEU  68   2.477   2.644  -5.702
  480   1HB   LEU  68          2HB       LEU  68   0.272   4.389  -4.616
  481   2HB   LEU  68          1HB       LEU  68   0.524   2.781  -3.935
  482    HG   LEU  68           HG       LEU  68   2.874   4.655  -4.242
  483   1HD1  LEU  68          1HD1      LEU  68   1.085   5.918  -3.050
  484   2HD1  LEU  68          2HD1      LEU  68   2.462   5.554  -2.011
  485   3HD1  LEU  68          3HD1      LEU  68   0.983   4.605  -1.874
  486   1HD2  LEU  68          1HD2      LEU  68   2.151   2.423  -2.312
  487   2HD2  LEU  68          2HD2      LEU  68   3.617   3.395  -2.203
  488   3HD2  LEU  68          3HD2      LEU  68   3.358   2.348  -3.595
  489    H    VAL  69           H        VAL  69  -0.821   3.545  -6.737
  490    HA   VAL  69           HA       VAL  69  -1.799   0.845  -6.800
  491    HB   VAL  69           HB       VAL  69  -2.674   3.464  -8.016
  492   1HG1  VAL  69          1HG1      VAL  69  -3.715   0.719  -8.725
  493   2HG1  VAL  69          2HG1      VAL  69  -3.255   2.031  -9.812
  494   3HG1  VAL  69          3HG1      VAL  69  -4.728   2.160  -8.851
  495   1HG2  VAL  69          1HG2      VAL  69  -4.673   3.017  -6.636
  496   2HG2  VAL  69          2HG2      VAL  69  -3.206   2.935  -5.660
  497   3HG2  VAL  69          3HG2      VAL  69  -4.005   1.452  -6.175
  498    H    GLY  70           H        GLY  70  -0.082   2.869  -9.107
  499   1HA   GLY  70          2HA       GLY  70  -0.398   1.217 -11.413
  500   2HA   GLY  70          1HA       GLY  70   0.888   2.392 -11.177
  501    H    GLN  71           H        GLN  71   2.075   1.128  -8.820
  502    HA   GLN  71           HA       GLN  71   3.507  -1.027 -10.237
  503   1HB   GLN  71          2HB       GLN  71   5.014  -0.958  -8.226
  504   2HB   GLN  71          1HB       GLN  71   4.880   0.591  -9.057
  505   1HG   GLN  71          2HG       GLN  71   2.980   1.093  -7.365
  506   2HG   GLN  71          1HG       GLN  71   3.617  -0.253  -6.452
  507   1HE2  GLN  71          1HE2      GLN  71   3.850   3.086  -6.740
  508   2HE2  GLN  71          2HE2      GLN  71   5.416   3.294  -6.107
  509    H    ILE  72           H        ILE  72   1.123  -0.646  -7.767
  510    HA   ILE  72           HA       ILE  72   1.462  -3.191  -6.475
  511    HB   ILE  72           HB       ILE  72  -0.823  -1.249  -6.795
  512   1HG1  ILE  72          2HG1      ILE  72   0.542  -2.219  -4.275
  513   2HG1  ILE  72          1HG1      ILE  72   1.217  -0.914  -5.251
  514   1HG2  ILE  72          1HG2      ILE  72  -0.935  -4.061  -5.763
  515   2HG2  ILE  72          2HG2      ILE  72  -2.175  -3.124  -6.586
  516   3HG2  ILE  72          3HG2      ILE  72  -1.838  -2.831  -4.881
  517   1HD1  ILE  72          1HD1      ILE  72  -0.240   0.569  -4.384
  518   2HD1  ILE  72          2HD1      ILE  72  -0.725  -0.683  -3.244
  519   3HD1  ILE  72          3HD1      ILE  72  -1.625  -0.465  -4.744
  520    H    ASP  73           H        ASP  73  -0.393  -2.083  -9.286
  521    HA   ASP  73           HA       ASP  73  -1.613  -4.642  -9.822
  522   1HB   ASP  73          2HB       ASP  73  -2.421  -2.464 -10.778
  523   2HB   ASP  73          1HB       ASP  73  -0.970  -2.411 -11.780
  524    H    ASP  74           H        ASP  74   1.301  -2.974 -11.037
  525    HA   ASP  74           HA       ASP  74   2.133  -5.025 -12.837
  526   1HB   ASP  74          2HB       ASP  74   4.056  -3.291 -11.308
  527   2HB   ASP  74          1HB       ASP  74   4.194  -3.898 -12.956
  528    H    ALA  75           H        ALA  75   2.842  -4.524  -9.379
  529    HA   ALA  75           HA       ALA  75   4.677  -6.748  -9.223
  530   1HB   ALA  75          1HB       ALA  75   4.524  -6.424  -6.794
  531   2HB   ALA  75          2HB       ALA  75   3.138  -5.357  -7.015
  532   3HB   ALA  75          3HB       ALA  75   4.727  -4.875  -7.613
  533    H    LEU  76           H        LEU  76   1.213  -6.360  -8.663
  534    HA   LEU  76           HA       LEU  76   0.838  -8.903  -7.395
  535   1HB   LEU  76          2HB       LEU  76  -0.819  -7.094  -7.249
  536   2HB   LEU  76          1HB       LEU  76  -1.124  -7.209  -8.978
  537    HG   LEU  76           HG       LEU  76  -1.397  -9.785  -7.494
  538   1HD1  LEU  76          1HD1      LEU  76  -3.681  -9.180  -6.672
  539   2HD1  LEU  76          2HD1      LEU  76  -3.324  -7.493  -7.040
  540   3HD1  LEU  76          3HD1      LEU  76  -2.386  -8.347  -5.815
  541   1HD2  LEU  76          1HD2      LEU  76  -2.000  -9.612  -9.860
  542   2HD2  LEU  76          2HD2      LEU  76  -3.124  -8.304  -9.503
  543   3HD2  LEU  76          3HD2      LEU  76  -3.446  -9.930  -8.905
  544    H    LYS  77           H        LYS  77   0.517  -7.906 -10.825
  545    HA   LYS  77           HA       LYS  77  -0.349 -10.452 -11.770
  546   1HB   LYS  77          2HB       LYS  77   0.704  -9.791 -13.954
  547   2HB   LYS  77          1HB       LYS  77  -0.370  -8.567 -13.316
  548   1HG   LYS  77          2HG       LYS  77   1.374  -7.153 -12.681
  549   2HG   LYS  77          1HG       LYS  77   2.557  -8.428 -12.655
  550   1HD   LYS  77          2HD       LYS  77   1.280  -7.274 -15.127
  551   2HD   LYS  77          1HD       LYS  77   2.910  -6.949 -14.551
  552   1HE   LYS  77          2HE       LYS  77   1.853  -9.380 -15.919
  553   2HE   LYS  77          1HE       LYS  77   3.445  -8.650 -16.003
  554   1HZ   LYS  77          1HZ       LYS  77   3.545 -10.761 -14.874
  555   2HZ   LYS  77          2HZ       LYS  77   2.398 -10.244 -13.733
  556   3HZ   LYS  77          3HZ       LYS  77   3.928  -9.510 -13.797
  557    H    LEU  78           H        LEU  78   2.855  -9.159 -11.031
  558    HA   LEU  78           HA       LEU  78   4.374 -11.327 -12.044
  559   1HB   LEU  78          2HB       LEU  78   4.960  -8.925 -10.860
  560   2HB   LEU  78          1HB       LEU  78   5.345 -10.023  -9.545
  561    HG   LEU  78           HG       LEU  78   7.350  -9.668 -10.854
  562   1HD1  LEU  78          1HD1      LEU  78   7.997 -11.891 -11.142
  563   2HD1  LEU  78          2HD1      LEU  78   6.435 -12.375 -11.800
  564   3HD1  LEU  78          3HD1      LEU  78   6.607 -12.060 -10.072
  565   1HD2  LEU  78          1HD2      LEU  78   7.476  -9.642 -13.153
  566   2HD2  LEU  78          2HD2      LEU  78   5.772  -9.220 -13.018
  567   3HD2  LEU  78          3HD2      LEU  78   6.245 -10.883 -13.360
  568    H    ALA  79           H        ALA  79   2.997 -10.765  -8.793
  569    HA   ALA  79           HA       ALA  79   3.909 -13.224  -7.684
  570   1HB   ALA  79          1HB       ALA  79   2.192 -12.932  -5.993
  571   2HB   ALA  79          2HB       ALA  79   1.288 -11.841  -7.043
  572   3HB   ALA  79          3HB       ALA  79   2.844 -11.339  -6.380
  573    H    ASN  80           H        ASN  80   0.798 -12.448  -9.249
  574    HA   ASN  80           HA       ASN  80  -0.201 -15.118  -9.216
  575   1HB   ASN  80          2HB       ASN  80  -0.743 -12.721 -10.961
  576   2HB   ASN  80          1HB       ASN  80  -1.555 -14.255 -11.245
  577   1HD2  ASN  80          1HD2      ASN  80  -2.240 -11.466  -9.957
  578   2HD2  ASN  80          2HD2      ASN  80  -3.164 -11.891  -8.599
  579    H    GLU  81           H        GLU  81   1.025 -13.360 -12.060
  580    HA   GLU  81           HA       GLU  81   1.504 -15.761 -13.574
  581   1HB   GLU  81          2HB       GLU  81   0.973 -13.611 -14.633
  582   2HB   GLU  81          1HB       GLU  81   2.436 -12.897 -13.972
  583   1HG   GLU  81          2HG       GLU  81   2.518 -13.618 -16.424
  584   2HG   GLU  81          1HG       GLU  81   3.837 -14.178 -15.409
  585    H    GLY  82           H        GLY  82   3.184 -14.794 -10.921
  586   1HA   GLY  82          2HA       GLY  82   5.690 -16.062 -11.915
  587   2HA   GLY  82          1HA       GLY  82   5.812 -14.517 -11.114
  588    H    LYS  83           H        LYS  83   7.185 -16.576 -10.063
  589    HA   LYS  83           HA       LYS  83   5.657 -17.965  -7.996
  590   1HB   LYS  83          2HB       LYS  83   7.968 -18.591  -9.209
  591   2HB   LYS  83          1HB       LYS  83   8.653 -17.695  -7.856
  592   1HG   LYS  83          2HG       LYS  83   7.035 -19.211  -6.413
  593   2HG   LYS  83          1HG       LYS  83   7.053 -20.239  -7.835
  594   1HD   LYS  83          2HD       LYS  83   9.518 -19.286  -6.355
  595   2HD   LYS  83          1HD       LYS  83   8.807 -20.895  -6.214
  596   1HE   LYS  83          2HE       LYS  83   9.106 -21.157  -8.704
  597   2HE   LYS  83          1HE       LYS  83  10.006 -19.642  -8.696
  598   1HZ   LYS  83          1HZ       LYS  83  11.713 -20.554  -7.484
  599   2HZ   LYS  83          2HZ       LYS  83  11.261 -21.870  -8.456
  600   3HZ   LYS  83          3HZ       LYS  83  10.752 -21.794  -6.837
  601    H    VAL  84           H        VAL  84   7.399 -17.617  -5.762
  602    HA   VAL  84           HA       VAL  84   6.576 -14.890  -4.947
  603    HB   VAL  84           HB       VAL  84   6.159 -16.931  -3.465
  604   1HG1  VAL  84          1HG1      VAL  84   8.419 -17.977  -3.817
  605   2HG1  VAL  84          2HG1      VAL  84   7.994 -17.768  -2.123
  606   3HG1  VAL  84          3HG1      VAL  84   9.127 -16.656  -2.884
  607   1HG2  VAL  84          1HG2      VAL  84   5.972 -14.756  -2.511
  608   2HG2  VAL  84          2HG2      VAL  84   7.717 -14.529  -2.499
  609   3HG2  VAL  84          3HG2      VAL  84   6.968 -15.683  -1.395
  610    H    LYS  85           H        LYS  85   9.427 -16.858  -5.530
  611    HA   LYS  85           HA       LYS  85  11.381 -15.020  -4.546
  612   1HB   LYS  85          2HB       LYS  85  11.878 -17.386  -5.079
  613   2HB   LYS  85          1HB       LYS  85  11.536 -17.079  -6.778
  614   1HG   LYS  85          2HG       LYS  85  13.867 -16.944  -6.701
  615   2HG   LYS  85          1HG       LYS  85  13.403 -15.257  -6.578
  616   1HD   LYS  85          2HD       LYS  85  13.622 -15.381  -4.112
  617   2HD   LYS  85          1HD       LYS  85  14.104 -17.071  -4.251
  618   1HE   LYS  85          2HE       LYS  85  15.566 -14.714  -5.476
  619   2HE   LYS  85          1HE       LYS  85  16.077 -15.605  -4.043
  620   1HZ   LYS  85          1HZ       LYS  85  15.668 -17.548  -5.894
  621   2HZ   LYS  85          2HZ       LYS  85  17.177 -16.897  -5.463
  622   3HZ   LYS  85          3HZ       LYS  85  16.342 -16.293  -6.814
  623    H    GLU  86           H        GLU  86  10.079 -15.590  -7.833
  624    HA   GLU  86           HA       GLU  86  11.439 -13.405  -9.068
  625   1HB   GLU  86          2HB       GLU  86   8.683 -14.415  -9.819
  626   2HB   GLU  86          1HB       GLU  86   9.874 -13.660 -10.877
  627   1HG   GLU  86          2HG       GLU  86  10.194 -16.336  -9.481
  628   2HG   GLU  86          1HG       GLU  86   9.854 -16.103 -11.197
  629    H    ALA  87           H        ALA  87   8.310 -13.652  -7.403
  630    HA   ALA  87           HA       ALA  87   7.491 -10.939  -7.907
  631   1HB   ALA  87          1HB       ALA  87   6.728 -12.538  -5.462
  632   2HB   ALA  87          2HB       ALA  87   6.068 -12.883  -7.054
  633   3HB   ALA  87          3HB       ALA  87   5.779 -11.315  -6.310
  634    H    GLN  88           H        GLN  88   9.161 -12.418  -5.090
  635    HA   GLN  88           HA       GLN  88   9.293 -10.015  -3.585
  636   1HB   GLN  88          2HB       GLN  88  10.538 -11.226  -2.083
  637   2HB   GLN  88          1HB       GLN  88   9.999 -12.575  -3.072
  638   1HG   GLN  88          2HG       GLN  88  12.311 -12.907  -2.882
  639   2HG   GLN  88          1HG       GLN  88  12.147 -12.160  -4.461
  640   1HE2  GLN  88          1HE2      GLN  88  11.476  -9.710  -2.322
  641   2HE2  GLN  88          2HE2      GLN  88  13.031  -9.057  -2.140
  642    H    ALA  89           H        ALA  89  11.219 -11.192  -6.260
  643    HA   ALA  89           HA       ALA  89  13.419  -9.391  -6.061
  644   1HB   ALA  89          1HB       ALA  89  13.891  -9.954  -8.313
  645   2HB   ALA  89          2HB       ALA  89  12.192 -10.243  -8.688
  646   3HB   ALA  89          3HB       ALA  89  13.078 -11.383  -7.677
  647    H    ALA  90           H        ALA  90  10.228  -9.054  -7.585
  648    HA   ALA  90           HA       ALA  90  10.604  -6.501  -8.762
  649   1HB   ALA  90          1HB       ALA  90   8.146  -7.876  -7.662
  650   2HB   ALA  90          2HB       ALA  90   8.634  -7.719  -9.348
  651   3HB   ALA  90          3HB       ALA  90   8.074  -6.305  -8.456
  652    H    ALA  91           H        ALA  91   9.664  -7.447  -5.474
  653    HA   ALA  91           HA       ALA  91   9.042  -4.832  -4.512
  654   1HB   ALA  91          1HB       ALA  91  10.271  -7.106  -2.928
  655   2HB   ALA  91          2HB       ALA  91   8.554  -6.992  -3.313
  656   3HB   ALA  91          3HB       ALA  91   9.312  -5.769  -2.293
  657    H    GLU  92           H        GLU  92  12.105  -6.600  -4.783
  658    HA   GLU  92           HA       GLU  92  13.736  -4.812  -3.300
  659   1HB   GLU  92          2HB       GLU  92  14.509  -6.409  -5.760
  660   2HB   GLU  92          1HB       GLU  92  15.614  -5.762  -4.545
  661   1HG   GLU  92          2HG       GLU  92  14.242  -7.113  -2.834
  662   2HG   GLU  92          1HG       GLU  92  13.564  -7.949  -4.226
  663    H    GLN  93           H        GLN  93  13.243  -4.896  -6.866
  664    HA   GLN  93           HA       GLN  93  14.654  -2.436  -7.288
  665   1HB   GLN  93          2HB       GLN  93  13.272  -2.346  -9.456
  666   2HB   GLN  93          1HB       GLN  93  14.298  -3.761  -9.229
  667   1HG   GLN  93          2HG       GLN  93  12.366  -5.036  -8.394
  668   2HG   GLN  93          1HG       GLN  93  11.337  -3.623  -8.612
  669   1HE2  GLN  93          1HE2      GLN  93  12.670  -6.377 -10.206
  670   2HE2  GLN  93          2HE2      GLN  93  12.166  -5.986 -11.778
  671    H    LEU  94           H        LEU  94  11.263  -3.135  -6.535
  672    HA   LEU  94           HA       LEU  94  10.456  -0.345  -6.809
  673   1HB   LEU  94          2HB       LEU  94   9.106  -2.747  -5.552
  674   2HB   LEU  94          1HB       LEU  94   8.375  -1.147  -5.601
  675    HG   LEU  94           HG       LEU  94   9.280  -2.697  -8.048
  676   1HD1  LEU  94          1HD1      LEU  94   6.531  -2.290  -6.838
  677   2HD1  LEU  94          2HD1      LEU  94   7.397  -3.820  -6.996
  678   3HD1  LEU  94          3HD1      LEU  94   6.825  -2.976  -8.436
  679   1HD2  LEU  94          1HD2      LEU  94   7.575  -0.888  -9.034
  680   2HD2  LEU  94          2HD2      LEU  94   9.267  -0.483  -8.779
  681   3HD2  LEU  94          3HD2      LEU  94   8.056   0.017  -7.598
  682    H    LYS  95           H        LYS  95  12.083  -2.185  -4.402
  683    HA   LYS  95           HA       LYS  95  11.142  -0.717  -2.090
  684   1HB   LYS  95          2HB       LYS  95  12.248  -2.888  -1.827
  685   2HB   LYS  95          1HB       LYS  95  13.725  -2.250  -2.538
  686   1HG   LYS  95          2HG       LYS  95  12.698  -0.691  -0.214
  687   2HG   LYS  95          1HG       LYS  95  13.231  -2.322   0.173
  688   1HD   LYS  95          2HD       LYS  95  15.406  -1.851  -0.950
  689   2HD   LYS  95          1HD       LYS  95  14.879  -0.194  -1.232
  690   1HE   LYS  95          2HE       LYS  95  15.035  -1.474   1.509
  691   2HE   LYS  95          1HE       LYS  95  16.301  -0.456   0.821
  692   1HZ   LYS  95          1HZ       LYS  95  14.694   1.337   0.613
  693   2HZ   LYS  95          2HZ       LYS  95  14.817   0.824   2.227
  694   3HZ   LYS  95          3HZ       LYS  95  13.482   0.358   1.286
  695    H    THR  96           H        THR  96  13.958  -0.363  -4.252
  696    HA   THR  96           HA       THR  96  14.992   1.944  -2.842
  697    HB   THR  96           HB       THR  96  16.558   0.782  -4.211
  698    HG1  THR  96           1HG      THR  96  16.542   2.544  -6.100
  699   1HG2  THR  96          1HG2      THR  96  16.138   0.544  -6.697
  700   2HG2  THR  96          2HG2      THR  96  14.481   1.067  -6.394
  701   3HG2  THR  96          3HG2      THR  96  15.081  -0.428  -5.673
  702    H    THR  97           H        THR  97  12.688   1.457  -5.477
  703    HA   THR  97           HA       THR  97  12.474   4.346  -5.984
  704    HB   THR  97           HB       THR  97  11.071   1.901  -7.093
  705    HG1  THR  97           1HG      THR  97  12.823   2.021  -8.239
  706   1HG2  THR  97          1HG2      THR  97  10.144   3.593  -8.764
  707   2HG2  THR  97          2HG2      THR  97  10.592   4.834  -7.595
  708   3HG2  THR  97          3HG2      THR  97   9.413   3.597  -7.161
  709    H    GLY  98           H        GLY  98   9.837   2.014  -5.535
  710   1HA   GLY  98          2HA       GLY  98   7.828   2.239  -4.351
  711   2HA   GLY  98          1HA       GLY  98   8.885   2.712  -3.022
  712    H    ARG  99           H        ARG  99   9.076   4.889  -2.503
  713    HA   ARG  99           HA       ARG  99   6.957   6.635  -3.506
  714   1HB   ARG  99          2HB       ARG  99   8.211   8.299  -1.904
  715   2HB   ARG  99          1HB       ARG  99   7.300   6.964  -1.212
  716   1HG   ARG  99          2HG       ARG  99  10.135   6.321  -1.884
  717   2HG   ARG  99          1HG       ARG  99   9.931   7.509  -0.604
  718   1HD   ARG  99          2HD       ARG  99  10.003   4.946  -0.010
  719   2HD   ARG  99          1HD       ARG  99   8.871   6.001   0.819
  720    HE   ARG  99           HE       ARG  99   8.140   4.179  -1.448
  721   1HH1  ARG  99          1HH2      ARG  99   7.256   6.055   1.363
  722   2HH1  ARG  99          2HH2      ARG  99   5.662   5.395   1.427
  723   1HH2  ARG  99          1HH1      ARG  99   6.064   3.358  -1.332
  724   2HH2  ARG  99          2HH1      ARG  99   4.991   3.887  -0.080
  725    H    ALA 100           H        ALA 100   8.005   9.102  -3.668
  726    HA   ALA 100           HA       ALA 100  10.461   9.189  -5.231
  727   1HB   ALA 100          1HB       ALA 100   7.774   9.514  -6.589
  728   2HB   ALA 100          2HB       ALA 100   9.053   8.373  -7.003
  729   3HB   ALA 100          3HB       ALA 100   9.287  10.097  -7.286
  730    H    GLY 101           H        GLY 101   7.391  11.028  -5.029
  731   1HA   GLY 101          2HA       GLY 101   8.861  13.544  -4.781
  732   2HA   GLY 101          1HA       GLY 101   7.108  13.358  -4.731
  733    H    ASN 102           H        ASN 102   6.393  12.041  -2.663
  734    HA   ASN 102           HA       ASN 102   6.225  11.973  -0.339
  735   1HB   ASN 102          2HB       ASN 102   8.698  11.208  -0.754
  736   2HB   ASN 102          1HB       ASN 102   9.116  12.795  -0.111
  737   1HD2  ASN 102          1HD2      ASN 102   8.020  13.318   2.093
  738   2HD2  ASN 102          2HD2      ASN 102   7.853  12.036   3.193
  739    H    GLN 103           H        GLN 103   8.094  14.724  -1.612
  740    HA   GLN 103           HA       GLN 103   6.998  16.462   0.527
  741   1HB   GLN 103          2HB       GLN 103   9.502  16.363  -0.482
  742   2HB   GLN 103          1HB       GLN 103   8.812  17.521  -1.621
  743   1HG   GLN 103          2HG       GLN 103   7.974  18.823   0.382
  744   2HG   GLN 103          1HG       GLN 103   8.942  17.757   1.396
  745   1HE2  GLN 103          1HE2      GLN 103   9.393  19.729  -1.607
  746   2HE2  GLN 103          2HE2      GLN 103  10.939  20.284  -1.178
  747    H    LYS 104           H        LYS 104   7.179  18.811  -1.225
  748    HA   LYS 104           HA       LYS 104   5.759  20.110  -2.510
  749   1HB   LYS 104          2HB       LYS 104   6.686  19.000  -4.361
  750   2HB   LYS 104          1HB       LYS 104   5.871  17.497  -3.971
  751   1HG   LYS 104          2HG       LYS 104   3.682  18.495  -4.595
  752   2HG   LYS 104          1HG       LYS 104   4.486  20.038  -4.905
  753   1HD   LYS 104          2HD       LYS 104   5.736  19.120  -6.743
  754   2HD   LYS 104          1HD       LYS 104   5.230  17.479  -6.344
  755   1HE   LYS 104          2HE       LYS 104   2.904  18.033  -6.895
  756   2HE   LYS 104          1HE       LYS 104   3.362  19.705  -7.220
  757   1HZ   LYS 104          1HZ       LYS 104   3.181  18.158  -9.195
  758   2HZ   LYS 104          2HZ       LYS 104   4.616  17.436  -8.641
  759   3HZ   LYS 104          3HZ       LYS 104   4.601  19.077  -9.079
  760    H    GLY 105           H        GLY 105   3.633  20.723  -1.806
  761   1HA   GLY 105          2HA       GLY 105   1.400  20.446  -1.154
  762   2HA   GLY 105          1HA       GLY 105   1.384  19.157  -2.367
  763    H    GLY 106           H        GLY 106   3.764  18.437  -0.144
  764   1HA   GLY 106          2HA       GLY 106   1.942  17.054   1.754
  765   2HA   GLY 106          1HA       GLY 106   3.073  16.067   0.827
  Start of MODEL    2
    1   1H    ALA   1          1HT       ALA   1 -20.347 -34.292  16.751
    2   2H    ALA   1          2HT       ALA   1 -20.994 -35.005  15.352
    3   3H    ALA   1          3HT       ALA   1 -21.409 -33.410  15.765
    4    HA   ALA   1           HA       ALA   1 -18.572 -33.879  15.475
    5   1HB   ALA   1          1HB       ALA   1 -19.845 -35.296  13.684
    6   2HB   ALA   1          2HB       ALA   1 -18.526 -34.249  13.162
    7   3HB   ALA   1          3HB       ALA   1 -20.200 -33.734  12.944
    8    H    ASP   2           H        ASP   2 -17.665 -31.860  15.337
    9    HA   ASP   2           HA       ASP   2 -19.435 -29.523  15.276
   10   1HB   ASP   2          2HB       ASP   2 -16.437 -29.277  15.186
   11   2HB   ASP   2          1HB       ASP   2 -17.614 -28.315  16.083
   12    H    LEU   3           H        LEU   3 -20.236 -29.276  13.190
   13    HA   LEU   3           HA       LEU   3 -18.451 -29.473  10.870
   14   1HB   LEU   3          2HB       LEU   3 -21.267 -28.367  10.905
   15   2HB   LEU   3          1HB       LEU   3 -20.418 -29.140   9.565
   16    HG   LEU   3           HG       LEU   3 -21.337 -30.486  12.128
   17   1HD1  LEU   3          1HD1      LEU   3 -22.745 -31.815  10.567
   18   2HD1  LEU   3          2HD1      LEU   3 -22.175 -30.820   9.227
   19   3HD1  LEU   3          3HD1      LEU   3 -23.146 -30.099  10.508
   20   1HD2  LEU   3          1HD2      LEU   3 -19.595 -31.403   9.836
   21   2HD2  LEU   3          2HD2      LEU   3 -20.522 -32.560  10.793
   22   3HD2  LEU   3          3HD2      LEU   3 -19.302 -31.550  11.569
   23    H    GLU   4           H        GLU   4 -18.034 -27.409  13.052
   24    HA   GLU   4           HA       GLU   4 -18.636 -24.858  11.717
   25   1HB   GLU   4          2HB       GLU   4 -16.986 -24.144  13.790
   26   2HB   GLU   4          1HB       GLU   4 -18.724 -24.373  13.965
   27   1HG   GLU   4          2HG       GLU   4 -18.434 -26.628  14.731
   28   2HG   GLU   4          1HG       GLU   4 -16.713 -26.601  14.345
   29    H    ASP   5           H        ASP   5 -15.537 -26.085  13.030
   30    HA   ASP   5           HA       ASP   5 -14.066 -24.463  11.115
   31   1HB   ASP   5          2HB       ASP   5 -13.111 -24.884  13.318
   32   2HB   ASP   5          1HB       ASP   5 -13.139 -26.628  13.032
   33    H    ASN   6           H        ASN   6 -13.874 -25.039   9.000
   34    HA   ASN   6           HA       ASN   6 -13.182 -27.843   8.324
   35   1HB   ASN   6          2HB       ASN   6 -15.460 -26.374   6.958
   36   2HB   ASN   6          1HB       ASN   6 -14.901 -28.016   6.613
   37   1HD2  ASN   6          1HD2      ASN   6 -17.155 -26.259   8.457
   38   2HD2  ASN   6          2HD2      ASN   6 -17.529 -27.460   9.596
   39    H    ASP   7           H        ASP   7 -11.516 -25.580   8.301
   40    HA   ASP   7           HA       ASP   7 -10.819 -25.483   5.434
   41   1HB   ASP   7          2HB       ASP   7 -10.586 -22.974   5.549
   42   2HB   ASP   7          1HB       ASP   7 -12.253 -23.549   5.614
   43    H    GLU   8           H        GLU   8  -8.796 -26.326   5.674
   44    HA   GLU   8           HA       GLU   8  -6.571 -26.538   6.303
   45   1HB   GLU   8          2HB       GLU   8  -6.867 -23.664   7.196
   46   2HB   GLU   8          1HB       GLU   8  -5.372 -24.496   6.780
   47   1HG   GLU   8          2HG       GLU   8  -5.854 -23.361   4.786
   48   2HG   GLU   8          1HG       GLU   8  -6.553 -24.949   4.483
   49    H    THR   9           H        THR   9  -8.922 -25.681   8.642
   50    HA   THR   9           HA       THR   9  -8.924 -25.758  10.992
   51    HB   THR   9           HB       THR   9  -9.243 -28.098  10.307
   52    HG1  THR   9           1HG      THR   9  -7.510 -27.723  12.516
   53   1HG2  THR   9          1HG2      THR   9  -7.264 -28.574   9.021
   54   2HG2  THR   9          2HG2      THR   9  -7.227 -29.634  10.427
   55   3HG2  THR   9          3HG2      THR   9  -6.212 -28.198  10.386
   56    H    GLY  10           H        GLY  10  -6.488 -24.443   9.804
   57   1HA   GLY  10          2HA       GLY  10  -4.423 -23.619  10.603
   58   2HA   GLY  10          1HA       GLY  10  -4.972 -24.094  12.219
   59    H    ASN  11           H        ASN  11  -4.195 -25.764   9.212
   60    HA   ASN  11           HA       ASN  11  -3.044 -28.010  10.685
   61   1HB   ASN  11          2HB       ASN  11  -2.891 -29.045   8.519
   62   2HB   ASN  11          1HB       ASN  11  -4.446 -28.218   8.603
   63   1HD2  ASN  11          1HD2      ASN  11  -2.809 -28.864   6.192
   64   2HD2  ASN  11          2HD2      ASN  11  -2.527 -27.382   5.415
   65    H    ASP  12           H        ASP  12  -1.923 -25.027   9.779
   66    HA   ASP  12           HA       ASP  12   0.859 -25.932   9.192
   67   1HB   ASP  12          2HB       ASP  12  -0.128 -24.180   7.723
   68   2HB   ASP  12          1HB       ASP  12  -0.379 -23.156   9.137
   69    H    ASN  13           H        ASN  13  -1.169 -24.743  11.668
   70    HA   ASN  13           HA       ASN  13  -0.782 -24.138  13.891
   71   1HB   ASN  13          2HB       ASN  13   0.681 -26.253  13.685
   72   2HB   ASN  13          1HB       ASN  13   2.038 -25.146  13.558
   73   1HD2  ASN  13          1HD2      ASN  13   2.834 -24.216  15.500
   74   2HD2  ASN  13          2HD2      ASN  13   2.101 -24.438  17.016
   75    H    GLY  14           H        GLY  14   0.925 -22.780  11.326
   76   1HA   GLY  14          2HA       GLY  14   2.010 -20.715  11.102
   77   2HA   GLY  14          1HA       GLY  14   1.236 -20.266  12.626
   78    H    LYS  15           H        LYS  15   3.838 -22.473  11.544
   79    HA   LYS  15           HA       LYS  15   5.271 -22.100  14.077
   80   1HB   LYS  15          2HB       LYS  15   6.069 -23.476  11.494
   81   2HB   LYS  15          1HB       LYS  15   6.998 -23.531  12.991
   82   1HG   LYS  15          2HG       LYS  15   5.362 -24.811  14.108
   83   2HG   LYS  15          1HG       LYS  15   4.113 -24.392  12.937
   84   1HD   LYS  15          2HD       LYS  15   5.043 -25.797  11.267
   85   2HD   LYS  15          1HD       LYS  15   6.569 -25.951  12.135
   86   1HE   LYS  15          2HE       LYS  15   5.206 -27.995  12.360
   87   2HE   LYS  15          1HE       LYS  15   5.438 -27.209  13.922
   88   1HZ   LYS  15          1HZ       LYS  15   3.280 -26.404  13.928
   89   2HZ   LYS  15          2HZ       LYS  15   3.095 -27.964  13.276
   90   3HZ   LYS  15          3HZ       LYS  15   3.078 -26.606  12.257
   91    H    GLY  16           H        GLY  16   4.750 -19.865  12.005
   92   1HA   GLY  16          2HA       GLY  16   7.502 -18.756  12.114
   93   2HA   GLY  16          1HA       GLY  16   6.770 -18.920  10.516
   94    H    GLY  17           H        GLY  17   4.122 -18.237  11.104
   95   1HA   GLY  17          2HA       GLY  17   2.711 -16.415  11.628
   96   2HA   GLY  17          1HA       GLY  17   4.043 -15.681  12.522
   97    H    GLU  18           H        GLU  18   4.389 -16.760   9.190
   98    HA   GLU  18           HA       GLU  18   4.099 -13.999   8.168
   99   1HB   GLU  18          2HB       GLU  18   6.566 -14.609   8.985
  100   2HB   GLU  18          1HB       GLU  18   6.640 -15.447   7.437
  101   1HG   GLU  18          2HG       GLU  18   5.915 -13.315   6.316
  102   2HG   GLU  18          1HG       GLU  18   6.032 -12.507   7.881
  103    H    LYS  19           H        LYS  19   3.040 -16.910   7.848
  104    HA   LYS  19           HA       LYS  19   2.293 -18.251   6.079
  105   1HB   LYS  19          2HB       LYS  19   1.131 -16.176   5.476
  106   2HB   LYS  19          1HB       LYS  19   2.560 -15.593   4.642
  107   1HG   LYS  19          2HG       LYS  19   0.956 -16.493   3.027
  108   2HG   LYS  19          1HG       LYS  19   2.399 -17.503   3.047
  109   1HD   LYS  19          2HD       LYS  19   1.329 -19.236   4.229
  110   2HD   LYS  19          1HD       LYS  19   0.053 -18.175   4.829
  111   1HE   LYS  19          2HE       LYS  19   0.403 -18.796   1.889
  112   2HE   LYS  19          1HE       LYS  19  -0.612 -19.774   2.950
  113   1HZ   LYS  19          1HZ       LYS  19  -1.326 -17.192   3.491
  114   2HZ   LYS  19          2HZ       LYS  19  -2.202 -18.301   2.550
  115   3HZ   LYS  19          3HZ       LYS  19  -1.132 -17.215   1.804
  116    H    ALA  20           H        ALA  20   4.130 -16.197   3.891
  117    HA   ALA  20           HA       ALA  20   5.861 -16.762   2.407
  118   1HB   ALA  20          1HB       ALA  20   6.802 -18.241   4.893
  119   2HB   ALA  20          2HB       ALA  20   7.216 -16.586   4.444
  120   3HB   ALA  20          3HB       ALA  20   7.799 -17.936   3.471
  121    H    ASP  21           H        ASP  21   4.522 -18.038   1.009
  122    HA   ASP  21           HA       ASP  21   5.107 -20.933   1.116
  123   1HB   ASP  21          2HB       ASP  21   2.912 -20.283   2.322
  124   2HB   ASP  21          1HB       ASP  21   2.279 -19.967   0.712
  125    H    ASN  22           H        ASN  22   3.138 -18.528  -0.749
  126    HA   ASN  22           HA       ASN  22   4.746 -19.162  -3.126
  127   1HB   ASN  22          2HB       ASN  22   2.923 -20.936  -3.040
  128   2HB   ASN  22          1HB       ASN  22   1.788 -19.617  -3.319
  129   1HD2  ASN  22          1HD2      ASN  22   4.509 -18.561  -4.899
  130   2HD2  ASN  22          2HD2      ASN  22   4.206 -19.212  -6.437
  131    H    ALA  23           H        ALA  23   4.926 -16.794  -2.311
  132    HA   ALA  23           HA       ALA  23   4.589 -14.548  -2.881
  133   1HB   ALA  23          1HB       ALA  23   4.305 -15.782  -5.207
  134   2HB   ALA  23          2HB       ALA  23   3.848 -14.090  -5.039
  135   3HB   ALA  23          3HB       ALA  23   2.607 -15.342  -5.003
  136    H    ALA  24           H        ALA  24   2.255 -16.605  -1.703
  137    HA   ALA  24           HA       ALA  24  -0.125 -15.007  -1.732
  138   1HB   ALA  24          1HB       ALA  24  -0.145 -17.370  -0.969
  139   2HB   ALA  24          2HB       ALA  24  -0.782 -16.305   0.284
  140   3HB   ALA  24          3HB       ALA  24   0.861 -16.928   0.414
  141    H    GLN  25           H        GLN  25   2.503 -15.310   0.638
  142    HA   GLN  25           HA       GLN  25   1.610 -13.203   2.331
  143   1HB   GLN  25          2HB       GLN  25   3.603 -13.534   3.484
  144   2HB   GLN  25          1HB       GLN  25   3.483 -15.056   2.605
  145   1HG   GLN  25          2HG       GLN  25   5.052 -14.299   0.936
  146   2HG   GLN  25          1HG       GLN  25   5.106 -12.677   1.642
  147   1HE2  GLN  25          1HE2      GLN  25   7.521 -13.265   1.810
  148   2HE2  GLN  25          2HE2      GLN  25   8.012 -14.099   3.206
  149    H    VAL  26           H        VAL  26   3.694 -13.179  -0.548
  150    HA   VAL  26           HA       VAL  26   4.253 -10.339  -0.319
  151    HB   VAL  26           HB       VAL  26   4.496 -12.226  -2.672
  152   1HG1  VAL  26          1HG1      VAL  26   4.418  -9.986  -3.527
  153   2HG1  VAL  26          2HG1      VAL  26   6.120 -10.440  -3.470
  154   3HG1  VAL  26          3HG1      VAL  26   5.449  -9.385  -2.225
  155   1HG2  VAL  26          1HG2      VAL  26   6.830 -12.379  -2.031
  156   2HG2  VAL  26          2HG2      VAL  26   5.853 -12.747  -0.612
  157   3HG2  VAL  26          3HG2      VAL  26   6.610 -11.163  -0.771
  158    H    LYS  27           H        LYS  27   1.729 -12.252  -1.887
  159    HA   LYS  27           HA       LYS  27   0.781 -10.131  -3.591
  160   1HB   LYS  27          2HB       LYS  27  -0.435 -12.673  -2.525
  161   2HB   LYS  27          1HB       LYS  27  -1.413 -11.536  -3.452
  162   1HG   LYS  27          2HG       LYS  27  -0.249 -11.907  -5.427
  163   2HG   LYS  27          1HG       LYS  27   1.251 -12.334  -4.599
  164   1HD   LYS  27          2HD       LYS  27   0.167 -14.301  -5.676
  165   2HD   LYS  27          1HD       LYS  27   0.305 -14.484  -3.929
  166   1HE   LYS  27          2HE       LYS  27  -1.976 -14.296  -3.587
  167   2HE   LYS  27          1HE       LYS  27  -2.202 -13.212  -4.961
  168   1HZ   LYS  27          1HZ       LYS  27  -3.149 -15.215  -5.614
  169   2HZ   LYS  27          2HZ       LYS  27  -1.882 -16.147  -4.977
  170   3HZ   LYS  27          3HZ       LYS  27  -1.630 -15.217  -6.374
  171    H    ASP  28           H        ASP  28  -0.578 -11.370  -0.495
  172    HA   ASP  28           HA       ASP  28  -2.525  -9.319  -0.184
  173   1HB   ASP  28          2HB       ASP  28  -2.224  -9.846   2.328
  174   2HB   ASP  28          1HB       ASP  28  -2.700 -11.185   1.283
  175    H    ALA  29           H        ALA  29   0.920  -9.297   0.357
  176    HA   ALA  29           HA       ALA  29   1.048  -7.004   2.054
  177   1HB   ALA  29          1HB       ALA  29   3.084  -7.705  -0.070
  178   2HB   ALA  29          2HB       ALA  29   2.947  -8.629   1.429
  179   3HB   ALA  29          3HB       ALA  29   3.364  -6.911   1.478
  180    H    LEU  30           H        LEU  30   1.019  -7.378  -1.490
  181    HA   LEU  30           HA       LEU  30   1.274  -4.611  -2.031
  182   1HB   LEU  30          2HB       LEU  30  -0.341  -6.541  -3.698
  183   2HB   LEU  30          1HB       LEU  30   0.470  -5.075  -4.237
  184    HG   LEU  30           HG       LEU  30   2.008  -7.350  -2.995
  185   1HD1  LEU  30          1HD1      LEU  30   1.604  -6.937  -5.960
  186   2HD1  LEU  30          2HD1      LEU  30   0.722  -8.140  -5.020
  187   3HD1  LEU  30          3HD1      LEU  30   2.475  -8.250  -5.168
  188   1HD2  LEU  30          1HD2      LEU  30   3.833  -6.316  -4.422
  189   2HD2  LEU  30          2HD2      LEU  30   3.259  -5.310  -3.094
  190   3HD2  LEU  30          3HD2      LEU  30   2.724  -4.984  -4.743
  191    H    THR  31           H        THR  31  -1.577  -6.612  -1.337
  192    HA   THR  31           HA       THR  31  -3.516  -4.521  -1.731
  193    HB   THR  31           HB       THR  31  -4.987  -5.948  -0.286
  194    HG1  THR  31           1HG      THR  31  -2.610  -6.868   0.462
  195   1HG2  THR  31          1HG2      THR  31  -4.860  -6.402  -2.686
  196   2HG2  THR  31          2HG2      THR  31  -4.984  -7.918  -1.796
  197   3HG2  THR  31          3HG2      THR  31  -3.427  -7.397  -2.438
  198    H    LYS  32           H        LYS  32  -1.440  -5.413   0.956
  199    HA   LYS  32           HA       LYS  32  -2.750  -3.860   2.971
  200   1HB   LYS  32          2HB       LYS  32  -0.990  -5.584   3.405
  201   2HB   LYS  32          1HB       LYS  32   0.203  -4.499   2.708
  202   1HG   LYS  32          2HG       LYS  32  -1.509  -3.342   4.879
  203   2HG   LYS  32          1HG       LYS  32  -0.354  -4.573   5.379
  204   1HD   LYS  32          2HD       LYS  32   1.440  -3.251   4.160
  205   2HD   LYS  32          1HD       LYS  32   0.248  -1.965   3.958
  206   1HE   LYS  32          2HE       LYS  32   1.389  -3.070   6.519
  207   2HE   LYS  32          1HE       LYS  32   1.431  -1.407   5.934
  208   1HZ   LYS  32          1HZ       LYS  32  -1.182  -1.841   5.977
  209   2HZ   LYS  32          2HZ       LYS  32  -0.327  -1.201   7.297
  210   3HZ   LYS  32          3HZ       LYS  32  -0.712  -2.856   7.253
  211    H    MET  33           H        MET  33   0.044  -3.104   0.853
  212    HA   MET  33           HA       MET  33   0.313  -0.385   1.706
  213   1HB   MET  33          2HB       MET  33   0.974  -1.549  -1.020
  214   2HB   MET  33          1HB       MET  33   1.619  -0.051  -0.348
  215   1HG   MET  33          2HG       MET  33   2.418  -1.592   1.627
  216   2HG   MET  33          1HG       MET  33   2.200  -2.899   0.466
  217   1HE   MET  33          1HE       MET  33   3.090  -2.979  -1.784
  218   2HE   MET  33          2HE       MET  33   4.409  -3.689  -0.859
  219   3HE   MET  33          3HE       MET  33   4.767  -2.551  -2.153
  220    H    ARG  34           H        ARG  34  -1.867  -1.916  -0.596
  221    HA   ARG  34           HA       ARG  34  -2.707   0.379  -2.057
  222   1HB   ARG  34          2HB       ARG  34  -3.428  -1.868  -2.716
  223   2HB   ARG  34          1HB       ARG  34  -4.295  -2.058  -1.201
  224   1HG   ARG  34          2HG       ARG  34  -5.889  -0.417  -1.756
  225   2HG   ARG  34          1HG       ARG  34  -4.908   0.215  -3.078
  226   1HD   ARG  34          2HD       ARG  34  -5.202  -1.962  -4.278
  227   2HD   ARG  34          1HD       ARG  34  -6.290  -2.484  -2.989
  228    HE   ARG  34           HE       ARG  34  -7.086   0.079  -4.074
  229   1HH1  ARG  34          1HH2      ARG  34  -7.140  -3.341  -4.602
  230   2HH1  ARG  34          2HH2      ARG  34  -8.601  -3.294  -5.531
  231   1HH2  ARG  34          1HH1      ARG  34  -8.994   0.134  -5.261
  232   2HH2  ARG  34          2HH1      ARG  34  -9.629  -1.333  -5.926
  233    H    ALA  35           H        ALA  35  -4.332  -1.085   0.773
  234    HA   ALA  35           HA       ALA  35  -6.111   1.103   1.148
  235   1HB   ALA  35          1HB       ALA  35  -4.985  -0.838   3.185
  236   2HB   ALA  35          2HB       ALA  35  -6.475  -1.037   2.262
  237   3HB   ALA  35          3HB       ALA  35  -6.351   0.239   3.473
  238    H    ALA  36           H        ALA  36  -2.750   0.672   2.093
  239    HA   ALA  36           HA       ALA  36  -2.557   2.735   4.053
  240   1HB   ALA  36          1HB       ALA  36  -0.358   2.130   2.075
  241   2HB   ALA  36          2HB       ALA  36  -0.791   0.983   3.342
  242   3HB   ALA  36          3HB       ALA  36  -0.219   2.597   3.771
  243    H    ALA  37           H        ALA  37  -2.094   2.896   0.495
  244    HA   ALA  37           HA       ALA  37  -1.464   5.677   0.435
  245   1HB   ALA  37          1HB       ALA  37  -3.035   4.249  -1.720
  246   2HB   ALA  37          2HB       ALA  37  -1.315   3.958  -1.481
  247   3HB   ALA  37          3HB       ALA  37  -1.880   5.573  -1.904
  248    H    LEU  38           H        LEU  38  -4.562   3.952   0.140
  249    HA   LEU  38           HA       LEU  38  -6.192   6.324  -0.087
  250   1HB   LEU  38          2HB       LEU  38  -7.030   3.637   1.018
  251   2HB   LEU  38          1HB       LEU  38  -8.061   4.846   0.264
  252    HG   LEU  38           HG       LEU  38  -5.811   3.374  -1.138
  253   1HD1  LEU  38          1HD1      LEU  38  -7.429   1.706  -0.882
  254   2HD1  LEU  38          2HD1      LEU  38  -7.938   2.436  -2.402
  255   3HD1  LEU  38          3HD1      LEU  38  -8.770   2.849  -0.903
  256   1HD2  LEU  38          1HD2      LEU  38  -7.873   5.412  -2.006
  257   2HD2  LEU  38          2HD2      LEU  38  -7.095   4.338  -3.165
  258   3HD2  LEU  38          3HD2      LEU  38  -6.124   5.466  -2.222
  259    H    ASP  39           H        ASP  39  -5.052   4.375   2.625
  260    HA   ASP  39           HA       ASP  39  -6.739   5.415   4.643
  261   1HB   ASP  39          2HB       ASP  39  -5.089   3.503   4.899
  262   2HB   ASP  39          1HB       ASP  39  -3.820   4.722   5.041
  263    H    ALA  40           H        ALA  40  -3.421   6.493   3.815
  264    HA   ALA  40           HA       ALA  40  -3.582   8.825   5.471
  265   1HB   ALA  40          1HB       ALA  40  -1.462   7.716   4.564
  266   2HB   ALA  40          2HB       ALA  40  -1.498   9.479   4.516
  267   3HB   ALA  40          3HB       ALA  40  -1.799   8.550   3.048
  268    H    GLN  41           H        GLN  41  -4.948   8.122   2.428
  269    HA   GLN  41           HA       GLN  41  -4.973  10.815   1.362
  270   1HB   GLN  41          2HB       GLN  41  -5.323   8.499   0.167
  271   2HB   GLN  41          1HB       GLN  41  -7.004   8.695   0.651
  272   1HG   GLN  41          2HG       GLN  41  -6.426  11.192  -0.430
  273   2HG   GLN  41          1HG       GLN  41  -5.463  10.126  -1.446
  274   1HE2  GLN  41          1HE2      GLN  41  -7.017   7.886  -1.818
  275   2HE2  GLN  41          2HE2      GLN  41  -8.521   8.296  -2.491
  276    H    LYS  42           H        LYS  42  -7.952  10.330   0.776
  277    HA   LYS  42           HA       LYS  42  -8.976  12.055   2.890
  278   1HB   LYS  42          2HB       LYS  42 -10.528  10.630   0.709
  279   2HB   LYS  42          1HB       LYS  42 -11.048  12.042   1.626
  280   1HG   LYS  42          2HG       LYS  42  -8.523  12.139  -0.021
  281   2HG   LYS  42          1HG       LYS  42 -10.084  12.382  -0.787
  282   1HD   LYS  42          2HD       LYS  42  -9.545  13.967   1.702
  283   2HD   LYS  42          1HD       LYS  42  -8.645  14.417   0.259
  284   1HE   LYS  42          2HE       LYS  42 -11.663  14.126   0.349
  285   2HE   LYS  42          1HE       LYS  42 -10.813  15.660   0.521
  286   1HZ   LYS  42          1HZ       LYS  42 -10.690  15.797  -1.671
  287   2HZ   LYS  42          2HZ       LYS  42 -11.509  14.317  -1.835
  288   3HZ   LYS  42          3HZ       LYS  42  -9.813  14.349  -1.742
  289    H    ALA  43           H        ALA  43  -8.178   9.958   4.310
  290    HA   ALA  43           HA       ALA  43 -10.732   8.591   5.046
  291   1HB   ALA  43          1HB       ALA  43  -8.106   7.249   4.418
  292   2HB   ALA  43          2HB       ALA  43  -9.707   6.857   3.803
  293   3HB   ALA  43          3HB       ALA  43  -9.292   6.487   5.477
  294    H    THR  44           H        THR  44  -7.317   9.015   6.024
  295    HA   THR  44           HA       THR  44  -8.266   9.642   8.791
  296    HB   THR  44           HB       THR  44  -5.714   8.135   8.147
  297    HG1  THR  44           1HG      THR  44  -8.166   7.220   7.974
  298   1HG2  THR  44          1HG2      THR  44  -5.993   9.421  10.336
  299   2HG2  THR  44          2HG2      THR  44  -5.608   7.707  10.489
  300   3HG2  THR  44          3HG2      THR  44  -7.262   8.263  10.739
  301    HA   PRO  45           HA       PRO  45  -5.953  12.988   6.121
  302   1HB   PRO  45          2HB       PRO  45  -7.615  14.141   8.362
  303   2HB   PRO  45          1HB       PRO  45  -7.200  14.881   6.802
  304   1HG   PRO  45          2HG       PRO  45  -9.536  13.617   7.176
  305   2HG   PRO  45          1HG       PRO  45  -8.678  13.560   5.626
  306   1HD   PRO  45          2HD       PRO  45  -9.137  11.363   7.519
  307   2HD   PRO  45          1HD       PRO  45  -8.476  11.283   5.871
  308    HA   PRO  46           HA       PRO  46  -3.080  12.947   9.756
  309   1HB   PRO  46          2HB       PRO  46  -0.892  11.897   8.416
  310   2HB   PRO  46          1HB       PRO  46  -2.122  10.913   9.227
  311   1HG   PRO  46          2HG       PRO  46  -1.612  11.194   6.377
  312   2HG   PRO  46          1HG       PRO  46  -2.684  10.062   7.211
  313   1HD   PRO  46          2HD       PRO  46  -3.380  12.572   5.836
  314   2HD   PRO  46          1HD       PRO  46  -4.452  11.269   6.390
  315    H    LYS  47           H        LYS  47  -1.625  13.430   6.525
  316    HA   LYS  47           HA       LYS  47  -0.110  15.753   7.458
  317   1HB   LYS  47          2HB       LYS  47  -0.439  14.870   4.575
  318   2HB   LYS  47          1HB       LYS  47   0.903  15.752   5.293
  319   1HG   LYS  47          2HG       LYS  47   1.325  13.688   6.742
  320   2HG   LYS  47          1HG       LYS  47   0.183  12.839   5.701
  321   1HD   LYS  47          2HD       LYS  47   1.587  13.496   3.720
  322   2HD   LYS  47          1HD       LYS  47   2.767  14.179   4.836
  323   1HE   LYS  47          2HE       LYS  47   2.866  11.884   5.946
  324   2HE   LYS  47          1HE       LYS  47   1.929  11.278   4.581
  325   1HZ   LYS  47          1HZ       LYS  47   3.846  12.615   3.308
  326   2HZ   LYS  47          2HZ       LYS  47   3.966  10.968   3.708
  327   3HZ   LYS  47          3HZ       LYS  47   4.703  12.139   4.694
  328    H    LEU  48           H        LEU  48  -3.215  15.175   6.178
  329    HA   LEU  48           HA       LEU  48  -3.516  17.753   4.851
  330   1HB   LEU  48          2HB       LEU  48  -5.331  15.449   5.537
  331   2HB   LEU  48          1HB       LEU  48  -6.058  16.992   5.097
  332    HG   LEU  48           HG       LEU  48  -4.527  16.910   3.011
  333   1HD1  LEU  48          1HD1      LEU  48  -3.872  14.608   2.326
  334   2HD1  LEU  48          2HD1      LEU  48  -4.393  14.009   3.900
  335   3HD1  LEU  48          3HD1      LEU  48  -3.031  15.125   3.788
  336   1HD2  LEU  48          1HD2      LEU  48  -6.875  16.607   2.722
  337   2HD2  LEU  48          2HD2      LEU  48  -6.834  15.008   3.464
  338   3HD2  LEU  48          3HD2      LEU  48  -6.112  15.261   1.874
  339    H    GLU  49           H        GLU  49  -2.486  18.337   7.255
  340    HA   GLU  49           HA       GLU  49  -4.697  19.118   9.079
  341   1HB   GLU  49          2HB       GLU  49  -2.725  18.004  10.053
  342   2HB   GLU  49          1HB       GLU  49  -1.691  19.274   9.393
  343   1HG   GLU  49          2HG       GLU  49  -2.658  20.936  10.799
  344   2HG   GLU  49          1HG       GLU  49  -4.007  19.887  11.237
  345    H    ASP  50           H        ASP  50  -2.627  20.427   6.668
  346    HA   ASP  50           HA       ASP  50  -3.823  23.062   6.830
  347   1HB   ASP  50          2HB       ASP  50  -2.237  23.277   8.721
  348   2HB   ASP  50          1HB       ASP  50  -0.913  22.797   7.657
  349    H    LYS  51           H        LYS  51  -3.726  21.341   4.755
  350    HA   LYS  51           HA       LYS  51  -1.920  22.717   2.838
  351   1HB   LYS  51          2HB       LYS  51  -2.229  19.700   3.055
  352   2HB   LYS  51          1HB       LYS  51  -1.349  20.547   1.782
  353   1HG   LYS  51          2HG       LYS  51   0.175  21.512   3.477
  354   2HG   LYS  51          1HG       LYS  51  -0.702  20.661   4.746
  355   1HD   LYS  51          2HD       LYS  51  -0.017  18.521   3.922
  356   2HD   LYS  51          1HD       LYS  51   0.585  19.220   2.418
  357   1HE   LYS  51          2HE       LYS  51   1.711  20.006   5.112
  358   2HE   LYS  51          1HE       LYS  51   2.355  18.648   4.190
  359   1HZ   LYS  51          1HZ       LYS  51   2.085  21.405   3.127
  360   2HZ   LYS  51          2HZ       LYS  51   2.865  20.091   2.380
  361   3HZ   LYS  51          3HZ       LYS  51   3.512  20.785   3.791
  362    H    SER  52           H        SER  52  -4.339  20.019   2.769
  363    HA   SER  52           HA       SER  52  -6.192  19.785   1.312
  364   1HB   SER  52          2HB       SER  52  -6.459  22.086   2.805
  365   2HB   SER  52          1HB       SER  52  -6.646  22.720   1.179
  366    HG   SER  52           HG       SER  52  -8.648  22.034   1.871
  367    HA   PRO  53           HA       PRO  53  -5.259  20.645  -2.933
  368   1HB   PRO  53          2HB       PRO  53  -7.476  22.645  -3.242
  369   2HB   PRO  53          1HB       PRO  53  -7.147  21.173  -4.183
  370   1HG   PRO  53          2HG       PRO  53  -9.109  21.180  -2.432
  371   2HG   PRO  53          1HG       PRO  53  -8.021  19.779  -2.531
  372   1HD   PRO  53          2HD       PRO  53  -8.022  22.001  -0.513
  373   2HD   PRO  53          1HD       PRO  53  -7.841  20.247  -0.262
  374    H    ASP  54           H        ASP  54  -3.722  22.195  -1.235
  375    HA   ASP  54           HA       ASP  54  -3.561  24.885  -2.534
  376   1HB   ASP  54          2HB       ASP  54  -3.770  25.008  -0.104
  377   2HB   ASP  54          1HB       ASP  54  -2.420  23.886   0.102
  378    H    SER  55           H        SER  55  -1.131  22.813  -0.943
  379    HA   SER  55           HA       SER  55   0.843  23.483  -2.945
  380   1HB   SER  55          2HB       SER  55   1.238  21.061  -1.238
  381   2HB   SER  55          1HB       SER  55   2.319  22.432  -1.493
  382    HG   SER  55           HG       SER  55   1.541  23.245   0.277
  383    HA   PRO  56           HA       PRO  56   0.386  20.164  -5.928
  384   1HB   PRO  56          2HB       PRO  56   2.532  18.423  -4.749
  385   2HB   PRO  56          1HB       PRO  56   2.343  19.025  -6.414
  386   1HG   PRO  56          2HG       PRO  56   4.149  20.084  -4.803
  387   2HG   PRO  56          1HG       PRO  56   3.186  21.117  -5.883
  388   1HD   PRO  56          2HD       PRO  56   2.858  20.665  -2.922
  389   2HD   PRO  56          1HD       PRO  56   2.734  22.174  -3.855
  390    H    GLU  57           H        GLU  57  -0.136  19.558  -2.697
  391    HA   GLU  57           HA       GLU  57  -0.530  16.868  -2.269
  392   1HB   GLU  57          2HB       GLU  57  -1.155  18.372  -0.520
  393   2HB   GLU  57          1HB       GLU  57  -2.352  19.173  -1.539
  394   1HG   GLU  57          2HG       GLU  57  -3.859  17.363  -1.408
  395   2HG   GLU  57          1HG       GLU  57  -2.600  16.228  -0.919
  396    H    MET  58           H        MET  58  -2.881  18.950  -4.017
  397    HA   MET  58           HA       MET  58  -4.728  16.858  -4.592
  398   1HB   MET  58          2HB       MET  58  -5.232  19.250  -4.949
  399   2HB   MET  58          1HB       MET  58  -4.072  19.292  -6.276
  400   1HG   MET  58          2HG       MET  58  -5.391  17.854  -7.623
  401   2HG   MET  58          1HG       MET  58  -6.371  17.332  -6.250
  402   1HE   MET  58          1HE       MET  58  -5.311  21.187  -6.805
  403   2HE   MET  58          2HE       MET  58  -6.307  21.451  -8.234
  404   3HE   MET  58          3HE       MET  58  -5.074  20.192  -8.250
  405    H    LYS  59           H        LYS  59  -1.936  18.031  -6.583
  406    HA   LYS  59           HA       LYS  59  -2.442  16.070  -8.642
  407   1HB   LYS  59          2HB       LYS  59   0.259  17.298  -8.111
  408   2HB   LYS  59          1HB       LYS  59  -0.424  16.760  -9.643
  409   1HG   LYS  59          2HG       LYS  59  -2.084  18.570  -9.564
  410   2HG   LYS  59          1HG       LYS  59  -1.448  19.085  -7.999
  411   1HD   LYS  59          2HD       LYS  59  -0.244  20.518  -9.353
  412   2HD   LYS  59          1HD       LYS  59   0.858  19.146  -9.350
  413   1HE   LYS  59          2HE       LYS  59   0.693  19.655 -11.633
  414   2HE   LYS  59          1HE       LYS  59  -0.492  18.363 -11.448
  415   1HZ   LYS  59          1HZ       LYS  59  -1.626  19.999 -12.611
  416   2HZ   LYS  59          2HZ       LYS  59  -0.945  21.270 -11.709
  417   3HZ   LYS  59          3HZ       LYS  59  -2.127  20.267 -11.015
  418    H    ASP  60           H        ASP  60   0.154  16.199  -6.154
  419    HA   ASP  60           HA       ASP  60   1.305  13.694  -6.763
  420   1HB   ASP  60          2HB       ASP  60   2.347  15.204  -5.112
  421   2HB   ASP  60          1HB       ASP  60   0.983  14.944  -4.023
  422    H    PHE  61           H        PHE  61  -1.639  14.491  -5.078
  423    HA   PHE  61           HA       PHE  61  -2.080  11.900  -3.914
  424   1HB   PHE  61          2HB       PHE  61  -3.443  13.606  -3.023
  425   2HB   PHE  61          1HB       PHE  61  -3.795  14.286  -4.604
  426    HD1  PHE  61           1HD      PHE  61  -6.188  14.329  -4.345
  427    HD2  PHE  61           2HD      PHE  61  -4.022  10.659  -3.838
  428    HE1  PHE  61           1HE      PHE  61  -8.311  13.071  -4.370
  429    HE2  PHE  61           2HE      PHE  61  -6.148   9.390  -3.870
  430    HZ   PHE  61           HZ       PHE  61  -8.301  10.596  -4.133
  431    H    ARG  62           H        ARG  62  -3.229  13.547  -6.816
  432    HA   ARG  62           HA       ARG  62  -4.513  11.290  -7.939
  433   1HB   ARG  62          2HB       ARG  62  -3.343  13.740  -9.274
  434   2HB   ARG  62          1HB       ARG  62  -4.453  12.612 -10.045
  435   1HG   ARG  62          2HG       ARG  62  -5.375  13.664  -7.408
  436   2HG   ARG  62          1HG       ARG  62  -5.249  14.875  -8.681
  437   1HD   ARG  62          2HD       ARG  62  -6.678  13.506 -10.148
  438   2HD   ARG  62          1HD       ARG  62  -6.781  12.263  -8.901
  439    HE   ARG  62           HE       ARG  62  -7.652  14.900  -7.994
  440   1HH1  ARG  62          1HH2      ARG  62  -8.507  11.975  -9.621
  441   2HH1  ARG  62          2HH2      ARG  62 -10.175  12.049  -9.157
  442   1HH2  ARG  62          1HH1      ARG  62  -9.837  15.008  -7.388
  443   2HH2  ARG  62          2HH1      ARG  62 -10.925  13.766  -7.907
  444    H    HIS  63           H        HIS  63  -1.412  12.769  -9.026
  445    HA   HIS  63           HA       HIS  63  -0.720  10.496 -10.628
  446   1HB   HIS  63          2HB       HIS  63   0.175  12.863 -10.812
  447   2HB   HIS  63          1HB       HIS  63   1.216  12.490  -9.444
  448    HD1  HIS  63           1HD      HIS  63   3.179  12.939 -11.269
  449    HD2  HIS  63           2HD      HIS  63   0.915   9.485 -11.880
  450    HE1  HIS  63           1HE      HIS  63   4.484  11.498 -12.889
  451    H    GLY  64           H        GLY  64  -0.375  11.042  -7.194
  452   1HA   GLY  64          2HA       GLY  64   1.789   9.058  -6.925
  453   2HA   GLY  64          1HA       GLY  64   1.016   9.914  -5.598
  454    H    PHE  65           H        PHE  65  -1.672   9.177  -5.898
  455    HA   PHE  65           HA       PHE  65  -1.591   6.500  -4.874
  456   1HB   PHE  65          2HB       PHE  65  -3.775   6.852  -4.288
  457   2HB   PHE  65          1HB       PHE  65  -3.462   8.510  -4.766
  458    HD1  PHE  65           1HD      PHE  65  -4.882   9.502  -6.375
  459    HD2  PHE  65           2HD      PHE  65  -4.554   5.226  -6.210
  460    HE1  PHE  65           1HE      PHE  65  -6.677   9.305  -8.053
  461    HE2  PHE  65           2HE      PHE  65  -6.348   5.023  -7.904
  462    HZ   PHE  65           HZ       PHE  65  -7.418   7.060  -8.826
  463    H    ASP  66           H        ASP  66  -1.887   7.800  -8.082
  464    HA   ASP  66           HA       ASP  66  -2.938   5.393  -9.299
  465   1HB   ASP  66          2HB       ASP  66  -3.081   7.568 -10.436
  466   2HB   ASP  66          1HB       ASP  66  -1.319   7.643 -10.513
  467    H    ILE  67           H        ILE  67   0.349   6.728  -8.964
  468    HA   ILE  67           HA       ILE  67   1.685   4.602 -10.314
  469    HB   ILE  67           HB       ILE  67   2.592   6.451  -8.088
  470   1HG1  ILE  67          2HG1      ILE  67   3.229   6.463 -11.048
  471   2HG1  ILE  67          1HG1      ILE  67   1.871   7.353 -10.355
  472   1HG2  ILE  67          1HG2      ILE  67   4.901   5.688  -9.383
  473   2HG2  ILE  67          2HG2      ILE  67   4.000   4.177  -9.411
  474   3HG2  ILE  67          3HG2      ILE  67   4.342   4.972  -7.875
  475   1HD1  ILE  67          1HD1      ILE  67   4.754   7.663  -9.467
  476   2HD1  ILE  67          2HD1      ILE  67   3.379   8.627  -8.928
  477   3HD1  ILE  67          3HD1      ILE  67   3.940   8.746 -10.597
  478    H    LEU  68           H        LEU  68   0.935   5.043  -6.863
  479    HA   LEU  68           HA       LEU  68   2.014   2.571  -5.955
  480   1HB   LEU  68          2HB       LEU  68  -0.172   4.389  -4.919
  481   2HB   LEU  68          1HB       LEU  68   0.261   2.900  -4.069
  482    HG   LEU  68           HG       LEU  68   2.239   5.084  -4.805
  483   1HD1  LEU  68          1HD1      LEU  68   0.652   5.946  -3.162
  484   2HD1  LEU  68          2HD1      LEU  68   2.199   5.629  -2.377
  485   3HD1  LEU  68          3HD1      LEU  68   0.861   4.500  -2.167
  486   1HD2  LEU  68          1HD2      LEU  68   3.444   3.758  -2.805
  487   2HD2  LEU  68          2HD2      LEU  68   3.590   3.224  -4.473
  488   3HD2  LEU  68          3HD2      LEU  68   2.439   2.437  -3.393
  489    H    VAL  69           H        VAL  69  -1.326   3.418  -6.855
  490    HA   VAL  69           HA       VAL  69  -2.334   0.746  -6.643
  491    HB   VAL  69           HB       VAL  69  -3.229   3.262  -8.057
  492   1HG1  VAL  69          1HG1      VAL  69  -5.351   2.010  -8.622
  493   2HG1  VAL  69          2HG1      VAL  69  -4.459   0.518  -8.319
  494   3HG1  VAL  69          3HG1      VAL  69  -3.949   1.604  -9.613
  495   1HG2  VAL  69          1HG2      VAL  69  -3.622   3.074  -5.644
  496   2HG2  VAL  69          2HG2      VAL  69  -4.412   1.515  -5.879
  497   3HG2  VAL  69          3HG2      VAL  69  -5.159   2.984  -6.504
  498    H    GLY  70           H        GLY  70  -0.906   2.569  -9.348
  499   1HA   GLY  70          2HA       GLY  70  -1.282   0.571 -11.360
  500   2HA   GLY  70          1HA       GLY  70  -0.060   1.837 -11.405
  501    H    GLN  71           H        GLN  71   1.088   0.828  -8.772
  502    HA   GLN  71           HA       GLN  71   2.815  -1.220 -10.022
  503   1HB   GLN  71          2HB       GLN  71   2.960   0.230  -7.358
  504   2HB   GLN  71          1HB       GLN  71   4.177  -0.908  -7.945
  505   1HG   GLN  71          2HG       GLN  71   4.862   0.505  -9.681
  506   2HG   GLN  71          1HG       GLN  71   3.364   1.418  -9.684
  507   1HE2  GLN  71          1HE2      GLN  71   2.974   2.641  -7.430
  508   2HE2  GLN  71          2HE2      GLN  71   4.355   3.373  -6.763
  509    H    ILE  72           H        ILE  72   0.478  -0.901  -7.447
  510    HA   ILE  72           HA       ILE  72   0.916  -3.443  -6.221
  511    HB   ILE  72           HB       ILE  72  -1.463  -1.597  -6.438
  512   1HG1  ILE  72          2HG1      ILE  72   0.142  -2.317  -3.971
  513   2HG1  ILE  72          1HG1      ILE  72   0.723  -1.100  -5.109
  514   1HG2  ILE  72          1HG2      ILE  72  -2.104  -3.205  -4.304
  515   2HG2  ILE  72          2HG2      ILE  72  -1.372  -4.386  -5.388
  516   3HG2  ILE  72          3HG2      ILE  72  -2.750  -3.435  -5.925
  517   1HD1  ILE  72          1HD1      ILE  72  -0.881   0.412  -4.530
  518   2HD1  ILE  72          2HD1      ILE  72  -0.859  -0.498  -3.024
  519   3HD1  ILE  72          3HD1      ILE  72  -2.104  -0.817  -4.229
  520    H    ASP  73           H        ASP  73  -1.008  -2.410  -9.016
  521    HA   ASP  73           HA       ASP  73  -2.211  -5.020  -9.463
  522   1HB   ASP  73          2HB       ASP  73  -3.075  -2.768 -10.342
  523   2HB   ASP  73          1HB       ASP  73  -1.781  -2.852 -11.536
  524    H    ASP  74           H        ASP  74   0.566  -3.232 -10.842
  525    HA   ASP  74           HA       ASP  74   1.359  -5.241 -12.732
  526   1HB   ASP  74          2HB       ASP  74   3.176  -3.284 -11.314
  527   2HB   ASP  74          1HB       ASP  74   3.483  -4.076 -12.855
  528    H    ALA  75           H        ALA  75   2.396  -4.648  -9.386
  529    HA   ALA  75           HA       ALA  75   4.347  -6.748  -9.384
  530   1HB   ALA  75          1HB       ALA  75   4.097  -6.501  -6.836
  531   2HB   ALA  75          2HB       ALA  75   2.932  -5.224  -7.194
  532   3HB   ALA  75          3HB       ALA  75   4.606  -5.065  -7.725
  533    H    LEU  76           H        LEU  76   0.907  -6.627  -8.635
  534    HA   LEU  76           HA       LEU  76   0.840  -9.190  -7.326
  535   1HB   LEU  76          2HB       LEU  76  -0.882  -7.393  -7.077
  536   2HB   LEU  76          1HB       LEU  76  -1.411  -7.702  -8.723
  537    HG   LEU  76           HG       LEU  76  -1.296 -10.096  -6.919
  538   1HD1  LEU  76          1HD1      LEU  76  -3.642  -9.457  -6.063
  539   2HD1  LEU  76          2HD1      LEU  76  -3.229  -7.804  -6.520
  540   3HD1  LEU  76          3HD1      LEU  76  -2.270  -8.648  -5.304
  541   1HD2  LEU  76          1HD2      LEU  76  -3.265  -9.024  -8.970
  542   2HD2  LEU  76          2HD2      LEU  76  -3.502 -10.522  -8.073
  543   3HD2  LEU  76          3HD2      LEU  76  -2.138 -10.361  -9.183
  544    H    LYS  77           H        LYS  77  -0.035  -8.216 -10.670
  545    HA   LYS  77           HA       LYS  77  -0.690 -10.844 -11.562
  546   1HB   LYS  77          2HB       LYS  77  -0.126 -10.031 -13.840
  547   2HB   LYS  77          1HB       LYS  77  -1.159  -8.894 -12.980
  548   1HG   LYS  77          2HG       LYS  77   0.812  -7.527 -12.397
  549   2HG   LYS  77          1HG       LYS  77   1.865  -8.667 -13.208
  550   1HD   LYS  77          2HD       LYS  77  -0.332  -7.103 -14.575
  551   2HD   LYS  77          1HD       LYS  77   1.367  -6.653 -14.555
  552   1HE   LYS  77          2HE       LYS  77   1.189  -7.791 -16.589
  553   2HE   LYS  77          1HE       LYS  77   1.794  -9.043 -15.502
  554   1HZ   LYS  77          1HZ       LYS  77  -1.067  -8.838 -15.503
  555   2HZ   LYS  77          2HZ       LYS  77  -0.080 -10.202 -15.716
  556   3HZ   LYS  77          3HZ       LYS  77  -0.448  -9.204 -17.041
  557    H    LEU  78           H        LEU  78   2.377  -9.143 -11.243
  558    HA   LEU  78           HA       LEU  78   4.021 -11.048 -12.549
  559   1HB   LEU  78          2HB       LEU  78   4.505  -8.653 -11.417
  560   2HB   LEU  78          1HB       LEU  78   5.045  -9.666 -10.088
  561    HG   LEU  78           HG       LEU  78   6.959  -9.214 -11.483
  562   1HD1  LEU  78          1HD1      LEU  78   6.145 -11.994 -12.325
  563   2HD1  LEU  78          2HD1      LEU  78   6.451 -11.620 -10.627
  564   3HD1  LEU  78          3HD1      LEU  78   7.730 -11.408 -11.821
  565   1HD2  LEU  78          1HD2      LEU  78   5.136  -9.092 -13.616
  566   2HD2  LEU  78          2HD2      LEU  78   6.064 -10.551 -13.959
  567   3HD2  LEU  78          3HD2      LEU  78   6.893  -9.013 -13.745
  568    H    ALA  79           H        ALA  79   3.098 -10.769  -9.107
  569    HA   ALA  79           HA       ALA  79   4.418 -13.124  -8.228
  570   1HB   ALA  79          1HB       ALA  79   2.369 -13.128  -6.534
  571   2HB   ALA  79          2HB       ALA  79   2.037 -11.561  -7.267
  572   3HB   ALA  79          3HB       ALA  79   3.577 -11.842  -6.457
  573    H    ASN  80           H        ASN  80   1.005 -12.727  -9.220
  574    HA   ASN  80           HA       ASN  80   0.352 -15.494  -9.175
  575   1HB   ASN  80          2HB       ASN  80  -0.766 -13.124 -10.655
  576   2HB   ASN  80          1HB       ASN  80  -1.422 -14.737 -10.913
  577   1HD2  ASN  80          1HD2      ASN  80  -2.491 -12.268  -9.504
  578   2HD2  ASN  80          2HD2      ASN  80  -3.017 -12.824  -7.990
  579    H    GLU  81           H        GLU  81   0.961 -13.490 -12.063
  580    HA   GLU  81           HA       GLU  81   1.397 -15.782 -13.773
  581   1HB   GLU  81          2HB       GLU  81   0.621 -13.354 -14.357
  582   2HB   GLU  81          1HB       GLU  81   2.344 -12.986 -14.408
  583   1HG   GLU  81          2HG       GLU  81   1.825 -13.581 -16.638
  584   2HG   GLU  81          1HG       GLU  81   2.532 -15.051 -15.970
  585    H    GLY  82           H        GLY  82   3.291 -14.914 -11.318
  586   1HA   GLY  82          2HA       GLY  82   5.777 -15.707 -12.756
  587   2HA   GLY  82          1HA       GLY  82   5.818 -14.280 -11.760
  588    H    LYS  83           H        LYS  83   7.502 -16.344 -11.237
  589    HA   LYS  83           HA       LYS  83   6.436 -18.134  -9.203
  590   1HB   LYS  83          2HB       LYS  83   8.604 -18.347 -10.737
  591   2HB   LYS  83          1HB       LYS  83   9.372 -17.436  -9.439
  592   1HG   LYS  83          2HG       LYS  83   8.876 -19.139  -7.829
  593   2HG   LYS  83          1HG       LYS  83   7.780 -19.962  -8.931
  594   1HD   LYS  83          2HD       LYS  83   9.764 -20.329 -10.458
  595   2HD   LYS  83          1HD       LYS  83  10.779 -19.731  -9.142
  596   1HE   LYS  83          2HE       LYS  83   9.895 -21.491  -7.660
  597   2HE   LYS  83          1HE       LYS  83   8.885 -22.091  -8.978
  598   1HZ   LYS  83          1HZ       LYS  83  11.354 -22.969  -8.468
  599   2HZ   LYS  83          2HZ       LYS  83  11.682 -21.766  -9.623
  600   3HZ   LYS  83          3HZ       LYS  83  10.619 -23.037  -9.995
  601    H    VAL  84           H        VAL  84   8.024 -17.917  -6.978
  602    HA   VAL  84           HA       VAL  84   7.111 -15.395  -5.818
  603    HB   VAL  84           HB       VAL  84   9.011 -17.365  -4.504
  604   1HG1  VAL  84          1HG1      VAL  84   8.705 -15.263  -3.324
  605   2HG1  VAL  84          2HG1      VAL  84   7.850 -16.531  -2.448
  606   3HG1  VAL  84          3HG1      VAL  84   6.952 -15.397  -3.459
  607   1HG2  VAL  84          1HG2      VAL  84   7.248 -18.808  -5.137
  608   2HG2  VAL  84          2HG2      VAL  84   6.023 -17.563  -4.895
  609   3HG2  VAL  84          3HG2      VAL  84   6.822 -18.299  -3.505
  610    H    LYS  85           H        LYS  85  10.199 -16.844  -6.834
  611    HA   LYS  85           HA       LYS  85  11.938 -14.832  -5.774
  612   1HB   LYS  85          2HB       LYS  85  12.150 -16.912  -7.932
  613   2HB   LYS  85          1HB       LYS  85  13.357 -15.630  -7.937
  614   1HG   LYS  85          2HG       LYS  85  14.272 -17.405  -6.627
  615   2HG   LYS  85          1HG       LYS  85  13.760 -16.177  -5.474
  616   1HD   LYS  85          2HD       LYS  85  11.651 -17.399  -5.104
  617   2HD   LYS  85          1HD       LYS  85  12.167 -18.630  -6.260
  618   1HE   LYS  85          2HE       LYS  85  13.473 -17.930  -3.623
  619   2HE   LYS  85          1HE       LYS  85  12.683 -19.449  -4.050
  620   1HZ   LYS  85          1HZ       LYS  85  15.273 -18.384  -4.950
  621   2HZ   LYS  85          2HZ       LYS  85  14.420 -19.467  -5.947
  622   3HZ   LYS  85          3HZ       LYS  85  14.889 -19.935  -4.384
  623    H    GLU  86           H        GLU  86  10.536 -15.142  -9.072
  624    HA   GLU  86           HA       GLU  86  11.566 -12.674 -10.052
  625   1HB   GLU  86          2HB       GLU  86   8.866 -13.861 -10.753
  626   2HB   GLU  86          1HB       GLU  86   9.864 -12.805 -11.753
  627   1HG   GLU  86          2HG       GLU  86  10.646 -15.580 -10.834
  628   2HG   GLU  86          1HG       GLU  86  10.070 -15.166 -12.451
  629    H    ALA  87           H        ALA  87   8.677 -13.436  -8.170
  630    HA   ALA  87           HA       ALA  87   7.509 -10.821  -8.362
  631   1HB   ALA  87          1HB       ALA  87   5.861 -11.673  -6.995
  632   2HB   ALA  87          2HB       ALA  87   7.015 -12.457  -5.912
  633   3HB   ALA  87          3HB       ALA  87   6.617 -13.193  -7.458
  634    H    GLN  88           H        GLN  88   9.556 -12.321  -5.834
  635    HA   GLN  88           HA       GLN  88   9.594 -10.056  -4.114
  636   1HB   GLN  88          2HB       GLN  88  11.054 -11.290  -2.831
  637   2HB   GLN  88          1HB       GLN  88  10.508 -12.577  -3.891
  638   1HG   GLN  88          2HG       GLN  88  12.842 -12.769  -3.905
  639   2HG   GLN  88          1HG       GLN  88  12.484 -11.942  -5.408
  640   1HE2  GLN  88          1HE2      GLN  88  12.233 -10.120  -2.390
  641   2HE2  GLN  88          2HE2      GLN  88  13.652  -9.221  -2.608
  642    H    ALA  89           H        ALA  89  11.384 -10.825  -7.019
  643    HA   ALA  89           HA       ALA  89  13.439  -8.857  -6.832
  644   1HB   ALA  89          1HB       ALA  89  13.014 -10.706  -8.657
  645   2HB   ALA  89          2HB       ALA  89  13.751  -9.182  -9.150
  646   3HB   ALA  89          3HB       ALA  89  12.034  -9.467  -9.441
  647    H    ALA  90           H        ALA  90  10.179  -8.704  -8.247
  648    HA   ALA  90           HA       ALA  90  10.221  -5.962  -8.958
  649   1HB   ALA  90          1HB       ALA  90   7.855  -7.638  -8.066
  650   2HB   ALA  90          2HB       ALA  90   8.471  -7.535  -9.716
  651   3HB   ALA  90          3HB       ALA  90   7.766  -6.115  -8.948
  652    H    ALA  91           H        ALA  91   9.404  -7.563  -5.896
  653    HA   ALA  91           HA       ALA  91   8.385  -5.218  -4.612
  654   1HB   ALA  91          1HB       ALA  91   8.812  -6.439  -2.500
  655   2HB   ALA  91          2HB       ALA  91   9.732  -7.652  -3.394
  656   3HB   ALA  91          3HB       ALA  91   8.002  -7.457  -3.691
  657    H    GLU  92           H        GLU  92  11.671  -6.589  -4.771
  658    HA   GLU  92           HA       GLU  92  12.919  -4.808  -2.955
  659   1HB   GLU  92          2HB       GLU  92  14.142  -6.000  -5.458
  660   2HB   GLU  92          1HB       GLU  92  15.016  -5.416  -4.043
  661   1HG   GLU  92          2HG       GLU  92  12.913  -7.429  -3.413
  662   2HG   GLU  92          1HG       GLU  92  14.221  -8.046  -4.415
  663    H    GLN  93           H        GLN  93  12.687  -4.488  -6.534
  664    HA   GLN  93           HA       GLN  93  13.944  -1.918  -6.583
  665   1HB   GLN  93          2HB       GLN  93  12.646  -1.634  -8.774
  666   2HB   GLN  93          1HB       GLN  93  13.722  -3.024  -8.676
  667   1HG   GLN  93          2HG       GLN  93  11.820  -4.475  -8.106
  668   2HG   GLN  93          1HG       GLN  93  10.731  -3.087  -8.172
  669   1HE2  GLN  93          1HE2      GLN  93  12.789  -5.200 -10.163
  670   2HE2  GLN  93          2HE2      GLN  93  12.115  -4.741 -11.652
  671    H    LEU  94           H        LEU  94  10.605  -2.894  -5.976
  672    HA   LEU  94           HA       LEU  94   9.634  -0.136  -5.963
  673   1HB   LEU  94          2HB       LEU  94   8.418  -2.802  -5.237
  674   2HB   LEU  94          1HB       LEU  94   7.571  -1.290  -4.908
  675    HG   LEU  94           HG       LEU  94   8.677  -1.820  -7.669
  676   1HD1  LEU  94          1HD1      LEU  94   7.369  -3.801  -7.267
  677   2HD1  LEU  94          2HD1      LEU  94   6.380  -2.717  -8.246
  678   3HD1  LEU  94          3HD1      LEU  94   6.080  -2.865  -6.515
  679   1HD2  LEU  94          1HD2      LEU  94   6.289  -0.268  -6.610
  680   2HD2  LEU  94          2HD2      LEU  94   6.756  -0.379  -8.306
  681   3HD2  LEU  94          3HD2      LEU  94   7.807   0.434  -7.154
  682    H    LYS  95           H        LYS  95  10.908  -2.428  -3.612
  683    HA   LYS  95           HA       LYS  95   9.959  -0.967  -1.290
  684   1HB   LYS  95          2HB       LYS  95  11.048  -3.428  -1.552
  685   2HB   LYS  95          1HB       LYS  95  12.506  -2.553  -1.115
  686   1HG   LYS  95          2HG       LYS  95   9.930  -2.733   0.474
  687   2HG   LYS  95          1HG       LYS  95  11.500  -3.404   0.901
  688   1HD   LYS  95          2HD       LYS  95  12.338  -0.940   0.784
  689   2HD   LYS  95          1HD       LYS  95  10.631  -0.516   0.879
  690   1HE   LYS  95          2HE       LYS  95  11.743  -0.572   3.118
  691   2HE   LYS  95          1HE       LYS  95  10.392  -1.695   2.991
  692   1HZ   LYS  95          1HZ       LYS  95  12.386  -2.665   4.037
  693   2HZ   LYS  95          2HZ       LYS  95  13.241  -2.437   2.588
  694   3HZ   LYS  95          3HZ       LYS  95  11.914  -3.496   2.633
  695    H    THR  96           H        THR  96  12.862  -0.874  -3.299
  696    HA   THR  96           HA       THR  96  14.265   1.033  -1.659
  697    HB   THR  96           HB       THR  96  14.640   0.686  -4.639
  698    HG1  THR  96           1HG      THR  96  14.892  -1.157  -2.602
  699   1HG2  THR  96          1HG2      THR  96  16.866   1.281  -4.213
  700   2HG2  THR  96          2HG2      THR  96  16.753   0.838  -2.510
  701   3HG2  THR  96          3HG2      THR  96  15.977   2.309  -3.090
  702    H    THR  97           H        THR  97  12.041   1.237  -4.433
  703    HA   THR  97           HA       THR  97  12.152   4.192  -4.350
  704    HB   THR  97           HB       THR  97  10.832   2.164  -6.178
  705    HG1  THR  97           1HG      THR  97  13.172   3.434  -6.131
  706   1HG2  THR  97          1HG2      THR  97  10.380   4.370  -7.527
  707   2HG2  THR  97          2HG2      THR  97  10.439   5.130  -5.939
  708   3HG2  THR  97          3HG2      THR  97   9.250   3.874  -6.278
  709    H    GLY  98           H        GLY  98   9.273   2.344  -5.062
  710   1HA   GLY  98          2HA       GLY  98   7.127   2.454  -4.130
  711   2HA   GLY  98          1HA       GLY  98   7.966   2.267  -2.590
  712    H    ARG  99           H        ARG  99   9.024   5.011  -4.253
  713    HA   ARG  99           HA       ARG  99   8.613   7.305  -3.990
  714   1HB   ARG  99          2HB       ARG  99   6.137   6.330  -4.300
  715   2HB   ARG  99          1HB       ARG  99   5.992   6.782  -2.607
  716   1HG   ARG  99          2HG       ARG  99   5.410   8.840  -3.455
  717   2HG   ARG  99          1HG       ARG  99   7.148   9.065  -3.623
  718   1HD   ARG  99          2HD       ARG  99   5.215   8.089  -5.742
  719   2HD   ARG  99          1HD       ARG  99   6.122   9.601  -5.747
  720    HE   ARG  99           HE       ARG  99   7.179   6.948  -6.431
  721   1HH1  ARG  99          1HH2      ARG  99   7.793  10.167  -5.388
  722   2HH1  ARG  99          2HH2      ARG  99   9.417  10.198  -5.989
  723   1HH2  ARG  99          1HH1      ARG  99   9.285   6.968  -7.257
  724   2HH2  ARG  99          2HH1      ARG  99  10.254   8.394  -7.081
  725    H    ALA 100           H        ALA 100   7.025   5.718  -1.217
  726    HA   ALA 100           HA       ALA 100   7.662   5.649   1.041
  727   1HB   ALA 100          1HB       ALA 100   9.926   7.579   0.585
  728   2HB   ALA 100          2HB       ALA 100  10.069   5.938  -0.047
  729   3HB   ALA 100          3HB       ALA 100   9.835   6.198   1.680
  730    H    GLY 101           H        GLY 101   7.407   8.557  -0.826
  731   1HA   GLY 101          2HA       GLY 101   5.737   9.803   1.217
  732   2HA   GLY 101          1HA       GLY 101   7.293  10.596   0.990
  733    H    ASN 102           H        ASN 102   7.797  11.477  -1.122
  734    HA   ASN 102           HA       ASN 102   5.649  11.613  -3.135
  735   1HB   ASN 102          2HB       ASN 102   6.772  14.109  -1.819
  736   2HB   ASN 102          1HB       ASN 102   5.670  14.090  -3.180
  737   1HD2  ASN 102          1HD2      ASN 102   5.509  14.904  -0.132
  738   2HD2  ASN 102          2HD2      ASN 102   4.023  14.244   0.356
  739    H    GLN 103           H        GLN 103   7.208  14.105  -4.134
  740    HA   GLN 103           HA       GLN 103   9.764  12.819  -4.923
  741   1HB   GLN 103          2HB       GLN 103   7.817  12.495  -6.641
  742   2HB   GLN 103          1HB       GLN 103   8.060  14.206  -6.996
  743   1HG   GLN 103          2HG       GLN 103  10.512  13.701  -7.307
  744   2HG   GLN 103          1HG       GLN 103  10.107  11.987  -7.223
  745   1HE2  GLN 103          1HE2      GLN 103   8.234  14.616  -8.801
  746   2HE2  GLN 103          2HE2      GLN 103   8.300  13.936 -10.354
  747    H    LYS 104           H        LYS 104   7.943  15.721  -5.913
  748    HA   LYS 104           HA       LYS 104  10.377  17.341  -5.480
  749   1HB   LYS 104          2HB       LYS 104   9.435  18.881  -6.945
  750   2HB   LYS 104          1HB       LYS 104   8.688  17.395  -7.524
  751   1HG   LYS 104          2HG       LYS 104   6.758  17.984  -5.820
  752   2HG   LYS 104          1HG       LYS 104   7.465  19.605  -5.860
  753   1HD   LYS 104          2HD       LYS 104   7.259  19.654  -8.310
  754   2HD   LYS 104          1HD       LYS 104   6.572  18.033  -8.288
  755   1HE   LYS 104          2HE       LYS 104   4.733  19.555  -8.452
  756   2HE   LYS 104          1HE       LYS 104   4.729  18.943  -6.801
  757   1HZ   LYS 104          1HZ       LYS 104   5.027  20.989  -6.027
  758   2HZ   LYS 104          2HZ       LYS 104   4.800  21.577  -7.601
  759   3HZ   LYS 104          3HZ       LYS 104   6.367  21.253  -7.028
  760    H    GLY 105           H        GLY 105   7.260  16.682  -4.218
  761   1HA   GLY 105          2HA       GLY 105   7.385  18.930  -2.286
  762   2HA   GLY 105          1HA       GLY 105   5.987  17.885  -2.596
  763    H    GLY 106           H        GLY 106   8.678  15.978  -2.622
  764   1HA   GLY 106          2HA       GLY 106   8.174  14.994   0.133
  765   2HA   GLY 106          1HA       GLY 106   9.017  14.111  -1.144
  Start of MODEL    3
    1   1H    ALA   1          1HT       ALA   1 -22.194  -9.769  18.107
    2   2H    ALA   1          2HT       ALA   1 -23.866 -10.016  17.895
    3   3H    ALA   1          3HT       ALA   1 -22.908  -9.478  16.594
    4    HA   ALA   1           HA       ALA   1 -21.658 -11.770  17.319
    5   1HB   ALA   1          1HB       ALA   1 -23.550 -13.428  17.396
    6   2HB   ALA   1          2HB       ALA   1 -24.657 -12.073  17.620
    7   3HB   ALA   1          3HB       ALA   1 -23.427 -12.417  18.834
    8    H    ASP   2           H        ASP   2 -21.422 -10.341  15.157
    9    HA   ASP   2           HA       ASP   2 -23.196 -11.279  12.994
   10   1HB   ASP   2          2HB       ASP   2 -20.766  -9.450  12.940
   11   2HB   ASP   2          1HB       ASP   2 -21.861  -9.736  11.582
   12    H    LEU   3           H        LEU   3 -22.749 -13.364  12.352
   13    HA   LEU   3           HA       LEU   3 -19.947 -14.315  12.307
   14   1HB   LEU   3          2HB       LEU   3 -21.242 -16.452  11.433
   15   2HB   LEU   3          1HB       LEU   3 -21.287 -16.039  13.142
   16    HG   LEU   3           HG       LEU   3 -23.386 -14.856  11.339
   17   1HD1  LEU   3          1HD1      LEU   3 -24.810 -16.841  11.625
   18   2HD1  LEU   3          2HD1      LEU   3 -23.462 -17.702  12.374
   19   3HD1  LEU   3          3HD1      LEU   3 -23.366 -17.204  10.683
   20   1HD2  LEU   3          1HD2      LEU   3 -24.690 -14.747  13.275
   21   2HD2  LEU   3          2HD2      LEU   3 -23.072 -14.461  13.913
   22   3HD2  LEU   3          3HD2      LEU   3 -23.814 -16.049  14.079
   23    H    GLU   4           H        GLU   4 -21.871 -12.582  10.216
   24    HA   GLU   4           HA       GLU   4 -21.253 -14.006   7.740
   25   1HB   GLU   4          2HB       GLU   4 -21.959 -11.533   6.854
   26   2HB   GLU   4          1HB       GLU   4 -23.149 -12.736   7.346
   27   1HG   GLU   4          2HG       GLU   4 -23.418 -11.746   9.501
   28   2HG   GLU   4          1HG       GLU   4 -21.978 -10.746   9.305
   29    H    ASP   5           H        ASP   5 -20.457 -10.603   8.399
   30    HA   ASP   5           HA       ASP   5 -17.990 -10.850   6.881
   31   1HB   ASP   5          2HB       ASP   5 -17.695  -8.426   7.632
   32   2HB   ASP   5          1HB       ASP   5 -19.137  -8.765   6.686
   33    H    ASN   6           H        ASN   6 -16.148 -11.640   7.736
   34    HA   ASN   6           HA       ASN   6 -15.339 -10.827  10.470
   35   1HB   ASN   6          2HB       ASN   6 -15.318 -13.713   9.538
   36   2HB   ASN   6          1HB       ASN   6 -14.740 -13.118  11.095
   37   1HD2  ASN   6          1HD2      ASN   6 -17.642 -13.842   9.207
   38   2HD2  ASN   6          2HD2      ASN   6 -18.732 -13.672  10.497
   39    H    ASP   7           H        ASP   7 -13.252 -13.065  10.042
   40    HA   ASP   7           HA       ASP   7 -11.642 -11.818   7.872
   41   1HB   ASP   7          2HB       ASP   7 -10.684 -12.127  10.742
   42   2HB   ASP   7          1HB       ASP   7  -9.679 -11.625   9.378
   43    H    GLU   8           H        GLU   8 -12.990 -14.488   8.422
   44    HA   GLU   8           HA       GLU   8 -12.474 -16.781   8.293
   45   1HB   GLU   8          2HB       GLU   8 -10.090 -15.750   6.748
   46   2HB   GLU   8          1HB       GLU   8 -10.849 -17.334   6.592
   47   1HG   GLU   8          2HG       GLU   8 -12.215 -14.690   5.996
   48   2HG   GLU   8          1HG       GLU   8 -11.539 -15.772   4.778
   49    H    THR   9           H        THR   9 -11.194 -15.142  10.514
   50    HA   THR   9           HA       THR   9  -8.749 -16.776  11.030
   51    HB   THR   9           HB       THR   9  -8.669 -14.273  11.350
   52    HG1  THR   9           1HG      THR   9  -8.345 -15.786  13.730
   53   1HG2  THR   9          1HG2      THR   9 -11.074 -14.278  12.303
   54   2HG2  THR   9          2HG2      THR   9  -9.890 -13.218  13.067
   55   3HG2  THR   9          3HG2      THR   9 -10.319 -14.753  13.826
   56    H    GLY  10           H        GLY  10 -11.667 -17.608  11.185
   57   1HA   GLY  10          2HA       GLY  10 -11.420 -19.084  13.726
   58   2HA   GLY  10          1HA       GLY  10 -12.820 -18.008  13.608
   59    H    ASN  11           H        ASN  11 -11.612 -19.458  10.684
   60    HA   ASN  11           HA       ASN  11 -14.164 -20.832  10.308
   61   1HB   ASN  11          2HB       ASN  11 -13.413 -21.146   8.041
   62   2HB   ASN  11          1HB       ASN  11 -12.933 -19.516   8.534
   63   1HD2  ASN  11          1HD2      ASN  11 -11.407 -20.483   6.489
   64   2HD2  ASN  11          2HD2      ASN  11  -9.889 -21.005   7.036
   65    H    ASP  12           H        ASP  12 -12.657 -22.910   8.588
   66    HA   ASP  12           HA       ASP  12 -12.140 -24.815  10.840
   67   1HB   ASP  12          2HB       ASP  12 -13.036 -25.229   7.982
   68   2HB   ASP  12          1HB       ASP  12 -12.471 -26.561   8.987
   69    H    ASN  13           H        ASN  13 -10.352 -22.890   8.882
   70    HA   ASN  13           HA       ASN  13  -7.995 -24.646   9.127
   71   1HB   ASN  13          2HB       ASN  13  -9.375 -24.055   6.547
   72   2HB   ASN  13          1HB       ASN  13  -7.619 -23.982   6.526
   73   1HD2  ASN  13          1HD2      ASN  13  -6.431 -26.010   6.862
   74   2HD2  ASN  13          2HD2      ASN  13  -7.215 -27.515   6.873
   75    H    GLY  14           H        GLY  14  -9.090 -21.903   9.910
   76   1HA   GLY  14          2HA       GLY  14  -7.167 -20.058   8.655
   77   2HA   GLY  14          1HA       GLY  14  -8.358 -19.624   9.878
   78    H    LYS  15           H        LYS  15  -6.273 -22.396  10.300
   79    HA   LYS  15           HA       LYS  15  -5.185 -21.173  12.737
   80   1HB   LYS  15          2HB       LYS  15  -3.858 -23.473  12.716
   81   2HB   LYS  15          1HB       LYS  15  -5.561 -23.432  13.152
   82   1HG   LYS  15          2HG       LYS  15  -5.058 -25.248  11.540
   83   2HG   LYS  15          1HG       LYS  15  -6.200 -24.080  10.884
   84   1HD   LYS  15          2HD       LYS  15  -4.605 -23.146   9.426
   85   2HD   LYS  15          1HD       LYS  15  -3.240 -23.749  10.368
   86   1HE   LYS  15          2HE       LYS  15  -3.619 -24.983   8.206
   87   2HE   LYS  15          1HE       LYS  15  -3.666 -26.020   9.632
   88   1HZ   LYS  15          1HZ       LYS  15  -5.515 -26.338   7.992
   89   2HZ   LYS  15          2HZ       LYS  15  -6.084 -24.800   8.443
   90   3HZ   LYS  15          3HZ       LYS  15  -6.004 -26.048   9.590
   91    H    GLY  16           H        GLY  16  -4.351 -20.998   9.505
   92   1HA   GLY  16          2HA       GLY  16  -1.410 -20.990   9.989
   93   2HA   GLY  16          1HA       GLY  16  -2.193 -20.877   8.411
   94    H    GLY  17           H        GLY  17  -4.085 -18.843   9.793
   95   1HA   GLY  17          2HA       GLY  17  -4.134 -16.505  10.017
   96   2HA   GLY  17          1HA       GLY  17  -2.430 -16.600  10.477
   97    H    GLU  18           H        GLU  18  -4.483 -16.940   7.573
   98    HA   GLU  18           HA       GLU  18  -4.102 -16.263   5.357
   99   1HB   GLU  18          2HB       GLU  18  -3.686 -14.088   6.816
  100   2HB   GLU  18          1HB       GLU  18  -2.010 -14.327   6.337
  101   1HG   GLU  18          2HG       GLU  18  -3.030 -12.848   4.725
  102   2HG   GLU  18          1HG       GLU  18  -2.802 -14.408   3.932
  103    H    LYS  19           H        LYS  19  -2.168 -18.159   6.928
  104    HA   LYS  19           HA       LYS  19  -0.154 -19.285   6.533
  105   1HB   LYS  19          2HB       LYS  19  -1.249 -20.286   4.740
  106   2HB   LYS  19          1HB       LYS  19  -1.312 -18.804   3.808
  107   1HG   LYS  19          2HG       LYS  19   0.781 -19.133   2.889
  108   2HG   LYS  19          1HG       LYS  19   1.467 -19.738   4.396
  109   1HD   LYS  19          2HD       LYS  19   1.452 -21.543   2.770
  110   2HD   LYS  19          1HD       LYS  19   0.252 -21.902   4.012
  111   1HE   LYS  19          2HE       LYS  19  -1.554 -21.197   2.595
  112   2HE   LYS  19          1HE       LYS  19  -0.443 -20.512   1.411
  113   1HZ   LYS  19          1HZ       LYS  19  -0.946 -22.536   0.485
  114   2HZ   LYS  19          2HZ       LYS  19  -1.059 -23.329   1.979
  115   3HZ   LYS  19          3HZ       LYS  19   0.462 -22.925   1.341
  116    H    ALA  20           H        ALA  20   1.505 -18.205   7.226
  117    HA   ALA  20           HA       ALA  20   2.666 -15.980   5.631
  118   1HB   ALA  20          1HB       ALA  20   4.024 -15.509   7.559
  119   2HB   ALA  20          2HB       ALA  20   3.591 -17.049   8.307
  120   3HB   ALA  20          3HB       ALA  20   2.382 -15.773   8.150
  121    H    ASP  21           H        ASP  21   3.448 -17.403   3.883
  122    HA   ASP  21           HA       ASP  21   5.962 -18.747   4.650
  123   1HB   ASP  21          2HB       ASP  21   4.045 -20.381   4.773
  124   2HB   ASP  21          1HB       ASP  21   3.877 -20.184   3.029
  125    H    ASN  22           H        ASN  22   3.805 -18.045   1.779
  126    HA   ASN  22           HA       ASN  22   6.168 -16.950   0.464
  127   1HB   ASN  22          2HB       ASN  22   5.569 -19.737   0.180
  128   2HB   ASN  22          1HB       ASN  22   5.277 -18.988  -1.378
  129   1HD2  ASN  22          1HD2      ASN  22   7.121 -17.527  -2.174
  130   2HD2  ASN  22          2HD2      ASN  22   8.703 -18.057  -1.847
  131    H    ALA  23           H        ALA  23   3.280 -18.456  -0.986
  132    HA   ALA  23           HA       ALA  23   2.919 -16.071  -2.643
  133   1HB   ALA  23          1HB       ALA  23   2.699 -18.485  -3.445
  134   2HB   ALA  23          2HB       ALA  23   1.408 -17.385  -3.932
  135   3HB   ALA  23          3HB       ALA  23   1.145 -18.526  -2.610
  136    H    ALA  24           H        ALA  24   1.018 -17.608  -0.058
  137    HA   ALA  24           HA       ALA  24  -1.308 -16.003  -0.481
  138   1HB   ALA  24          1HB       ALA  24  -0.279 -17.187   2.105
  139   2HB   ALA  24          2HB       ALA  24  -1.289 -18.019   0.924
  140   3HB   ALA  24          3HB       ALA  24  -1.925 -16.630   1.807
  141    H    GLN  25           H        GLN  25   1.198 -15.574   2.010
  142    HA   GLN  25           HA       GLN  25   0.307 -13.042   2.910
  143   1HB   GLN  25          2HB       GLN  25   2.205 -13.101   4.243
  144   2HB   GLN  25          1HB       GLN  25   2.051 -14.796   3.793
  145   1HG   GLN  25          2HG       GLN  25   4.305 -14.447   3.378
  146   2HG   GLN  25          1HG       GLN  25   3.620 -14.122   1.783
  147   1HE2  GLN  25          1HE2      GLN  25   4.358 -12.188   0.881
  148   2HE2  GLN  25          2HE2      GLN  25   4.834 -10.816   1.759
  149    H    VAL  26           H        VAL  26   2.126 -13.928   0.095
  150    HA   VAL  26           HA       VAL  26   3.278 -11.326  -0.334
  151    HB   VAL  26           HB       VAL  26   3.004 -13.846  -1.919
  152   1HG1  VAL  26          1HG1      VAL  26   3.398 -11.124  -3.158
  153   2HG1  VAL  26          2HG1      VAL  26   2.485 -12.502  -3.766
  154   3HG1  VAL  26          3HG1      VAL  26   4.245 -12.519  -3.832
  155   1HG2  VAL  26          1HG2      VAL  26   4.932 -13.365  -0.404
  156   2HG2  VAL  26          2HG2      VAL  26   5.344 -11.987  -1.427
  157   3HG2  VAL  26          3HG2      VAL  26   5.414 -13.620  -2.082
  158    H    LYS  27           H        LYS  27   0.320 -12.936  -1.624
  159    HA   LYS  27           HA       LYS  27  -0.457 -10.711  -3.255
  160   1HB   LYS  27          2HB       LYS  27  -1.986 -12.983  -1.982
  161   2HB   LYS  27          1HB       LYS  27  -2.850 -11.690  -2.803
  162   1HG   LYS  27          2HG       LYS  27  -1.812 -12.169  -4.886
  163   2HG   LYS  27          1HG       LYS  27  -0.582 -13.185  -4.134
  164   1HD   LYS  27          2HD       LYS  27  -2.336 -14.793  -3.458
  165   2HD   LYS  27          1HD       LYS  27  -3.557 -13.792  -4.236
  166   1HE   LYS  27          2HE       LYS  27  -2.099 -14.060  -6.374
  167   2HE   LYS  27          1HE       LYS  27  -1.351 -15.405  -5.509
  168   1HZ   LYS  27          1HZ       LYS  27  -4.261 -15.098  -6.015
  169   2HZ   LYS  27          2HZ       LYS  27  -3.520 -16.402  -5.220
  170   3HZ   LYS  27          3HZ       LYS  27  -3.222 -16.127  -6.871
  171    H    ASP  28           H        ASP  28  -1.527 -11.586   0.078
  172    HA   ASP  28           HA       ASP  28  -3.109  -9.274   0.493
  173   1HB   ASP  28          2HB       ASP  28  -3.085 -11.165   2.079
  174   2HB   ASP  28          1HB       ASP  28  -1.425 -10.759   2.534
  175    H    ALA  29           H        ALA  29   0.378  -9.661   0.558
  176    HA   ALA  29           HA       ALA  29   0.989  -7.229   1.960
  177   1HB   ALA  29          1HB       ALA  29   2.581  -9.176   1.413
  178   2HB   ALA  29          2HB       ALA  29   3.232  -7.552   1.188
  179   3HB   ALA  29          3HB       ALA  29   2.689  -8.490  -0.204
  180    H    LEU  30           H        LEU  30   0.751  -8.008  -1.499
  181    HA   LEU  30           HA       LEU  30   1.306  -5.422  -2.447
  182   1HB   LEU  30          2HB       LEU  30  -0.553  -7.467  -3.655
  183   2HB   LEU  30          1HB       LEU  30   0.256  -6.174  -4.518
  184    HG   LEU  30           HG       LEU  30   1.668  -8.383  -3.025
  185   1HD1  LEU  30          1HD1      LEU  30   2.201  -9.278  -5.265
  186   2HD1  LEU  30          2HD1      LEU  30   1.270  -7.974  -6.005
  187   3HD1  LEU  30          3HD1      LEU  30   0.454  -9.194  -5.029
  188   1HD2  LEU  30          1HD2      LEU  30   3.574  -7.421  -4.569
  189   2HD2  LEU  30          2HD2      LEU  30   3.190  -6.625  -3.050
  190   3HD2  LEU  30          3HD2      LEU  30   2.576  -5.970  -4.568
  191    H    THR  31           H        THR  31  -1.864  -6.905  -1.759
  192    HA   THR  31           HA       THR  31  -3.404  -4.562  -2.372
  193    HB   THR  31           HB       THR  31  -5.019  -5.829  -0.622
  194    HG1  THR  31           1HG      THR  31  -3.377  -7.933  -1.502
  195   1HG2  THR  31          1HG2      THR  31  -5.652  -5.720  -2.900
  196   2HG2  THR  31          2HG2      THR  31  -5.558  -7.445  -2.548
  197   3HG2  THR  31          3HG2      THR  31  -4.249  -6.653  -3.422
  198    H    LYS  32           H        LYS  32  -1.721  -5.631   0.513
  199    HA   LYS  32           HA       LYS  32  -2.979  -3.942   2.419
  200   1HB   LYS  32          2HB       LYS  32  -1.408  -5.760   2.999
  201   2HB   LYS  32          1HB       LYS  32  -0.082  -4.827   2.320
  202   1HG   LYS  32          2HG       LYS  32  -1.794  -3.493   4.406
  203   2HG   LYS  32          1HG       LYS  32  -0.687  -4.747   4.951
  204   1HD   LYS  32          2HD       LYS  32   1.101  -3.404   3.539
  205   2HD   LYS  32          1HD       LYS  32  -0.059  -2.084   3.679
  206   1HE   LYS  32          2HE       LYS  32   1.356  -3.575   5.889
  207   2HE   LYS  32          1HE       LYS  32   1.407  -1.847   5.533
  208   1HZ   LYS  32          1HZ       LYS  32  -0.855  -1.620   6.175
  209   2HZ   LYS  32          2HZ       LYS  32  -0.063  -2.467   7.416
  210   3HZ   LYS  32          3HZ       LYS  32  -1.055  -3.299   6.316
  211    H    MET  33           H        MET  33  -0.023  -3.379   0.482
  212    HA   MET  33           HA       MET  33   0.404  -0.700   1.368
  213   1HB   MET  33          2HB       MET  33   1.058  -1.831  -1.382
  214   2HB   MET  33          1HB       MET  33   1.794  -0.413  -0.633
  215   1HG   MET  33          2HG       MET  33   2.475  -2.010   1.281
  216   2HG   MET  33          1HG       MET  33   2.086  -3.310   0.159
  217   1HE   MET  33          1HE       MET  33   5.809  -3.560   0.000
  218   2HE   MET  33          2HE       MET  33   4.484  -4.415  -0.784
  219   3HE   MET  33          3HE       MET  33   4.337  -3.939   0.907
  220    H    ARG  34           H        ARG  34  -1.700  -2.004  -1.169
  221    HA   ARG  34           HA       ARG  34  -2.329   0.459  -2.447
  222   1HB   ARG  34          2HB       ARG  34  -3.129  -1.422  -3.592
  223   2HB   ARG  34          1HB       ARG  34  -3.770  -2.170  -2.138
  224   1HG   ARG  34          2HG       ARG  34  -5.622  -0.587  -2.075
  225   2HG   ARG  34          1HG       ARG  34  -4.925   0.332  -3.411
  226   1HD   ARG  34          2HD       ARG  34  -5.135  -1.766  -4.817
  227   2HD   ARG  34          1HD       ARG  34  -6.045  -2.477  -3.484
  228    HE   ARG  34           HE       ARG  34  -7.144   0.095  -4.236
  229   1HH1  ARG  34          1HH2      ARG  34  -6.855  -3.216  -5.100
  230   2HH1  ARG  34          2HH2      ARG  34  -8.400  -3.301  -5.879
  231   1HH2  ARG  34          1HH1      ARG  34  -9.150   0.059  -5.330
  232   2HH2  ARG  34          2HH1      ARG  34  -9.694  -1.423  -6.041
  233    H    ALA  35           H        ALA  35  -4.058  -1.162   0.246
  234    HA   ALA  35           HA       ALA  35  -6.007   0.868   0.626
  235   1HB   ALA  35          1HB       ALA  35  -4.846  -0.771   2.877
  236   2HB   ALA  35          2HB       ALA  35  -5.889  -1.488   1.649
  237   3HB   ALA  35          3HB       ALA  35  -6.502  -0.198   2.682
  238    H    ALA  36           H        ALA  36  -2.707   0.634   1.778
  239    HA   ALA  36           HA       ALA  36  -2.804   2.561   3.844
  240   1HB   ALA  36          1HB       ALA  36  -0.355   2.830   3.354
  241   2HB   ALA  36          2HB       ALA  36  -0.583   1.812   1.933
  242   3HB   ALA  36          3HB       ALA  36  -0.861   1.151   3.546
  243    H    ALA  37           H        ALA  37  -1.985   3.008   0.387
  244    HA   ALA  37           HA       ALA  37  -1.608   5.830   0.547
  245   1HB   ALA  37          1HB       ALA  37  -1.398   3.913  -1.454
  246   2HB   ALA  37          2HB       ALA  37  -1.204   5.646  -1.706
  247   3HB   ALA  37          3HB       ALA  37  -2.766   4.876  -2.011
  248    H    LEU  38           H        LEU  38  -4.494   3.872  -0.214
  249    HA   LEU  38           HA       LEU  38  -6.229   6.140  -0.599
  250   1HB   LEU  38          2HB       LEU  38  -7.046   3.387   0.392
  251   2HB   LEU  38          1HB       LEU  38  -8.064   4.568  -0.420
  252    HG   LEU  38           HG       LEU  38  -5.664   3.175  -1.642
  253   1HD1  LEU  38          1HD1      LEU  38  -7.513   2.194  -3.130
  254   2HD1  LEU  38          2HD1      LEU  38  -8.656   2.779  -1.917
  255   3HD1  LEU  38          3HD1      LEU  38  -7.437   1.585  -1.478
  256   1HD2  LEU  38          1HD2      LEU  38  -7.553   5.324  -2.619
  257   2HD2  LEU  38          2HD2      LEU  38  -6.769   4.236  -3.762
  258   3HD2  LEU  38          3HD2      LEU  38  -5.791   5.270  -2.719
  259    H    ASP  39           H        ASP  39  -5.476   4.107   2.227
  260    HA   ASP  39           HA       ASP  39  -7.297   5.383   4.004
  261   1HB   ASP  39          2HB       ASP  39  -5.867   3.258   4.411
  262   2HB   ASP  39          1HB       ASP  39  -4.591   4.379   4.898
  263    H    ALA  40           H        ALA  40  -3.985   6.246   3.051
  264    HA   ALA  40           HA       ALA  40  -3.702   8.405   4.944
  265   1HB   ALA  40          1HB       ALA  40  -1.898   9.144   3.166
  266   2HB   ALA  40          2HB       ALA  40  -2.247   7.575   2.440
  267   3HB   ALA  40          3HB       ALA  40  -1.641   7.664   4.092
  268    H    GLN  41           H        GLN  41  -5.409   8.092   1.960
  269    HA   GLN  41           HA       GLN  41  -5.315  10.851   1.170
  270   1HB   GLN  41          2HB       GLN  41  -6.701  10.216  -0.591
  271   2HB   GLN  41          1HB       GLN  41  -6.031   8.656  -0.160
  272   1HG   GLN  41          2HG       GLN  41  -8.227   8.673   1.470
  273   2HG   GLN  41          1HG       GLN  41  -8.826   9.668   0.147
  274   1HE2  GLN  41          1HE2      GLN  41  -9.397   6.783   1.031
  275   2HE2  GLN  41          2HE2      GLN  41  -9.250   5.894  -0.407
  276    H    LYS  42           H        LYS  42  -8.178  11.092   0.858
  277    HA   LYS  42           HA       LYS  42  -8.827  12.580   3.229
  278   1HB   LYS  42          2HB       LYS  42 -10.947  11.625   1.313
  279   2HB   LYS  42          1HB       LYS  42 -10.744  13.216   2.046
  280   1HG   LYS  42          2HG       LYS  42  -8.576  13.356   0.605
  281   2HG   LYS  42          1HG       LYS  42  -9.265  12.010  -0.297
  282   1HD   LYS  42          2HD       LYS  42 -10.540  14.737   0.100
  283   2HD   LYS  42          1HD       LYS  42  -9.849  14.110  -1.392
  284   1HE   LYS  42          2HE       LYS  42 -12.108  13.666  -1.745
  285   2HE   LYS  42          1HE       LYS  42 -11.599  12.149  -1.008
  286   1HZ   LYS  42          1HZ       LYS  42 -13.308  14.238   0.043
  287   2HZ   LYS  42          2HZ       LYS  42 -12.176  13.634   1.146
  288   3HZ   LYS  42          3HZ       LYS  42 -13.279  12.581   0.401
  289    H    ALA  43           H        ALA  43  -8.160  10.209   4.284
  290    HA   ALA  43           HA       ALA  43 -10.758   9.157   5.295
  291   1HB   ALA  43          1HB       ALA  43  -9.906   6.811   5.121
  292   2HB   ALA  43          2HB       ALA  43  -8.522   7.414   4.208
  293   3HB   ALA  43          3HB       ALA  43 -10.150   7.571   3.551
  294    H    THR  44           H        THR  44  -7.209   8.948   5.620
  295    HA   THR  44           HA       THR  44  -7.545   9.231   8.576
  296    HB   THR  44           HB       THR  44  -5.422   7.523   7.257
  297    HG1  THR  44           1HG      THR  44  -7.103   6.285   6.892
  298   1HG2  THR  44          1HG2      THR  44  -5.257   6.605   9.572
  299   2HG2  THR  44          2HG2      THR  44  -6.464   7.776  10.095
  300   3HG2  THR  44          3HG2      THR  44  -4.894   8.329   9.511
  301    HA   PRO  45           HA       PRO  45  -5.195  12.588   6.011
  302   1HB   PRO  45          2HB       PRO  45  -6.320  13.747   8.550
  303   2HB   PRO  45          1HB       PRO  45  -6.093  14.520   6.973
  304   1HG   PRO  45          2HG       PRO  45  -8.470  13.513   7.768
  305   2HG   PRO  45          1HG       PRO  45  -7.963  13.562   6.070
  306   1HD   PRO  45          2HD       PRO  45  -8.344  11.213   7.768
  307   2HD   PRO  45          1HD       PRO  45  -8.007  11.282   6.023
  308    HA   PRO  46           HA       PRO  46  -1.941  11.738   9.162
  309   1HB   PRO  46          2HB       PRO  46   0.090  11.246   7.322
  310   2HB   PRO  46          1HB       PRO  46  -0.960  10.007   8.020
  311   1HG   PRO  46          2HG       PRO  46  -0.920  11.051   5.297
  312   2HG   PRO  46          1HG       PRO  46  -1.750   9.622   5.937
  313   1HD   PRO  46          2HD       PRO  46  -2.894  12.221   5.299
  314   2HD   PRO  46          1HD       PRO  46  -3.734  10.760   5.847
  315    H    LYS  47           H        LYS  47  -0.489  13.129   6.197
  316    HA   LYS  47           HA       LYS  47   0.536  15.405   7.786
  317   1HB   LYS  47          2HB       LYS  47   0.826  14.884   4.799
  318   2HB   LYS  47          1HB       LYS  47   1.735  16.047   5.756
  319   1HG   LYS  47          2HG       LYS  47   2.719  14.229   7.080
  320   2HG   LYS  47          1HG       LYS  47   1.781  13.045   6.176
  321   1HD   LYS  47          2HD       LYS  47   2.998  13.415   4.181
  322   2HD   LYS  47          1HD       LYS  47   3.637  14.956   4.753
  323   1HE   LYS  47          2HE       LYS  47   4.298  12.323   6.092
  324   2HE   LYS  47          1HE       LYS  47   5.281  12.998   4.791
  325   1HZ   LYS  47          1HZ       LYS  47   6.244  14.346   6.240
  326   2HZ   LYS  47          2HZ       LYS  47   5.342  13.641   7.499
  327   3HZ   LYS  47          3HZ       LYS  47   4.745  15.004   6.685
  328    H    LEU  48           H        LEU  48  -2.243  14.617   6.091
  329    HA   LEU  48           HA       LEU  48  -2.823  17.290   5.066
  330   1HB   LEU  48          2HB       LEU  48  -3.934  14.620   4.796
  331   2HB   LEU  48          1HB       LEU  48  -5.221  15.734   5.234
  332    HG   LEU  48           HG       LEU  48  -3.285  16.344   2.990
  333   1HD1  LEU  48          1HD1      LEU  48  -4.480  14.191   2.563
  334   2HD1  LEU  48          2HD1      LEU  48  -4.950  15.462   1.439
  335   3HD1  LEU  48          3HD1      LEU  48  -6.013  15.037   2.776
  336   1HD2  LEU  48          1HD2      LEU  48  -6.037  17.362   3.805
  337   2HD2  LEU  48          2HD2      LEU  48  -5.227  17.817   2.305
  338   3HD2  LEU  48          3HD2      LEU  48  -4.526  18.264   3.856
  339    H    GLU  49           H        GLU  49  -2.863  18.696   6.776
  340    HA   GLU  49           HA       GLU  49  -5.133  18.418   8.659
  341   1HB   GLU  49          2HB       GLU  49  -2.895  17.501   9.642
  342   2HB   GLU  49          1HB       GLU  49  -2.416  19.198   9.728
  343   1HG   GLU  49          2HG       GLU  49  -4.613  19.617  10.952
  344   2HG   GLU  49          1HG       GLU  49  -4.772  17.867  11.078
  345    H    ASP  50           H        ASP  50  -3.380  20.239   6.522
  346    HA   ASP  50           HA       ASP  50  -4.885  22.624   6.980
  347   1HB   ASP  50          2HB       ASP  50  -2.192  22.422   8.274
  348   2HB   ASP  50          1HB       ASP  50  -2.561  23.948   7.470
  349    H    LYS  51           H        LYS  51  -4.704  21.362   4.696
  350    HA   LYS  51           HA       LYS  51  -2.990  23.088   3.002
  351   1HB   LYS  51          2HB       LYS  51  -2.872  20.064   3.124
  352   2HB   LYS  51          1HB       LYS  51  -2.299  20.971   1.724
  353   1HG   LYS  51          2HG       LYS  51  -0.804  22.275   3.315
  354   2HG   LYS  51          1HG       LYS  51  -1.265  21.128   4.574
  355   1HD   LYS  51          2HD       LYS  51  -0.199  19.313   3.489
  356   2HD   LYS  51          1HD       LYS  51  -0.145  20.153   1.941
  357   1HE   LYS  51          2HE       LYS  51   2.099  20.137   2.967
  358   2HE   LYS  51          1HE       LYS  51   1.474  21.784   2.893
  359   1HZ   LYS  51          1HZ       LYS  51   2.365  20.474   5.126
  360   2HZ   LYS  51          2HZ       LYS  51   0.675  20.470   5.278
  361   3HZ   LYS  51          3HZ       LYS  51   1.507  21.938   5.083
  362    H    SER  52           H        SER  52  -5.132  20.187   2.701
  363    HA   SER  52           HA       SER  52  -6.920  19.889   1.188
  364   1HB   SER  52          2HB       SER  52  -7.324  22.248   2.605
  365   2HB   SER  52          1HB       SER  52  -7.503  22.783   0.942
  366    HG   SER  52           HG       SER  52  -8.788  20.511   2.067
  367    HA   PRO  53           HA       PRO  53  -5.634  20.814  -2.939
  368   1HB   PRO  53          2HB       PRO  53  -8.006  22.464  -3.671
  369   2HB   PRO  53          1HB       PRO  53  -7.466  20.910  -4.339
  370   1HG   PRO  53          2HG       PRO  53  -9.616  21.062  -2.760
  371   2HG   PRO  53          1HG       PRO  53  -8.503  19.684  -2.679
  372   1HD   PRO  53          2HD       PRO  53  -8.706  22.038  -0.833
  373   2HD   PRO  53          1HD       PRO  53  -8.472  20.316  -0.449
  374    H    ASP  54           H        ASP  54  -4.657  22.644  -1.050
  375    HA   ASP  54           HA       ASP  54  -4.731  25.308  -2.368
  376   1HB   ASP  54          2HB       ASP  54  -5.139  25.109   0.087
  377   2HB   ASP  54          1HB       ASP  54  -3.503  24.478   0.282
  378    H    SER  55           H        SER  55  -2.986  22.564  -2.730
  379    HA   SER  55           HA       SER  55  -0.796  23.943  -3.991
  380   1HB   SER  55          2HB       SER  55   0.306  22.292  -1.765
  381   2HB   SER  55          1HB       SER  55   0.890  23.813  -2.429
  382    HG   SER  55           HG       SER  55  -1.389  23.478  -0.777
  383    HA   PRO  56           HA       PRO  56   0.027  20.092  -6.076
  384   1HB   PRO  56          2HB       PRO  56   2.315  19.242  -4.319
  385   2HB   PRO  56          1HB       PRO  56   2.222  19.307  -6.093
  386   1HG   PRO  56          2HG       PRO  56   3.546  21.163  -4.762
  387   2HG   PRO  56          1HG       PRO  56   2.531  21.607  -6.148
  388   1HD   PRO  56          2HD       PRO  56   1.980  21.949  -3.221
  389   2HD   PRO  56          1HD       PRO  56   1.573  23.032  -4.574
  390    H    GLU  57           H        GLU  57  -0.755  20.091  -2.814
  391    HA   GLU  57           HA       GLU  57  -0.657  17.453  -1.920
  392   1HB   GLU  57          2HB       GLU  57  -1.605  19.116  -0.448
  393   2HB   GLU  57          1HB       GLU  57  -2.880  19.496  -1.605
  394   1HG   GLU  57          2HG       GLU  57  -3.573  18.032   0.361
  395   2HG   GLU  57          1HG       GLU  57  -3.966  17.389  -1.230
  396    H    MET  58           H        MET  58  -3.306  18.877  -3.873
  397    HA   MET  58           HA       MET  58  -4.726  16.432  -4.242
  398   1HB   MET  58          2HB       MET  58  -5.746  18.585  -4.844
  399   2HB   MET  58          1HB       MET  58  -4.547  18.823  -6.116
  400   1HG   MET  58          2HG       MET  58  -5.384  16.878  -7.334
  401   2HG   MET  58          1HG       MET  58  -6.482  16.482  -6.015
  402   1HE   MET  58          1HE       MET  58  -9.388  18.766  -6.252
  403   2HE   MET  58          2HE       MET  58  -8.121  18.571  -5.043
  404   3HE   MET  58          3HE       MET  58  -8.771  17.154  -5.861
  405    H    LYS  59           H        LYS  59  -2.153  17.936  -6.224
  406    HA   LYS  59           HA       LYS  59  -2.119  15.857  -8.212
  407   1HB   LYS  59          2HB       LYS  59   0.151  17.714  -7.440
  408   2HB   LYS  59          1HB       LYS  59  -0.050  16.874  -8.976
  409   1HG   LYS  59          2HG       LYS  59  -2.217  18.741  -8.005
  410   2HG   LYS  59          1HG       LYS  59  -0.775  19.406  -8.758
  411   1HD   LYS  59          2HD       LYS  59  -2.172  17.146 -10.161
  412   2HD   LYS  59          1HD       LYS  59  -2.916  18.736 -10.204
  413   1HE   LYS  59          2HE       LYS  59  -0.736  19.673 -11.049
  414   2HE   LYS  59          1HE       LYS  59  -0.123  18.022 -11.142
  415   1HZ   LYS  59          1HZ       LYS  59  -1.231  17.675 -13.016
  416   2HZ   LYS  59          2HZ       LYS  59  -1.565  19.342 -13.064
  417   3HZ   LYS  59          3HZ       LYS  59  -2.678  18.267 -12.367
  418    H    ASP  60           H        ASP  60   0.132  16.531  -5.497
  419    HA   ASP  60           HA       ASP  60   1.681  14.161  -5.787
  420   1HB   ASP  60          2HB       ASP  60   2.221  16.047  -4.144
  421   2HB   ASP  60          1HB       ASP  60   0.951  15.384  -3.108
  422    H    PHE  61           H        PHE  61  -1.509  14.714  -4.421
  423    HA   PHE  61           HA       PHE  61  -1.722  12.141  -3.139
  424   1HB   PHE  61          2HB       PHE  61  -3.298  13.686  -2.333
  425   2HB   PHE  61          1HB       PHE  61  -3.668  14.307  -3.938
  426    HD1  PHE  61           1HD      PHE  61  -6.029  14.057  -3.917
  427    HD2  PHE  61           2HD      PHE  61  -3.516  10.705  -2.978
  428    HE1  PHE  61           1HE      PHE  61  -7.979  12.560  -4.084
  429    HE2  PHE  61           2HE      PHE  61  -5.474   9.184  -3.148
  430    HZ   PHE  61           HZ       PHE  61  -7.713  10.120  -3.703
  431    H    ARG  62           H        ARG  62  -2.964  13.493  -6.196
  432    HA   ARG  62           HA       ARG  62  -3.895  11.018  -7.212
  433   1HB   ARG  62          2HB       ARG  62  -2.970  13.506  -8.654
  434   2HB   ARG  62          1HB       ARG  62  -3.725  12.132  -9.459
  435   1HG   ARG  62          2HG       ARG  62  -5.486  12.702  -7.329
  436   2HG   ARG  62          1HG       ARG  62  -4.985  14.290  -7.884
  437   1HD   ARG  62          2HD       ARG  62  -5.518  13.362 -10.267
  438   2HD   ARG  62          1HD       ARG  62  -6.428  12.128  -9.400
  439    HE   ARG  62           HE       ARG  62  -7.107  14.817  -8.525
  440   1HH1  ARG  62          1HH2      ARG  62  -7.611  12.333 -10.892
  441   2HH1  ARG  62          2HH2      ARG  62  -9.193  12.891 -11.325
  442   1HH2  ARG  62          1HH1      ARG  62  -9.187  15.526  -9.079
  443   2HH2  ARG  62          2HH1      ARG  62 -10.082  14.676 -10.297
  444    H    HIS  63           H        HIS  63  -0.876  12.780  -8.078
  445    HA   HIS  63           HA       HIS  63   0.206  10.575  -9.529
  446   1HB   HIS  63          2HB       HIS  63   0.941  13.011  -9.598
  447   2HB   HIS  63          1HB       HIS  63   1.811  12.698  -8.098
  448    HD1  HIS  63           1HD      HIS  63   4.106  13.061  -9.244
  449    HD2  HIS  63           2HD      HIS  63   1.900   9.949 -10.930
  450    HE1  HIS  63           1HE      HIS  63   5.699  11.778 -10.737
  451    H    GLY  64           H        GLY  64   0.134  11.275  -6.095
  452   1HA   GLY  64          2HA       GLY  64   2.305   9.478  -5.383
  453   2HA   GLY  64          1HA       GLY  64   1.121  10.145  -4.259
  454    H    PHE  65           H        PHE  65  -1.252   9.104  -4.998
  455    HA   PHE  65           HA       PHE  65  -1.054   6.329  -4.281
  456   1HB   PHE  65          2HB       PHE  65  -3.329   6.430  -3.963
  457   2HB   PHE  65          1HB       PHE  65  -3.008   8.157  -3.993
  458    HD1  PHE  65           1HD      PHE  65  -4.275   9.507  -5.435
  459    HD2  PHE  65           2HD      PHE  65  -3.890   5.337  -6.322
  460    HE1  PHE  65           1HE      PHE  65  -5.919   9.745  -7.258
  461    HE2  PHE  65           2HE      PHE  65  -5.541   5.576  -8.173
  462    HZ   PHE  65           HZ       PHE  65  -6.555   7.789  -8.628
  463    H    ASP  66           H        ASP  66  -1.342   8.031  -7.312
  464    HA   ASP  66           HA       ASP  66  -2.127   5.856  -8.958
  465   1HB   ASP  66          2HB       ASP  66  -2.138   8.200  -9.747
  466   2HB   ASP  66          1HB       ASP  66  -0.372   8.203  -9.730
  467    H    ILE  67           H        ILE  67   1.062   7.048  -8.006
  468    HA   ILE  67           HA       ILE  67   2.559   5.196  -9.564
  469    HB   ILE  67           HB       ILE  67   3.156   6.674  -6.992
  470   1HG1  ILE  67          2HG1      ILE  67   4.308   7.029  -9.763
  471   2HG1  ILE  67          1HG1      ILE  67   2.803   7.821  -9.274
  472   1HG2  ILE  67          1HG2      ILE  67   4.828   4.719  -8.565
  473   2HG2  ILE  67          2HG2      ILE  67   4.671   4.896  -6.822
  474   3HG2  ILE  67          3HG2      ILE  67   5.602   6.068  -7.732
  475   1HD1  ILE  67          1HD1      ILE  67   4.767   9.307  -8.935
  476   2HD1  ILE  67          2HD1      ILE  67   5.488   8.105  -7.863
  477   3HD1  ILE  67          3HD1      ILE  67   3.991   8.918  -7.399
  478    H    LEU  68           H        LEU  68   1.524   5.022  -6.157
  479    HA   LEU  68           HA       LEU  68   2.517   2.426  -5.579
  480   1HB   LEU  68          2HB       LEU  68   0.266   4.113  -4.474
  481   2HB   LEU  68          1HB       LEU  68   0.594   2.500  -3.821
  482    HG   LEU  68           HG       LEU  68   2.825   4.511  -4.115
  483   1HD1  LEU  68          1HD1      LEU  68   1.095   5.686  -2.876
  484   2HD1  LEU  68          2HD1      LEU  68   2.380   5.208  -1.764
  485   3HD1  LEU  68          3HD1      LEU  68   0.871   4.302  -1.808
  486   1HD2  LEU  68          1HD2      LEU  68   2.645   2.611  -1.812
  487   2HD2  LEU  68          2HD2      LEU  68   4.033   3.054  -2.804
  488   3HD2  LEU  68          3HD2      LEU  68   2.875   1.866  -3.394
  489    H    VAL  69           H        VAL  69  -0.869   3.301  -6.401
  490    HA   VAL  69           HA       VAL  69  -1.768   0.600  -6.602
  491    HB   VAL  69           HB       VAL  69  -3.674   1.482  -7.881
  492   1HG1  VAL  69          1HG1      VAL  69  -4.490   3.122  -6.271
  493   2HG1  VAL  69          2HG1      VAL  69  -2.850   3.366  -5.674
  494   3HG1  VAL  69          3HG1      VAL  69  -3.646   1.812  -5.442
  495   1HG2  VAL  69          1HG2      VAL  69  -2.940   3.014  -9.436
  496   2HG2  VAL  69          2HG2      VAL  69  -1.813   3.753  -8.316
  497   3HG2  VAL  69          3HG2      VAL  69  -3.530   4.117  -8.197
  498    H    GLY  70           H        GLY  70  -0.175   2.713  -8.932
  499   1HA   GLY  70          2HA       GLY  70  -0.612   1.122 -11.261
  500   2HA   GLY  70          1HA       GLY  70   0.695   2.285 -11.064
  501    H    GLN  71           H        GLN  71   2.058   1.019  -8.853
  502    HA   GLN  71           HA       GLN  71   3.328  -1.193 -10.337
  503   1HB   GLN  71          2HB       GLN  71   5.016  -1.071  -8.511
  504   2HB   GLN  71          1HB       GLN  71   4.781   0.486  -9.299
  505   1HG   GLN  71          2HG       GLN  71   3.015   0.895  -7.417
  506   2HG   GLN  71          1HG       GLN  71   3.823  -0.421  -6.594
  507   1HE2  GLN  71          1HE2      GLN  71   3.765   2.869  -6.736
  508   2HE2  GLN  71          2HE2      GLN  71   5.371   3.199  -6.288
  509    H    ILE  72           H        ILE  72   1.340  -0.698  -7.472
  510    HA   ILE  72           HA       ILE  72   1.816  -3.240  -6.270
  511    HB   ILE  72           HB       ILE  72  -0.579  -1.384  -6.255
  512   1HG1  ILE  72          2HG1      ILE  72   1.314  -2.108  -4.002
  513   2HG1  ILE  72          1HG1      ILE  72   1.647  -0.778  -5.111
  514   1HG2  ILE  72          1HG2      ILE  72  -0.152  -3.981  -4.787
  515   2HG2  ILE  72          2HG2      ILE  72  -1.490  -3.567  -5.852
  516   3HG2  ILE  72          3HG2      ILE  72  -1.332  -2.780  -4.286
  517   1HD1  ILE  72          1HD1      ILE  72  -0.574   0.207  -4.507
  518   2HD1  ILE  72          2HD1      ILE  72   0.520   0.084  -3.126
  519   3HD1  ILE  72          3HD1      ILE  72  -0.783  -1.085  -3.329
  520    H    ASP  73           H        ASP  73  -0.504  -2.154  -8.749
  521    HA   ASP  73           HA       ASP  73  -1.748  -4.729  -9.086
  522   1HB   ASP  73          2HB       ASP  73  -2.737  -2.604  -9.990
  523   2HB   ASP  73          1HB       ASP  73  -1.449  -2.560 -11.198
  524    H    ASP  74           H        ASP  74   1.005  -3.126 -10.711
  525    HA   ASP  74           HA       ASP  74   1.484  -5.246 -12.572
  526   1HB   ASP  74          2HB       ASP  74   3.677  -3.527 -11.435
  527   2HB   ASP  74          1HB       ASP  74   3.524  -4.193 -13.057
  528    H    ALA  75           H        ALA  75   2.198  -4.903  -9.197
  529    HA   ALA  75           HA       ALA  75   4.272  -6.934  -9.187
  530   1HB   ALA  75          1HB       ALA  75   4.280  -5.196  -7.472
  531   2HB   ALA  75          2HB       ALA  75   4.106  -6.779  -6.726
  532   3HB   ALA  75          3HB       ALA  75   2.697  -5.728  -6.894
  533    H    LEU  76           H        LEU  76   0.785  -6.897  -8.743
  534    HA   LEU  76           HA       LEU  76   0.564  -9.533  -7.578
  535   1HB   LEU  76          2HB       LEU  76  -1.160  -7.661  -7.561
  536   2HB   LEU  76          1HB       LEU  76  -1.489  -8.040  -9.248
  537    HG   LEU  76           HG       LEU  76  -1.598 -10.295  -7.252
  538   1HD1  LEU  76          1HD1      LEU  76  -2.859  -8.576  -6.117
  539   2HD1  LEU  76          2HD1      LEU  76  -4.000  -9.719  -6.828
  540   3HD1  LEU  76          3HD1      LEU  76  -3.714  -8.157  -7.602
  541   1HD2  LEU  76          1HD2      LEU  76  -1.975 -10.808  -9.627
  542   2HD2  LEU  76          2HD2      LEU  76  -3.213  -9.559  -9.721
  543   3HD2  LEU  76          3HD2      LEU  76  -3.478 -10.998  -8.739
  544    H    LYS  77           H        LYS  77  -0.089  -8.313 -10.899
  545    HA   LYS  77           HA       LYS  77  -0.546 -10.845 -12.061
  546   1HB   LYS  77          2HB       LYS  77   0.309  -9.775 -14.212
  547   2HB   LYS  77          1HB       LYS  77  -1.030  -8.956 -13.424
  548   1HG   LYS  77          2HG       LYS  77   0.196  -7.076 -13.013
  549   2HG   LYS  77          1HG       LYS  77   1.576  -7.994 -12.429
  550   1HD   LYS  77          2HD       LYS  77   0.910  -7.364 -15.312
  551   2HD   LYS  77          1HD       LYS  77   2.247  -6.717 -14.370
  552   1HE   LYS  77          2HE       LYS  77   3.445  -8.410 -15.343
  553   2HE   LYS  77          1HE       LYS  77   2.675  -9.431 -14.123
  554   1HZ   LYS  77          1HZ       LYS  77   1.963 -10.539 -15.933
  555   2HZ   LYS  77          2HZ       LYS  77   2.123  -9.199 -16.968
  556   3HZ   LYS  77          3HZ       LYS  77   0.761  -9.345 -15.960
  557    H    LEU  78           H        LEU  78   2.454  -9.158 -11.278
  558    HA   LEU  78           HA       LEU  78   4.236 -11.004 -12.557
  559   1HB   LEU  78          2HB       LEU  78   4.703  -8.656 -11.355
  560   2HB   LEU  78          1HB       LEU  78   5.013  -9.687  -9.963
  561    HG   LEU  78           HG       LEU  78   7.127  -9.327 -11.081
  562   1HD1  LEU  78          1HD1      LEU  78   6.310 -12.066 -12.038
  563   2HD1  LEU  78          2HD1      LEU  78   6.425 -11.706 -10.314
  564   3HD1  LEU  78          3HD1      LEU  78   7.847 -11.554 -11.335
  565   1HD2  LEU  78          1HD2      LEU  78   7.496  -9.402 -13.369
  566   2HD2  LEU  78          2HD2      LEU  78   5.805  -8.911 -13.383
  567   3HD2  LEU  78          3HD2      LEU  78   6.237 -10.596 -13.657
  568    H    ALA  79           H        ALA  79   3.006 -10.814  -9.195
  569    HA   ALA  79           HA       ALA  79   4.165 -13.268  -8.329
  570   1HB   ALA  79          1HB       ALA  79   3.218 -11.897  -6.623
  571   2HB   ALA  79          2HB       ALA  79   2.152 -13.300  -6.719
  572   3HB   ALA  79          3HB       ALA  79   1.678 -11.779  -7.473
  573    H    ASN  80           H        ASN  80   1.062 -12.524  -9.845
  574    HA   ASN  80           HA       ASN  80   0.000 -15.166  -9.921
  575   1HB   ASN  80          2HB       ASN  80  -1.071 -12.851 -10.476
  576   2HB   ASN  80          1HB       ASN  80  -0.433 -13.124 -12.097
  577   1HD2  ASN  80          1HD2      ASN  80  -3.271 -13.055 -11.306
  578   2HD2  ASN  80          2HD2      ASN  80  -3.910 -14.573 -11.725
  579    H    GLU  81           H        GLU  81   1.298 -13.385 -12.720
  580    HA   GLU  81           HA       GLU  81   1.961 -15.765 -14.239
  581   1HB   GLU  81          2HB       GLU  81   1.371 -13.356 -15.047
  582   2HB   GLU  81          1HB       GLU  81   3.068 -12.992 -14.736
  583   1HG   GLU  81          2HG       GLU  81   3.109 -13.619 -16.991
  584   2HG   GLU  81          1HG       GLU  81   3.515 -15.138 -16.196
  585    H    GLY  82           H        GLY  82   3.416 -14.864 -11.484
  586   1HA   GLY  82          2HA       GLY  82   6.108 -15.762 -12.422
  587   2HA   GLY  82          1HA       GLY  82   5.991 -14.293 -11.483
  588    H    LYS  83           H        LYS  83   7.537 -16.378 -10.596
  589    HA   LYS  83           HA       LYS  83   6.085 -17.973  -8.607
  590   1HB   LYS  83          2HB       LYS  83   8.359 -18.504  -9.840
  591   2HB   LYS  83          1HB       LYS  83   9.072 -17.502  -8.583
  592   1HG   LYS  83          2HG       LYS  83   8.199 -18.966  -6.849
  593   2HG   LYS  83          1HG       LYS  83   7.302 -19.904  -8.036
  594   1HD   LYS  83          2HD       LYS  83   9.464 -20.538  -9.108
  595   2HD   LYS  83          1HD       LYS  83  10.315 -19.650  -7.842
  596   1HE   LYS  83          2HE       LYS  83   9.634 -21.148  -6.154
  597   2HE   LYS  83          1HE       LYS  83   8.342 -21.823  -7.147
  598   1HZ   LYS  83          1HZ       LYS  83   9.755 -23.157  -8.240
  599   2HZ   LYS  83          2HZ       LYS  83  10.703 -22.966  -6.838
  600   3HZ   LYS  83          3HZ       LYS  83  11.023 -22.031  -8.220
  601    H    VAL  84           H        VAL  84   7.379 -17.622  -6.182
  602    HA   VAL  84           HA       VAL  84   6.562 -14.910  -5.449
  603    HB   VAL  84           HB       VAL  84   7.529 -17.314  -3.900
  604   1HG1  VAL  84          1HG1      VAL  84   7.529 -14.436  -3.028
  605   2HG1  VAL  84          2HG1      VAL  84   8.635 -15.734  -2.590
  606   3HG1  VAL  84          3HG1      VAL  84   7.032 -15.665  -1.857
  607   1HG2  VAL  84          1HG2      VAL  84   5.071 -15.575  -3.588
  608   2HG2  VAL  84          2HG2      VAL  84   5.375 -17.152  -2.861
  609   3HG2  VAL  84          3HG2      VAL  84   5.131 -17.020  -4.599
  610    H    LYS  85           H        LYS  85   9.601 -16.664  -5.892
  611    HA   LYS  85           HA       LYS  85  11.305 -14.666  -4.718
  612   1HB   LYS  85          2HB       LYS  85  11.650 -16.998  -6.548
  613   2HB   LYS  85          1HB       LYS  85  12.901 -15.764  -6.677
  614   1HG   LYS  85          2HG       LYS  85  12.120 -16.649  -3.915
  615   2HG   LYS  85          1HG       LYS  85  13.054 -17.776  -4.894
  616   1HD   LYS  85          2HD       LYS  85  14.854 -16.244  -5.148
  617   2HD   LYS  85          1HD       LYS  85  13.894 -14.893  -4.534
  618   1HE   LYS  85          2HE       LYS  85  14.713 -17.336  -2.939
  619   2HE   LYS  85          1HE       LYS  85  15.446 -15.737  -2.805
  620   1HZ   LYS  85          1HZ       LYS  85  12.645 -15.517  -2.590
  621   2HZ   LYS  85          2HZ       LYS  85  13.832 -15.117  -1.444
  622   3HZ   LYS  85          3HZ       LYS  85  13.191 -16.690  -1.493
  623    H    GLU  86           H        GLU  86  10.258 -15.202  -8.080
  624    HA   GLU  86           HA       GLU  86  11.589 -12.892  -9.136
  625   1HB   GLU  86          2HB       GLU  86   9.019 -14.029 -10.254
  626   2HB   GLU  86          1HB       GLU  86  10.331 -13.244 -11.126
  627   1HG   GLU  86          2HG       GLU  86  10.581 -15.907  -9.680
  628   2HG   GLU  86          1HG       GLU  86  10.343 -15.731 -11.415
  629    H    ALA  87           H        ALA  87   8.389 -13.363  -7.668
  630    HA   ALA  87           HA       ALA  87   7.334 -10.777  -8.345
  631   1HB   ALA  87          1HB       ALA  87   6.205 -12.933  -7.319
  632   2HB   ALA  87          2HB       ALA  87   5.545 -11.341  -6.961
  633   3HB   ALA  87          3HB       ALA  87   6.574 -12.157  -5.785
  634    H    GLN  88           H        GLN  88   8.588 -11.891  -5.164
  635    HA   GLN  88           HA       GLN  88   8.585  -9.325  -3.985
  636   1HB   GLN  88          2HB       GLN  88   9.914 -10.237  -2.229
  637   2HB   GLN  88          1HB       GLN  88   8.884 -11.545  -2.799
  638   1HG   GLN  88          2HG       GLN  88  10.949 -12.601  -2.721
  639   2HG   GLN  88          1HG       GLN  88  10.904 -12.089  -4.389
  640   1HE2  GLN  88          1HE2      GLN  88  11.360  -9.291  -2.464
  641   2HE2  GLN  88          2HE2      GLN  88  13.048  -9.214  -2.568
  642    H    ALA  89           H        ALA  89  10.892 -10.804  -6.174
  643    HA   ALA  89           HA       ALA  89  13.137  -9.085  -5.739
  644   1HB   ALA  89          1HB       ALA  89  12.992 -11.169  -7.248
  645   2HB   ALA  89          2HB       ALA  89  13.905  -9.806  -7.890
  646   3HB   ALA  89          3HB       ALA  89  12.263 -10.109  -8.456
  647    H    ALA  90           H        ALA  90  10.252  -8.744  -7.789
  648    HA   ALA  90           HA       ALA  90  10.906  -6.255  -9.003
  649   1HB   ALA  90          1HB       ALA  90   8.143  -7.229  -8.240
  650   2HB   ALA  90          2HB       ALA  90   9.029  -7.812  -9.645
  651   3HB   ALA  90          3HB       ALA  90   8.560  -6.116  -9.545
  652    H    ALA  91           H        ALA  91   9.583  -7.010  -5.804
  653    HA   ALA  91           HA       ALA  91   8.648  -4.345  -5.260
  654   1HB   ALA  91          1HB       ALA  91   8.300  -5.093  -3.058
  655   2HB   ALA  91          2HB       ALA  91   9.685  -6.182  -3.104
  656   3HB   ALA  91          3HB       ALA  91   8.213  -6.593  -3.981
  657    H    GLU  92           H        GLU  92  11.713  -6.010  -4.616
  658    HA   GLU  92           HA       GLU  92  13.004  -3.932  -3.199
  659   1HB   GLU  92          2HB       GLU  92  14.307  -5.943  -5.041
  660   2HB   GLU  92          1HB       GLU  92  15.047  -5.129  -3.658
  661   1HG   GLU  92          2HG       GLU  92  13.140  -6.165  -2.260
  662   2HG   GLU  92          1HG       GLU  92  12.855  -7.207  -3.655
  663    H    GLN  93           H        GLN  93  13.207  -4.634  -6.744
  664    HA   GLN  93           HA       GLN  93  14.901  -2.359  -7.207
  665   1HB   GLN  93          2HB       GLN  93  14.380  -2.631  -9.581
  666   2HB   GLN  93          1HB       GLN  93  14.597  -4.223  -8.855
  667   1HG   GLN  93          2HG       GLN  93  12.071  -4.261  -8.517
  668   2HG   GLN  93          1HG       GLN  93  11.999  -2.863  -9.588
  669   1HE2  GLN  93          1HE2      GLN  93  13.338  -6.210  -9.481
  670   2HE2  GLN  93          2HE2      GLN  93  13.156  -6.508 -11.141
  671    H    LEU  94           H        LEU  94  11.383  -2.774  -7.125
  672    HA   LEU  94           HA       LEU  94  10.832  -0.006  -7.880
  673   1HB   LEU  94          2HB       LEU  94   9.097  -2.049  -6.466
  674   2HB   LEU  94          1HB       LEU  94   8.539  -0.463  -7.001
  675    HG   LEU  94           HG       LEU  94   9.754  -2.495  -8.885
  676   1HD1  LEU  94          1HD1      LEU  94   6.928  -2.186  -7.888
  677   2HD1  LEU  94          2HD1      LEU  94   7.862  -3.656  -8.158
  678   3HD1  LEU  94          3HD1      LEU  94   7.223  -2.761  -9.530
  679   1HD2  LEU  94          1HD2      LEU  94   8.241   0.106  -9.210
  680   2HD2  LEU  94          2HD2      LEU  94   8.265  -1.090 -10.501
  681   3HD2  LEU  94          3HD2      LEU  94   9.774  -0.380  -9.939
  682    H    LYS  95           H        LYS  95  11.958  -1.535  -5.039
  683    HA   LYS  95           HA       LYS  95  10.645   0.157  -3.107
  684   1HB   LYS  95          2HB       LYS  95  11.820  -2.002  -2.550
  685   2HB   LYS  95          1HB       LYS  95  13.354  -1.205  -2.870
  686   1HG   LYS  95          2HG       LYS  95  11.825   0.470  -1.070
  687   2HG   LYS  95          1HG       LYS  95  11.819  -1.165  -0.429
  688   1HD   LYS  95          2HD       LYS  95  14.293  -1.233  -0.568
  689   2HD   LYS  95          1HD       LYS  95  14.296   0.397  -1.234
  690   1HE   LYS  95          2HE       LYS  95  13.675   1.382   0.790
  691   2HE   LYS  95          1HE       LYS  95  12.918  -0.089   1.396
  692   1HZ   LYS  95          1HZ       LYS  95  14.796  -0.440   2.505
  693   2HZ   LYS  95          2HZ       LYS  95  15.614   0.801   1.683
  694   3HZ   LYS  95          3HZ       LYS  95  15.554  -0.762   1.020
  695    H    THR  96           H        THR  96  13.868   0.255  -4.616
  696    HA   THR  96           HA       THR  96  14.434   2.906  -3.542
  697    HB   THR  96           HB       THR  96  16.246   1.321  -3.899
  698    HG1  THR  96           1HG      THR  96  16.305   3.750  -4.567
  699   1HG2  THR  96          1HG2      THR  96  15.450   1.451  -6.822
  700   2HG2  THR  96          2HG2      THR  96  15.266   0.059  -5.758
  701   3HG2  THR  96          3HG2      THR  96  16.880   0.626  -6.193
  702    H    THR  97           H        THR  97  12.965   1.659  -6.473
  703    HA   THR  97           HA       THR  97  13.213   4.294  -7.817
  704    HB   THR  97           HB       THR  97  12.387   1.528  -8.703
  705    HG1  THR  97           1HG      THR  97  14.597   2.144  -8.712
  706   1HG2  THR  97          1HG2      THR  97  10.766   2.922  -9.776
  707   2HG2  THR  97          2HG2      THR  97  12.010   2.591 -10.971
  708   3HG2  THR  97          3HG2      THR  97  11.975   4.149 -10.150
  709    H    GLY  98           H        GLY  98  10.857   2.210  -6.227
  710   1HA   GLY  98          2HA       GLY  98   8.566   3.712  -7.217
  711   2HA   GLY  98          1HA       GLY  98   8.530   2.516  -5.923
  712    H    ARG  99           H        ARG  99  10.938   4.959  -5.647
  713    HA   ARG  99           HA       ARG  99  11.201   6.692  -4.086
  714   1HB   ARG  99          2HB       ARG  99   8.205   7.051  -4.296
  715   2HB   ARG  99          1HB       ARG  99   9.427   8.278  -3.985
  716   1HG   ARG  99          2HG       ARG  99   9.136   6.738  -6.590
  717   2HG   ARG  99          1HG       ARG  99   8.592   8.388  -6.319
  718   1HD   ARG  99          2HD       ARG  99  11.444   7.367  -6.258
  719   2HD   ARG  99          1HD       ARG  99  10.742   8.534  -7.378
  720    HE   ARG  99           HE       ARG  99  10.380   9.714  -4.898
  721   1HH1  ARG  99          1HH2      ARG  99  12.988   8.357  -6.689
  722   2HH1  ARG  99          2HH2      ARG  99  14.184   9.407  -6.001
  723   1HH2  ARG  99          1HH1      ARG  99  11.957  11.121  -4.014
  724   2HH2  ARG  99          2HH1      ARG  99  13.605  10.956  -4.517
  725    H    ALA 100           H        ALA 100  10.717   7.281  -1.833
  726    HA   ALA 100           HA       ALA 100   9.932   4.923  -0.256
  727   1HB   ALA 100          1HB       ALA 100  10.667   6.242   1.677
  728   2HB   ALA 100          2HB       ALA 100  10.834   7.670   0.657
  729   3HB   ALA 100          3HB       ALA 100  11.902   6.285   0.417
  730    H    GLY 101           H        GLY 101   8.558   7.893  -1.349
  731   1HA   GLY 101          2HA       GLY 101   5.981   7.214  -0.199
  732   2HA   GLY 101          1HA       GLY 101   6.710   8.633   0.563
  733    H    ASN 102           H        ASN 102   6.979  10.564  -0.737
  734    HA   ASN 102           HA       ASN 102   5.195  10.667  -3.089
  735   1HB   ASN 102          2HB       ASN 102   6.588  12.801  -1.461
  736   2HB   ASN 102          1HB       ASN 102   5.658  13.137  -2.920
  737   1HD2  ASN 102          1HD2      ASN 102   4.944  14.064  -0.240
  738   2HD2  ASN 102          2HD2      ASN 102   3.441  13.369   0.135
  739    H    GLN 103           H        GLN 103   6.436  12.770  -4.449
  740    HA   GLN 103           HA       GLN 103   9.137  11.804  -5.178
  741   1HB   GLN 103          2HB       GLN 103   7.223  10.736  -6.557
  742   2HB   GLN 103          1HB       GLN 103   7.057  12.331  -7.297
  743   1HG   GLN 103          2HG       GLN 103   9.584  12.249  -7.693
  744   2HG   GLN 103          1HG       GLN 103   9.481  10.517  -7.343
  745   1HE2  GLN 103          1HE2      GLN 103   8.042  13.052  -9.413
  746   2HE2  GLN 103          2HE2      GLN 103   7.716  12.033 -10.737
  747    H    LYS 104           H        LYS 104   6.600  14.118  -6.027
  748    HA   LYS 104           HA       LYS 104   8.526  16.135  -6.893
  749   1HB   LYS 104          2HB       LYS 104   6.456  16.239  -8.060
  750   2HB   LYS 104          1HB       LYS 104   5.518  16.013  -6.591
  751   1HG   LYS 104          2HG       LYS 104   5.830  18.244  -5.884
  752   2HG   LYS 104          1HG       LYS 104   7.229  18.480  -6.941
  753   1HD   LYS 104          2HD       LYS 104   5.766  18.365  -8.917
  754   2HD   LYS 104          1HD       LYS 104   4.371  18.079  -7.872
  755   1HE   LYS 104          2HE       LYS 104   4.346  20.419  -8.374
  756   2HE   LYS 104          1HE       LYS 104   4.930  20.275  -6.718
  757   1HZ   LYS 104          1HZ       LYS 104   6.249  21.350  -8.980
  758   2HZ   LYS 104          2HZ       LYS 104   7.159  20.067  -8.332
  759   3HZ   LYS 104          3HZ       LYS 104   6.724  21.384  -7.354
  760    H    GLY 105           H        GLY 105   5.846  16.490  -4.596
  761   1HA   GLY 105          2HA       GLY 105   7.516  18.309  -2.999
  762   2HA   GLY 105          1HA       GLY 105   5.800  17.963  -2.746
  763    H    GLY 106           H        GLY 106   8.628  15.798  -2.935
  764   1HA   GLY 106          2HA       GLY 106   7.785  14.517  -0.384
  765   2HA   GLY 106          1HA       GLY 106   8.908  13.825  -1.564
  Start of MODEL    4
    1   1H    ALA   1          1HT       ALA   1  -0.376 -16.932  27.090
    2   2H    ALA   1          2HT       ALA   1  -0.166 -17.707  28.587
    3   3H    ALA   1          3HT       ALA   1  -0.161 -18.613  27.149
    4    HA   ALA   1           HA       ALA   1   1.794 -16.710  26.792
    5   1HB   ALA   1          1HB       ALA   1   3.213 -16.955  28.751
    6   2HB   ALA   1          2HB       ALA   1   2.055 -18.054  29.501
    7   3HB   ALA   1          3HB       ALA   1   1.640 -16.353  29.274
    8    H    ASP   2           H        ASP   2   2.192 -18.143  25.073
    9    HA   ASP   2           HA       ASP   2   3.937 -20.373  25.643
   10   1HB   ASP   2          2HB       ASP   2   1.575 -21.284  26.119
   11   2HB   ASP   2          1HB       ASP   2   1.300 -21.148  24.382
   12    H    LEU   3           H        LEU   3   3.555 -17.908  23.953
   13    HA   LEU   3           HA       LEU   3   3.610 -19.007  21.205
   14   1HB   LEU   3          2HB       LEU   3   4.048 -16.121  21.981
   15   2HB   LEU   3          1HB       LEU   3   3.422 -16.767  20.464
   16    HG   LEU   3           HG       LEU   3   2.040 -16.805  23.162
   17   1HD1  LEU   3          1HD1      LEU   3   0.313 -15.509  21.820
   18   2HD1  LEU   3          2HD1      LEU   3   1.521 -15.381  20.542
   19   3HD1  LEU   3          3HD1      LEU   3   1.826 -14.655  22.120
   20   1HD2  LEU   3          1HD2      LEU   3   1.428 -18.862  22.159
   21   2HD2  LEU   3          2HD2      LEU   3   1.404 -18.168  20.538
   22   3HD2  LEU   3          3HD2      LEU   3   0.130 -17.767  21.689
   23    H    GLU   4           H        GLU   4   5.738 -16.918  23.209
   24    HA   GLU   4           HA       GLU   4   8.065 -16.627  23.119
   25   1HB   GLU   4          2HB       GLU   4   8.098 -19.497  22.159
   26   2HB   GLU   4          1HB       GLU   4   9.347 -18.652  23.073
   27   1HG   GLU   4          2HG       GLU   4   7.819 -18.452  24.994
   28   2HG   GLU   4          1HG       GLU   4   6.559 -19.287  24.083
   29    H    ASP   5           H        ASP   5  10.039 -16.982  21.583
   30    HA   ASP   5           HA       ASP   5  10.920 -16.208  19.539
   31   1HB   ASP   5          2HB       ASP   5  10.518 -17.806  17.726
   32   2HB   ASP   5          1HB       ASP   5  10.734 -18.655  19.257
   33    H    ASN   6           H        ASN   6   8.569 -14.689  20.313
   34    HA   ASN   6           HA       ASN   6   7.044 -14.326  17.801
   35   1HB   ASN   6          2HB       ASN   6   6.836 -13.211  20.597
   36   2HB   ASN   6          1HB       ASN   6   5.970 -12.446  19.265
   37   1HD2  ASN   6          1HD2      ASN   6   3.921 -13.156  20.327
   38   2HD2  ASN   6          2HD2      ASN   6   3.403 -14.764  20.163
   39    H    ASP   7           H        ASP   7   7.450 -12.672  16.371
   40    HA   ASP   7           HA       ASP   7   9.781 -10.923  16.940
   41   1HB   ASP   7          2HB       ASP   7   9.639 -12.207  14.783
   42   2HB   ASP   7          1HB       ASP   7   8.218 -11.250  14.361
   43    H    GLU   8           H        GLU   8   7.728 -10.170  18.506
   44    HA   GLU   8           HA       GLU   8   6.336  -8.381  19.063
   45   1HB   GLU   8          2HB       GLU   8   7.853  -7.029  16.821
   46   2HB   GLU   8          1HB       GLU   8   6.942  -6.226  18.096
   47   1HG   GLU   8          2HG       GLU   8   8.442  -7.062  19.792
   48   2HG   GLU   8          1HG       GLU   8   9.267  -8.092  18.624
   49    H    THR   9           H        THR   9   6.018 -10.021  16.213
   50    HA   THR   9           HA       THR   9   3.801  -8.340  15.179
   51    HB   THR   9           HB       THR   9   5.487 -10.585  14.092
   52    HG1  THR   9           1HG      THR   9   6.092  -8.466  13.677
   53   1HG2  THR   9          1HG2      THR   9   3.925 -10.547  12.072
   54   2HG2  THR   9          2HG2      THR   9   2.738  -9.791  13.131
   55   3HG2  THR   9          3HG2      THR   9   3.344 -11.409  13.495
   56    H    GLY  10           H        GLY  10   4.242 -10.528  17.479
   57   1HA   GLY  10          2HA       GLY  10   2.743 -11.892  18.692
   58   2HA   GLY  10          1HA       GLY  10   1.452 -11.268  17.663
   59    H    ASN  11           H        ASN  11   2.963 -12.093  15.236
   60    HA   ASN  11           HA       ASN  11   2.874 -13.821  13.713
   61   1HB   ASN  11          2HB       ASN  11   4.160 -15.742  14.286
   62   2HB   ASN  11          1HB       ASN  11   4.861 -14.383  15.159
   63   1HD2  ASN  11          1HD2      ASN  11   2.901 -17.323  15.547
   64   2HD2  ASN  11          2HD2      ASN  11   3.072 -17.417  17.233
   65    H    ASP  12           H        ASP  12   1.810 -15.557  16.688
   66    HA   ASP  12           HA       ASP  12  -0.443 -16.665  15.087
   67   1HB   ASP  12          2HB       ASP  12   1.091 -18.200  16.364
   68   2HB   ASP  12          1HB       ASP  12   0.501 -17.462  17.853
   69    H    ASN  13           H        ASN  13   0.226 -14.237  17.374
   70    HA   ASN  13           HA       ASN  13  -2.456 -14.315  18.612
   71   1HB   ASN  13          2HB       ASN  13  -0.259 -13.584  19.783
   72   2HB   ASN  13          1HB       ASN  13  -0.453 -12.068  18.901
   73   1HD2  ASN  13          1HD2      ASN  13  -2.907 -11.214  19.091
   74   2HD2  ASN  13          2HD2      ASN  13  -3.545 -11.253  20.665
   75    H    GLY  14           H        GLY  14  -0.927 -12.935  15.868
   76   1HA   GLY  14          2HA       GLY  14  -2.879 -10.720  15.624
   77   2HA   GLY  14          1HA       GLY  14  -1.533 -11.040  14.529
   78    H    LYS  15           H        LYS  15  -2.853 -13.983  14.966
   79    HA   LYS  15           HA       LYS  15  -4.119 -15.360  13.551
   80   1HB   LYS  15          2HB       LYS  15  -5.895 -12.899  13.481
   81   2HB   LYS  15          1HB       LYS  15  -6.374 -14.521  12.999
   82   1HG   LYS  15          2HG       LYS  15  -7.105 -14.711  15.166
   83   2HG   LYS  15          1HG       LYS  15  -5.409 -15.018  15.530
   84   1HD   LYS  15          2HD       LYS  15  -5.077 -12.605  15.977
   85   2HD   LYS  15          1HD       LYS  15  -6.778 -12.308  15.623
   86   1HE   LYS  15          2HE       LYS  15  -6.640 -12.478  17.998
   87   2HE   LYS  15          1HE       LYS  15  -7.306 -14.018  17.454
   88   1HZ   LYS  15          1HZ       LYS  15  -4.896 -13.517  18.845
   89   2HZ   LYS  15          2HZ       LYS  15  -4.558 -14.285  17.366
   90   3HZ   LYS  15          3HZ       LYS  15  -5.625 -15.003  18.475
   91    H    GLY  16           H        GLY  16  -2.401 -12.852  12.388
   92   1HA   GLY  16          2HA       GLY  16  -2.865 -13.691   9.591
   93   2HA   GLY  16          1HA       GLY  16  -3.161 -11.988   9.943
   94    H    GLY  17           H        GLY  17  -0.629 -14.360  10.834
   95   1HA   GLY  17          2HA       GLY  17   1.414 -12.650   9.553
   96   2HA   GLY  17          1HA       GLY  17   1.556 -12.842  11.303
   97    H    GLU  18           H        GLU  18   0.473 -15.613  11.190
   98    HA   GLU  18           HA       GLU  18   3.006 -16.954  10.540
   99   1HB   GLU  18          2HB       GLU  18   1.420 -17.389  12.591
  100   2HB   GLU  18          1HB       GLU  18   0.494 -18.367  11.454
  101   1HG   GLU  18          2HG       GLU  18   2.538 -19.674  10.936
  102   2HG   GLU  18          1HG       GLU  18   3.438 -18.711  12.108
  103    H    LYS  19           H        LYS  19   1.169 -15.792   8.468
  104    HA   LYS  19           HA       LYS  19  -0.035 -18.018   7.048
  105   1HB   LYS  19          2HB       LYS  19  -0.805 -15.652   6.814
  106   2HB   LYS  19          1HB       LYS  19   0.731 -15.243   6.064
  107   1HG   LYS  19          2HG       LYS  19  -0.611 -15.592   4.187
  108   2HG   LYS  19          1HG       LYS  19   0.113 -17.178   4.382
  109   1HD   LYS  19          2HD       LYS  19  -2.153 -17.710   4.123
  110   2HD   LYS  19          1HD       LYS  19  -1.982 -17.690   5.872
  111   1HE   LYS  19          2HE       LYS  19  -2.979 -15.517   6.041
  112   2HE   LYS  19          1HE       LYS  19  -2.875 -15.258   4.302
  113   1HZ   LYS  19          1HZ       LYS  19  -4.272 -17.534   4.430
  114   2HZ   LYS  19          2HZ       LYS  19  -4.970 -15.991   4.324
  115   3HZ   LYS  19          3HZ       LYS  19  -4.814 -16.752   5.834
  116    H    ALA  20           H        ALA  20   2.322 -15.872   5.509
  117    HA   ALA  20           HA       ALA  20   4.104 -16.434   4.084
  118   1HB   ALA  20          1HB       ALA  20   5.364 -16.737   6.067
  119   2HB   ALA  20          2HB       ALA  20   5.638 -18.224   5.161
  120   3HB   ALA  20          3HB       ALA  20   4.489 -18.207   6.498
  121    H    ASP  21           H        ASP  21   1.556 -17.791   3.585
  122    HA   ASP  21           HA       ASP  21   2.157 -20.560   2.942
  123   1HB   ASP  21          2HB       ASP  21  -0.173 -19.398   3.406
  124   2HB   ASP  21          1HB       ASP  21  -0.124 -19.041   1.681
  125    H    ASN  22           H        ASN  22   3.696 -18.149   1.823
  126    HA   ASN  22           HA       ASN  22   4.963 -17.871  -0.121
  127   1HB   ASN  22          2HB       ASN  22   4.198 -20.527  -0.268
  128   2HB   ASN  22          1HB       ASN  22   3.525 -19.900  -1.763
  129   1HD2  ASN  22          1HD2      ASN  22   5.226 -18.428  -3.013
  130   2HD2  ASN  22          2HD2      ASN  22   6.799 -19.067  -3.065
  131    H    ALA  23           H        ALA  23   1.794 -18.862  -1.428
  132    HA   ALA  23           HA       ALA  23   1.739 -16.533  -3.175
  133   1HB   ALA  23          1HB       ALA  23   0.879 -18.550  -4.109
  134   2HB   ALA  23          2HB       ALA  23  -0.518 -17.511  -3.836
  135   3HB   ALA  23          3HB       ALA  23  -0.168 -18.828  -2.718
  136    H    ALA  24           H        ALA  24   0.143 -17.494  -0.180
  137    HA   ALA  24           HA       ALA  24  -1.943 -15.525  -0.273
  138   1HB   ALA  24          1HB       ALA  24  -2.083 -15.874   2.184
  139   2HB   ALA  24          2HB       ALA  24  -0.582 -16.794   2.123
  140   3HB   ALA  24          3HB       ALA  24  -2.023 -17.401   1.305
  141    H    GLN  25           H        GLN  25   1.160 -15.495   1.484
  142    HA   GLN  25           HA       GLN  25   0.988 -12.819   2.402
  143   1HB   GLN  25          2HB       GLN  25   3.177 -13.141   3.133
  144   2HB   GLN  25          1HB       GLN  25   2.663 -14.810   2.908
  145   1HG   GLN  25          2HG       GLN  25   4.736 -14.770   1.818
  146   2HG   GLN  25          1HG       GLN  25   3.605 -14.531   0.488
  147   1HE2  GLN  25          1HE2      GLN  25   5.142 -13.308  -0.795
  148   2HE2  GLN  25          2HE2      GLN  25   5.633 -11.745  -0.351
  149    H    VAL  26           H        VAL  26   1.476 -14.015  -0.770
  150    HA   VAL  26           HA       VAL  26   3.074 -11.851  -1.760
  151    HB   VAL  26           HB       VAL  26   2.136 -14.299  -2.731
  152   1HG1  VAL  26          1HG1      VAL  26   0.113 -13.428  -3.704
  153   2HG1  VAL  26          2HG1      VAL  26   1.246 -13.769  -4.996
  154   3HG1  VAL  26          3HG1      VAL  26   0.990 -12.109  -4.479
  155   1HG2  VAL  26          1HG2      VAL  26   3.548 -12.179  -4.363
  156   2HG2  VAL  26          2HG2      VAL  26   3.636 -13.925  -4.590
  157   3HG2  VAL  26          3HG2      VAL  26   4.341 -13.188  -3.153
  158    H    LYS  27           H        LYS  27  -0.404 -12.471  -2.338
  159    HA   LYS  27           HA       LYS  27  -0.791  -9.803  -3.364
  160   1HB   LYS  27          2HB       LYS  27  -3.136 -10.351  -3.449
  161   2HB   LYS  27          1HB       LYS  27  -2.234 -11.799  -3.891
  162   1HG   LYS  27          2HG       LYS  27  -2.401 -12.323  -1.290
  163   2HG   LYS  27          1HG       LYS  27  -3.770 -11.214  -1.369
  164   1HD   LYS  27          2HD       LYS  27  -4.666 -12.601  -3.288
  165   2HD   LYS  27          1HD       LYS  27  -3.393 -13.772  -2.951
  166   1HE   LYS  27          2HE       LYS  27  -5.451 -14.456  -1.825
  167   2HE   LYS  27          1HE       LYS  27  -4.249 -13.993  -0.623
  168   1HZ   LYS  27          1HZ       LYS  27  -5.288 -11.772  -0.570
  169   2HZ   LYS  27          2HZ       LYS  27  -6.337 -13.008  -0.064
  170   3HZ   LYS  27          3HZ       LYS  27  -6.501 -12.334  -1.614
  171    H    ASP  28           H        ASP  28  -1.085 -11.196  -0.136
  172    HA   ASP  28           HA       ASP  28  -2.618  -9.141   1.078
  173   1HB   ASP  28          2HB       ASP  28  -1.938 -11.321   2.153
  174   2HB   ASP  28          1HB       ASP  28  -0.331 -10.629   2.391
  175    H    ALA  29           H        ALA  29   0.953  -9.409   0.925
  176    HA   ALA  29           HA       ALA  29   1.466  -6.874   2.125
  177   1HB   ALA  29          1HB       ALA  29   3.259  -8.471   2.003
  178   2HB   ALA  29          2HB       ALA  29   3.718  -7.128   0.954
  179   3HB   ALA  29          3HB       ALA  29   3.087  -8.620   0.255
  180    H    LEU  30           H        LEU  30   1.210  -7.836  -1.291
  181    HA   LEU  30           HA       LEU  30   1.791  -5.271  -2.297
  182   1HB   LEU  30          2HB       LEU  30   0.004  -7.405  -3.458
  183   2HB   LEU  30          1HB       LEU  30   0.717  -6.080  -4.368
  184    HG   LEU  30           HG       LEU  30   2.352  -8.086  -2.795
  185   1HD1  LEU  30          1HD1      LEU  30   2.724  -9.326  -4.773
  186   2HD1  LEU  30          2HD1      LEU  30   2.085  -8.042  -5.796
  187   3HD1  LEU  30          3HD1      LEU  30   0.991  -9.006  -4.806
  188   1HD2  LEU  30          1HD2      LEU  30   4.113  -7.184  -4.491
  189   2HD2  LEU  30          2HD2      LEU  30   3.695  -6.192  -3.105
  190   3HD2  LEU  30          3HD2      LEU  30   2.999  -5.832  -4.683
  191    H    THR  31           H        THR  31  -1.467  -6.724  -1.893
  192    HA   THR  31           HA       THR  31  -2.834  -4.268  -2.333
  193    HB   THR  31           HB       THR  31  -3.962  -6.338  -0.483
  194    HG1  THR  31           1HG      THR  31  -2.763  -7.188  -2.450
  195   1HG2  THR  31          1HG2      THR  31  -5.305  -4.364  -1.105
  196   2HG2  THR  31          2HG2      THR  31  -6.017  -5.852  -1.728
  197   3HG2  THR  31          3HG2      THR  31  -5.118  -4.784  -2.807
  198    H    LYS  32           H        LYS  32  -1.121  -5.420   0.487
  199    HA   LYS  32           HA       LYS  32  -2.523  -3.948   2.487
  200   1HB   LYS  32          2HB       LYS  32  -0.800  -5.574   3.104
  201   2HB   LYS  32          1HB       LYS  32   0.437  -4.606   2.314
  202   1HG   LYS  32          2HG       LYS  32  -1.173  -3.150   4.363
  203   2HG   LYS  32          1HG       LYS  32  -0.148  -4.436   4.993
  204   1HD   LYS  32          2HD       LYS  32   1.809  -3.431   3.838
  205   2HD   LYS  32          1HD       LYS  32   0.786  -2.116   3.269
  206   1HE   LYS  32          2HE       LYS  32   1.747  -1.210   5.206
  207   2HE   LYS  32          1HE       LYS  32   0.191  -1.797   5.792
  208   1HZ   LYS  32          1HZ       LYS  32   1.395  -3.920   6.347
  209   2HZ   LYS  32          2HZ       LYS  32   1.797  -2.572   7.300
  210   3HZ   LYS  32          3HZ       LYS  32   2.844  -3.086   6.064
  211    H    MET  33           H        MET  33   0.363  -3.028   0.586
  212    HA   MET  33           HA       MET  33   0.477  -0.331   1.517
  213   1HB   MET  33          2HB       MET  33   1.272  -1.417  -1.208
  214   2HB   MET  33          1HB       MET  33   1.786   0.134  -0.539
  215   1HG   MET  33          2HG       MET  33   2.616  -1.376   1.485
  216   2HG   MET  33          1HG       MET  33   2.605  -2.647   0.260
  217   1HE   MET  33          1HE       MET  33   3.470  -0.902  -2.502
  218   2HE   MET  33          2HE       MET  33   3.554  -2.551  -1.889
  219   3HE   MET  33          3HE       MET  33   5.033  -1.718  -2.362
  220    H    ARG  34           H        ARG  34  -1.469  -1.841  -1.032
  221    HA   ARG  34           HA       ARG  34  -2.372   0.527  -2.330
  222   1HB   ARG  34          2HB       ARG  34  -2.851  -1.569  -3.348
  223   2HB   ARG  34          1HB       ARG  34  -3.654  -2.168  -1.909
  224   1HG   ARG  34          2HG       ARG  34  -5.558  -0.844  -2.252
  225   2HG   ARG  34          1HG       ARG  34  -4.715   0.245  -3.356
  226   1HD   ARG  34          2HD       ARG  34  -4.568  -1.502  -5.049
  227   2HD   ARG  34          1HD       ARG  34  -5.264  -2.686  -3.934
  228    HE   ARG  34           HE       ARG  34  -6.743  -0.713  -5.483
  229   1HH1  ARG  34          1HH2      ARG  34  -6.583  -2.560  -2.577
  230   2HH1  ARG  34          2HH2      ARG  34  -8.298  -2.562  -2.321
  231   1HH2  ARG  34          1HH1      ARG  34  -8.994  -0.706  -5.165
  232   2HH2  ARG  34          2HH1      ARG  34  -9.659  -1.511  -3.784
  233    H    ALA  35           H        ALA  35  -4.003  -1.298   0.299
  234    HA   ALA  35           HA       ALA  35  -6.108   0.570   0.673
  235   1HB   ALA  35          1HB       ALA  35  -6.404  -0.439   2.878
  236   2HB   ALA  35          2HB       ALA  35  -4.782  -1.127   2.806
  237   3HB   ALA  35          3HB       ALA  35  -6.034  -1.701   1.702
  238    H    ALA  36           H        ALA  36  -2.796   0.560   1.909
  239    HA   ALA  36           HA       ALA  36  -3.091   2.606   3.871
  240   1HB   ALA  36          1HB       ALA  36  -1.031   1.162   3.454
  241   2HB   ALA  36          2HB       ALA  36  -0.710   2.873   3.738
  242   3HB   ALA  36          3HB       ALA  36  -0.668   2.229   2.097
  243    H    ALA  37           H        ALA  37  -2.312   2.810   0.388
  244    HA   ALA  37           HA       ALA  37  -2.055   5.644   0.287
  245   1HB   ALA  37          1HB       ALA  37  -3.278   4.211  -2.048
  246   2HB   ALA  37          2HB       ALA  37  -1.680   3.690  -1.522
  247   3HB   ALA  37          3HB       ALA  37  -1.940   5.362  -2.014
  248    H    LEU  38           H        LEU  38  -4.896   3.546  -0.244
  249    HA   LEU  38           HA       LEU  38  -6.728   5.712  -0.702
  250   1HB   LEU  38          2HB       LEU  38  -7.239   2.905   0.333
  251   2HB   LEU  38          1HB       LEU  38  -8.485   4.008  -0.244
  252    HG   LEU  38           HG       LEU  38  -6.127   3.110  -1.930
  253   1HD1  LEU  38          1HD1      LEU  38  -7.539   1.484  -2.956
  254   2HD1  LEU  38          2HD1      LEU  38  -8.975   2.123  -2.159
  255   3HD1  LEU  38          3HD1      LEU  38  -7.757   1.261  -1.222
  256   1HD2  LEU  38          1HD2      LEU  38  -8.607   4.763  -2.425
  257   2HD2  LEU  38          2HD2      LEU  38  -7.872   3.863  -3.750
  258   3HD2  LEU  38          3HD2      LEU  38  -6.942   5.089  -2.899
  259    H    ASP  39           H        ASP  39  -6.149   3.727   2.226
  260    HA   ASP  39           HA       ASP  39  -7.904   5.210   3.898
  261   1HB   ASP  39          2HB       ASP  39  -6.563   2.992   4.364
  262   2HB   ASP  39          1HB       ASP  39  -5.320   4.083   4.977
  263    H    ALA  40           H        ALA  40  -4.616   5.838   2.849
  264    HA   ALA  40           HA       ALA  40  -4.138   7.975   4.721
  265   1HB   ALA  40          1HB       ALA  40  -2.226   6.893   3.736
  266   2HB   ALA  40          2HB       ALA  40  -2.256   8.545   3.119
  267   3HB   ALA  40          3HB       ALA  40  -2.816   7.214   2.106
  268    H    GLN  41           H        GLN  41  -5.932   7.690   1.811
  269    HA   GLN  41           HA       GLN  41  -5.697  10.390   0.885
  270   1HB   GLN  41          2HB       GLN  41  -7.230   9.771  -0.760
  271   2HB   GLN  41          1HB       GLN  41  -6.552   8.215  -0.314
  272   1HG   GLN  41          2HG       GLN  41  -8.653   8.341   1.450
  273   2HG   GLN  41          1HG       GLN  41  -9.312   9.271   0.113
  274   1HE2  GLN  41          1HE2      GLN  41  -9.943   6.447   1.115
  275   2HE2  GLN  41          2HE2      GLN  41  -9.802   5.476  -0.271
  276    H    LYS  42           H        LYS  42  -8.570  10.797   0.615
  277    HA   LYS  42           HA       LYS  42  -9.014  12.406   2.973
  278   1HB   LYS  42          2HB       LYS  42 -11.337  11.694   1.212
  279   2HB   LYS  42          1HB       LYS  42 -10.827  13.272   1.815
  280   1HG   LYS  42          2HG       LYS  42  -8.804  13.022   0.243
  281   2HG   LYS  42          1HG       LYS  42  -9.699  11.695  -0.501
  282   1HD   LYS  42          2HD       LYS  42 -10.675  14.551  -0.211
  283   2HD   LYS  42          1HD       LYS  42 -10.121  13.789  -1.703
  284   1HE   LYS  42          2HE       LYS  42 -11.950  12.020  -1.266
  285   2HE   LYS  42          1HE       LYS  42 -12.602  13.170  -0.097
  286   1HZ   LYS  42          1HZ       LYS  42 -12.712  14.830  -1.849
  287   2HZ   LYS  42          2HZ       LYS  42 -13.618  13.453  -2.266
  288   3HZ   LYS  42          3HZ       LYS  42 -12.093  13.719  -2.971
  289    H    ALA  43           H        ALA  43  -8.510  10.030   4.026
  290    HA   ALA  43           HA       ALA  43 -11.172   9.078   5.037
  291   1HB   ALA  43          1HB       ALA  43 -10.298   7.444   3.382
  292   2HB   ALA  43          2HB       ALA  43 -10.334   6.767   5.011
  293   3HB   ALA  43          3HB       ALA  43  -8.812   7.318   4.317
  294    H    THR  44           H        THR  44  -7.655   8.856   5.536
  295    HA   THR  44           HA       THR  44  -8.040   9.560   8.393
  296    HB   THR  44           HB       THR  44  -6.182   7.333   7.516
  297    HG1  THR  44           1HG      THR  44  -8.551   6.816   8.892
  298   1HG2  THR  44          1HG2      THR  44  -5.950   6.896   9.834
  299   2HG2  THR  44          2HG2      THR  44  -7.367   7.865  10.239
  300   3HG2  THR  44          3HG2      THR  44  -5.883   8.655   9.706
  301    HA   PRO  45           HA       PRO  45  -5.045  12.003   5.563
  302   1HB   PRO  45          2HB       PRO  45  -5.953  13.779   7.819
  303   2HB   PRO  45          1HB       PRO  45  -5.547  14.213   6.144
  304   1HG   PRO  45          2HG       PRO  45  -8.082  13.911   6.911
  305   2HG   PRO  45          1HG       PRO  45  -7.533  13.396   5.305
  306   1HD   PRO  45          2HD       PRO  45  -8.341  11.722   7.618
  307   2HD   PRO  45          1HD       PRO  45  -8.252  11.292   5.895
  308    HA   PRO  46           HA       PRO  46  -2.147  10.645   8.942
  309   1HB   PRO  46          2HB       PRO  46  -0.157  10.603   6.737
  310   2HB   PRO  46          1HB       PRO  46  -0.624   9.305   7.850
  311   1HG   PRO  46          2HG       PRO  46  -1.315   9.293   5.245
  312   2HG   PRO  46          1HG       PRO  46  -2.347   8.586   6.503
  313   1HD   PRO  46          2HD       PRO  46  -2.641  11.215   5.080
  314   2HD   PRO  46          1HD       PRO  46  -3.890  10.069   5.605
  315    H    LYS  47           H        LYS  47  -0.857  12.647   6.267
  316    HA   LYS  47           HA       LYS  47  -0.333  14.848   8.183
  317   1HB   LYS  47          2HB       LYS  47   1.997  15.083   7.180
  318   2HB   LYS  47          1HB       LYS  47   1.779  13.715   8.268
  319   1HG   LYS  47          2HG       LYS  47   1.529  12.188   6.409
  320   2HG   LYS  47          1HG       LYS  47   1.514  13.516   5.253
  321   1HD   LYS  47          2HD       LYS  47   3.884  13.167   7.090
  322   2HD   LYS  47          1HD       LYS  47   3.742  12.157   5.653
  323   1HE   LYS  47          2HE       LYS  47   3.509  14.231   4.270
  324   2HE   LYS  47          1HE       LYS  47   3.801  15.189   5.721
  325   1HZ   LYS  47          1HZ       LYS  47   5.650  13.211   4.507
  326   2HZ   LYS  47          2HZ       LYS  47   5.924  14.006   5.983
  327   3HZ   LYS  47          3HZ       LYS  47   5.848  14.895   4.538
  328    H    LEU  48           H        LEU  48  -1.779  13.927   5.482
  329    HA   LEU  48           HA       LEU  48  -0.886  16.004   3.645
  330   1HB   LEU  48          2HB       LEU  48  -3.314  14.205   3.572
  331   2HB   LEU  48          1HB       LEU  48  -2.803  15.260   2.259
  332    HG   LEU  48           HG       LEU  48  -0.958  13.170   3.436
  333   1HD1  LEU  48          1HD1      LEU  48  -1.641  11.682   1.586
  334   2HD1  LEU  48          2HD1      LEU  48  -2.863  12.855   1.096
  335   3HD1  LEU  48          3HD1      LEU  48  -3.001  12.035   2.651
  336   1HD2  LEU  48          1HD2      LEU  48  -1.035  14.798   0.880
  337   2HD2  LEU  48          2HD2      LEU  48  -0.045  13.350   1.026
  338   3HD2  LEU  48          3HD2      LEU  48   0.247  14.723   2.089
  339    H    GLU  49           H        GLU  49  -2.683  16.079   6.386
  340    HA   GLU  49           HA       GLU  49  -4.647  18.062   5.482
  341   1HB   GLU  49          2HB       GLU  49  -5.480  16.627   7.161
  342   2HB   GLU  49          1HB       GLU  49  -3.967  16.686   8.059
  343   1HG   GLU  49          2HG       GLU  49  -5.570  19.216   7.697
  344   2HG   GLU  49          1HG       GLU  49  -6.076  18.050   8.917
  345    H    ASP  50           H        ASP  50  -1.462  17.942   6.437
  346    HA   ASP  50           HA       ASP  50  -1.250  20.515   7.778
  347   1HB   ASP  50          2HB       ASP  50   0.635  18.529   6.540
  348   2HB   ASP  50          1HB       ASP  50   1.244  20.128   6.979
  349    H    LYS  51           H        LYS  51  -2.316  19.818   4.831
  350    HA   LYS  51           HA       LYS  51  -1.311  22.349   3.638
  351   1HB   LYS  51          2HB       LYS  51  -0.922  19.554   2.619
  352   2HB   LYS  51          1HB       LYS  51  -1.173  20.844   1.437
  353   1HG   LYS  51          2HG       LYS  51   0.765  22.029   2.180
  354   2HG   LYS  51          1HG       LYS  51   0.908  21.031   3.624
  355   1HD   LYS  51          2HD       LYS  51   1.349  19.049   2.201
  356   2HD   LYS  51          1HD       LYS  51   1.272  20.082   0.772
  357   1HE   LYS  51          2HE       LYS  51   3.172  20.618   3.062
  358   2HE   LYS  51          1HE       LYS  51   3.614  19.622   1.677
  359   1HZ   LYS  51          1HZ       LYS  51   3.030  22.499   1.787
  360   2HZ   LYS  51          2HZ       LYS  51   2.732  21.648   0.346
  361   3HZ   LYS  51          3HZ       LYS  51   4.298  21.689   1.008
  362    H    SER  52           H        SER  52  -3.575  19.568   3.256
  363    HA   SER  52           HA       SER  52  -5.796  19.607   2.424
  364   1HB   SER  52          2HB       SER  52  -5.514  21.753   4.119
  365   2HB   SER  52          1HB       SER  52  -5.994  22.574   2.640
  366    HG   SER  52           HG       SER  52  -7.344  20.278   3.598
  367    HA   PRO  53           HA       PRO  53  -5.741  20.883  -1.828
  368   1HB   PRO  53          2HB       PRO  53  -7.813  23.019  -1.467
  369   2HB   PRO  53          1HB       PRO  53  -7.811  21.628  -2.572
  370   1HG   PRO  53          2HG       PRO  53  -9.346  21.588  -0.429
  371   2HG   PRO  53          1HG       PRO  53  -8.430  20.138  -0.890
  372   1HD   PRO  53          2HD       PRO  53  -7.796  22.135   1.264
  373   2HD   PRO  53          1HD       PRO  53  -7.718  20.354   1.310
  374    H    ASP  54           H        ASP  54  -3.769  22.128  -0.378
  375    HA   ASP  54           HA       ASP  54  -3.610  24.921  -1.414
  376   1HB   ASP  54          2HB       ASP  54  -3.407  24.805   1.026
  377   2HB   ASP  54          1HB       ASP  54  -2.167  23.554   0.898
  378    H    SER  55           H        SER  55  -2.599  24.687  -3.400
  379    HA   SER  55           HA       SER  55  -0.721  24.468  -4.789
  380   1HB   SER  55          2HB       SER  55   0.450  24.394  -2.326
  381   2HB   SER  55          1HB       SER  55   0.862  22.786  -2.904
  382    HG   SER  55           HG       SER  55   1.328  25.275  -4.202
  383    HA   PRO  56           HA       PRO  56  -0.980  20.478  -6.777
  384   1HB   PRO  56          2HB       PRO  56   1.708  19.529  -5.830
  385   2HB   PRO  56          1HB       PRO  56   1.028  19.524  -7.473
  386   1HG   PRO  56          2HG       PRO  56   2.811  21.333  -6.797
  387   2HG   PRO  56          1HG       PRO  56   1.402  21.803  -7.764
  388   1HD   PRO  56          2HD       PRO  56   1.931  22.254  -4.846
  389   2HD   PRO  56          1HD       PRO  56   1.164  23.334  -6.035
  390    H    GLU  57           H        GLU  57  -1.053  20.620  -3.533
  391    HA   GLU  57           HA       GLU  57  -0.626  18.082  -2.460
  392   1HB   GLU  57          2HB       GLU  57  -1.402  19.807  -0.986
  393   2HB   GLU  57          1HB       GLU  57  -2.862  20.063  -1.940
  394   1HG   GLU  57          2HG       GLU  57  -3.188  18.748   0.212
  395   2HG   GLU  57          1HG       GLU  57  -3.786  17.952  -1.243
  396    H    MET  58           H        MET  58  -3.461  19.180  -4.315
  397    HA   MET  58           HA       MET  58  -4.946  16.741  -4.161
  398   1HB   MET  58          2HB       MET  58  -5.821  18.980  -4.922
  399   2HB   MET  58          1HB       MET  58  -4.957  18.740  -6.439
  400   1HG   MET  58          2HG       MET  58  -7.189  17.994  -6.842
  401   2HG   MET  58          1HG       MET  58  -6.232  16.528  -6.653
  402   1HE   MET  58          1HE       MET  58  -9.578  17.750  -5.943
  403   2HE   MET  58          2HE       MET  58  -9.946  16.230  -5.130
  404   3HE   MET  58          3HE       MET  58  -9.024  16.216  -6.631
  405    H    LYS  59           H        LYS  59  -2.592  17.896  -6.595
  406    HA   LYS  59           HA       LYS  59  -2.920  15.633  -8.327
  407   1HB   LYS  59          2HB       LYS  59  -0.447  17.349  -8.101
  408   2HB   LYS  59          1HB       LYS  59  -1.029  16.474  -9.517
  409   1HG   LYS  59          2HG       LYS  59  -3.052  17.900  -9.562
  410   2HG   LYS  59          1HG       LYS  59  -2.451  18.786  -8.163
  411   1HD   LYS  59          2HD       LYS  59  -1.670  20.169  -9.847
  412   2HD   LYS  59          1HD       LYS  59  -0.291  19.083  -9.696
  413   1HE   LYS  59          2HE       LYS  59  -0.886  19.341 -12.057
  414   2HE   LYS  59          1HE       LYS  59  -1.221  17.689 -11.537
  415   1HZ   LYS  59          1HZ       LYS  59  -3.518  18.190 -11.321
  416   2HZ   LYS  59          2HZ       LYS  59  -3.028  18.743 -12.850
  417   3HZ   LYS  59          3HZ       LYS  59  -3.258  19.846 -11.578
  418    H    ASP  60           H        ASP  60  -0.161  16.344  -6.084
  419    HA   ASP  60           HA       ASP  60   1.179  13.910  -6.492
  420   1HB   ASP  60          2HB       ASP  60   1.779  14.197  -3.918
  421   2HB   ASP  60          1HB       ASP  60   2.389  15.333  -5.112
  422    H    PHE  61           H        PHE  61  -1.752  14.538  -4.669
  423    HA   PHE  61           HA       PHE  61  -1.791  11.997  -3.306
  424   1HB   PHE  61          2HB       PHE  61  -3.303  13.477  -2.340
  425   2HB   PHE  61          1HB       PHE  61  -3.696  14.240  -3.872
  426    HD1  PHE  61           1HD      PHE  61  -6.066  14.168  -3.822
  427    HD2  PHE  61           2HD      PHE  61  -3.808  10.590  -3.100
  428    HE1  PHE  61           1HE      PHE  61  -8.145  12.841  -3.938
  429    HE2  PHE  61           2HE      PHE  61  -5.895   9.251  -3.218
  430    HZ   PHE  61           HZ       PHE  61  -8.065  10.377  -3.637
  431    H    ARG  62           H        ARG  62  -3.216  13.319  -6.259
  432    HA   ARG  62           HA       ARG  62  -4.289  10.840  -7.200
  433   1HB   ARG  62          2HB       ARG  62  -3.499  13.316  -8.754
  434   2HB   ARG  62          1HB       ARG  62  -4.538  12.023  -9.348
  435   1HG   ARG  62          2HG       ARG  62  -5.299  13.316  -6.740
  436   2HG   ARG  62          1HG       ARG  62  -5.547  14.251  -8.208
  437   1HD   ARG  62          2HD       ARG  62  -6.852  12.373  -9.173
  438   2HD   ARG  62          1HD       ARG  62  -6.622  11.462  -7.681
  439    HE   ARG  62           HE       ARG  62  -7.829  14.087  -7.257
  440   1HH1  ARG  62          1HH2      ARG  62  -8.296  10.754  -8.028
  441   2HH1  ARG  62          2HH2      ARG  62  -9.936  10.718  -7.472
  442   1HH2  ARG  62          1HH1      ARG  62  -9.981  14.054  -6.531
  443   2HH2  ARG  62          2HH1      ARG  62 -10.887  12.582  -6.630
  444    H    HIS  63           H        HIS  63  -1.419  12.678  -8.356
  445    HA   HIS  63           HA       HIS  63  -0.448  10.532  -9.973
  446   1HB   HIS  63          2HB       HIS  63   0.185  13.061  -9.977
  447   2HB   HIS  63          1HB       HIS  63   1.360  12.613  -8.744
  448    HD1  HIS  63           1HD      HIS  63   2.686  13.581 -11.165
  449    HD2  HIS  63           2HD      HIS  63   1.434   9.614 -10.914
  450    HE1  HIS  63           1HE      HIS  63   4.032  12.293 -12.879
  451    H    GLY  64           H        GLY  64  -0.093  11.199  -6.549
  452   1HA   GLY  64          2HA       GLY  64   2.185   9.382  -6.229
  453   2HA   GLY  64          1HA       GLY  64   1.303  10.167  -4.921
  454    H    PHE  65           H        PHE  65  -1.242   9.257  -5.105
  455    HA   PHE  65           HA       PHE  65  -0.995   6.514  -4.268
  456   1HB   PHE  65          2HB       PHE  65  -3.085   6.844  -3.406
  457   2HB   PHE  65          1HB       PHE  65  -2.958   8.497  -3.978
  458    HD1  PHE  65           1HD      PHE  65  -4.574   9.299  -5.491
  459    HD2  PHE  65           2HD      PHE  65  -3.938   5.072  -5.148
  460    HE1  PHE  65           1HE      PHE  65  -6.467   8.896  -7.032
  461    HE2  PHE  65           2HE      PHE  65  -5.834   4.662  -6.692
  462    HZ   PHE  65           HZ       PHE  65  -7.100   6.576  -7.634
  463    H    ASP  66           H        ASP  66  -1.539   8.022  -7.342
  464    HA   ASP  66           HA       ASP  66  -2.719   5.759  -8.679
  465   1HB   ASP  66          2HB       ASP  66  -2.883   7.952  -9.692
  466   2HB   ASP  66          1HB       ASP  66  -1.127   8.111  -9.730
  467    H    ILE  67           H        ILE  67   0.623   6.934  -8.429
  468    HA   ILE  67           HA       ILE  67   1.797   4.843  -9.976
  469    HB   ILE  67           HB       ILE  67   2.916   6.605  -7.778
  470   1HG1  ILE  67          2HG1      ILE  67   3.320   6.701 -10.777
  471   2HG1  ILE  67          1HG1      ILE  67   2.027   7.581  -9.959
  472   1HG2  ILE  67          1HG2      ILE  67   5.065   5.789  -9.387
  473   2HG2  ILE  67          2HG2      ILE  67   4.142   4.307  -9.176
  474   3HG2  ILE  67          3HG2      ILE  67   4.724   5.194  -7.766
  475   1HD1  ILE  67          1HD1      ILE  67   4.000   9.027 -10.271
  476   2HD1  ILE  67          2HD1      ILE  67   4.997   7.864  -9.396
  477   3HD1  ILE  67          3HD1      ILE  67   3.713   8.731  -8.556
  478    H    LEU  68           H        LEU  68   1.169   5.094  -6.489
  479    HA   LEU  68           HA       LEU  68   2.397   2.653  -5.723
  480   1HB   LEU  68          2HB       LEU  68   0.667   4.620  -4.475
  481   2HB   LEU  68          1HB       LEU  68   0.038   3.019  -4.101
  482    HG   LEU  68           HG       LEU  68   2.525   2.438  -3.494
  483   1HD1  LEU  68          1HD1      LEU  68   2.545   5.469  -3.316
  484   2HD1  LEU  68          2HD1      LEU  68   3.507   4.493  -4.429
  485   3HD1  LEU  68          3HD1      LEU  68   3.798   4.394  -2.692
  486   1HD2  LEU  68          1HD2      LEU  68   0.892   4.344  -1.801
  487   2HD2  LEU  68          2HD2      LEU  68   2.176   3.292  -1.210
  488   3HD2  LEU  68          3HD2      LEU  68   0.697   2.593  -1.864
  489    H    VAL  69           H        VAL  69  -1.101   3.225  -6.347
  490    HA   VAL  69           HA       VAL  69  -1.744   0.446  -6.370
  491    HB   VAL  69           HB       VAL  69  -3.237   2.765  -6.503
  492   1HG1  VAL  69          1HG1      VAL  69  -4.487   2.852  -8.550
  493   2HG1  VAL  69          2HG1      VAL  69  -3.704   1.395  -9.158
  494   3HG1  VAL  69          3HG1      VAL  69  -2.782   2.888  -8.995
  495   1HG2  VAL  69          1HG2      VAL  69  -4.024  -0.094  -7.085
  496   2HG2  VAL  69          2HG2      VAL  69  -5.212   1.193  -6.874
  497   3HG2  VAL  69          3HG2      VAL  69  -4.126   0.769  -5.553
  498    H    GLY  70           H        GLY  70  -0.571   2.604  -8.899
  499   1HA   GLY  70          2HA       GLY  70  -0.968   0.816 -11.106
  500   2HA   GLY  70          1HA       GLY  70   0.204   2.134 -11.063
  501    H    GLN  71           H        GLN  71   1.541   1.082  -8.652
  502    HA   GLN  71           HA       GLN  71   3.273  -0.889 -10.011
  503   1HB   GLN  71          2HB       GLN  71   3.470   0.471  -7.311
  504   2HB   GLN  71          1HB       GLN  71   4.700  -0.590  -7.985
  505   1HG   GLN  71          2HG       GLN  71   5.309   0.939  -9.649
  506   2HG   GLN  71          1HG       GLN  71   3.776   1.806  -9.557
  507   1HE2  GLN  71          1HE2      GLN  71   3.384   2.845  -7.215
  508   2HE2  GLN  71          2HE2      GLN  71   4.752   3.568  -6.512
  509    H    ILE  72           H        ILE  72   1.355  -0.642  -7.037
  510    HA   ILE  72           HA       ILE  72   1.939  -3.219  -6.018
  511    HB   ILE  72           HB       ILE  72  -0.603  -1.570  -5.840
  512   1HG1  ILE  72          2HG1      ILE  72   1.545  -1.819  -3.719
  513   2HG1  ILE  72          1HG1      ILE  72   1.715  -0.643  -5.019
  514   1HG2  ILE  72          1HG2      ILE  72   0.392  -3.846  -4.111
  515   2HG2  ILE  72          2HG2      ILE  72  -0.987  -3.928  -5.206
  516   3HG2  ILE  72          3HG2      ILE  72  -1.039  -2.883  -3.792
  517   1HD1  ILE  72          1HD1      ILE  72  -0.630  -0.833  -3.108
  518   2HD1  ILE  72          2HD1      ILE  72  -0.469   0.339  -4.415
  519   3HD1  ILE  72          3HD1      ILE  72   0.648   0.380  -3.050
  520    H    ASP  73           H        ASP  73  -0.353  -2.078  -8.440
  521    HA   ASP  73           HA       ASP  73  -1.676  -4.631  -8.786
  522   1HB   ASP  73          2HB       ASP  73  -2.742  -2.535  -9.517
  523   2HB   ASP  73          1HB       ASP  73  -1.439  -2.266 -10.675
  524    H    ASP  74           H        ASP  74   0.927  -2.915 -10.584
  525    HA   ASP  74           HA       ASP  74   1.361  -5.047 -12.459
  526   1HB   ASP  74          2HB       ASP  74   3.448  -3.127 -11.459
  527   2HB   ASP  74          1HB       ASP  74   3.442  -3.981 -12.993
  528    H    ALA  75           H        ALA  75   2.324  -4.572  -9.158
  529    HA   ALA  75           HA       ALA  75   4.466  -6.525  -9.235
  530   1HB   ALA  75          1HB       ALA  75   4.129  -6.391  -6.666
  531   2HB   ALA  75          2HB       ALA  75   2.996  -5.091  -7.027
  532   3HB   ALA  75          3HB       ALA  75   4.687  -4.944  -7.502
  533    H    LEU  76           H        LEU  76   1.008  -6.562  -8.550
  534    HA   LEU  76           HA       LEU  76   0.951  -9.205  -7.395
  535   1HB   LEU  76          2HB       LEU  76  -0.870  -7.428  -7.215
  536   2HB   LEU  76          1HB       LEU  76  -1.325  -7.835  -8.865
  537    HG   LEU  76           HG       LEU  76  -1.085 -10.155  -6.975
  538   1HD1  LEU  76          1HD1      LEU  76  -2.218  -8.404  -5.590
  539   2HD1  LEU  76          2HD1      LEU  76  -3.248  -9.789  -5.949
  540   3HD1  LEU  76          3HD1      LEU  76  -3.461  -8.281  -6.837
  541   1HD2  LEU  76          1HD2      LEU  76  -2.979 -10.980  -8.229
  542   2HD2  LEU  76          2HD2      LEU  76  -1.845 -10.302  -9.393
  543   3HD2  LEU  76          3HD2      LEU  76  -3.279  -9.391  -8.928
  544    H    LYS  77           H        LYS  77   0.073  -8.053 -10.695
  545    HA   LYS  77           HA       LYS  77  -0.391 -10.640 -11.773
  546   1HB   LYS  77          2HB       LYS  77   0.390  -9.575 -13.995
  547   2HB   LYS  77          1HB       LYS  77  -1.000  -8.847 -13.203
  548   1HG   LYS  77          2HG       LYS  77   0.083  -6.875 -12.873
  549   2HG   LYS  77          1HG       LYS  77   1.518  -7.673 -12.251
  550   1HD   LYS  77          2HD       LYS  77   0.859  -7.403 -15.194
  551   2HD   LYS  77          1HD       LYS  77   1.948  -6.342 -14.321
  552   1HE   LYS  77          2HE       LYS  77   3.112  -8.648 -13.647
  553   2HE   LYS  77          1HE       LYS  77   2.358  -9.199 -15.138
  554   1HZ   LYS  77          1HZ       LYS  77   3.904  -8.156 -16.290
  555   2HZ   LYS  77          2HZ       LYS  77   4.677  -7.704 -14.845
  556   3HZ   LYS  77          3HZ       LYS  77   3.524  -6.675 -15.553
  557    H    LEU  78           H        LEU  78   2.585  -8.826 -11.231
  558    HA   LEU  78           HA       LEU  78   4.343 -10.618 -12.588
  559   1HB   LEU  78          2HB       LEU  78   4.772  -8.258 -11.405
  560   2HB   LEU  78          1HB       LEU  78   5.199  -9.272 -10.033
  561    HG   LEU  78           HG       LEU  78   7.212  -8.799 -11.292
  562   1HD1  LEU  78          1HD1      LEU  78   6.769 -11.139 -10.376
  563   2HD1  LEU  78          2HD1      LEU  78   8.018 -11.011 -11.614
  564   3HD1  LEU  78          3HD1      LEU  78   6.417 -11.617 -12.039
  565   1HD2  LEU  78          1HD2      LEU  78   5.685  -8.577 -13.523
  566   2HD2  LEU  78          2HD2      LEU  78   6.306 -10.208 -13.774
  567   3HD2  LEU  78          3HD2      LEU  78   7.421  -8.860 -13.580
  568    H    ALA  79           H        ALA  79   3.164 -10.473  -9.235
  569    HA   ALA  79           HA       ALA  79   4.465 -12.845  -8.322
  570   1HB   ALA  79          1HB       ALA  79   3.231 -11.182  -6.868
  571   2HB   ALA  79          2HB       ALA  79   2.825 -12.866  -6.542
  572   3HB   ALA  79          3HB       ALA  79   1.723 -11.859  -7.482
  573    H    ASN  80           H        ASN  80   1.358 -12.301  -9.954
  574    HA   ASN  80           HA       ASN  80   0.499 -15.033  -9.961
  575   1HB   ASN  80          2HB       ASN  80  -0.032 -12.920 -12.068
  576   2HB   ASN  80          1HB       ASN  80  -0.976 -14.382 -11.791
  577   1HD2  ASN  80          1HD2      ASN  80  -2.880 -13.079 -11.305
  578   2HD2  ASN  80          2HD2      ASN  80  -3.032 -12.254  -9.830
  579    H    GLU  81           H        GLU  81   1.677 -13.231 -12.791
  580    HA   GLU  81           HA       GLU  81   2.513 -15.594 -14.204
  581   1HB   GLU  81          2HB       GLU  81   1.885 -13.655 -15.464
  582   2HB   GLU  81          1HB       GLU  81   3.023 -12.630 -14.591
  583   1HG   GLU  81          2HG       GLU  81   4.882 -13.498 -15.726
  584   2HG   GLU  81          1HG       GLU  81   4.054 -14.998 -16.150
  585    H    GLY  82           H        GLY  82   3.838 -14.489 -11.459
  586   1HA   GLY  82          2HA       GLY  82   6.586 -15.376 -12.252
  587   2HA   GLY  82          1HA       GLY  82   6.387 -13.912 -11.306
  588    H    LYS  83           H        LYS  83   7.898 -15.760 -10.158
  589    HA   LYS  83           HA       LYS  83   6.329 -17.599  -8.512
  590   1HB   LYS  83          2HB       LYS  83   8.893 -17.676  -9.365
  591   2HB   LYS  83          1HB       LYS  83   9.164 -16.917  -7.801
  592   1HG   LYS  83          2HG       LYS  83   7.864 -18.791  -6.740
  593   2HG   LYS  83          1HG       LYS  83   7.769 -19.559  -8.318
  594   1HD   LYS  83          2HD       LYS  83  10.096 -19.937  -8.420
  595   2HD   LYS  83          1HD       LYS  83  10.438 -18.754  -7.159
  596   1HE   LYS  83          2HE       LYS  83   9.201 -20.249  -5.539
  597   2HE   LYS  83          1HE       LYS  83   9.127 -21.464  -6.816
  598   1HZ   LYS  83          1HZ       LYS  83  11.736 -20.649  -6.776
  599   2HZ   LYS  83          2HZ       LYS  83  11.124 -22.095  -6.125
  600   3HZ   LYS  83          3HZ       LYS  83  11.313 -20.728  -5.135
  601    H    VAL  84           H        VAL  84   7.581 -17.247  -5.976
  602    HA   VAL  84           HA       VAL  84   6.191 -14.796  -5.088
  603    HB   VAL  84           HB       VAL  84   6.044 -17.200  -4.025
  604   1HG1  VAL  84          1HG1      VAL  84   7.566 -17.465  -2.068
  605   2HG1  VAL  84          2HG1      VAL  84   8.496 -16.080  -2.605
  606   3HG1  VAL  84          3HG1      VAL  84   8.440 -17.543  -3.591
  607   1HG2  VAL  84          1HG2      VAL  84   5.735 -16.081  -1.733
  608   2HG2  VAL  84          2HG2      VAL  84   4.776 -15.469  -3.080
  609   3HG2  VAL  84          3HG2      VAL  84   6.204 -14.582  -2.544
  610    H    LYS  85           H        LYS  85   9.419 -16.299  -5.017
  611    HA   LYS  85           HA       LYS  85  10.714 -14.101  -3.672
  612   1HB   LYS  85          2HB       LYS  85  11.896 -16.148  -3.596
  613   2HB   LYS  85          1HB       LYS  85  11.653 -16.457  -5.313
  614   1HG   LYS  85          2HG       LYS  85  13.277 -14.893  -5.957
  615   2HG   LYS  85          1HG       LYS  85  13.252 -14.072  -4.398
  616   1HD   LYS  85          2HD       LYS  85  14.089 -16.965  -4.498
  617   2HD   LYS  85          1HD       LYS  85  15.236 -15.734  -5.014
  618   1HE   LYS  85          2HE       LYS  85  15.040 -14.590  -2.859
  619   2HE   LYS  85          1HE       LYS  85  13.815 -15.743  -2.333
  620   1HZ   LYS  85          1HZ       LYS  85  16.362 -16.817  -3.273
  621   2HZ   LYS  85          2HZ       LYS  85  15.334 -17.377  -2.042
  622   3HZ   LYS  85          3HZ       LYS  85  16.355 -16.051  -1.761
  623    H    GLU  86           H        GLU  86  10.149 -15.012  -7.031
  624    HA   GLU  86           HA       GLU  86  11.666 -12.960  -8.295
  625   1HB   GLU  86          2HB       GLU  86  10.895 -14.542  -9.825
  626   2HB   GLU  86          1HB       GLU  86   9.335 -14.701  -9.032
  627   1HG   GLU  86          2HG       GLU  86   9.196 -13.617 -11.275
  628   2HG   GLU  86          1HG       GLU  86   8.572 -12.597  -9.989
  629    H    ALA  87           H        ALA  87   8.272 -13.078  -7.253
  630    HA   ALA  87           HA       ALA  87   7.576 -10.424  -7.992
  631   1HB   ALA  87          1HB       ALA  87   5.579 -10.892  -6.944
  632   2HB   ALA  87          2HB       ALA  87   6.364 -11.488  -5.480
  633   3HB   ALA  87          3HB       ALA  87   6.236 -12.526  -6.893
  634    H    GLN  88           H        GLN  88   8.889 -11.668  -4.886
  635    HA   GLN  88           HA       GLN  88   8.860  -9.156  -3.556
  636   1HB   GLN  88          2HB       GLN  88   9.671 -10.412  -1.843
  637   2HB   GLN  88          1HB       GLN  88   9.640 -11.778  -2.949
  638   1HG   GLN  88          2HG       GLN  88  11.822 -11.698  -2.018
  639   2HG   GLN  88          1HG       GLN  88  11.996 -11.102  -3.661
  640   1HE2  GLN  88          1HE2      GLN  88  10.385  -8.666  -2.098
  641   2HE2  GLN  88          2HE2      GLN  88  11.703  -7.734  -1.574
  642    H    ALA  89           H        ALA  89  11.197 -10.581  -5.781
  643    HA   ALA  89           HA       ALA  89  13.312  -8.714  -5.441
  644   1HB   ALA  89          1HB       ALA  89  13.331 -10.852  -6.829
  645   2HB   ALA  89          2HB       ALA  89  14.105  -9.456  -7.580
  646   3HB   ALA  89          3HB       ALA  89  12.484  -9.942  -8.080
  647    H    ALA  90           H        ALA  90  10.497  -8.618  -7.629
  648    HA   ALA  90           HA       ALA  90  11.099  -6.167  -8.914
  649   1HB   ALA  90          1HB       ALA  90   9.300  -7.737  -9.621
  650   2HB   ALA  90          2HB       ALA  90   8.723  -6.078  -9.473
  651   3HB   ALA  90          3HB       ALA  90   8.357  -7.256  -8.211
  652    H    ALA  91           H        ALA  91   9.556  -6.856  -5.814
  653    HA   ALA  91           HA       ALA  91   8.599  -4.213  -5.273
  654   1HB   ALA  91          1HB       ALA  91   8.432  -4.936  -2.962
  655   2HB   ALA  91          2HB       ALA  91   9.546  -6.270  -3.256
  656   3HB   ALA  91          3HB       ALA  91   7.947  -6.276  -4.000
  657    H    GLU  92           H        GLU  92  11.705  -5.799  -4.542
  658    HA   GLU  92           HA       GLU  92  12.821  -3.726  -2.971
  659   1HB   GLU  92          2HB       GLU  92  14.274  -5.574  -4.882
  660   2HB   GLU  92          1HB       GLU  92  14.993  -4.700  -3.526
  661   1HG   GLU  92          2HG       GLU  92  13.242  -5.895  -2.057
  662   2HG   GLU  92          1HG       GLU  92  12.988  -6.956  -3.442
  663    H    GLN  93           H        GLN  93  13.150  -4.258  -6.516
  664    HA   GLN  93           HA       GLN  93  14.613  -1.822  -6.910
  665   1HB   GLN  93          2HB       GLN  93  13.788  -2.001  -9.310
  666   2HB   GLN  93          1HB       GLN  93  14.662  -3.406  -8.703
  667   1HG   GLN  93          2HG       GLN  93  12.436  -4.439  -8.136
  668   2HG   GLN  93          1HG       GLN  93  11.671  -3.092  -8.971
  669   1HE2  GLN  93          1HE2      GLN  93  11.115  -3.662 -11.066
  670   2HE2  GLN  93          2HE2      GLN  93  12.020  -4.685 -12.075
  671    H    LEU  94           H        LEU  94  11.148  -2.544  -6.782
  672    HA   LEU  94           HA       LEU  94  10.391   0.184  -7.499
  673   1HB   LEU  94          2HB       LEU  94   8.791  -2.053  -6.222
  674   2HB   LEU  94          1HB       LEU  94   8.117  -0.492  -6.699
  675    HG   LEU  94           HG       LEU  94   9.534  -2.373  -8.609
  676   1HD1  LEU  94          1HD1      LEU  94   7.435  -3.339  -7.645
  677   2HD1  LEU  94          2HD1      LEU  94   7.345  -3.057  -9.383
  678   3HD1  LEU  94          3HD1      LEU  94   6.562  -1.942  -8.268
  679   1HD2  LEU  94          1HD2      LEU  94   9.597  -0.252  -9.612
  680   2HD2  LEU  94          2HD2      LEU  94   8.074   0.250  -8.882
  681   3HD2  LEU  94          3HD2      LEU  94   8.075  -0.886 -10.228
  682    H    LYS  95           H        LYS  95  11.698  -1.251  -4.725
  683    HA   LYS  95           HA       LYS  95  10.265   0.264  -2.722
  684   1HB   LYS  95          2HB       LYS  95  11.702  -1.797  -2.332
  685   2HB   LYS  95          1HB       LYS  95  13.113  -0.771  -2.550
  686   1HG   LYS  95          2HG       LYS  95  10.941  -0.170  -0.521
  687   2HG   LYS  95          1HG       LYS  95  12.349  -1.155  -0.140
  688   1HD   LYS  95          2HD       LYS  95  13.650   0.963  -1.181
  689   2HD   LYS  95          1HD       LYS  95  12.180   1.790  -0.680
  690   1HE   LYS  95          2HE       LYS  95  13.883   0.055   1.133
  691   2HE   LYS  95          1HE       LYS  95  13.947   1.815   1.077
  692   1HZ   LYS  95          1HZ       LYS  95  12.076   0.124   2.391
  693   2HZ   LYS  95          2HZ       LYS  95  11.285   1.198   1.339
  694   3HZ   LYS  95          3HZ       LYS  95  12.312   1.795   2.554
  695    H    THR  96           H        THR  96  13.391   0.726  -4.388
  696    HA   THR  96           HA       THR  96  13.773   3.369  -3.222
  697    HB   THR  96           HB       THR  96  15.775   2.261  -3.839
  698    HG1  THR  96           1HG      THR  96  16.643   3.809  -5.016
  699   1HG2  THR  96          1HG2      THR  96  14.348   1.731  -6.447
  700   2HG2  THR  96          2HG2      THR  96  14.995   0.557  -5.300
  701   3HG2  THR  96          3HG2      THR  96  16.091   1.534  -6.275
  702    H    THR  97           H        THR  97  12.354   2.134  -6.230
  703    HA   THR  97           HA       THR  97  12.096   4.860  -7.331
  704    HB   THR  97           HB       THR  97  11.425   2.093  -8.351
  705    HG1  THR  97           1HG      THR  97  13.013   2.698  -9.884
  706   1HG2  THR  97          1HG2      THR  97  10.915   3.339 -10.519
  707   2HG2  THR  97          2HG2      THR  97  10.784   4.792  -9.529
  708   3HG2  THR  97          3HG2      THR  97   9.691   3.437  -9.252
  709    H    GLY  98           H        GLY  98  10.127   2.435  -5.735
  710   1HA   GLY  98          2HA       GLY  98   7.600   3.708  -6.421
  711   2HA   GLY  98          1HA       GLY  98   7.804   2.384  -5.287
  712    H    ARG  99           H        ARG  99   7.625   5.816  -5.629
  713    HA   ARG  99           HA       ARG  99   7.123   6.149  -2.786
  714   1HB   ARG  99          2HB       ARG  99   9.011   7.790  -2.456
  715   2HB   ARG  99          1HB       ARG  99   9.532   6.113  -2.625
  716   1HG   ARG  99          2HG       ARG  99  10.020   6.498  -5.011
  717   2HG   ARG  99          1HG       ARG  99   9.494   8.175  -4.850
  718   1HD   ARG  99          2HD       ARG  99  11.767   6.909  -3.298
  719   2HD   ARG  99          1HD       ARG  99  11.966   7.959  -4.701
  720    HE   ARG  99           HE       ARG  99  10.509   9.578  -3.116
  721   1HH1  ARG  99          1HH2      ARG  99  13.179   7.492  -2.398
  722   2HH1  ARG  99          2HH2      ARG  99  13.725   8.448  -1.064
  723   1HH2  ARG  99          1HH1      ARG  99  11.226  10.824  -1.382
  724   2HH2  ARG  99          2HH1      ARG  99  12.628  10.328  -0.492
  725    H    ALA 100           H        ALA 100   6.007   8.073  -2.418
  726    HA   ALA 100           HA       ALA 100   5.065   9.496  -4.782
  727   1HB   ALA 100          1HB       ALA 100   4.532   9.996  -1.835
  728   2HB   ALA 100          2HB       ALA 100   3.543   8.994  -2.896
  729   3HB   ALA 100          3HB       ALA 100   3.655  10.732  -3.176
  730    H    GLY 101           H        GLY 101   7.896   9.678  -3.272
  731   1HA   GLY 101          2HA       GLY 101   9.559  11.340  -3.295
  732   2HA   GLY 101          1HA       GLY 101   8.434  12.351  -4.197
  733    H    ASN 102           H        ASN 102   6.649  11.488  -1.653
  734    HA   ASN 102           HA       ASN 102   5.992  12.552   0.312
  735   1HB   ASN 102          2HB       ASN 102   8.413  11.805   0.816
  736   2HB   ASN 102          1HB       ASN 102   8.839  13.502   0.602
  737   1HD2  ASN 102          1HD2      ASN 102   7.040  14.990   1.860
  738   2HD2  ASN 102          2HD2      ASN 102   6.776  14.510   3.466
  739    H    GLN 103           H        GLN 103   8.571  14.793  -0.777
  740    HA   GLN 103           HA       GLN 103   6.644  17.030  -0.509
  741   1HB   GLN 103          2HB       GLN 103   9.153  16.978   0.309
  742   2HB   GLN 103          1HB       GLN 103   9.504  17.343  -1.380
  743   1HG   GLN 103          2HG       GLN 103   7.506  19.161  -0.871
  744   2HG   GLN 103          1HG       GLN 103   8.293  19.085   0.702
  745   1HE2  GLN 103          1HE2      GLN 103   8.886  19.741  -2.762
  746   2HE2  GLN 103          2HE2      GLN 103  10.285  20.673  -2.514
  747    H    LYS 104           H        LYS 104   6.648  18.657  -2.207
  748    HA   LYS 104           HA       LYS 104   7.462  17.919  -4.898
  749   1HB   LYS 104          2HB       LYS 104   5.369  16.716  -4.847
  750   2HB   LYS 104          1HB       LYS 104   4.538  18.081  -4.109
  751   1HG   LYS 104          2HG       LYS 104   4.524  19.332  -6.099
  752   2HG   LYS 104          1HG       LYS 104   5.875  18.426  -6.789
  753   1HD   LYS 104          2HD       LYS 104   4.422  16.423  -6.974
  754   2HD   LYS 104          1HD       LYS 104   3.073  17.354  -6.329
  755   1HE   LYS 104          2HE       LYS 104   4.503  17.719  -8.962
  756   2HE   LYS 104          1HE       LYS 104   2.784  17.444  -8.681
  757   1HZ   LYS 104          1HZ       LYS 104   2.640  19.645  -8.865
  758   2HZ   LYS 104          2HZ       LYS 104   4.297  19.896  -8.581
  759   3HZ   LYS 104          3HZ       LYS 104   3.230  19.680  -7.277
  760    H    GLY 105           H        GLY 105   4.721  19.933  -4.188
  761   1HA   GLY 105          2HA       GLY 105   6.259  22.340  -4.980
  762   2HA   GLY 105          1HA       GLY 105   4.500  22.217  -4.833
  763    H    GLY 106           H        GLY 106   6.341  20.767  -2.347
  764   1HA   GLY 106          2HA       GLY 106   5.374  22.774  -0.399
  765   2HA   GLY 106          1HA       GLY 106   6.017  21.170  -0.016
  Start of MODEL    5
    1   1H    ALA   1          1HT       ALA   1  26.118 -17.325   4.212
    2   2H    ALA   1          2HT       ALA   1  26.897 -18.724   3.646
    3   3H    ALA   1          3HT       ALA   1  25.247 -18.772   4.051
    4    HA   ALA   1           HA       ALA   1  26.434 -17.198   1.832
    5   1HB   ALA   1          1HB       ALA   1  25.533 -18.828   0.352
    6   2HB   ALA   1          2HB       ALA   1  24.576 -19.574   1.633
    7   3HB   ALA   1          3HB       ALA   1  26.330 -19.759   1.619
    8    H    ASP   2           H        ASP   2  24.509 -16.649   0.302
    9    HA   ASP   2           HA       ASP   2  22.554 -15.406   0.000
   10   1HB   ASP   2          2HB       ASP   2  21.638 -17.654   0.879
   11   2HB   ASP   2          1HB       ASP   2  21.449 -16.826   2.426
   12    H    LEU   3           H        LEU   3  24.674 -14.469   1.886
   13    HA   LEU   3           HA       LEU   3  23.166 -12.984   3.937
   14   1HB   LEU   3          2HB       LEU   3  25.786 -11.969   3.952
   15   2HB   LEU   3          1HB       LEU   3  25.174 -13.248   4.989
   16    HG   LEU   3           HG       LEU   3  25.835 -14.917   3.202
   17   1HD1  LEU   3          1HD1      LEU   3  27.236 -12.476   2.056
   18   2HD1  LEU   3          2HD1      LEU   3  25.928 -13.366   1.277
   19   3HD1  LEU   3          3HD1      LEU   3  27.492 -14.135   1.527
   20   1HD2  LEU   3          1HD2      LEU   3  27.887 -13.122   4.508
   21   2HD2  LEU   3          2HD2      LEU   3  28.320 -14.619   3.684
   22   3HD2  LEU   3          3HD2      LEU   3  27.268 -14.667   5.097
   23    H    GLU   4           H        GLU   4  25.676 -11.704   1.745
   24    HA   GLU   4           HA       GLU   4  25.729  -9.719   0.519
   25   1HB   GLU   4          2HB       GLU   4  22.744 -10.065   0.192
   26   2HB   GLU   4          1HB       GLU   4  23.896  -9.356  -0.942
   27   1HG   GLU   4          2HG       GLU   4  24.985 -11.597  -1.168
   28   2HG   GLU   4          1HG       GLU   4  23.724 -12.274  -0.137
   29    H    ASP   5           H        ASP   5  26.113  -7.964   1.825
   30    HA   ASP   5           HA       ASP   5  25.738  -6.242   3.367
   31   1HB   ASP   5          2HB       ASP   5  24.766  -5.203   1.481
   32   2HB   ASP   5          1HB       ASP   5  23.374  -6.275   1.515
   33    H    ASN   6           H        ASN   6  25.546  -7.160   5.417
   34    HA   ASN   6           HA       ASN   6  22.957  -8.346   6.244
   35   1HB   ASN   6          2HB       ASN   6  25.558  -8.058   7.779
   36   2HB   ASN   6          1HB       ASN   6  24.152  -8.999   8.281
   37   1HD2  ASN   6          1HD2      ASN   6  26.937  -9.970   7.625
   38   2HD2  ASN   6          2HD2      ASN   6  26.728 -11.117   6.391
   39    H    ASP   7           H        ASP   7  22.227  -5.889   5.867
   40    HA   ASP   7           HA       ASP   7  22.721  -4.265   8.314
   41   1HB   ASP   7          2HB       ASP   7  21.471  -3.643   5.629
   42   2HB   ASP   7          1HB       ASP   7  21.384  -2.533   6.996
   43    H    GLU   8           H        GLU   8  21.406  -5.906   9.548
   44    HA   GLU   8           HA       GLU   8  19.386  -6.639  10.490
   45   1HB   GLU   8          2HB       GLU   8  18.501  -3.905   9.520
   46   2HB   GLU   8          1HB       GLU   8  17.644  -4.898  10.697
   47   1HG   GLU   8          2HG       GLU   8  19.388  -4.701  12.299
   48   2HG   GLU   8          1HG       GLU   8  20.525  -4.085  11.099
   49    H    THR   9           H        THR   9  19.944  -7.015   7.521
   50    HA   THR   9           HA       THR   9  17.244  -7.034   6.353
   51    HB   THR   9           HB       THR   9  19.728  -8.211   5.099
   52    HG1  THR   9           1HG      THR   9  20.195  -6.112   5.951
   53   1HG2  THR   9          1HG2      THR   9  17.342  -6.707   4.011
   54   2HG2  THR   9          2HG2      THR   9  17.558  -8.456   3.961
   55   3HG2  THR   9          3HG2      THR   9  18.641  -7.405   3.049
   56    H    GLY  10           H        GLY  10  17.676  -8.683   8.662
   57   1HA   GLY  10          2HA       GLY  10  16.959 -10.837   9.308
   58   2HA   GLY  10          1HA       GLY  10  16.718 -11.221   7.603
   59    H    ASN  11           H        ASN  11  19.767  -9.944   7.967
   60    HA   ASN  11           HA       ASN  11  21.854 -10.919   7.590
   61   1HB   ASN  11          2HB       ASN  11  22.445 -12.522   9.517
   62   2HB   ASN  11          1HB       ASN  11  21.969 -10.876   9.930
   63   1HD2  ASN  11          1HD2      ASN  11  21.093 -14.238  10.255
   64   2HD2  ASN  11          2HD2      ASN  11  19.692 -13.989  11.179
   65    H    ASP  12           H        ASP  12  20.271 -13.881   8.807
   66    HA   ASP  12           HA       ASP  12  21.345 -15.317   6.454
   67   1HB   ASP  12          2HB       ASP  12  21.675 -16.282   8.702
   68   2HB   ASP  12          1HB       ASP  12  19.925 -16.360   8.920
   69    H    ASN  13           H        ASN  13  18.620 -13.595   6.998
   70    HA   ASN  13           HA       ASN  13  16.497 -13.579   6.006
   71   1HB   ASN  13          2HB       ASN  13  18.043 -14.023   3.994
   72   2HB   ASN  13          1HB       ASN  13  17.536 -15.706   4.136
   73   1HD2  ASN  13          1HD2      ASN  13  16.276 -15.720   2.170
   74   2HD2  ASN  13          2HD2      ASN  13  14.838 -14.831   2.012
   75    H    GLY  14           H        GLY  14  16.773 -15.277   8.239
   76   1HA   GLY  14          2HA       GLY  14  15.536 -17.863   7.599
   77   2HA   GLY  14          1HA       GLY  14  15.904 -17.265   9.217
   78    H    LYS  15           H        LYS  15  14.192 -15.161   7.074
   79    HA   LYS  15           HA       LYS  15  12.030 -14.277   7.184
   80   1HB   LYS  15          2HB       LYS  15  11.212 -17.029   8.152
   81   2HB   LYS  15          1HB       LYS  15  10.211 -15.846   7.315
   82   1HG   LYS  15          2HG       LYS  15  12.697 -16.973   6.015
   83   2HG   LYS  15          1HG       LYS  15  11.160 -17.825   5.936
   84   1HD   LYS  15          2HD       LYS  15  10.094 -15.897   4.882
   85   2HD   LYS  15          1HD       LYS  15  11.576 -14.959   5.036
   86   1HE   LYS  15          2HE       LYS  15  11.561 -17.584   3.552
   87   2HE   LYS  15          1HE       LYS  15  11.101 -16.080   2.754
   88   1HZ   LYS  15          1HZ       LYS  15  13.335 -16.096   2.376
   89   2HZ   LYS  15          2HZ       LYS  15  13.702 -16.897   3.829
   90   3HZ   LYS  15          3HZ       LYS  15  13.304 -15.245   3.841
   91    H    GLY  16           H        GLY  16  13.754 -15.050   9.827
   92   1HA   GLY  16          2HA       GLY  16  13.545 -14.502  12.098
   93   2HA   GLY  16          1HA       GLY  16  12.322 -13.342  11.579
   94    H    GLY  17           H        GLY  17  11.558 -16.502  10.600
   95   1HA   GLY  17          2HA       GLY  17  10.085 -18.119  11.472
   96   2HA   GLY  17          1HA       GLY  17  10.275 -17.374  13.059
   97    H    GLU  18           H        GLU  18   9.413 -15.239  10.498
   98    HA   GLU  18           HA       GLU  18   6.767 -14.828  11.743
   99   1HB   GLU  18          2HB       GLU  18   8.347 -13.355   9.630
  100   2HB   GLU  18          1HB       GLU  18   6.658 -12.969   9.960
  101   1HG   GLU  18          2HG       GLU  18   7.137 -12.361  12.221
  102   2HG   GLU  18          1HG       GLU  18   8.758 -13.053  12.138
  103    H    LYS  19           H        LYS  19   7.679 -17.171   9.919
  104    HA   LYS  19           HA       LYS  19   6.711 -18.501   8.262
  105   1HB   LYS  19          2HB       LYS  19   4.782 -18.399   9.802
  106   2HB   LYS  19          1HB       LYS  19   4.251 -16.898   9.062
  107   1HG   LYS  19          2HG       LYS  19   2.890 -18.485   8.009
  108   2HG   LYS  19          1HG       LYS  19   4.182 -18.279   6.841
  109   1HD   LYS  19          2HD       LYS  19   4.107 -20.604   6.960
  110   2HD   LYS  19          1HD       LYS  19   5.297 -20.283   8.214
  111   1HE   LYS  19          2HE       LYS  19   3.721 -21.818   9.156
  112   2HE   LYS  19          1HE       LYS  19   3.371 -20.247   9.875
  113   1HZ   LYS  19          1HZ       LYS  19   1.990 -21.210   7.442
  114   2HZ   LYS  19          2HZ       LYS  19   1.532 -19.946   8.481
  115   3HZ   LYS  19          3HZ       LYS  19   1.416 -21.561   8.997
  116    H    ALA  20           H        ALA  20   4.661 -15.672   7.657
  117    HA   ALA  20           HA       ALA  20   4.610 -14.225   5.828
  118   1HB   ALA  20          1HB       ALA  20   6.627 -13.581   4.936
  119   2HB   ALA  20          2HB       ALA  20   7.055 -15.232   4.496
  120   3HB   ALA  20          3HB       ALA  20   7.306 -14.666   6.143
  121    H    ASP  21           H        ASP  21   5.092 -17.529   5.554
  122    HA   ASP  21           HA       ASP  21   4.490 -19.190   4.083
  123   1HB   ASP  21          2HB       ASP  21   2.350 -18.631   4.931
  124   2HB   ASP  21          1HB       ASP  21   2.275 -17.170   3.958
  125    H    ASN  22           H        ASN  22   5.719 -16.408   2.997
  126    HA   ASN  22           HA       ASN  22   6.533 -15.683   0.957
  127   1HB   ASN  22          2HB       ASN  22   6.473 -18.598   0.912
  128   2HB   ASN  22          1HB       ASN  22   6.194 -17.980  -0.705
  129   1HD2  ASN  22          1HD2      ASN  22   7.918 -16.800  -1.723
  130   2HD2  ASN  22          2HD2      ASN  22   9.496 -16.794  -1.103
  131    H    ALA  23           H        ALA  23   3.750 -17.815   0.359
  132    HA   ALA  23           HA       ALA  23   2.836 -16.121  -1.859
  133   1HB   ALA  23          1HB       ALA  23   2.639 -18.593  -1.948
  134   2HB   ALA  23          2HB       ALA  23   1.080 -17.792  -2.143
  135   3HB   ALA  23          3HB       ALA  23   1.505 -18.534  -0.600
  136    H    ALA  24           H        ALA  24   1.754 -16.763   1.497
  137    HA   ALA  24           HA       ALA  24  -0.734 -15.316   1.123
  138   1HB   ALA  24          1HB       ALA  24  -1.055 -15.522   3.444
  139   2HB   ALA  24          2HB       ALA  24   0.675 -15.514   3.783
  140   3HB   ALA  24          3HB       ALA  24  -0.075 -16.934   3.050
  141    H    GLN  25           H        GLN  25   2.252 -14.401   2.805
  142    HA   GLN  25           HA       GLN  25   1.596 -11.684   3.213
  143   1HB   GLN  25          2HB       GLN  25   3.825 -11.445   3.892
  144   2HB   GLN  25          1HB       GLN  25   3.525 -13.162   4.109
  145   1HG   GLN  25          2HG       GLN  25   5.512 -13.326   2.956
  146   2HG   GLN  25          1HG       GLN  25   4.425 -13.268   1.574
  147   1HE2  GLN  25          1HE2      GLN  25   5.214 -11.826   0.018
  148   2HE2  GLN  25          2HE2      GLN  25   6.005 -10.364   0.360
  149    H    VAL  26           H        VAL  26   2.211 -13.281   0.269
  150    HA   VAL  26           HA       VAL  26   3.492 -11.102  -1.098
  151    HB   VAL  26           HB       VAL  26   2.955 -13.761  -1.680
  152   1HG1  VAL  26          1HG1      VAL  26   1.847 -13.762  -3.894
  153   2HG1  VAL  26          2HG1      VAL  26   1.362 -12.090  -3.643
  154   3HG1  VAL  26          3HG1      VAL  26   0.743 -13.368  -2.588
  155   1HG2  VAL  26          1HG2      VAL  26   4.128 -13.269  -3.834
  156   2HG2  VAL  26          2HG2      VAL  26   4.911 -12.549  -2.427
  157   3HG2  VAL  26          3HG2      VAL  26   3.928 -11.553  -3.499
  158    H    LYS  27           H        LYS  27   0.121 -12.277  -1.341
  159    HA   LYS  27           HA       LYS  27  -0.753  -9.932  -2.773
  160   1HB   LYS  27          2HB       LYS  27  -2.208 -12.095  -1.247
  161   2HB   LYS  27          1HB       LYS  27  -3.077 -10.750  -1.987
  162   1HG   LYS  27          2HG       LYS  27  -2.442 -11.370  -4.168
  163   2HG   LYS  27          1HG       LYS  27  -1.112 -12.376  -3.601
  164   1HD   LYS  27          2HD       LYS  27  -2.651 -14.020  -2.711
  165   2HD   LYS  27          1HD       LYS  27  -4.033 -12.983  -3.071
  166   1HE   LYS  27          2HE       LYS  27  -3.525 -13.132  -5.479
  167   2HE   LYS  27          1HE       LYS  27  -2.133 -14.158  -5.124
  168   1HZ   LYS  27          1HZ       LYS  27  -4.450 -15.169  -3.854
  169   2HZ   LYS  27          2HZ       LYS  27  -3.446 -15.917  -5.004
  170   3HZ   LYS  27          3HZ       LYS  27  -4.754 -14.955  -5.507
  171    H    ASP  28           H        ASP  28  -0.841 -10.805   0.675
  172    HA   ASP  28           HA       ASP  28  -2.372  -8.609   1.590
  173   1HB   ASP  28          2HB       ASP  28  -1.667 -10.586   2.963
  174   2HB   ASP  28          1HB       ASP  28  -0.044  -9.904   3.037
  175    H    ALA  29           H        ALA  29   1.065  -8.807   0.761
  176    HA   ALA  29           HA       ALA  29   1.802  -6.250   1.856
  177   1HB   ALA  29          1HB       ALA  29   3.790  -6.471   0.372
  178   2HB   ALA  29          2HB       ALA  29   3.042  -7.881  -0.376
  179   3HB   ALA  29          3HB       ALA  29   3.503  -7.927   1.325
  180    H    LEU  30           H        LEU  30   0.919  -7.290  -1.432
  181    HA   LEU  30           HA       LEU  30   1.187  -4.757  -2.621
  182   1HB   LEU  30          2HB       LEU  30  -0.838  -6.880  -3.305
  183   2HB   LEU  30          1HB       LEU  30  -0.202  -5.658  -4.392
  184    HG   LEU  30           HG       LEU  30   1.414  -7.832  -3.056
  185   1HD1  LEU  30          1HD1      LEU  30   0.147  -8.851  -4.775
  186   2HD1  LEU  30          2HD1      LEU  30   1.705  -8.505  -5.527
  187   3HD1  LEU  30          3HD1      LEU  30   0.323  -7.454  -5.833
  188   1HD2  LEU  30          1HD2      LEU  30   2.953  -6.092  -3.321
  189   2HD2  LEU  30          2HD2      LEU  30   2.156  -5.469  -4.764
  190   3HD2  LEU  30          3HD2      LEU  30   3.121  -6.943  -4.855
  191    H    THR  31           H        THR  31  -1.827  -6.276  -1.404
  192    HA   THR  31           HA       THR  31  -3.394  -3.944  -1.763
  193    HB   THR  31           HB       THR  31  -4.204  -6.298  -1.326
  194    HG1  THR  31           1HG      THR  31  -5.345  -4.180   0.157
  195   1HG2  THR  31          1HG2      THR  31  -4.069  -5.460   1.565
  196   2HG2  THR  31          2HG2      THR  31  -2.851  -6.490   0.822
  197   3HG2  THR  31          3HG2      THR  31  -4.522  -7.034   0.914
  198    H    LYS  32           H        LYS  32  -1.231  -4.860   0.843
  199    HA   LYS  32           HA       LYS  32  -2.219  -3.092   2.844
  200   1HB   LYS  32          2HB       LYS  32  -0.469  -4.728   3.358
  201   2HB   LYS  32          1HB       LYS  32   0.632  -3.953   2.225
  202   1HG   LYS  32          2HG       LYS  32  -0.483  -2.155   4.335
  203   2HG   LYS  32          1HG       LYS  32   0.596  -3.417   4.919
  204   1HD   LYS  32          2HD       LYS  32   2.324  -2.692   3.300
  205   2HD   LYS  32          1HD       LYS  32   1.258  -1.400   2.748
  206   1HE   LYS  32          2HE       LYS  32   2.333  -1.742   5.564
  207   2HE   LYS  32          1HE       LYS  32   2.836  -0.517   4.400
  208   1HZ   LYS  32          1HZ       LYS  32   1.266   0.496   5.808
  209   2HZ   LYS  32          2HZ       LYS  32   0.189  -0.813   5.692
  210   3HZ   LYS  32          3HZ       LYS  32   0.451   0.198   4.351
  211    H    MET  33           H        MET  33   0.205  -2.634   0.286
  212    HA   MET  33           HA       MET  33   0.527   0.191   0.781
  213   1HB   MET  33          2HB       MET  33   1.035  -1.321  -1.797
  214   2HB   MET  33          1HB       MET  33   1.723   0.239  -1.340
  215   1HG   MET  33          2HG       MET  33   2.603  -1.059   0.768
  216   2HG   MET  33          1HG       MET  33   2.324  -2.494  -0.222
  217   1HE   MET  33          1HE       MET  33   4.087  -3.412  -1.840
  218   2HE   MET  33          2HE       MET  33   4.640  -2.327  -3.115
  219   3HE   MET  33          3HE       MET  33   2.921  -2.444  -2.754
  220    H    ARG  34           H        ARG  34  -1.567  -1.660  -1.491
  221    HA   ARG  34           HA       ARG  34  -2.598   0.600  -2.905
  222   1HB   ARG  34          2HB       ARG  34  -3.077  -1.766  -3.551
  223   2HB   ARG  34          1HB       ARG  34  -4.129  -1.893  -2.148
  224   1HG   ARG  34          2HG       ARG  34  -5.669  -0.341  -2.982
  225   2HG   ARG  34          1HG       ARG  34  -4.536   0.284  -4.184
  226   1HD   ARG  34          2HD       ARG  34  -4.646  -1.795  -5.445
  227   2HD   ARG  34          1HD       ARG  34  -5.643  -2.539  -4.198
  228    HE   ARG  34           HE       ARG  34  -6.848  -0.120  -5.275
  229   1HH1  ARG  34          1HH2      ARG  34  -6.270  -3.490  -5.721
  230   2HH1  ARG  34          2HH2      ARG  34  -7.693  -3.747  -6.676
  231   1HH2  ARG  34          1HH1      ARG  34  -8.717  -0.440  -6.533
  232   2HH2  ARG  34          2HH1      ARG  34  -9.072  -2.024  -7.137
  233    H    ALA  35           H        ALA  35  -4.273  -1.182  -0.313
  234    HA   ALA  35           HA       ALA  35  -6.282   0.746   0.137
  235   1HB   ALA  35          1HB       ALA  35  -6.643  -0.356   2.287
  236   2HB   ALA  35          2HB       ALA  35  -5.040  -1.089   2.208
  237   3HB   ALA  35          3HB       ALA  35  -6.288  -1.572   1.060
  238    H    ALA  36           H        ALA  36  -2.941   0.707   1.261
  239    HA   ALA  36           HA       ALA  36  -3.225   2.614   3.376
  240   1HB   ALA  36          1HB       ALA  36  -1.118   1.400   3.029
  241   2HB   ALA  36          2HB       ALA  36  -0.835   3.140   2.961
  242   3HB   ALA  36          3HB       ALA  36  -0.900   2.201   1.470
  243    H    ALA  37           H        ALA  37  -2.726   2.986  -0.128
  244    HA   ALA  37           HA       ALA  37  -2.553   5.837  -0.142
  245   1HB   ALA  37          1HB       ALA  37  -3.570   3.895  -2.237
  246   2HB   ALA  37          2HB       ALA  37  -1.943   4.563  -2.117
  247   3HB   ALA  37          3HB       ALA  37  -3.298   5.612  -2.535
  248    H    LEU  38           H        LEU  38  -5.350   3.642  -0.523
  249    HA   LEU  38           HA       LEU  38  -7.297   5.725  -0.826
  250   1HB   LEU  38          2HB       LEU  38  -7.807   3.031   0.447
  251   2HB   LEU  38          1HB       LEU  38  -8.946   4.041  -0.444
  252    HG   LEU  38           HG       LEU  38  -6.496   2.672  -1.596
  253   1HD1  LEU  38          1HD1      LEU  38  -8.259   1.426  -2.899
  254   2HD1  LEU  38          2HD1      LEU  38  -9.473   2.171  -1.858
  255   3HD1  LEU  38          3HD1      LEU  38  -8.267   1.087  -1.168
  256   1HD2  LEU  38          1HD2      LEU  38  -7.771   3.479  -3.777
  257   2HD2  LEU  38          2HD2      LEU  38  -6.703   4.590  -2.923
  258   3HD2  LEU  38          3HD2      LEU  38  -8.448   4.693  -2.692
  259    H    ASP  39           H        ASP  39  -5.869   4.182   2.013
  260    HA   ASP  39           HA       ASP  39  -7.735   5.230   3.913
  261   1HB   ASP  39          2HB       ASP  39  -5.821   3.468   4.247
  262   2HB   ASP  39          1HB       ASP  39  -4.803   4.876   4.556
  263    H    ALA  40           H        ALA  40  -4.434   6.446   3.208
  264    HA   ALA  40           HA       ALA  40  -4.903   8.917   4.547
  265   1HB   ALA  40          1HB       ALA  40  -2.828   9.634   3.661
  266   2HB   ALA  40          2HB       ALA  40  -2.998   8.626   2.223
  267   3HB   ALA  40          3HB       ALA  40  -2.658   7.885   3.788
  268    H    GLN  41           H        GLN  41  -6.235   7.766   1.682
  269    HA   GLN  41           HA       GLN  41  -6.316  10.254   0.201
  270   1HB   GLN  41          2HB       GLN  41  -6.595   8.054  -0.913
  271   2HB   GLN  41          1HB       GLN  41  -8.121   7.836  -0.071
  272   1HG   GLN  41          2HG       GLN  41  -9.061   9.805  -1.152
  273   2HG   GLN  41          1HG       GLN  41  -7.518  10.141  -1.935
  274   1HE2  GLN  41          1HE2      GLN  41  -9.677   7.249  -1.584
  275   2HE2  GLN  41          2HE2      GLN  41  -9.587   6.812  -3.221
  276    H    LYS  42           H        LYS  42  -7.032  11.666   1.911
  277    HA   LYS  42           HA       LYS  42  -8.665  12.903   3.062
  278   1HB   LYS  42          2HB       LYS  42 -10.620  11.922   0.983
  279   2HB   LYS  42          1HB       LYS  42 -10.502  13.517   1.727
  280   1HG   LYS  42          2HG       LYS  42  -8.500  12.317  -0.220
  281   2HG   LYS  42          1HG       LYS  42  -9.666  13.585  -0.591
  282   1HD   LYS  42          2HD       LYS  42  -8.589  14.926   1.311
  283   2HD   LYS  42          1HD       LYS  42  -7.288  13.739   1.270
  284   1HE   LYS  42          2HE       LYS  42  -6.564  15.484  -0.170
  285   2HE   LYS  42          1HE       LYS  42  -7.143  14.214  -1.248
  286   1HZ   LYS  42          1HZ       LYS  42  -8.997  16.299  -0.320
  287   2HZ   LYS  42          2HZ       LYS  42  -9.043  15.375  -1.746
  288   3HZ   LYS  42          3HZ       LYS  42  -7.924  16.644  -1.586
  289    H    ALA  43           H        ALA  43  -8.329  10.391   4.221
  290    HA   ALA  43           HA       ALA  43 -11.114   9.858   5.188
  291   1HB   ALA  43          1HB       ALA  43 -11.002   7.560   4.895
  292   2HB   ALA  43          2HB       ALA  43  -9.243   7.522   4.987
  293   3HB   ALA  43          3HB       ALA  43 -10.034   8.073   3.513
  294    H    THR  44           H        THR  44  -7.654   9.220   5.778
  295    HA   THR  44           HA       THR  44  -8.097   9.852   8.663
  296    HB   THR  44           HB       THR  44  -6.145   7.757   7.677
  297    HG1  THR  44           1HG      THR  44  -8.400   7.256   7.214
  298   1HG2  THR  44          1HG2      THR  44  -7.413   8.280  10.381
  299   2HG2  THR  44          2HG2      THR  44  -5.784   8.769   9.914
  300   3HG2  THR  44          3HG2      THR  44  -6.193   7.058  10.024
  301    HA   PRO  45           HA       PRO  45  -5.148  12.568   5.914
  302   1HB   PRO  45          2HB       PRO  45  -6.193  14.093   8.290
  303   2HB   PRO  45          1HB       PRO  45  -5.774  14.696   6.672
  304   1HG   PRO  45          2HG       PRO  45  -8.320  14.105   7.406
  305   2HG   PRO  45          1HG       PRO  45  -7.734  13.947   5.741
  306   1HD   PRO  45          2HD       PRO  45  -8.554  11.819   7.566
  307   2HD   PRO  45          1HD       PRO  45  -8.099  11.683   5.855
  308    HA   PRO  46           HA       PRO  46  -2.230  11.511   9.338
  309   1HB   PRO  46          2HB       PRO  46  -0.567   9.871   7.850
  310   2HB   PRO  46          1HB       PRO  46  -2.006   9.305   8.717
  311   1HG   PRO  46          2HG       PRO  46  -1.583   9.482   5.850
  312   2HG   PRO  46          1HG       PRO  46  -2.940   8.765   6.731
  313   1HD   PRO  46          2HD       PRO  46  -2.767  11.427   5.453
  314   2HD   PRO  46          1HD       PRO  46  -4.199  10.527   5.984
  315    H    LYS  47           H        LYS  47  -0.640  11.495   6.133
  316    HA   LYS  47           HA       LYS  47   1.381  13.383   7.101
  317   1HB   LYS  47          2HB       LYS  47   1.019  12.505   4.230
  318   2HB   LYS  47          1HB       LYS  47   2.497  13.008   5.046
  319   1HG   LYS  47          2HG       LYS  47   2.184  10.985   6.577
  320   2HG   LYS  47          1HG       LYS  47   0.945  10.447   5.447
  321   1HD   LYS  47          2HD       LYS  47   2.828   9.358   4.599
  322   2HD   LYS  47          1HD       LYS  47   2.813  10.828   3.628
  323   1HE   LYS  47          2HE       LYS  47   4.499  11.851   5.051
  324   2HE   LYS  47          1HE       LYS  47   4.422  10.502   6.183
  325   1HZ   LYS  47          1HZ       LYS  47   6.249  10.592   4.349
  326   2HZ   LYS  47          2HZ       LYS  47   5.020   9.955   3.365
  327   3HZ   LYS  47          3HZ       LYS  47   5.517   9.118   4.758
  328    H    LEU  48           H        LEU  48  -1.683  13.581   5.628
  329    HA   LEU  48           HA       LEU  48  -1.239  16.095   4.214
  330   1HB   LEU  48          2HB       LEU  48  -3.856  14.895   5.207
  331   2HB   LEU  48          1HB       LEU  48  -3.680  16.151   3.982
  332    HG   LEU  48           HG       LEU  48  -2.709  13.279   3.756
  333   1HD1  LEU  48          1HD1      LEU  48  -4.934  14.816   2.393
  334   2HD1  LEU  48          2HD1      LEU  48  -5.100  13.413   3.445
  335   3HD1  LEU  48          3HD1      LEU  48  -4.363  13.235   1.853
  336   1HD2  LEU  48          1HD2      LEU  48  -2.317  14.111   1.307
  337   2HD2  LEU  48          2HD2      LEU  48  -1.115  14.502   2.533
  338   3HD2  LEU  48          3HD2      LEU  48  -2.290  15.719   2.032
  339    H    GLU  49           H        GLU  49  -2.824  15.116   7.232
  340    HA   GLU  49           HA       GLU  49  -3.047  16.197   9.282
  341   1HB   GLU  49          2HB       GLU  49  -0.491  16.636   8.496
  342   2HB   GLU  49          1HB       GLU  49  -1.045  18.305   8.566
  343   1HG   GLU  49          2HG       GLU  49  -1.295  16.294  10.828
  344   2HG   GLU  49          1HG       GLU  49  -0.064  17.550  10.722
  345    H    ASP  50           H        ASP  50  -4.490  17.109   6.819
  346    HA   ASP  50           HA       ASP  50  -6.311  18.600   6.643
  347   1HB   ASP  50          2HB       ASP  50  -5.791  19.174   9.175
  348   2HB   ASP  50          1HB       ASP  50  -5.038  20.612   8.488
  349    H    LYS  51           H        LYS  51  -4.317  18.401   4.872
  350    HA   LYS  51           HA       LYS  51  -3.507  21.204   4.190
  351   1HB   LYS  51          2HB       LYS  51  -2.438  18.471   3.517
  352   2HB   LYS  51          1HB       LYS  51  -2.124  19.816   2.416
  353   1HG   LYS  51          2HG       LYS  51  -1.028  21.075   4.149
  354   2HG   LYS  51          1HG       LYS  51  -1.514  19.902   5.380
  355   1HD   LYS  51          2HD       LYS  51  -0.166  18.165   4.202
  356   2HD   LYS  51          1HD       LYS  51   0.364  19.390   3.050
  357   1HE   LYS  51          2HE       LYS  51   2.079  19.166   4.748
  358   2HE   LYS  51          1HE       LYS  51   1.273  20.717   4.981
  359   1HZ   LYS  51          1HZ       LYS  51   0.458  18.260   6.420
  360   2HZ   LYS  51          2HZ       LYS  51   0.032  19.868   6.768
  361   3HZ   LYS  51          3HZ       LYS  51   1.622  19.332   7.032
  362    H    SER  52           H        SER  52  -5.428  18.430   3.159
  363    HA   SER  52           HA       SER  52  -6.896  18.234   1.287
  364   1HB   SER  52          2HB       SER  52  -7.496  20.372   2.910
  365   2HB   SER  52          1HB       SER  52  -7.386  21.169   1.347
  366    HG   SER  52           HG       SER  52  -9.001  18.950   2.080
  367    HA   PRO  53           HA       PRO  53  -5.222  19.613  -2.603
  368   1HB   PRO  53          2HB       PRO  53  -7.435  21.574  -3.115
  369   2HB   PRO  53          1HB       PRO  53  -6.875  20.223  -4.123
  370   1HG   PRO  53          2HG       PRO  53  -9.127  19.992  -2.789
  371   2HG   PRO  53          1HG       PRO  53  -7.981  18.635  -2.820
  372   1HD   PRO  53          2HD       PRO  53  -8.440  20.633  -0.620
  373   2HD   PRO  53          1HD       PRO  53  -8.251  18.862  -0.520
  374    H    ASP  54           H        ASP  54  -4.463  21.170  -0.236
  375    HA   ASP  54           HA       ASP  54  -4.002  23.900  -1.280
  376   1HB   ASP  54          2HB       ASP  54  -4.857  23.457   1.115
  377   2HB   ASP  54          1HB       ASP  54  -3.240  22.836   1.462
  378    H    SER  55           H        SER  55  -2.183  23.950  -2.507
  379    HA   SER  55           HA       SER  55   0.134  23.900  -2.910
  380   1HB   SER  55          2HB       SER  55   0.669  21.867  -0.771
  381   2HB   SER  55          1HB       SER  55   1.618  23.282  -1.231
  382    HG   SER  55           HG       SER  55   0.672  24.285   0.318
  383    HA   PRO  56           HA       PRO  56   0.705  20.277  -5.426
  384   1HB   PRO  56          2HB       PRO  56   2.790  18.973  -3.710
  385   2HB   PRO  56          1HB       PRO  56   2.826  19.347  -5.447
  386   1HG   PRO  56          2HG       PRO  56   4.188  20.828  -3.739
  387   2HG   PRO  56          1HG       PRO  56   3.310  21.584  -5.084
  388   1HD   PRO  56          2HD       PRO  56   2.555  21.445  -2.179
  389   2HD   PRO  56          1HD       PRO  56   2.386  22.795  -3.330
  390    H    GLU  57           H        GLU  57  -0.387  19.794  -2.267
  391    HA   GLU  57           HA       GLU  57  -0.508  17.011  -1.926
  392   1HB   GLU  57          2HB       GLU  57  -1.485  18.365  -0.201
  393   2HB   GLU  57          1HB       GLU  57  -2.605  19.122  -1.334
  394   1HG   GLU  57          2HG       GLU  57  -3.898  17.129  -1.558
  395   2HG   GLU  57          1HG       GLU  57  -2.640  16.139  -0.821
  396    H    MET  58           H        MET  58  -2.793  19.040  -3.762
  397    HA   MET  58           HA       MET  58  -4.514  17.047  -4.719
  398   1HB   MET  58          2HB       MET  58  -4.876  19.455  -5.054
  399   2HB   MET  58          1HB       MET  58  -3.510  19.524  -6.159
  400   1HG   MET  58          2HG       MET  58  -5.570  17.485  -6.843
  401   2HG   MET  58          1HG       MET  58  -6.095  19.159  -6.979
  402   1HE   MET  58          1HE       MET  58  -5.475  18.970 -10.621
  403   2HE   MET  58          2HE       MET  58  -6.284  19.832  -9.312
  404   3HE   MET  58          3HE       MET  58  -6.474  18.085  -9.459
  405    H    LYS  59           H        LYS  59  -1.592  18.281  -6.479
  406    HA   LYS  59           HA       LYS  59  -1.823  16.237  -8.485
  407   1HB   LYS  59          2HB       LYS  59   0.852  17.434  -7.823
  408   2HB   LYS  59          1HB       LYS  59   0.142  17.072  -9.392
  409   1HG   LYS  59          2HG       LYS  59  -1.508  18.924  -8.991
  410   2HG   LYS  59          1HG       LYS  59  -0.620  19.323  -7.522
  411   1HD   LYS  59          2HD       LYS  59   0.307  20.756  -9.150
  412   2HD   LYS  59          1HD       LYS  59   1.469  19.440  -8.988
  413   1HE   LYS  59          2HE       LYS  59   0.885  18.493 -11.054
  414   2HE   LYS  59          1HE       LYS  59  -0.691  19.272 -11.083
  415   1HZ   LYS  59          1HZ       LYS  59   1.918  20.317 -11.831
  416   2HZ   LYS  59          2HZ       LYS  59   0.863  21.403 -11.061
  417   3HZ   LYS  59          3HZ       LYS  59   0.393  20.630 -12.500
  418    H    ASP  60           H        ASP  60   0.434  16.502  -5.696
  419    HA   ASP  60           HA       ASP  60   1.657  13.972  -6.067
  420   1HB   ASP  60          2HB       ASP  60   2.427  15.600  -4.316
  421   2HB   ASP  60          1HB       ASP  60   0.982  15.199  -3.379
  422    H    PHE  61           H        PHE  61  -1.482  14.817  -4.729
  423    HA   PHE  61           HA       PHE  61  -2.004  12.199  -3.642
  424   1HB   PHE  61          2HB       PHE  61  -3.417  13.878  -2.786
  425   2HB   PHE  61          1HB       PHE  61  -3.675  14.601  -4.367
  426    HD1  PHE  61           1HD      PHE  61  -6.065  14.662  -4.200
  427    HD2  PHE  61           2HD      PHE  61  -3.945  10.957  -3.759
  428    HE1  PHE  61           1HE      PHE  61  -8.189  13.429  -4.415
  429    HE2  PHE  61           2HE      PHE  61  -6.069   9.708  -3.994
  430    HZ   PHE  61           HZ       PHE  61  -8.201  10.945  -4.318
  431    H    ARG  62           H        ARG  62  -2.900  13.909  -6.613
  432    HA   ARG  62           HA       ARG  62  -4.071  11.659  -7.896
  433   1HB   ARG  62          2HB       ARG  62  -2.793  14.160  -9.027
  434   2HB   ARG  62          1HB       ARG  62  -3.693  12.997  -9.996
  435   1HG   ARG  62          2HG       ARG  62  -5.196  13.834  -7.591
  436   2HG   ARG  62          1HG       ARG  62  -4.789  15.196  -8.626
  437   1HD   ARG  62          2HD       ARG  62  -5.853  14.153 -10.533
  438   2HD   ARG  62          1HD       ARG  62  -6.101  12.654  -9.635
  439    HE   ARG  62           HE       ARG  62  -7.362  14.857  -8.271
  440   1HH1  ARG  62          1HH2      ARG  62  -7.585  12.763 -11.007
  441   2HH1  ARG  62          2HH2      ARG  62  -9.312  12.846 -11.098
  442   1HH2  ARG  62          1HH1      ARG  62  -9.629  14.974  -8.381
  443   2HH2  ARG  62          2HH1      ARG  62 -10.465  14.093  -9.616
  444    H    HIS  63           H        HIS  63  -0.860  13.156  -8.492
  445    HA   HIS  63           HA       HIS  63   0.090  10.988 -10.102
  446   1HB   HIS  63          2HB       HIS  63   0.980  13.454  -9.757
  447   2HB   HIS  63          1HB       HIS  63   1.962  12.721  -8.492
  448    HD1  HIS  63           1HD      HIS  63   4.231  12.252  -9.409
  449    HD2  HIS  63           2HD      HIS  63   1.262  11.491 -12.237
  450    HE1  HIS  63           1HE      HIS  63   5.414  11.390 -11.474
  451    H    GLY  64           H        GLY  64   0.099  11.496  -6.605
  452   1HA   GLY  64          2HA       GLY  64   2.069   9.434  -6.066
  453   2HA   GLY  64          1HA       GLY  64   1.016  10.174  -4.865
  454    H    PHE  65           H        PHE  65  -1.502   9.460  -5.570
  455    HA   PHE  65           HA       PHE  65  -1.551   6.662  -4.917
  456   1HB   PHE  65          2HB       PHE  65  -3.753   7.013  -4.426
  457   2HB   PHE  65          1HB       PHE  65  -3.383   8.709  -4.679
  458    HD1  PHE  65           1HD      PHE  65  -4.633   9.916  -6.270
  459    HD2  PHE  65           2HD      PHE  65  -4.445   5.641  -6.556
  460    HE1  PHE  65           1HE      PHE  65  -6.276   9.977  -8.113
  461    HE2  PHE  65           2HE      PHE  65  -6.091   5.695  -8.408
  462    HZ   PHE  65           HZ       PHE  65  -7.009   7.864  -9.189
  463    H    ASP  66           H        ASP  66  -1.604   8.373  -7.963
  464    HA   ASP  66           HA       ASP  66  -2.643   6.184  -9.544
  465   1HB   ASP  66          2HB       ASP  66  -2.531   8.561 -10.333
  466   2HB   ASP  66          1HB       ASP  66  -0.776   8.411 -10.411
  467    H    ILE  67           H        ILE  67   0.653   7.300  -8.810
  468    HA   ILE  67           HA       ILE  67   1.975   5.251 -10.289
  469    HB   ILE  67           HB       ILE  67   2.863   6.852  -7.878
  470   1HG1  ILE  67          2HG1      ILE  67   3.639   7.086 -10.795
  471   2HG1  ILE  67          1HG1      ILE  67   2.290   7.985 -10.092
  472   1HG2  ILE  67          1HG2      ILE  67   5.193   6.142  -8.925
  473   2HG2  ILE  67          2HG2      ILE  67   4.276   4.766  -9.535
  474   3HG2  ILE  67          3HG2      ILE  67   4.367   5.064  -7.802
  475   1HD1  ILE  67          1HD1      ILE  67   4.477   9.253 -10.122
  476   2HD1  ILE  67          2HD1      ILE  67   5.119   8.061  -8.996
  477   3HD1  ILE  67          3HD1      ILE  67   3.765   9.085  -8.518
  478    H    LEU  68           H        LEU  68   1.255   5.396  -6.770
  479    HA   LEU  68           HA       LEU  68   2.227   2.822  -6.142
  480   1HB   LEU  68          2HB       LEU  68   0.493   4.805  -4.855
  481   2HB   LEU  68          1HB       LEU  68  -0.095   3.178  -4.521
  482    HG   LEU  68           HG       LEU  68   2.343   2.604  -3.884
  483   1HD1  LEU  68          1HD1      LEU  68   2.492   5.629  -3.709
  484   2HD1  LEU  68          2HD1      LEU  68   3.305   4.665  -4.942
  485   3HD1  LEU  68          3HD1      LEU  68   3.751   4.483  -3.245
  486   1HD2  LEU  68          1HD2      LEU  68   0.632   2.813  -2.205
  487   2HD2  LEU  68          2HD2      LEU  68   0.680   4.573  -2.298
  488   3HD2  LEU  68          3HD2      LEU  68   2.054   3.687  -1.634
  489    H    VAL  69           H        VAL  69  -1.080   3.746  -7.144
  490    HA   VAL  69           HA       VAL  69  -2.117   1.086  -7.180
  491    HB   VAL  69           HB       VAL  69  -2.854   3.701  -8.476
  492   1HG1  VAL  69          1HG1      VAL  69  -3.339   2.300 -10.324
  493   2HG1  VAL  69          2HG1      VAL  69  -4.872   2.506  -9.478
  494   3HG1  VAL  69          3HG1      VAL  69  -3.955   1.011  -9.287
  495   1HG2  VAL  69          1HG2      VAL  69  -4.431   1.719  -6.810
  496   2HG2  VAL  69          2HG2      VAL  69  -4.922   3.359  -7.227
  497   3HG2  VAL  69          3HG2      VAL  69  -3.549   3.097  -6.152
  498    H    GLY  70           H        GLY  70  -0.315   2.944  -9.595
  499   1HA   GLY  70          2HA       GLY  70  -0.612   1.104 -11.765
  500   2HA   GLY  70          1HA       GLY  70   0.654   2.315 -11.627
  501    H    GLN  71           H        GLN  71   2.121   1.436  -9.432
  502    HA   GLN  71           HA       GLN  71   3.475  -0.872 -10.600
  503   1HB   GLN  71          2HB       GLN  71   4.681  -0.470  -8.105
  504   2HB   GLN  71          1HB       GLN  71   5.180   0.310  -9.604
  505   1HG   GLN  71          2HG       GLN  71   3.916   2.252  -9.147
  506   2HG   GLN  71          1HG       GLN  71   2.991   1.450  -7.874
  507   1HE2  GLN  71          1HE2      GLN  71   3.819   3.512  -6.676
  508   2HE2  GLN  71          2HE2      GLN  71   5.323   3.364  -5.892
  509    H    ILE  72           H        ILE  72   1.433  -0.302  -7.791
  510    HA   ILE  72           HA       ILE  72   1.811  -2.849  -6.563
  511    HB   ILE  72           HB       ILE  72  -0.568  -0.984  -6.633
  512   1HG1  ILE  72          2HG1      ILE  72   1.384  -1.491  -4.370
  513   2HG1  ILE  72          1HG1      ILE  72   1.702  -0.269  -5.605
  514   1HG2  ILE  72          1HG2      ILE  72  -0.069  -3.557  -5.166
  515   2HG2  ILE  72          2HG2      ILE  72  -1.537  -3.014  -5.973
  516   3HG2  ILE  72          3HG2      ILE  72  -1.063  -2.315  -4.428
  517   1HD1  ILE  72          1HD1      ILE  72  -0.679   0.619  -5.013
  518   2HD1  ILE  72          2HD1      ILE  72   0.631   0.937  -3.880
  519   3HD1  ILE  72          3HD1      ILE  72  -0.513  -0.363  -3.556
  520    H    ASP  73           H        ASP  73  -0.294  -1.722  -9.168
  521    HA   ASP  73           HA       ASP  73  -1.780  -4.183  -9.429
  522   1HB   ASP  73          2HB       ASP  73  -2.570  -2.025 -10.371
  523   2HB   ASP  73          1HB       ASP  73  -1.216  -2.040 -11.505
  524    H    ASP  74           H        ASP  74   1.092  -2.845 -11.099
  525    HA   ASP  74           HA       ASP  74   1.446  -5.080 -12.858
  526   1HB   ASP  74          2HB       ASP  74   3.732  -3.441 -11.789
  527   2HB   ASP  74          1HB       ASP  74   3.539  -4.149 -13.392
  528    H    ALA  75           H        ALA  75   2.437  -4.493  -9.538
  529    HA   ALA  75           HA       ALA  75   4.298  -6.684  -9.386
  530   1HB   ALA  75          1HB       ALA  75   2.827  -5.576  -7.000
  531   2HB   ALA  75          2HB       ALA  75   4.026  -4.595  -7.841
  532   3HB   ALA  75          3HB       ALA  75   4.496  -6.131  -7.114
  533    H    LEU  76           H        LEU  76   0.820  -6.421  -8.957
  534    HA   LEU  76           HA       LEU  76   0.536  -8.935  -7.553
  535   1HB   LEU  76          2HB       LEU  76  -1.186  -7.098  -7.550
  536   2HB   LEU  76          1HB       LEU  76  -1.531  -7.464  -9.234
  537    HG   LEU  76           HG       LEU  76  -1.625  -9.800  -7.359
  538   1HD1  LEU  76          1HD1      LEU  76  -3.791  -7.676  -7.360
  539   2HD1  LEU  76          2HD1      LEU  76  -2.715  -8.036  -6.010
  540   3HD1  LEU  76          3HD1      LEU  76  -3.877  -9.244  -6.557
  541   1HD2  LEU  76          1HD2      LEU  76  -3.661 -10.302  -8.726
  542   2HD2  LEU  76          2HD2      LEU  76  -2.222 -10.090  -9.719
  543   3HD2  LEU  76          3HD2      LEU  76  -3.411  -8.795  -9.604
  544    H    LYS  77           H        LYS  77  -0.063  -8.008 -10.970
  545    HA   LYS  77           HA       LYS  77  -0.721 -10.607 -11.882
  546   1HB   LYS  77          2HB       LYS  77   0.176  -9.833 -14.127
  547   2HB   LYS  77          1HB       LYS  77  -1.031  -8.768 -13.408
  548   1HG   LYS  77          2HG       LYS  77   0.652  -7.219 -12.675
  549   2HG   LYS  77          1HG       LYS  77   1.949  -8.330 -13.065
  550   1HD   LYS  77          2HD       LYS  77   0.078  -7.066 -15.067
  551   2HD   LYS  77          1HD       LYS  77   1.723  -6.548 -14.733
  552   1HE   LYS  77          2HE       LYS  77   2.217  -7.935 -16.503
  553   2HE   LYS  77          1HE       LYS  77   2.179  -9.190 -15.261
  554   1HZ   LYS  77          1HZ       LYS  77   0.593 -10.106 -16.499
  555   2HZ   LYS  77          2HZ       LYS  77   0.376  -8.706 -17.436
  556   3HZ   LYS  77          3HZ       LYS  77  -0.434  -8.869 -15.952
  557    H    LEU  78           H        LEU  78   2.397  -9.034 -11.414
  558    HA   LEU  78           HA       LEU  78   4.037 -11.083 -12.478
  559   1HB   LEU  78          2HB       LEU  78   4.560  -8.641 -11.475
  560   2HB   LEU  78          1HB       LEU  78   4.927  -9.577 -10.034
  561    HG   LEU  78           HG       LEU  78   6.972  -9.306 -11.287
  562   1HD1  LEU  78          1HD1      LEU  78   7.656 -11.572 -11.442
  563   2HD1  LEU  78          2HD1      LEU  78   6.042 -12.119 -11.898
  564   3HD1  LEU  78          3HD1      LEU  78   6.357 -11.568 -10.253
  565   1HD2  LEU  78          1HD2      LEU  78   7.202  -9.520 -13.570
  566   2HD2  LEU  78          2HD2      LEU  78   5.492  -9.107 -13.546
  567   3HD2  LEU  78          3HD2      LEU  78   5.990 -10.793 -13.700
  568    H    ALA  79           H        ALA  79   2.932 -10.518  -9.117
  569    HA   ALA  79           HA       ALA  79   3.991 -12.940  -8.058
  570   1HB   ALA  79          1HB       ALA  79   2.581 -12.585  -6.180
  571   2HB   ALA  79          2HB       ALA  79   1.369 -11.743  -7.147
  572   3HB   ALA  79          3HB       ALA  79   2.910 -10.961  -6.784
  573    H    ASN  80           H        ASN  80   0.901 -12.168  -9.591
  574    HA   ASN  80           HA       ASN  80  -0.309 -14.740  -9.390
  575   1HB   ASN  80          2HB       ASN  80  -1.325 -12.512 -10.218
  576   2HB   ASN  80          1HB       ASN  80  -0.608 -12.910 -11.777
  577   1HD2  ASN  80          1HD2      ASN  80  -3.431 -12.756 -11.389
  578   2HD2  ASN  80          2HD2      ASN  80  -4.087 -14.306 -11.609
  579    H    GLU  81           H        GLU  81   1.038 -13.351 -12.344
  580    HA   GLU  81           HA       GLU  81   1.551 -15.906 -13.577
  581   1HB   GLU  81          2HB       GLU  81   1.047 -13.567 -14.605
  582   2HB   GLU  81          1HB       GLU  81   2.775 -13.276 -14.422
  583   1HG   GLU  81          2HG       GLU  81   2.481 -14.131 -16.631
  584   2HG   GLU  81          1HG       GLU  81   3.123 -15.480 -15.692
  585    H    GLY  82           H        GLY  82   3.127 -14.813 -10.977
  586   1HA   GLY  82          2HA       GLY  82   5.738 -15.935 -11.889
  587   2HA   GLY  82          1HA       GLY  82   5.730 -14.366 -11.113
  588    H    LYS  83           H        LYS  83   7.164 -16.503 -10.084
  589    HA   LYS  83           HA       LYS  83   5.699 -17.806  -7.921
  590   1HB   LYS  83          2HB       LYS  83   7.915 -18.556  -9.143
  591   2HB   LYS  83          1HB       LYS  83   8.707 -17.492  -7.983
  592   1HG   LYS  83          2HG       LYS  83   7.729 -18.755  -6.122
  593   2HG   LYS  83          1HG       LYS  83   6.835 -19.769  -7.249
  594   1HD   LYS  83          2HD       LYS  83   8.919 -20.638  -8.172
  595   2HD   LYS  83          1HD       LYS  83   9.858 -19.546  -7.154
  596   1HE   LYS  83          2HE       LYS  83   9.898 -21.609  -5.990
  597   2HE   LYS  83          1HE       LYS  83   8.658 -20.672  -5.160
  598   1HZ   LYS  83          1HZ       LYS  83   7.943 -22.424  -7.419
  599   2HZ   LYS  83          2HZ       LYS  83   6.969 -21.879  -6.137
  600   3HZ   LYS  83          3HZ       LYS  83   8.144 -23.077  -5.868
  601    H    VAL  84           H        VAL  84   6.860 -17.396  -5.575
  602    HA   VAL  84           HA       VAL  84   6.289 -14.615  -4.975
  603    HB   VAL  84           HB       VAL  84   7.261 -16.946  -3.308
  604   1HG1  VAL  84          1HG1      VAL  84   6.773 -15.412  -1.352
  605   2HG1  VAL  84          2HG1      VAL  84   6.707 -14.076  -2.492
  606   3HG1  VAL  84          3HG1      VAL  84   8.206 -14.974  -2.266
  607   1HG2  VAL  84          1HG2      VAL  84   5.039 -16.990  -2.464
  608   2HG2  VAL  84          2HG2      VAL  84   4.859 -16.774  -4.205
  609   3HG2  VAL  84          3HG2      VAL  84   4.677 -15.397  -3.120
  610    H    LYS  85           H        LYS  85   9.252 -16.609  -5.158
  611    HA   LYS  85           HA       LYS  85  11.026 -14.639  -4.101
  612   1HB   LYS  85          2HB       LYS  85  11.314 -17.028  -5.894
  613   2HB   LYS  85          1HB       LYS  85  12.656 -15.885  -5.857
  614   1HG   LYS  85          2HG       LYS  85  13.017 -16.202  -3.537
  615   2HG   LYS  85          1HG       LYS  85  11.436 -16.951  -3.307
  616   1HD   LYS  85          2HD       LYS  85  13.221 -18.652  -3.271
  617   2HD   LYS  85          1HD       LYS  85  12.158 -18.892  -4.656
  618   1HE   LYS  85          2HE       LYS  85  13.756 -18.102  -6.183
  619   2HE   LYS  85          1HE       LYS  85  14.646 -17.215  -4.945
  620   1HZ   LYS  85          1HZ       LYS  85  15.387 -19.278  -4.001
  621   2HZ   LYS  85          2HZ       LYS  85  15.774 -19.255  -5.656
  622   3HZ   LYS  85          3HZ       LYS  85  14.457 -20.172  -5.102
  623    H    GLU  86           H        GLU  86   9.936 -15.254  -7.438
  624    HA   GLU  86           HA       GLU  86  11.385 -13.050  -8.593
  625   1HB   GLU  86          2HB       GLU  86   8.821 -14.361  -9.559
  626   2HB   GLU  86          1HB       GLU  86   9.917 -13.371 -10.530
  627   1HG   GLU  86          2HG       GLU  86  10.786 -15.899  -9.116
  628   2HG   GLU  86          1HG       GLU  86  10.232 -15.876 -10.791
  629    H    ALA  87           H        ALA  87   8.169 -13.383  -7.163
  630    HA   ALA  87           HA       ALA  87   7.170 -10.810  -7.928
  631   1HB   ALA  87          1HB       ALA  87   6.387 -12.118  -5.330
  632   2HB   ALA  87          2HB       ALA  87   5.936 -12.846  -6.864
  633   3HB   ALA  87          3HB       ALA  87   5.385 -11.223  -6.473
  634    H    GLN  88           H        GLN  88   8.502 -11.841  -4.758
  635    HA   GLN  88           HA       GLN  88   8.531  -9.235  -3.660
  636   1HB   GLN  88          2HB       GLN  88   9.564 -10.199  -1.836
  637   2HB   GLN  88          1HB       GLN  88   8.991 -11.654  -2.632
  638   1HG   GLN  88          2HG       GLN  88  11.226 -12.148  -2.158
  639   2HG   GLN  88          1HG       GLN  88  11.281 -11.661  -3.843
  640   1HE2  GLN  88          1HE2      GLN  88  10.777  -9.040  -1.587
  641   2HE2  GLN  88          2HE2      GLN  88  12.363  -8.448  -1.616
  642    H    ALA  89           H        ALA  89  10.804 -10.842  -5.811
  643    HA   ALA  89           HA       ALA  89  12.997  -9.036  -5.529
  644   1HB   ALA  89          1HB       ALA  89  13.811  -9.931  -7.566
  645   2HB   ALA  89          2HB       ALA  89  12.187 -10.268  -8.169
  646   3HB   ALA  89          3HB       ALA  89  12.868 -11.249  -6.871
  647    H    ALA  90           H        ALA  90  10.094  -8.935  -7.576
  648    HA   ALA  90           HA       ALA  90  10.704  -6.583  -9.037
  649   1HB   ALA  90          1HB       ALA  90   8.766  -8.147  -9.466
  650   2HB   ALA  90          2HB       ALA  90   8.329  -6.439  -9.487
  651   3HB   ALA  90          3HB       ALA  90   7.955  -7.426  -8.075
  652    H    ALA  91           H        ALA  91   9.370  -7.058  -5.799
  653    HA   ALA  91           HA       ALA  91   8.611  -4.335  -5.319
  654   1HB   ALA  91          1HB       ALA  91   8.054  -6.465  -3.952
  655   2HB   ALA  91          2HB       ALA  91   8.370  -4.982  -3.052
  656   3HB   ALA  91          3HB       ALA  91   9.619  -6.220  -3.182
  657    H    GLU  92           H        GLU  92  11.652  -6.098  -4.796
  658    HA   GLU  92           HA       GLU  92  13.061  -4.089  -3.375
  659   1HB   GLU  92          2HB       GLU  92  14.272  -6.009  -5.373
  660   2HB   GLU  92          1HB       GLU  92  15.078  -5.242  -4.004
  661   1HG   GLU  92          2HG       GLU  92  13.421  -6.391  -2.497
  662   2HG   GLU  92          1HG       GLU  92  12.857  -7.284  -3.905
  663    H    GLN  93           H        GLN  93  13.070  -4.723  -6.913
  664    HA   GLN  93           HA       GLN  93  14.802  -2.557  -7.548
  665   1HB   GLN  93          2HB       GLN  93  13.644  -2.631  -9.824
  666   2HB   GLN  93          1HB       GLN  93  14.360  -4.144  -9.272
  667   1HG   GLN  93          2HG       GLN  93  12.155  -4.872  -8.433
  668   2HG   GLN  93          1HG       GLN  93  11.439  -3.377  -9.032
  669   1HE2  GLN  93          1HE2      GLN  93  10.792  -3.350 -11.207
  670   2HE2  GLN  93          2HE2      GLN  93  11.170  -4.563 -12.333
  671    H    LEU  94           H        LEU  94  11.328  -2.637  -6.930
  672    HA   LEU  94           HA       LEU  94  10.895   0.109  -7.768
  673   1HB   LEU  94          2HB       LEU  94   9.312  -1.684  -5.905
  674   2HB   LEU  94          1HB       LEU  94   8.796  -0.073  -6.422
  675    HG   LEU  94           HG       LEU  94   9.441  -2.324  -8.355
  676   1HD1  LEU  94          1HD1      LEU  94   6.883  -2.393  -8.581
  677   2HD1  LEU  94          2HD1      LEU  94   6.838  -1.513  -7.052
  678   3HD1  LEU  94          3HD1      LEU  94   7.569  -3.116  -7.125
  679   1HD2  LEU  94          1HD2      LEU  94   7.856  -0.796  -9.786
  680   2HD2  LEU  94          2HD2      LEU  94   9.532  -0.308  -9.573
  681   3HD2  LEU  94          3HD2      LEU  94   8.266   0.449  -8.606
  682    H    LYS  95           H        LYS  95  12.187  -1.491  -5.011
  683    HA   LYS  95           HA       LYS  95  11.773   0.630  -3.085
  684   1HB   LYS  95          2HB       LYS  95  12.464  -1.906  -2.777
  685   2HB   LYS  95          1HB       LYS  95  14.101  -1.293  -2.978
  686   1HG   LYS  95          2HG       LYS  95  12.097  -0.290  -0.930
  687   2HG   LYS  95          1HG       LYS  95  13.425  -1.403  -0.603
  688   1HD   LYS  95          2HD       LYS  95  14.876   0.542  -1.728
  689   2HD   LYS  95          1HD       LYS  95  13.516   1.533  -1.197
  690   1HE   LYS  95          2HE       LYS  95  15.237  -0.253   0.543
  691   2HE   LYS  95          1HE       LYS  95  15.192   1.512   0.560
  692   1HZ   LYS  95          1HZ       LYS  95  13.817   0.882   2.305
  693   2HZ   LYS  95          2HZ       LYS  95  13.116  -0.397   1.435
  694   3HZ   LYS  95          3HZ       LYS  95  12.724   1.211   1.050
  695    H    THR  96           H        THR  96  14.174  -0.141  -5.529
  696    HA   THR  96           HA       THR  96  16.194   1.694  -4.725
  697    HB   THR  96           HB       THR  96  15.591   1.101  -7.625
  698    HG1  THR  96           1HG      THR  96  16.315  -0.936  -7.374
  699   1HG2  THR  96          1HG2      THR  96  17.536   2.486  -7.092
  700   2HG2  THR  96          2HG2      THR  96  18.062   0.916  -7.700
  701   3HG2  THR  96          3HG2      THR  96  18.121   1.257  -5.972
  702    H    THR  97           H        THR  97  13.507   2.078  -7.106
  703    HA   THR  97           HA       THR  97  14.011   4.991  -7.152
  704    HB   THR  97           HB       THR  97  13.383   4.273  -9.278
  705    HG1  THR  97           1HG      THR  97  11.731   5.517  -9.474
  706   1HG2  THR  97          1HG2      THR  97  12.857   2.030  -9.186
  707   2HG2  THR  97          2HG2      THR  97  11.241   2.698  -9.416
  708   3HG2  THR  97          3HG2      THR  97  11.781   2.238  -7.804
  709    H    GLY  98           H        GLY  98  10.846   3.686  -7.319
  710   1HA   GLY  98          2HA       GLY  98   8.934   4.038  -6.000
  711   2HA   GLY  98          1HA       GLY  98  10.012   3.870  -4.613
  712    H    ARG  99           H        ARG  99   8.006   6.057  -6.205
  713    HA   ARG  99           HA       ARG  99   7.705   8.368  -6.015
  714   1HB   ARG  99          2HB       ARG  99   9.061   7.638  -3.410
  715   2HB   ARG  99          1HB       ARG  99   8.698   9.316  -3.781
  716   1HG   ARG  99          2HG       ARG  99   6.837   8.486  -2.532
  717   2HG   ARG  99          1HG       ARG  99   6.296   8.598  -4.204
  718   1HD   ARG  99          2HD       ARG  99   5.653   6.452  -3.045
  719   2HD   ARG  99          1HD       ARG  99   6.583   6.219  -4.522
  720    HE   ARG  99           HE       ARG  99   8.404   6.321  -2.338
  721   1HH1  ARG  99          1HH2      ARG  99   5.856   4.414  -3.660
  722   2HH1  ARG  99          2HH2      ARG  99   6.462   2.920  -3.027
  723   1HH2  ARG  99          1HH1      ARG  99   9.212   4.382  -1.497
  724   2HH2  ARG  99          2HH1      ARG  99   8.358   2.903  -1.792
  725    H    ALA 100           H        ALA 100   9.225  10.444  -5.358
  726    HA   ALA 100           HA       ALA 100  12.017  10.091  -6.138
  727   1HB   ALA 100          1HB       ALA 100  10.014  11.325  -8.043
  728   2HB   ALA 100          2HB       ALA 100  11.127   9.994  -8.356
  729   3HB   ALA 100          3HB       ALA 100  11.749  11.632  -8.156
  730    H    GLY 101           H        GLY 101   9.431  12.588  -6.117
  731   1HA   GLY 101          2HA       GLY 101  11.311  14.583  -5.081
  732   2HA   GLY 101          1HA       GLY 101   9.587  14.829  -5.367
  733    H    ASN 102           H        ASN 102   8.084  13.962  -3.771
  734    HA   ASN 102           HA       ASN 102   7.391  13.900  -1.515
  735   1HB   ASN 102          2HB       ASN 102   8.545  11.598  -2.120
  736   2HB   ASN 102          1HB       ASN 102   9.783  12.141  -0.989
  737   1HD2  ASN 102          1HD2      ASN 102   8.230  13.440   0.969
  738   2HD2  ASN 102          2HD2      ASN 102   7.180  12.320   1.696
  739    H    GLN 103           H        GLN 103   9.576  15.869  -2.326
  740    HA   GLN 103           HA       GLN 103  10.690  16.414   0.404
  741   1HB   GLN 103          2HB       GLN 103  12.355  15.779  -1.405
  742   2HB   GLN 103          1HB       GLN 103  11.850  17.240  -2.267
  743   1HG   GLN 103          2HG       GLN 103  12.386  18.452   0.004
  744   2HG   GLN 103          1HG       GLN 103  13.337  17.007   0.346
  745   1HE2  GLN 103          1HE2      GLN 103  12.821  18.915  -2.681
  746   2HE2  GLN 103          2HE2      GLN 103  14.473  19.145  -2.993
  747    H    LYS 104           H        LYS 104   9.151  17.675  -2.494
  748    HA   LYS 104           HA       LYS 104   9.214  20.427  -1.460
  749   1HB   LYS 104          2HB       LYS 104   8.574  21.086  -3.598
  750   2HB   LYS 104          1HB       LYS 104   9.372  19.560  -3.966
  751   1HG   LYS 104          2HG       LYS 104   6.998  18.496  -3.713
  752   2HG   LYS 104          1HG       LYS 104   6.413  20.156  -3.844
  753   1HD   LYS 104          2HD       LYS 104   7.594  20.409  -5.997
  754   2HD   LYS 104          1HD       LYS 104   8.178  18.750  -5.872
  755   1HE   LYS 104          2HE       LYS 104   5.637  18.137  -5.637
  756   2HE   LYS 104          1HE       LYS 104   5.368  19.733  -6.342
  757   1HZ   LYS 104          1HZ       LYS 104   5.485  18.364  -8.173
  758   2HZ   LYS 104          2HZ       LYS 104   6.708  17.389  -7.515
  759   3HZ   LYS 104          3HZ       LYS 104   7.073  18.950  -8.076
  760    H    GLY 105           H        GLY 105   6.894  17.832  -1.995
  761   1HA   GLY 105          2HA       GLY 105   4.681  19.453  -0.891
  762   2HA   GLY 105          1HA       GLY 105   4.557  17.846  -1.610
  763    H    GLY 106           H        GLY 106   7.164  17.685   0.365
  764   1HA   GLY 106          2HA       GLY 106   5.561  16.500   2.586
  765   2HA   GLY 106          1HA       GLY 106   7.232  16.090   2.203
  Start of MODEL    6
    1   1H    ALA   1          1HT       ALA   1  -4.642 -30.749  -0.453
    2   2H    ALA   1          2HT       ALA   1  -4.347 -29.429  -1.480
    3   3H    ALA   1          3HT       ALA   1  -5.680 -29.409  -0.428
    4    HA   ALA   1           HA       ALA   1  -3.477 -29.842   1.176
    5   1HB   ALA   1          1HB       ALA   1  -3.047 -27.476  -0.663
    6   2HB   ALA   1          2HB       ALA   1  -2.188 -29.005  -0.840
    7   3HB   ALA   1          3HB       ALA   1  -1.977 -28.043   0.623
    8    H    ASP   2           H        ASP   2  -6.308 -29.234   1.192
    9    HA   ASP   2           HA       ASP   2  -6.552 -26.441   2.066
   10   1HB   ASP   2          2HB       ASP   2  -8.444 -28.781   1.862
   11   2HB   ASP   2          1HB       ASP   2  -8.908 -27.316   2.722
   12    H    LEU   3           H        LEU   3  -4.912 -28.635   3.419
   13    HA   LEU   3           HA       LEU   3  -5.574 -27.826   6.161
   14   1HB   LEU   3          2HB       LEU   3  -5.675 -30.115   7.032
   15   2HB   LEU   3          1HB       LEU   3  -6.966 -29.832   5.871
   16    HG   LEU   3           HG       LEU   3  -4.362 -31.056   4.936
   17   1HD1  LEU   3          1HD1      LEU   3  -5.256 -33.286   5.392
   18   2HD1  LEU   3          2HD1      LEU   3  -6.688 -32.580   6.137
   19   3HD1  LEU   3          3HD1      LEU   3  -5.111 -32.380   6.898
   20   1HD2  LEU   3          1HD2      LEU   3  -5.955 -32.199   3.355
   21   2HD2  LEU   3          2HD2      LEU   3  -5.936 -30.451   3.186
   22   3HD2  LEU   3          3HD2      LEU   3  -7.260 -31.236   4.046
   23    H    GLU   4           H        GLU   4  -3.383 -29.216   3.843
   24    HA   GLU   4           HA       GLU   4  -1.059 -29.484   3.876
   25   1HB   GLU   4          2HB       GLU   4  -1.127 -27.564   6.212
   26   2HB   GLU   4          1HB       GLU   4   0.177 -27.798   5.047
   27   1HG   GLU   4          2HG       GLU   4  -1.332 -26.989   3.239
   28   2HG   GLU   4          1HG       GLU   4  -2.574 -26.676   4.452
   29    H    ASP   5           H        ASP   5   0.849 -29.873   5.618
   30    HA   ASP   5           HA       ASP   5   0.025 -32.239   7.109
   31   1HB   ASP   5          2HB       ASP   5   2.459 -32.337   7.712
   32   2HB   ASP   5          1HB       ASP   5   2.179 -32.247   5.972
   33    H    ASN   6           H        ASN   6  -1.463 -30.852   8.551
   34    HA   ASN   6           HA       ASN   6  -0.025 -29.293  10.621
   35   1HB   ASN   6          2HB       ASN   6  -2.978 -29.969  10.551
   36   2HB   ASN   6          1HB       ASN   6  -2.191 -28.670  11.443
   37   1HD2  ASN   6          1HD2      ASN   6  -4.134 -27.669   9.957
   38   2HD2  ASN   6          2HD2      ASN   6  -3.591 -27.004   8.492
   39    H    ASP   7           H        ASP   7   0.633 -30.238  12.512
   40    HA   ASP   7           HA       ASP   7  -0.835 -32.605  13.542
   41   1HB   ASP   7          2HB       ASP   7   1.050 -33.432  12.094
   42   2HB   ASP   7          1HB       ASP   7   2.175 -32.601  13.169
   43    H    GLU   8           H        GLU   8  -0.761 -29.922  14.506
   44    HA   GLU   8           HA       GLU   8  -0.308 -28.694  16.455
   45   1HB   GLU   8          2HB       GLU   8  -0.132 -31.509  17.569
   46   2HB   GLU   8          1HB       GLU   8  -0.357 -30.041  18.524
   47   1HG   GLU   8          2HG       GLU   8  -2.247 -30.972  16.340
   48   2HG   GLU   8          1HG       GLU   8  -2.508 -31.232  18.065
   49    H    THR   9           H        THR   9   2.024 -29.494  14.781
   50    HA   THR   9           HA       THR   9   4.167 -29.971  16.732
   51    HB   THR   9           HB       THR   9   4.624 -29.248  13.839
   52    HG1  THR   9           1HG      THR   9   2.819 -30.786  14.113
   53   1HG2  THR   9          1HG2      THR   9   5.846 -31.525  15.372
   54   2HG2  THR   9          2HG2      THR   9   6.407 -29.879  15.647
   55   3HG2  THR   9          3HG2      THR   9   6.525 -30.591  14.040
   56    H    GLY  10           H        GLY  10   2.425 -27.491  16.626
   57   1HA   GLY  10          2HA       GLY  10   2.715 -25.199  17.035
   58   2HA   GLY  10          1HA       GLY  10   4.421 -25.561  17.314
   59    H    ASN  11           H        ASN  11   2.176 -25.504  14.529
   60    HA   ASN  11           HA       ASN  11   4.350 -24.646  12.742
   61   1HB   ASN  11          2HB       ASN  11   2.617 -24.812  10.988
   62   2HB   ASN  11          1HB       ASN  11   2.655 -26.274  11.977
   63   1HD2  ASN  11          1HD2      ASN  11   1.016 -23.045  12.061
   64   2HD2  ASN  11          2HD2      ASN  11  -0.480 -23.668  12.567
   65    H    ASP  12           H        ASP  12   2.200 -23.102  14.824
   66    HA   ASP  12           HA       ASP  12   2.597 -20.509  13.411
   67   1HB   ASP  12          2HB       ASP  12   0.276 -21.527  13.052
   68   2HB   ASP  12          1HB       ASP  12   0.002 -21.253  14.769
   69    H    ASN  13           H        ASN  13   3.386 -22.188  15.998
   70    HA   ASN  13           HA       ASN  13   2.679 -20.241  18.100
   71   1HB   ASN  13          2HB       ASN  13   4.011 -22.935  18.006
   72   2HB   ASN  13          1HB       ASN  13   4.306 -21.897  19.396
   73   1HD2  ASN  13          1HD2      ASN  13   2.289 -21.098  20.565
   74   2HD2  ASN  13          2HD2      ASN  13   0.920 -22.102  20.579
   75    H    GLY  14           H        GLY  14   4.627 -19.871  15.695
   76   1HA   GLY  14          2HA       GLY  14   7.159 -19.262  17.069
   77   2HA   GLY  14          1HA       GLY  14   6.836 -19.046  15.349
   78    H    LYS  15           H        LYS  15   4.385 -17.755  17.360
   79    HA   LYS  15           HA       LYS  15   3.710 -15.520  17.663
   80   1HB   LYS  15          2HB       LYS  15   6.679 -15.425  18.265
   81   2HB   LYS  15          1HB       LYS  15   5.662 -13.999  18.413
   82   1HG   LYS  15          2HG       LYS  15   5.446 -14.760  20.580
   83   2HG   LYS  15          1HG       LYS  15   4.158 -15.728  19.877
   84   1HD   LYS  15          2HD       LYS  15   6.053 -17.485  19.436
   85   2HD   LYS  15          1HD       LYS  15   6.962 -16.558  20.628
   86   1HE   LYS  15          2HE       LYS  15   4.973 -16.809  22.190
   87   2HE   LYS  15          1HE       LYS  15   4.304 -17.959  21.034
   88   1HZ   LYS  15          1HZ       LYS  15   5.743 -18.807  22.973
   89   2HZ   LYS  15          2HZ       LYS  15   7.057 -18.287  22.033
   90   3HZ   LYS  15          3HZ       LYS  15   5.991 -19.460  21.425
   91    H    GLY  16           H        GLY  16   3.851 -16.119  15.002
   92   1HA   GLY  16          2HA       GLY  16   5.537 -14.101  13.645
   93   2HA   GLY  16          1HA       GLY  16   4.523 -15.306  12.856
   94    H    GLY  17           H        GLY  17   2.031 -14.897  13.648
   95   1HA   GLY  17          2HA       GLY  17   0.203 -13.387  13.667
   96   2HA   GLY  17          1HA       GLY  17   1.352 -12.055  13.816
   97    H    GLU  18           H        GLU  18   2.826 -13.396  11.452
   98    HA   GLU  18           HA       GLU  18   0.969 -12.893   9.221
   99   1HB   GLU  18          2HB       GLU  18   2.225 -11.143   8.189
  100   2HB   GLU  18          1HB       GLU  18   2.014 -10.649   9.866
  101   1HG   GLU  18          2HG       GLU  18   4.504 -11.908   8.659
  102   2HG   GLU  18          1HG       GLU  18   4.321 -10.243   9.205
  103    H    LYS  19           H        LYS  19   3.546 -14.441  10.650
  104    HA   LYS  19           HA       LYS  19   5.277 -15.842   9.860
  105   1HB   LYS  19          2HB       LYS  19   4.362 -17.815   8.865
  106   2HB   LYS  19          1HB       LYS  19   3.143 -17.173   9.960
  107   1HG   LYS  19          2HG       LYS  19   1.982 -16.123   8.029
  108   2HG   LYS  19          1HG       LYS  19   3.174 -16.825   6.930
  109   1HD   LYS  19          2HD       LYS  19   2.418 -19.015   7.301
  110   2HD   LYS  19          1HD       LYS  19   1.675 -18.612   8.847
  111   1HE   LYS  19          2HE       LYS  19   0.672 -17.559   6.186
  112   2HE   LYS  19          1HE       LYS  19   0.020 -18.991   6.982
  113   1HZ   LYS  19          1HZ       LYS  19  -1.342 -17.491   7.928
  114   2HZ   LYS  19          2HZ       LYS  19  -0.281 -16.186   7.674
  115   3HZ   LYS  19          3HZ       LYS  19  -0.040 -17.240   8.983
  116    H    ALA  20           H        ALA  20   5.396 -17.232   7.387
  117    HA   ALA  20           HA       ALA  20   5.703 -15.173   5.291
  118   1HB   ALA  20          1HB       ALA  20   8.041 -15.533   4.967
  119   2HB   ALA  20          2HB       ALA  20   8.048 -16.941   6.031
  120   3HB   ALA  20          3HB       ALA  20   7.861 -15.324   6.708
  121    H    ASP  21           H        ASP  21   3.820 -16.925   5.063
  122    HA   ASP  21           HA       ASP  21   4.570 -19.547   4.119
  123   1HB   ASP  21          2HB       ASP  21   2.274 -18.818   5.000
  124   2HB   ASP  21          1HB       ASP  21   2.038 -18.036   3.442
  125    H    ASN  22           H        ASN  22   5.331 -16.678   2.922
  126    HA   ASN  22           HA       ASN  22   6.025 -15.901   0.852
  127   1HB   ASN  22          2HB       ASN  22   6.182 -18.843   0.641
  128   2HB   ASN  22          1HB       ASN  22   5.903 -18.077  -0.913
  129   1HD2  ASN  22          1HD2      ASN  22   7.534 -16.503  -1.647
  130   2HD2  ASN  22          2HD2      ASN  22   9.105 -16.545  -1.017
  131    H    ALA  23           H        ALA  23   3.555 -18.387   0.180
  132    HA   ALA  23           HA       ALA  23   2.245 -16.889  -1.882
  133   1HB   ALA  23          1HB       ALA  23   1.258 -19.103  -0.053
  134   2HB   ALA  23          2HB       ALA  23   1.870 -19.280  -1.698
  135   3HB   ALA  23          3HB       ALA  23   0.326 -18.473  -1.413
  136    H    ALA  24           H        ALA  24   1.750 -17.009   1.656
  137    HA   ALA  24           HA       ALA  24  -0.636 -15.353   1.543
  138   1HB   ALA  24          1HB       ALA  24  -0.404 -15.145   3.933
  139   2HB   ALA  24          2HB       ALA  24   1.309 -15.556   3.866
  140   3HB   ALA  24          3HB       ALA  24   0.091 -16.787   3.535
  141    H    GLN  25           H        GLN  25   2.820 -14.818   1.963
  142    HA   GLN  25           HA       GLN  25   2.765 -12.007   2.398
  143   1HB   GLN  25          2HB       GLN  25   4.760 -14.080   1.675
  144   2HB   GLN  25          1HB       GLN  25   5.200 -12.463   1.141
  145   1HG   GLN  25          2HG       GLN  25   4.254 -12.955   3.970
  146   2HG   GLN  25          1HG       GLN  25   5.930 -13.231   3.519
  147   1HE2  GLN  25          1HE2      GLN  25   3.798 -10.613   2.248
  148   2HE2  GLN  25          2HE2      GLN  25   4.760  -9.359   2.855
  149    H    VAL  26           H        VAL  26   2.084 -13.791  -0.467
  150    HA   VAL  26           HA       VAL  26   3.039 -11.944  -2.433
  151    HB   VAL  26           HB       VAL  26   0.887 -14.046  -2.429
  152   1HG1  VAL  26          1HG1      VAL  26   1.034 -13.599  -5.055
  153   2HG1  VAL  26          2HG1      VAL  26   1.388 -11.957  -4.517
  154   3HG1  VAL  26          3HG1      VAL  26  -0.126 -12.726  -4.057
  155   1HG2  VAL  26          1HG2      VAL  26   2.407 -15.204  -3.893
  156   2HG2  VAL  26          2HG2      VAL  26   3.309 -14.649  -2.484
  157   3HG2  VAL  26          3HG2      VAL  26   3.444 -13.781  -4.011
  158    H    LYS  27           H        LYS  27  -0.437 -12.455  -2.070
  159    HA   LYS  27           HA       LYS  27  -1.012  -9.762  -2.862
  160   1HB   LYS  27          2HB       LYS  27  -3.316 -10.310  -2.457
  161   2HB   LYS  27          1HB       LYS  27  -2.534 -11.739  -3.130
  162   1HG   LYS  27          2HG       LYS  27  -2.150 -12.376  -0.592
  163   2HG   LYS  27          1HG       LYS  27  -3.469 -11.241  -0.310
  164   1HD   LYS  27          2HD       LYS  27  -4.847 -12.510  -1.985
  165   2HD   LYS  27          1HD       LYS  27  -3.549 -13.701  -2.082
  166   1HE   LYS  27          2HE       LYS  27  -5.021 -14.620  -0.491
  167   2HE   LYS  27          1HE       LYS  27  -3.777 -13.855   0.496
  168   1HZ   LYS  27          1HZ       LYS  27  -6.436 -13.411   0.703
  169   2HZ   LYS  27          2HZ       LYS  27  -5.924 -12.084  -0.228
  170   3HZ   LYS  27          3HZ       LYS  27  -5.225 -12.377   1.291
  171    H    ASP  28           H        ASP  28  -0.669 -11.236   0.349
  172    HA   ASP  28           HA       ASP  28  -1.939  -9.221   1.876
  173   1HB   ASP  28          2HB       ASP  28  -1.082 -11.310   2.868
  174   2HB   ASP  28          1HB       ASP  28   0.574 -10.774   2.574
  175    H    ALA  29           H        ALA  29   1.378  -9.317   0.570
  176    HA   ALA  29           HA       ALA  29   2.184  -6.833   1.778
  177   1HB   ALA  29          1HB       ALA  29   3.724  -8.615   0.822
  178   2HB   ALA  29          2HB       ALA  29   4.104  -6.958   0.351
  179   3HB   ALA  29          3HB       ALA  29   3.273  -8.028  -0.779
  180    H    LEU  30           H        LEU  30   1.214  -7.627  -1.569
  181    HA   LEU  30           HA       LEU  30   1.117  -4.935  -2.416
  182   1HB   LEU  30          2HB       LEU  30  -0.705  -7.080  -3.473
  183   2HB   LEU  30          1HB       LEU  30  -0.015  -5.716  -4.343
  184    HG   LEU  30           HG       LEU  30   1.581  -8.041  -3.216
  185   1HD1  LEU  30          1HD1      LEU  30   0.911  -7.326  -6.078
  186   2HD1  LEU  30          2HD1      LEU  30   0.132  -8.614  -5.158
  187   3HD1  LEU  30          3HD1      LEU  30   1.852  -8.719  -5.537
  188   1HD2  LEU  30          1HD2      LEU  30   3.400  -7.038  -4.636
  189   2HD2  LEU  30          2HD2      LEU  30   2.934  -6.024  -3.273
  190   3HD2  LEU  30          3HD2      LEU  30   2.360  -5.639  -4.897
  191    H    THR  31           H        THR  31  -1.513  -6.997  -1.136
  192    HA   THR  31           HA       THR  31  -3.551  -5.012  -1.321
  193    HB   THR  31           HB       THR  31  -4.657  -6.345   0.534
  194    HG1  THR  31           1HG      THR  31  -3.606  -8.154   1.228
  195   1HG2  THR  31          1HG2      THR  31  -5.131  -8.219  -0.892
  196   2HG2  THR  31          2HG2      THR  31  -3.590  -8.044  -1.726
  197   3HG2  THR  31          3HG2      THR  31  -4.853  -6.837  -1.949
  198    H    LYS  32           H        LYS  32  -1.198  -5.668   1.272
  199    HA   LYS  32           HA       LYS  32  -2.337  -3.956   3.227
  200   1HB   LYS  32          2HB       LYS  32  -0.512  -5.479   3.792
  201   2HB   LYS  32          1HB       LYS  32   0.584  -4.617   2.715
  202   1HG   LYS  32          2HG       LYS  32  -0.721  -2.835   4.698
  203   2HG   LYS  32          1HG       LYS  32   0.260  -4.090   5.444
  204   1HD   LYS  32          2HD       LYS  32   2.219  -3.402   4.224
  205   2HD   LYS  32          1HD       LYS  32   1.273  -2.308   3.215
  206   1HE   LYS  32          2HE       LYS  32   1.689  -2.046   6.208
  207   2HE   LYS  32          1HE       LYS  32   2.443  -1.044   4.969
  208   1HZ   LYS  32          1HZ       LYS  32   0.680   0.266   5.294
  209   2HZ   LYS  32          2HZ       LYS  32  -0.230  -0.956   6.045
  210   3HZ   LYS  32          3HZ       LYS  32  -0.166  -0.863   4.351
  211    H    MET  33           H        MET  33   0.246  -3.229   0.847
  212    HA   MET  33           HA       MET  33   0.324  -0.432   1.483
  213   1HB   MET  33          2HB       MET  33   0.995  -1.709  -1.186
  214   2HB   MET  33          1HB       MET  33   1.573  -0.155  -0.579
  215   1HG   MET  33          2HG       MET  33   2.516  -1.504   1.416
  216   2HG   MET  33          1HG       MET  33   2.265  -2.925   0.402
  217   1HE   MET  33          1HE       MET  33   4.896  -2.957  -2.140
  218   2HE   MET  33          2HE       MET  33   3.134  -2.963  -2.177
  219   3HE   MET  33          3HE       MET  33   3.986  -3.852  -0.915
  220    H    ARG  34           H        ARG  34  -1.776  -2.296  -0.667
  221    HA   ARG  34           HA       ARG  34  -2.816  -0.118  -2.178
  222   1HB   ARG  34          2HB       ARG  34  -3.363  -2.377  -2.838
  223   2HB   ARG  34          1HB       ARG  34  -4.157  -2.686  -1.294
  224   1HG   ARG  34          2HG       ARG  34  -5.984  -1.313  -1.795
  225   2HG   ARG  34          1HG       ARG  34  -5.105  -0.409  -3.030
  226   1HD   ARG  34          2HD       ARG  34  -5.102  -2.385  -4.499
  227   2HD   ARG  34          1HD       ARG  34  -5.954  -3.313  -3.265
  228    HE   ARG  34           HE       ARG  34  -7.473  -0.967  -3.835
  229   1HH1  ARG  34          1HH2      ARG  34  -6.390  -3.917  -5.252
  230   2HH1  ARG  34          2HH2      ARG  34  -7.770  -4.089  -6.283
  231   1HH2  ARG  34          1HH1      ARG  34  -9.303  -1.187  -5.173
  232   2HH2  ARG  34          2HH1      ARG  34  -9.415  -2.549  -6.236
  233    H    ALA  35           H        ALA  35  -4.245  -1.621   0.733
  234    HA   ALA  35           HA       ALA  35  -6.309   0.283   1.067
  235   1HB   ALA  35          1HB       ALA  35  -6.265  -0.428   3.489
  236   2HB   ALA  35          2HB       ALA  35  -4.820  -1.370   3.124
  237   3HB   ALA  35          3HB       ALA  35  -6.354  -1.768   2.347
  238    H    ALA  36           H        ALA  36  -2.910   0.420   1.960
  239    HA   ALA  36           HA       ALA  36  -3.043   2.605   3.783
  240   1HB   ALA  36          1HB       ALA  36  -0.705   2.908   3.371
  241   2HB   ALA  36          2HB       ALA  36  -0.824   2.152   1.782
  242   3HB   ALA  36          3HB       ALA  36  -1.006   1.175   3.239
  243    H    ALA  37           H        ALA  37  -2.673   2.565   0.236
  244    HA   ALA  37           HA       ALA  37  -2.512   5.398  -0.082
  245   1HB   ALA  37          1HB       ALA  37  -3.330   4.897  -2.436
  246   2HB   ALA  37          2HB       ALA  37  -3.472   3.209  -1.943
  247   3HB   ALA  37          3HB       ALA  37  -1.896   4.001  -1.933
  248    H    LEU  38           H        LEU  38  -5.305   3.183   0.004
  249    HA   LEU  38           HA       LEU  38  -7.255   5.217  -0.581
  250   1HB   LEU  38          2HB       LEU  38  -7.738   2.745   1.087
  251   2HB   LEU  38          1HB       LEU  38  -8.903   3.637   0.111
  252    HG   LEU  38           HG       LEU  38  -6.496   2.151  -0.981
  253   1HD1  LEU  38          1HD1      LEU  38  -8.356   0.727  -0.033
  254   2HD1  LEU  38          2HD1      LEU  38  -8.062   0.492  -1.755
  255   3HD1  LEU  38          3HD1      LEU  38  -9.435   1.461  -1.223
  256   1HD2  LEU  38          1HD2      LEU  38  -7.852   2.537  -3.157
  257   2HD2  LEU  38          2HD2      LEU  38  -6.976   3.914  -2.492
  258   3HD2  LEU  38          3HD2      LEU  38  -8.715   3.774  -2.240
  259    H    ASP  39           H        ASP  39  -5.759   4.011   2.374
  260    HA   ASP  39           HA       ASP  39  -7.438   5.345   4.239
  261   1HB   ASP  39          2HB       ASP  39  -5.424   3.599   4.512
  262   2HB   ASP  39          1HB       ASP  39  -4.490   5.067   4.790
  263    H    ALA  40           H        ALA  40  -4.221   6.404   3.002
  264    HA   ALA  40           HA       ALA  40  -4.460   9.039   4.103
  265   1HB   ALA  40          1HB       ALA  40  -2.276   8.312   3.411
  266   2HB   ALA  40          2HB       ALA  40  -2.725   9.639   2.341
  267   3HB   ALA  40          3HB       ALA  40  -2.842   7.974   1.775
  268    H    GLN  41           H        GLN  41  -6.001   7.574   1.385
  269    HA   GLN  41           HA       GLN  41  -6.382  10.046  -0.098
  270   1HB   GLN  41          2HB       GLN  41  -6.425   7.876  -1.250
  271   2HB   GLN  41          1HB       GLN  41  -7.827   7.400  -0.300
  272   1HG   GLN  41          2HG       GLN  41  -8.340   9.976  -1.575
  273   2HG   GLN  41          1HG       GLN  41  -7.847   8.798  -2.786
  274   1HE2  GLN  41          1HE2      GLN  41  -8.992   6.450  -2.108
  275   2HE2  GLN  41          2HE2      GLN  41 -10.671   6.592  -1.915
  276    H    LYS  42           H        LYS  42  -7.247  11.401   1.586
  277    HA   LYS  42           HA       LYS  42  -8.967  12.284   2.958
  278   1HB   LYS  42          2HB       LYS  42 -10.775  11.494   0.676
  279   2HB   LYS  42          1HB       LYS  42 -10.782  12.975   1.632
  280   1HG   LYS  42          2HG       LYS  42  -8.618  12.175  -0.349
  281   2HG   LYS  42          1HG       LYS  42  -9.880  13.367  -0.642
  282   1HD   LYS  42          2HD       LYS  42  -9.016  14.598   1.426
  283   2HD   LYS  42          1HD       LYS  42  -7.619  13.529   1.366
  284   1HE   LYS  42          2HE       LYS  42  -7.513  14.299  -1.171
  285   2HE   LYS  42          1HE       LYS  42  -8.446  15.671  -0.570
  286   1HZ   LYS  42          1HZ       LYS  42  -6.713  16.008   1.119
  287   2HZ   LYS  42          2HZ       LYS  42  -6.112  16.160  -0.462
  288   3HZ   LYS  42          3HZ       LYS  42  -5.806  14.749   0.433
  289    H    ALA  43           H        ALA  43  -8.565   9.797   3.954
  290    HA   ALA  43           HA       ALA  43 -11.349   8.856   4.523
  291   1HB   ALA  43          1HB       ALA  43  -8.996   7.153   3.698
  292   2HB   ALA  43          2HB       ALA  43 -10.596   7.227   2.964
  293   3HB   ALA  43          3HB       ALA  43 -10.392   6.490   4.551
  294    H    THR  44           H        THR  44  -7.924   8.587   5.489
  295    HA   THR  44           HA       THR  44  -8.748   8.910   8.332
  296    HB   THR  44           HB       THR  44  -6.614   6.964   7.391
  297    HG1  THR  44           1HG      THR  44  -9.237   6.428   8.325
  298   1HG2  THR  44          1HG2      THR  44  -6.480   6.263   9.647
  299   2HG2  THR  44          2HG2      THR  44  -8.000   7.049  10.071
  300   3HG2  THR  44          3HG2      THR  44  -6.563   8.017   9.754
  301    HA   PRO  45           HA       PRO  45  -5.706  11.955   6.093
  302   1HB   PRO  45          2HB       PRO  45  -7.169  13.307   8.358
  303   2HB   PRO  45          1HB       PRO  45  -6.570  14.003   6.837
  304   1HG   PRO  45          2HG       PRO  45  -9.138  13.249   7.157
  305   2HG   PRO  45          1HG       PRO  45  -8.298  13.137   5.599
  306   1HD   PRO  45          2HD       PRO  45  -9.227  10.946   7.318
  307   2HD   PRO  45          1HD       PRO  45  -8.598  10.871   5.660
  308    HA   PRO  46           HA       PRO  46  -3.167  11.043   9.828
  309   1HB   PRO  46          2HB       PRO  46  -1.034   9.879   8.511
  310   2HB   PRO  46          1HB       PRO  46  -2.465   8.981   9.052
  311   1HG   PRO  46          2HG       PRO  46  -1.642   9.643   6.328
  312   2HG   PRO  46          1HG       PRO  46  -2.885   8.511   6.878
  313   1HD   PRO  46          2HD       PRO  46  -3.240  11.244   5.869
  314   2HD   PRO  46          1HD       PRO  46  -4.478  10.021   6.215
  315    H    LYS  47           H        LYS  47  -1.344  11.760   6.822
  316    HA   LYS  47           HA       LYS  47   0.092  13.916   8.249
  317   1HB   LYS  47          2HB       LYS  47   0.550  13.292   5.344
  318   2HB   LYS  47          1HB       LYS  47   1.702  13.808   6.574
  319   1HG   LYS  47          2HG       LYS  47   1.208  11.492   7.683
  320   2HG   LYS  47          1HG       LYS  47   0.537  11.063   6.109
  321   1HD   LYS  47          2HD       LYS  47   2.632  11.474   5.001
  322   2HD   LYS  47          1HD       LYS  47   3.328  12.204   6.444
  323   1HE   LYS  47          2HE       LYS  47   3.623  10.154   7.506
  324   2HE   LYS  47          1HE       LYS  47   2.334   9.369   6.586
  325   1HZ   LYS  47          1HZ       LYS  47   3.678   9.209   4.706
  326   2HZ   LYS  47          2HZ       LYS  47   4.730   8.819   5.980
  327   3HZ   LYS  47          3HZ       LYS  47   4.789  10.362   5.273
  328    H    LEU  48           H        LEU  48  -2.623  13.475   6.243
  329    HA   LEU  48           HA       LEU  48  -2.585  16.134   5.014
  330   1HB   LEU  48          2HB       LEU  48  -4.809  14.075   5.293
  331   2HB   LEU  48          1HB       LEU  48  -4.926  15.547   4.335
  332    HG   LEU  48           HG       LEU  48  -2.774  13.459   3.892
  333   1HD1  LEU  48          1HD1      LEU  48  -4.796  12.280   3.466
  334   2HD1  LEU  48          2HD1      LEU  48  -4.245  12.823   1.882
  335   3HD1  LEU  48          3HD1      LEU  48  -5.549  13.679   2.707
  336   1HD2  LEU  48          1HD2      LEU  48  -3.757  15.887   2.384
  337   2HD2  LEU  48          2HD2      LEU  48  -2.923  14.584   1.542
  338   3HD2  LEU  48          3HD2      LEU  48  -2.108  15.459   2.835
  339    H    GLU  49           H        GLU  49  -2.351  17.495   6.875
  340    HA   GLU  49           HA       GLU  49  -4.491  17.378   8.938
  341   1HB   GLU  49          2HB       GLU  49  -1.956  17.471   9.438
  342   2HB   GLU  49          1HB       GLU  49  -2.069  19.175   9.004
  343   1HG   GLU  49          2HG       GLU  49  -3.688  19.577  10.761
  344   2HG   GLU  49          1HG       GLU  49  -3.819  17.850  11.100
  345    H    ASP  50           H        ASP  50  -3.107  19.660   6.561
  346    HA   ASP  50           HA       ASP  50  -5.613  21.065   6.315
  347   1HB   ASP  50          2HB       ASP  50  -4.842  21.920   8.560
  348   2HB   ASP  50          1HB       ASP  50  -3.436  22.612   7.755
  349    H    LYS  51           H        LYS  51  -3.888  19.946   4.463
  350    HA   LYS  51           HA       LYS  51  -2.294  22.119   3.245
  351   1HB   LYS  51          2HB       LYS  51  -2.764  19.214   2.530
  352   2HB   LYS  51          1HB       LYS  51  -1.804  20.312   1.536
  353   1HG   LYS  51          2HG       LYS  51  -0.256  20.695   3.370
  354   2HG   LYS  51          1HG       LYS  51  -1.265  19.758   4.468
  355   1HD   LYS  51          2HD       LYS  51  -0.857  17.728   3.178
  356   2HD   LYS  51          1HD       LYS  51   0.062  18.642   1.982
  357   1HE   LYS  51          2HE       LYS  51   0.842  18.625   4.900
  358   2HE   LYS  51          1HE       LYS  51   1.413  17.392   3.777
  359   1HZ   LYS  51          1HZ       LYS  51   1.949  19.543   2.359
  360   2HZ   LYS  51          2HZ       LYS  51   3.044  18.907   3.486
  361   3HZ   LYS  51          3HZ       LYS  51   2.069  20.231   3.908
  362    H    SER  52           H        SER  52  -4.544  19.802   1.649
  363    HA   SER  52           HA       SER  52  -6.309  20.267   0.140
  364   1HB   SER  52          2HB       SER  52  -6.570  22.070   2.176
  365   2HB   SER  52          1HB       SER  52  -6.373  23.170   0.813
  366    HG   SER  52           HG       SER  52  -8.379  21.312   1.389
  367    HA   PRO  53           HA       PRO  53  -4.535  22.070  -3.485
  368   1HB   PRO  53          2HB       PRO  53  -6.515  24.302  -3.695
  369   2HB   PRO  53          1HB       PRO  53  -6.134  23.018  -4.864
  370   1HG   PRO  53          2HG       PRO  53  -8.387  22.926  -3.486
  371   2HG   PRO  53          1HG       PRO  53  -7.443  21.450  -3.756
  372   1HD   PRO  53          2HD       PRO  53  -7.575  23.144  -1.271
  373   2HD   PRO  53          1HD       PRO  53  -7.624  21.369  -1.438
  374    H    ASP  54           H        ASP  54  -3.601  23.148  -0.940
  375    HA   ASP  54           HA       ASP  54  -2.875  25.960  -1.570
  376   1HB   ASP  54          2HB       ASP  54  -3.685  25.389   0.735
  377   2HB   ASP  54          1HB       ASP  54  -2.287  24.326   0.936
  378    H    SER  55           H        SER  55  -1.738  22.878  -2.151
  379    HA   SER  55           HA       SER  55   0.831  23.828  -3.044
  380   1HB   SER  55          2HB       SER  55   0.811  23.311  -0.358
  381   2HB   SER  55          1HB       SER  55   1.265  21.729  -0.973
  382    HG   SER  55           HG       SER  55   2.673  24.084  -0.902
  383    HA   PRO  56           HA       PRO  56   0.876  20.092  -5.495
  384   1HB   PRO  56          2HB       PRO  56   2.987  18.733  -3.851
  385   2HB   PRO  56          1HB       PRO  56   2.924  19.006  -5.606
  386   1HG   PRO  56          2HG       PRO  56   4.510  20.476  -4.105
  387   2HG   PRO  56          1HG       PRO  56   3.561  21.236  -5.400
  388   1HD   PRO  56          2HD       PRO  56   3.035  21.240  -2.433
  389   2HD   PRO  56          1HD       PRO  56   2.881  22.568  -3.610
  390    H    GLU  57           H        GLU  57  -0.028  19.893  -2.299
  391    HA   GLU  57           HA       GLU  57  -0.243  17.223  -1.602
  392   1HB   GLU  57          2HB       GLU  57  -1.109  18.732  -0.036
  393   2HB   GLU  57          1HB       GLU  57  -2.130  19.540  -1.219
  394   1HG   GLU  57          2HG       GLU  57  -2.611  16.639  -0.534
  395   2HG   GLU  57          1HG       GLU  57  -3.226  17.908   0.524
  396    H    MET  58           H        MET  58  -2.610  18.957  -3.687
  397    HA   MET  58           HA       MET  58  -4.189  16.668  -4.312
  398   1HB   MET  58          2HB       MET  58  -3.611  19.236  -5.805
  399   2HB   MET  58          1HB       MET  58  -4.661  17.999  -6.490
  400   1HG   MET  58          2HG       MET  58  -6.001  18.106  -4.327
  401   2HG   MET  58          1HG       MET  58  -5.058  19.538  -3.915
  402   1HE   MET  58          1HE       MET  58  -8.521  19.096  -6.787
  403   2HE   MET  58          2HE       MET  58  -8.282  18.439  -5.172
  404   3HE   MET  58          3HE       MET  58  -7.323  17.820  -6.514
  405    H    LYS  59           H        LYS  59  -1.402  18.073  -6.084
  406    HA   LYS  59           HA       LYS  59  -1.395  16.072  -8.116
  407   1HB   LYS  59          2HB       LYS  59   1.043  17.545  -7.135
  408   2HB   LYS  59          1HB       LYS  59   0.721  16.936  -8.759
  409   1HG   LYS  59          2HG       LYS  59  -1.190  18.524  -8.936
  410   2HG   LYS  59          1HG       LYS  59  -0.766  19.164  -7.348
  411   1HD   LYS  59          2HD       LYS  59   0.522  20.647  -8.532
  412   2HD   LYS  59          1HD       LYS  59   1.666  19.307  -8.595
  413   1HE   LYS  59          2HE       LYS  59   1.340  20.213 -10.843
  414   2HE   LYS  59          1HE       LYS  59   0.657  18.590 -10.764
  415   1HZ   LYS  59          1HZ       LYS  59  -1.354  20.281  -9.966
  416   2HZ   LYS  59          2HZ       LYS  59  -1.230  19.477 -11.459
  417   3HZ   LYS  59          3HZ       LYS  59  -0.636  21.063 -11.288
  418    H    ASP  60           H        ASP  60   0.663  16.385  -5.203
  419    HA   ASP  60           HA       ASP  60   2.042  13.927  -5.564
  420   1HB   ASP  60          2HB       ASP  60   2.637  15.584  -3.765
  421   2HB   ASP  60          1HB       ASP  60   1.180  15.078  -2.904
  422    H    PHE  61           H        PHE  61  -1.153  14.663  -4.257
  423    HA   PHE  61           HA       PHE  61  -1.651  11.979  -3.318
  424   1HB   PHE  61          2HB       PHE  61  -3.086  13.556  -2.341
  425   2HB   PHE  61          1HB       PHE  61  -3.336  14.419  -3.853
  426    HD1  PHE  61           1HD      PHE  61  -5.736  14.429  -3.841
  427    HD2  PHE  61           2HD      PHE  61  -3.586  10.731  -3.446
  428    HE1  PHE  61           1HE      PHE  61  -7.837  13.169  -4.190
  429    HE2  PHE  61           2HE      PHE  61  -5.681   9.464  -3.827
  430    HZ   PHE  61           HZ       PHE  61  -7.810  10.689  -4.192
  431    H    ARG  62           H        ARG  62  -2.567  13.837  -6.210
  432    HA   ARG  62           HA       ARG  62  -3.822  11.692  -7.558
  433   1HB   ARG  62          2HB       ARG  62  -2.312  14.048  -8.708
  434   2HB   ARG  62          1HB       ARG  62  -3.345  12.977  -9.640
  435   1HG   ARG  62          2HG       ARG  62  -4.731  13.984  -7.246
  436   2HG   ARG  62          1HG       ARG  62  -4.173  15.301  -8.270
  437   1HD   ARG  62          2HD       ARG  62  -6.397  14.659  -8.970
  438   2HD   ARG  62          1HD       ARG  62  -5.269  14.158 -10.226
  439    HE   ARG  62           HE       ARG  62  -5.755  12.059  -8.280
  440   1HH1  ARG  62          1HH2      ARG  62  -6.895  13.690 -11.098
  441   2HH1  ARG  62          2HH2      ARG  62  -7.873  12.364 -11.634
  442   1HH2  ARG  62          1HH1      ARG  62  -7.031  10.315  -8.964
  443   2HH2  ARG  62          2HH1      ARG  62  -7.952  10.455 -10.423
  444    H    HIS  63           H        HIS  63  -0.523  12.983  -8.061
  445    HA   HIS  63           HA       HIS  63   0.344  10.740  -9.627
  446   1HB   HIS  63          2HB       HIS  63   1.297  13.193  -9.309
  447   2HB   HIS  63          1HB       HIS  63   2.265  12.431  -8.048
  448    HD1  HIS  63           1HD      HIS  63   1.480  12.023 -11.747
  449    HD2  HIS  63           2HD      HIS  63   4.445  11.054  -9.003
  450    HE1  HIS  63           1HE      HIS  63   3.345  10.937 -13.072
  451    H    GLY  64           H        GLY  64   0.089  11.212  -6.178
  452   1HA   GLY  64          2HA       GLY  64   2.099   9.252  -5.444
  453   2HA   GLY  64          1HA       GLY  64   0.881   9.920  -4.361
  454    H    PHE  65           H        PHE  65  -1.503   9.063  -5.236
  455    HA   PHE  65           HA       PHE  65  -1.428   6.255  -4.672
  456   1HB   PHE  65          2HB       PHE  65  -3.739   6.354  -4.542
  457   2HB   PHE  65          1HB       PHE  65  -3.355   8.056  -4.330
  458    HD1  PHE  65           1HD      PHE  65  -4.296   9.658  -5.794
  459    HD2  PHE  65           2HD      PHE  65  -4.226   5.538  -6.940
  460    HE1  PHE  65           1HE      PHE  65  -5.691  10.190  -7.762
  461    HE2  PHE  65           2HE      PHE  65  -5.622   6.060  -8.919
  462    HZ   PHE  65           HZ       PHE  65  -6.356   8.392  -9.330
  463    H    ASP  66           H        ASP  66  -1.378   8.054  -7.629
  464    HA   ASP  66           HA       ASP  66  -2.187   5.982  -9.404
  465   1HB   ASP  66          2HB       ASP  66  -2.041   8.376 -10.046
  466   2HB   ASP  66          1HB       ASP  66  -0.284   8.266  -9.945
  467    H    ILE  67           H        ILE  67   0.958   6.934  -8.115
  468    HA   ILE  67           HA       ILE  67   2.462   5.029  -9.655
  469    HB   ILE  67           HB       ILE  67   2.993   6.473  -7.048
  470   1HG1  ILE  67          2HG1      ILE  67   4.189   6.763  -9.813
  471   2HG1  ILE  67          1HG1      ILE  67   2.828   7.723  -9.225
  472   1HG2  ILE  67          1HG2      ILE  67   4.356   4.544  -6.865
  473   2HG2  ILE  67          2HG2      ILE  67   5.419   5.762  -7.548
  474   3HG2  ILE  67          3HG2      ILE  67   4.719   4.523  -8.589
  475   1HD1  ILE  67          1HD1      ILE  67   5.533   7.571  -7.854
  476   2HD1  ILE  67          2HD1      ILE  67   4.204   8.653  -7.437
  477   3HD1  ILE  67          3HD1      ILE  67   5.065   8.852  -8.963
  478    H    LEU  68           H        LEU  68   1.222   4.970  -6.314
  479    HA   LEU  68           HA       LEU  68   2.007   2.344  -5.635
  480   1HB   LEU  68          2HB       LEU  68  -0.293   4.078  -4.722
  481   2HB   LEU  68          1HB       LEU  68   0.075   2.524  -3.972
  482    HG   LEU  68           HG       LEU  68   2.265   4.582  -4.276
  483   1HD1  LEU  68          1HD1      LEU  68   1.717   5.619  -2.189
  484   2HD1  LEU  68          2HD1      LEU  68   0.426   4.459  -1.876
  485   3HD1  LEU  68          3HD1      LEU  68   0.247   5.660  -3.155
  486   1HD2  LEU  68          1HD2      LEU  68   1.678   2.476  -2.173
  487   2HD2  LEU  68          2HD2      LEU  68   3.133   3.468  -2.269
  488   3HD2  LEU  68          3HD2      LEU  68   2.797   2.272  -3.516
  489    H    VAL  69           H        VAL  69  -1.245   3.386  -6.785
  490    HA   VAL  69           HA       VAL  69  -2.253   0.715  -7.015
  491    HB   VAL  69           HB       VAL  69  -3.970   1.644  -8.501
  492   1HG1  VAL  69          1HG1      VAL  69  -4.884   3.341  -7.023
  493   2HG1  VAL  69          2HG1      VAL  69  -3.316   3.528  -6.251
  494   3HG1  VAL  69          3HG1      VAL  69  -4.195   2.011  -6.096
  495   1HG2  VAL  69          1HG2      VAL  69  -3.634   4.291  -8.823
  496   2HG2  VAL  69          2HG2      VAL  69  -3.080   3.118 -10.013
  497   3HG2  VAL  69          3HG2      VAL  69  -1.947   3.780  -8.849
  498    H    GLY  70           H        GLY  70  -0.406   2.757  -9.195
  499   1HA   GLY  70          2HA       GLY  70  -0.645   1.166 -11.544
  500   2HA   GLY  70          1HA       GLY  70   0.663   2.298 -11.217
  501    H    GLN  71           H        GLN  71   1.686   0.970  -8.833
  502    HA   GLN  71           HA       GLN  71   3.109  -1.227 -10.208
  503   1HB   GLN  71          2HB       GLN  71   4.610  -1.138  -8.232
  504   2HB   GLN  71          1HB       GLN  71   4.439   0.441  -8.999
  505   1HG   GLN  71          2HG       GLN  71   2.594   0.915  -7.337
  506   2HG   GLN  71          1HG       GLN  71   3.066  -0.538  -6.488
  507   1HE2  GLN  71          1HE2      GLN  71   3.519   2.767  -6.421
  508   2HE2  GLN  71          2HE2      GLN  71   5.068   2.812  -5.716
  509    H    ILE  72           H        ILE  72   0.749  -0.764  -7.681
  510    HA   ILE  72           HA       ILE  72   1.054  -3.290  -6.374
  511    HB   ILE  72           HB       ILE  72  -1.251  -1.371  -6.746
  512   1HG1  ILE  72          2HG1      ILE  72   0.177  -2.240  -4.221
  513   2HG1  ILE  72          1HG1      ILE  72   0.776  -0.923  -5.232
  514   1HG2  ILE  72          1HG2      ILE  72  -2.338  -2.798  -4.878
  515   2HG2  ILE  72          2HG2      ILE  72  -1.248  -4.075  -5.410
  516   3HG2  ILE  72          3HG2      ILE  72  -2.432  -3.406  -6.528
  517   1HD1  ILE  72          1HD1      ILE  72  -0.764  -0.312  -3.251
  518   2HD1  ILE  72          2HD1      ILE  72  -2.076  -0.964  -4.237
  519   3HD1  ILE  72          3HD1      ILE  72  -1.130   0.410  -4.817
  520    H    ASP  73           H        ASP  73  -0.774  -2.222  -9.217
  521    HA   ASP  73           HA       ASP  73  -1.947  -4.831  -9.725
  522   1HB   ASP  73          2HB       ASP  73  -2.940  -2.740 -10.610
  523   2HB   ASP  73          1HB       ASP  73  -1.514  -2.506 -11.620
  524    H    ASP  74           H        ASP  74   0.829  -3.034 -11.135
  525    HA   ASP  74           HA       ASP  74   1.589  -5.036 -13.016
  526   1HB   ASP  74          2HB       ASP  74   3.562  -3.275 -11.549
  527   2HB   ASP  74          1HB       ASP  74   3.693  -3.933 -13.180
  528    H    ALA  75           H        ALA  75   2.523  -4.648  -9.595
  529    HA   ALA  75           HA       ALA  75   4.379  -6.870  -9.715
  530   1HB   ALA  75          1HB       ALA  75   4.657  -5.091  -8.048
  531   2HB   ALA  75          2HB       ALA  75   4.431  -6.644  -7.243
  532   3HB   ALA  75          3HB       ALA  75   3.099  -5.491  -7.334
  533    H    LEU  76           H        LEU  76   0.964  -6.508  -8.989
  534    HA   LEU  76           HA       LEU  76   0.626  -9.029  -7.661
  535   1HB   LEU  76          2HB       LEU  76  -1.013  -7.109  -7.663
  536   2HB   LEU  76          1HB       LEU  76  -1.423  -7.518  -9.322
  537    HG   LEU  76           HG       LEU  76  -1.554  -9.700  -7.240
  538   1HD1  LEU  76          1HD1      LEU  76  -2.726  -7.937  -6.102
  539   2HD1  LEU  76          2HD1      LEU  76  -3.939  -9.020  -6.785
  540   3HD1  LEU  76          3HD1      LEU  76  -3.590  -7.482  -7.572
  541   1HD2  LEU  76          1HD2      LEU  76  -2.078 -10.490  -9.406
  542   2HD2  LEU  76          2HD2      LEU  76  -2.980  -9.039  -9.836
  543   3HD2  LEU  76          3HD2      LEU  76  -3.663 -10.197  -8.699
  544    H    LYS  77           H        LYS  77  -0.087  -8.102 -11.079
  545    HA   LYS  77           HA       LYS  77  -0.700 -10.746 -11.940
  546   1HB   LYS  77          2HB       LYS  77  -0.038  -9.994 -14.228
  547   2HB   LYS  77          1HB       LYS  77  -1.136  -8.871 -13.443
  548   1HG   LYS  77          2HG       LYS  77   0.410  -7.282 -14.066
  549   2HG   LYS  77          1HG       LYS  77   1.272  -7.837 -12.648
  550   1HD   LYS  77          2HD       LYS  77   2.928  -7.965 -14.285
  551   2HD   LYS  77          1HD       LYS  77   2.312  -9.614 -14.263
  552   1HE   LYS  77          2HE       LYS  77   1.991  -7.498 -16.348
  553   2HE   LYS  77          1HE       LYS  77   2.221  -9.235 -16.529
  554   1HZ   LYS  77          1HZ       LYS  77   0.000  -9.653 -16.219
  555   2HZ   LYS  77          2HZ       LYS  77  -0.065  -8.172 -17.051
  556   3HZ   LYS  77          3HZ       LYS  77  -0.280  -8.215 -15.369
  557    H    LEU  78           H        LEU  78   2.381  -9.024 -11.654
  558    HA   LEU  78           HA       LEU  78   3.992 -11.055 -12.813
  559   1HB   LEU  78          2HB       LEU  78   4.543  -8.589 -11.872
  560   2HB   LEU  78          1HB       LEU  78   5.039  -9.507 -10.457
  561    HG   LEU  78           HG       LEU  78   6.951  -9.154 -11.927
  562   1HD1  LEU  78          1HD1      LEU  78   7.717 -11.429 -12.070
  563   2HD1  LEU  78          2HD1      LEU  78   6.066 -12.044 -12.163
  564   3HD1  LEU  78          3HD1      LEU  78   6.659 -11.315 -10.666
  565   1HD2  LEU  78          1HD2      LEU  78   5.153  -9.320 -14.034
  566   2HD2  LEU  78          2HD2      LEU  78   5.989 -10.872 -14.148
  567   3HD2  LEU  78          3HD2      LEU  78   6.907  -9.369 -14.197
  568    H    ALA  79           H        ALA  79   2.972 -10.504  -9.456
  569    HA   ALA  79           HA       ALA  79   4.229 -12.793  -8.338
  570   1HB   ALA  79          1HB       ALA  79   2.972 -10.861  -7.157
  571   2HB   ALA  79          2HB       ALA  79   2.840 -12.480  -6.473
  572   3HB   ALA  79          3HB       ALA  79   1.519 -11.820  -7.442
  573    H    ASN  80           H        ASN  80   0.870 -12.438  -9.569
  574    HA   ASN  80           HA       ASN  80   0.175 -15.173  -9.237
  575   1HB   ASN  80          2HB       ASN  80  -0.832 -12.905 -10.895
  576   2HB   ASN  80          1HB       ASN  80  -1.322 -14.512 -11.411
  577   1HD2  ASN  80          1HD2      ASN  80  -2.692 -12.161  -9.903
  578   2HD2  ASN  80          2HD2      ASN  80  -3.480 -12.921  -8.603
  579    H    GLU  81           H        GLU  81   1.156 -13.554 -12.272
  580    HA   GLU  81           HA       GLU  81   1.678 -16.084 -13.568
  581   1HB   GLU  81          2HB       GLU  81   0.942 -14.124 -14.833
  582   2HB   GLU  81          1HB       GLU  81   2.369 -13.232 -14.333
  583   1HG   GLU  81          2HG       GLU  81   2.355 -14.277 -16.698
  584   2HG   GLU  81          1HG       GLU  81   3.797 -14.494 -15.718
  585    H    GLY  82           H        GLY  82   3.343 -14.798 -11.107
  586   1HA   GLY  82          2HA       GLY  82   5.956 -15.868 -12.104
  587   2HA   GLY  82          1HA       GLY  82   5.913 -14.313 -11.299
  588    H    LYS  83           H        LYS  83   7.491 -15.981 -10.074
  589    HA   LYS  83           HA       LYS  83   6.108 -17.650  -8.090
  590   1HB   LYS  83          2HB       LYS  83   8.948 -17.040  -8.827
  591   2HB   LYS  83          1HB       LYS  83   8.665 -17.535  -7.170
  592   1HG   LYS  83          2HG       LYS  83   9.149 -19.513  -8.484
  593   2HG   LYS  83          1HG       LYS  83   7.455 -19.544  -8.029
  594   1HD   LYS  83          2HD       LYS  83   7.509 -20.149 -10.345
  595   2HD   LYS  83          1HD       LYS  83   6.939 -18.488 -10.300
  596   1HE   LYS  83          2HE       LYS  83   8.752 -19.075 -12.042
  597   2HE   LYS  83          1HE       LYS  83   9.005 -17.628 -11.072
  598   1HZ   LYS  83          1HZ       LYS  83  10.526 -18.763  -9.695
  599   2HZ   LYS  83          2HZ       LYS  83  10.964 -19.150 -11.289
  600   3HZ   LYS  83          3HZ       LYS  83  10.114 -20.276 -10.340
  601    H    VAL  84           H        VAL  84   7.167 -17.177  -5.675
  602    HA   VAL  84           HA       VAL  84   6.032 -14.547  -4.998
  603    HB   VAL  84           HB       VAL  84   7.204 -16.739  -3.240
  604   1HG1  VAL  84          1HG1      VAL  84   5.843 -14.102  -2.610
  605   2HG1  VAL  84          2HG1      VAL  84   7.441 -14.634  -2.088
  606   3HG1  VAL  84          3HG1      VAL  84   5.997 -15.401  -1.434
  607   1HG2  VAL  84          1HG2      VAL  84   5.201 -17.665  -3.959
  608   2HG2  VAL  84          2HG2      VAL  84   4.465 -16.101  -4.278
  609   3HG2  VAL  84          3HG2      VAL  84   4.588 -16.694  -2.625
  610    H    LYS  85           H        LYS  85   9.153 -16.256  -4.536
  611    HA   LYS  85           HA       LYS  85  10.593 -13.990  -3.548
  612   1HB   LYS  85          2HB       LYS  85  11.820 -15.948  -3.252
  613   2HB   LYS  85          1HB       LYS  85  11.284 -16.631  -4.782
  614   1HG   LYS  85          2HG       LYS  85  12.836 -15.250  -6.020
  615   2HG   LYS  85          1HG       LYS  85  13.260 -14.335  -4.574
  616   1HD   LYS  85          2HD       LYS  85  13.632 -17.318  -4.514
  617   2HD   LYS  85          1HD       LYS  85  14.781 -16.369  -5.449
  618   1HE   LYS  85          2HE       LYS  85  14.146 -15.457  -2.661
  619   2HE   LYS  85          1HE       LYS  85  15.209 -16.848  -2.871
  620   1HZ   LYS  85          1HZ       LYS  85  15.670 -14.069  -3.486
  621   2HZ   LYS  85          2HZ       LYS  85  16.184 -15.154  -4.688
  622   3HZ   LYS  85          3HZ       LYS  85  16.776 -15.298  -3.101
  623    H    GLU  86           H        GLU  86   9.618 -15.075  -6.693
  624    HA   GLU  86           HA       GLU  86  11.248 -13.375  -8.321
  625   1HB   GLU  86          2HB       GLU  86  10.120 -15.151  -9.410
  626   2HB   GLU  86          1HB       GLU  86   8.576 -14.751  -8.667
  627   1HG   GLU  86          2HG       GLU  86   8.690 -14.147 -11.059
  628   2HG   GLU  86          1HG       GLU  86   8.396 -12.749 -10.040
  629    H    ALA  87           H        ALA  87   7.908 -13.003  -7.107
  630    HA   ALA  87           HA       ALA  87   7.524 -10.340  -8.066
  631   1HB   ALA  87          1HB       ALA  87   5.454 -10.955  -7.309
  632   2HB   ALA  87          2HB       ALA  87   6.008 -10.535  -5.689
  633   3HB   ALA  87          3HB       ALA  87   6.148 -12.195  -6.263
  634    H    GLN  88           H        GLN  88   9.068 -11.577  -5.128
  635    HA   GLN  88           HA       GLN  88   9.196  -9.114  -3.720
  636   1HB   GLN  88          2HB       GLN  88  10.280 -10.417  -2.199
  637   2HB   GLN  88          1HB       GLN  88  10.139 -11.733  -3.352
  638   1HG   GLN  88          2HG       GLN  88  12.436 -11.576  -2.719
  639   2HG   GLN  88          1HG       GLN  88  12.333 -10.972  -4.361
  640   1HE2  GLN  88          1HE2      GLN  88  10.922  -8.652  -2.378
  641   2HE2  GLN  88          2HE2      GLN  88  12.271  -7.648  -2.145
  642    H    ALA  89           H        ALA  89  11.184 -10.458  -6.307
  643    HA   ALA  89           HA       ALA  89  13.274  -8.542  -6.280
  644   1HB   ALA  89          1HB       ALA  89  12.047  -9.920  -8.680
  645   2HB   ALA  89          2HB       ALA  89  13.297 -10.607  -7.644
  646   3HB   ALA  89          3HB       ALA  89  13.643  -9.174  -8.614
  647    H    ALA  90           H        ALA  90  10.111  -8.512  -7.905
  648    HA   ALA  90           HA       ALA  90  10.397  -6.074  -9.314
  649   1HB   ALA  90          1HB       ALA  90   8.503  -7.605  -9.655
  650   2HB   ALA  90          2HB       ALA  90   7.930  -5.982  -9.268
  651   3HB   ALA  90          3HB       ALA  90   7.914  -7.242  -8.034
  652    H    ALA  91           H        ALA  91   9.421  -6.679  -5.935
  653    HA   ALA  91           HA       ALA  91   8.672  -3.973  -5.376
  654   1HB   ALA  91          1HB       ALA  91   8.592  -4.611  -3.115
  655   2HB   ALA  91          2HB       ALA  91   9.885  -5.796  -3.301
  656   3HB   ALA  91          3HB       ALA  91   8.284  -6.126  -3.965
  657    H    GLU  92           H        GLU  92  11.788  -5.643  -5.382
  658    HA   GLU  92           HA       GLU  92  13.308  -3.658  -4.012
  659   1HB   GLU  92          2HB       GLU  92  14.253  -5.425  -6.282
  660   2HB   GLU  92          1HB       GLU  92  15.260  -4.654  -5.054
  661   1HG   GLU  92          2HG       GLU  92  13.832  -5.920  -3.330
  662   2HG   GLU  92          1HG       GLU  92  13.256  -6.872  -4.692
  663    H    GLN  93           H        GLN  93  12.874  -4.105  -7.555
  664    HA   GLN  93           HA       GLN  93  14.257  -1.701  -8.254
  665   1HB   GLN  93          2HB       GLN  93  12.878  -1.808 -10.387
  666   2HB   GLN  93          1HB       GLN  93  13.823  -3.251 -10.023
  667   1HG   GLN  93          2HG       GLN  93  11.791  -4.244  -8.967
  668   2HG   GLN  93          1HG       GLN  93  10.866  -2.841  -9.504
  669   1HE2  GLN  93          1HE2      GLN  93   9.566  -3.937 -11.087
  670   2HE2  GLN  93          2HE2      GLN  93  10.225  -4.668 -12.472
  671    H    LEU  94           H        LEU  94  10.861  -2.296  -7.371
  672    HA   LEU  94           HA       LEU  94  10.034   0.429  -7.932
  673   1HB   LEU  94          2HB       LEU  94   8.846  -1.672  -6.094
  674   2HB   LEU  94          1HB       LEU  94   8.099  -0.108  -6.421
  675    HG   LEU  94           HG       LEU  94   8.854  -1.985  -8.667
  676   1HD1  LEU  94          1HD1      LEU  94   7.421  -3.359  -7.369
  677   2HD1  LEU  94          2HD1      LEU  94   6.369  -2.642  -8.586
  678   3HD1  LEU  94          3HD1      LEU  94   6.376  -2.004  -6.940
  679   1HD2  LEU  94          1HD2      LEU  94   8.313   0.193  -9.467
  680   2HD2  LEU  94          2HD2      LEU  94   6.965   0.365  -8.341
  681   3HD2  LEU  94          3HD2      LEU  94   6.847  -0.748  -9.701
  682    H    LYS  95           H        LYS  95  11.958  -1.058  -5.546
  683    HA   LYS  95           HA       LYS  95  11.355   0.835  -3.413
  684   1HB   LYS  95          2HB       LYS  95  12.517  -1.556  -3.337
  685   2HB   LYS  95          1HB       LYS  95  13.987  -0.625  -3.598
  686   1HG   LYS  95          2HG       LYS  95  11.995  -0.092  -1.370
  687   2HG   LYS  95          1HG       LYS  95  13.484  -1.013  -1.181
  688   1HD   LYS  95          2HD       LYS  95  14.727   1.028  -2.061
  689   2HD   LYS  95          1HD       LYS  95  13.211   1.916  -1.896
  690   1HE   LYS  95          2HE       LYS  95  14.559   2.230   0.124
  691   2HE   LYS  95          1HE       LYS  95  13.130   1.272   0.510
  692   1HZ   LYS  95          1HZ       LYS  95  15.715   0.020  -0.199
  693   2HZ   LYS  95          2HZ       LYS  95  14.373  -0.689   0.565
  694   3HZ   LYS  95          3HZ       LYS  95  15.328   0.445   1.398
  695    H    THR  96           H        THR  96  14.159   0.408  -5.602
  696    HA   THR  96           HA       THR  96  15.282   2.977  -4.939
  697    HB   THR  96           HB       THR  96  16.033   1.600  -7.491
  698    HG1  THR  96           1HG      THR  96  16.035   0.440  -4.945
  699   1HG2  THR  96          1HG2      THR  96  17.234   3.563  -6.289
  700   2HG2  THR  96          2HG2      THR  96  18.218   2.217  -6.862
  701   3HG2  THR  96          3HG2      THR  96  17.790   2.330  -5.156
  702    H    THR  97           H        THR  97  12.525   2.357  -6.692
  703    HA   THR  97           HA       THR  97  12.827   4.919  -8.174
  704    HB   THR  97           HB       THR  97  12.213   2.202  -9.317
  705    HG1  THR  97           1HG      THR  97  14.160   2.793  -9.911
  706   1HG2  THR  97          1HG2      THR  97  11.161   4.848 -10.330
  707   2HG2  THR  97          2HG2      THR  97  10.247   3.383  -9.974
  708   3HG2  THR  97          3HG2      THR  97  11.332   3.429 -11.361
  709    H    GLY  98           H        GLY  98  10.680   2.323  -7.058
  710   1HA   GLY  98          2HA       GLY  98   8.292   4.008  -7.280
  711   2HA   GLY  98          1HA       GLY  98   8.355   2.382  -6.610
  712    H    ARG  99           H        ARG  99   9.806   5.562  -5.796
  713    HA   ARG  99           HA       ARG  99   9.705   4.906  -2.948
  714   1HB   ARG  99          2HB       ARG  99  11.545   6.253  -3.981
  715   2HB   ARG  99          1HB       ARG  99  10.381   7.539  -4.295
  716   1HG   ARG  99          2HG       ARG  99  10.090   8.013  -2.013
  717   2HG   ARG  99          1HG       ARG  99  10.705   6.441  -1.504
  718   1HD   ARG  99          2HD       ARG  99  12.390   8.582  -2.830
  719   2HD   ARG  99          1HD       ARG  99  12.317   8.305  -1.089
  720    HE   ARG  99           HE       ARG  99  12.961   5.817  -2.159
  721   1HH1  ARG  99          1HH2      ARG  99  14.221   9.024  -2.178
  722   2HH1  ARG  99          2HH2      ARG  99  15.848   8.526  -2.502
  723   1HH2  ARG  99          1HH1      ARG  99  15.079   5.150  -2.598
  724   2HH2  ARG  99          2HH1      ARG  99  16.330   6.338  -2.751
  725    H    ALA 100           H        ALA 100   7.364   5.954  -5.084
  726    HA   ALA 100           HA       ALA 100   5.222   6.843  -4.701
  727   1HB   ALA 100          1HB       ALA 100   5.667   6.974  -1.740
  728   2HB   ALA 100          2HB       ALA 100   5.730   5.384  -2.497
  729   3HB   ALA 100          3HB       ALA 100   4.275   6.365  -2.644
  730    H    GLY 101           H        GLY 101   8.073   8.337  -4.060
  731   1HA   GLY 101          2HA       GLY 101   8.649  10.607  -4.057
  732   2HA   GLY 101          1HA       GLY 101   6.945  10.978  -4.305
  733    H    ASN 102           H        ASN 102   8.458   9.204  -1.611
  734    HA   ASN 102           HA       ASN 102   6.983  10.860   0.308
  735   1HB   ASN 102          2HB       ASN 102   7.547   8.318   0.470
  736   2HB   ASN 102          1HB       ASN 102   9.129   8.862   1.029
  737   1HD2  ASN 102          1HD2      ASN 102   8.155  11.224   2.475
  738   2HD2  ASN 102          2HD2      ASN 102   7.300  10.663   3.830
  739    H    GLN 103           H        GLN 103   9.251  11.939  -1.437
  740    HA   GLN 103           HA       GLN 103  10.934  13.087   0.766
  741   1HB   GLN 103          2HB       GLN 103  12.117  11.580  -0.917
  742   2HB   GLN 103          1HB       GLN 103  11.717  12.789  -2.143
  743   1HG   GLN 103          2HG       GLN 103  12.871  14.518  -0.758
  744   2HG   GLN 103          1HG       GLN 103  13.376  13.249   0.358
  745   1HE2  GLN 103          1HE2      GLN 103  13.562  14.091  -3.148
  746   2HE2  GLN 103          2HE2      GLN 103  15.089  13.388  -3.388
  747    H    LYS 104           H        LYS 104   8.941  13.623  -2.022
  748    HA   LYS 104           HA       LYS 104   9.646  16.471  -2.197
  749   1HB   LYS 104          2HB       LYS 104   9.176  15.461  -4.306
  750   2HB   LYS 104          1HB       LYS 104   7.720  14.675  -3.698
  751   1HG   LYS 104          2HG       LYS 104   6.514  16.744  -3.598
  752   2HG   LYS 104          1HG       LYS 104   7.993  17.691  -3.786
  753   1HD   LYS 104          2HD       LYS 104   8.251  16.637  -6.079
  754   2HD   LYS 104          1HD       LYS 104   6.628  15.972  -5.869
  755   1HE   LYS 104          2HE       LYS 104   6.519  18.093  -7.099
  756   2HE   LYS 104          1HE       LYS 104   5.754  18.272  -5.521
  757   1HZ   LYS 104          1HZ       LYS 104   8.556  18.816  -5.446
  758   2HZ   LYS 104          2HZ       LYS 104   7.251  19.764  -4.908
  759   3HZ   LYS 104          3HZ       LYS 104   7.741  19.832  -6.534
  760    H    GLY 105           H        GLY 105   6.409  15.034  -2.201
  761   1HA   GLY 105          2HA       GLY 105   5.457  17.199  -0.431
  762   2HA   GLY 105          1HA       GLY 105   4.451  16.052  -1.316
  763    H    GLY 106           H        GLY 106   7.167  15.443   0.896
  764   1HA   GLY 106          2HA       GLY 106   5.432  13.594   2.450
  765   2HA   GLY 106          1HA       GLY 106   7.199  13.642   2.500
  Start of MODEL    7
    1   1H    ALA   1          1HT       ALA   1   8.912 -40.547  -3.795
    2   2H    ALA   1          2HT       ALA   1   8.706 -40.751  -2.119
    3   3H    ALA   1          3HT       ALA   1   8.939 -39.199  -2.767
    4    HA   ALA   1           HA       ALA   1   6.737 -40.376  -4.052
    5   1HB   ALA   1          1HB       ALA   1   5.256 -40.575  -2.051
    6   2HB   ALA   1          2HB       ALA   1   6.676 -40.398  -1.018
    7   3HB   ALA   1          3HB       ALA   1   6.526 -41.799  -2.078
    8    H    ASP   2           H        ASP   2   5.028 -38.760  -4.100
    9    HA   ASP   2           HA       ASP   2   6.042 -36.059  -3.818
   10   1HB   ASP   2          2HB       ASP   2   3.161 -36.843  -4.292
   11   2HB   ASP   2          1HB       ASP   2   3.978 -35.361  -4.793
   12    H    LEU   3           H        LEU   3   6.357 -35.435  -1.678
   13    HA   LEU   3           HA       LEU   3   4.291 -36.023   0.343
   14   1HB   LEU   3          2HB       LEU   3   6.740 -34.281   0.706
   15   2HB   LEU   3          1HB       LEU   3   5.832 -35.151   1.943
   16    HG   LEU   3           HG       LEU   3   7.609 -36.326  -0.209
   17   1HD1  LEU   3          1HD1      LEU   3   8.815 -37.241   1.721
   18   2HD1  LEU   3          2HD1      LEU   3   7.630 -36.535   2.820
   19   3HD1  LEU   3          3HD1      LEU   3   8.686 -35.489   1.870
   20   1HD2  LEU   3          1HD2      LEU   3   5.780 -37.831  -0.165
   21   2HD2  LEU   3          2HD2      LEU   3   5.530 -37.617   1.568
   22   3HD2  LEU   3          3HD2      LEU   3   6.920 -38.529   0.985
   23    H    GLU   4           H        GLU   4   3.840 -34.150  -2.017
   24    HA   GLU   4           HA       GLU   4   3.629 -31.499  -0.797
   25   1HB   GLU   4          2HB       GLU   4   2.419 -32.519  -3.384
   26   2HB   GLU   4          1HB       GLU   4   2.627 -30.833  -2.917
   27   1HG   GLU   4          2HG       GLU   4   4.882 -32.826  -3.308
   28   2HG   GLU   4          1HG       GLU   4   4.421 -31.575  -4.462
   29    H    ASP   5           H        ASP   5   1.990 -34.165  -0.077
   30    HA   ASP   5           HA       ASP   5  -0.757 -33.155  -0.296
   31   1HB   ASP   5          2HB       ASP   5  -1.333 -35.198   1.005
   32   2HB   ASP   5          1HB       ASP   5  -0.357 -35.572  -0.416
   33    H    ASN   6           H        ASN   6   1.407 -31.694   1.262
   34    HA   ASN   6           HA       ASN   6   0.362 -31.833   4.037
   35   1HB   ASN   6          2HB       ASN   6   2.524 -29.962   3.068
   36   2HB   ASN   6          1HB       ASN   6   2.283 -30.630   4.683
   37   1HD2  ASN   6          1HD2      ASN   6   4.655 -30.808   2.751
   38   2HD2  ASN   6          2HD2      ASN   6   4.971 -32.471   2.630
   39    H    ASP   7           H        ASP   7  -0.801 -30.156   4.992
   40    HA   ASP   7           HA       ASP   7  -1.776 -28.000   3.185
   41   1HB   ASP   7          2HB       ASP   7  -2.701 -28.921   5.929
   42   2HB   ASP   7          1HB       ASP   7  -3.406 -27.566   5.048
   43    H    GLU   8           H        GLU   8   0.461 -27.017   3.368
   44    HA   GLU   8           HA       GLU   8   1.937 -25.434   4.250
   45   1HB   GLU   8          2HB       GLU   8  -0.548 -24.662   5.803
   46   2HB   GLU   8          1HB       GLU   8   0.925 -23.701   5.715
   47   1HG   GLU   8          2HG       GLU   8   0.660 -23.269   3.407
   48   2HG   GLU   8          1HG       GLU   8  -0.513 -24.572   3.211
   49    H    THR   9           H        THR   9   0.766 -27.950   6.025
   50    HA   THR   9           HA       THR   9   1.214 -28.836   8.136
   51    HB   THR   9           HB       THR   9   3.271 -29.330   6.903
   52    HG1  THR   9           1HG      THR   9   3.090 -28.931   9.576
   53   1HG2  THR   9          1HG2      THR   9   4.083 -27.159   6.266
   54   2HG2  THR   9          2HG2      THR   9   5.285 -27.860   7.345
   55   3HG2  THR   9          3HG2      THR   9   4.176 -26.634   7.947
   56    H    GLY  10           H        GLY  10   0.278 -26.076   8.203
   57   1HA   GLY  10          2HA       GLY  10   1.136 -25.476  10.963
   58   2HA   GLY  10          1HA       GLY  10   1.421 -24.201   9.773
   59    H    ASN  11           H        ASN  11  -1.296 -26.462   9.790
   60    HA   ASN  11           HA       ASN  11  -3.157 -24.183   9.694
   61   1HB   ASN  11          2HB       ASN  11  -4.858 -25.839   9.207
   62   2HB   ASN  11          1HB       ASN  11  -3.432 -26.225   8.243
   63   1HD2  ASN  11          1HD2      ASN  11  -5.533 -28.121   9.140
   64   2HD2  ASN  11          2HD2      ASN  11  -4.740 -29.287  10.084
   65    H    ASP  12           H        ASP  12  -1.673 -25.995  12.075
   66    HA   ASP  12           HA       ASP  12  -3.942 -25.797  13.988
   67   1HB   ASP  12          2HB       ASP  12  -1.238 -27.150  14.091
   68   2HB   ASP  12          1HB       ASP  12  -2.261 -26.982  15.517
   69    H    ASN  13           H        ASN  13  -1.116 -24.174  12.982
   70    HA   ASN  13           HA       ASN  13  -0.652 -22.796  15.536
   71   1HB   ASN  13          2HB       ASN  13   0.500 -22.422  12.758
   72   2HB   ASN  13          1HB       ASN  13   0.982 -21.463  14.158
   73   1HD2  ASN  13          1HD2      ASN  13   2.659 -22.306  15.395
   74   2HD2  ASN  13          2HD2      ASN  13   3.191 -23.915  15.339
   75    H    GLY  14           H        GLY  14  -1.484 -21.740  12.232
   76   1HA   GLY  14          2HA       GLY  14  -2.786 -19.928  11.506
   77   2HA   GLY  14          1HA       GLY  14  -3.743 -20.190  12.968
   78    H    LYS  15           H        LYS  15  -0.418 -19.686  13.538
   79    HA   LYS  15           HA       LYS  15  -0.659 -16.760  13.831
   80   1HB   LYS  15          2HB       LYS  15  -0.179 -16.788  16.214
   81   2HB   LYS  15          1HB       LYS  15  -1.630 -17.739  15.908
   82   1HG   LYS  15          2HG       LYS  15   0.278 -19.694  15.675
   83   2HG   LYS  15          1HG       LYS  15   1.060 -18.634  16.847
   84   1HD   LYS  15          2HD       LYS  15  -1.753 -19.729  17.117
   85   2HD   LYS  15          1HD       LYS  15  -0.334 -20.394  17.918
   86   1HE   LYS  15          2HE       LYS  15  -1.301 -17.538  18.246
   87   2HE   LYS  15          1HE       LYS  15  -1.633 -18.839  19.386
   88   1HZ   LYS  15          1HZ       LYS  15   0.322 -17.429  19.944
   89   2HZ   LYS  15          2HZ       LYS  15   1.099 -18.038  18.562
   90   3HZ   LYS  15          3HZ       LYS  15   0.668 -19.085  19.830
   91    H    GLY  16           H        GLY  16   1.023 -17.988  12.068
   92   1HA   GLY  16          2HA       GLY  16   3.670 -18.331  13.374
   93   2HA   GLY  16          1HA       GLY  16   3.309 -18.645  11.677
   94    H    GLY  17           H        GLY  17   2.102 -16.248  10.928
   95   1HA   GLY  17          2HA       GLY  17   2.521 -13.955  10.513
   96   2HA   GLY  17          1HA       GLY  17   3.779 -13.995  11.751
   97    H    GLU  18           H        GLU  18   4.568 -16.574  10.033
   98    HA   GLU  18           HA       GLU  18   5.839 -15.226   7.730
   99   1HB   GLU  18          2HB       GLU  18   7.360 -15.055   9.814
  100   2HB   GLU  18          1HB       GLU  18   7.558 -16.801   9.657
  101   1HG   GLU  18          2HG       GLU  18   8.169 -16.298   7.182
  102   2HG   GLU  18          1HG       GLU  18   8.384 -14.633   7.725
  103    H    LYS  19           H        LYS  19   3.871 -16.946   7.398
  104    HA   LYS  19           HA       LYS  19   4.693 -19.735   7.380
  105   1HB   LYS  19          2HB       LYS  19   2.579 -20.091   6.189
  106   2HB   LYS  19          1HB       LYS  19   2.328 -19.022   7.569
  107   1HG   LYS  19          2HG       LYS  19   2.621 -17.069   5.970
  108   2HG   LYS  19          1HG       LYS  19   2.562 -18.239   4.645
  109   1HD   LYS  19          2HD       LYS  19   0.329 -18.910   5.227
  110   2HD   LYS  19          1HD       LYS  19   0.392 -18.034   6.755
  111   1HE   LYS  19          2HE       LYS  19   0.280 -15.927   5.689
  112   2HE   LYS  19          1HE       LYS  19   0.711 -16.598   4.118
  113   1HZ   LYS  19          1HZ       LYS  19  -1.825 -16.989   5.608
  114   2HZ   LYS  19          2HZ       LYS  19  -1.409 -17.869   4.216
  115   3HZ   LYS  19          3HZ       LYS  19  -1.616 -16.184   4.128
  116    H    ALA  20           H        ALA  20   5.085 -17.074   5.216
  117    HA   ALA  20           HA       ALA  20   5.902 -16.972   2.997
  118   1HB   ALA  20          1HB       ALA  20   7.189 -19.653   3.494
  119   2HB   ALA  20          2HB       ALA  20   7.747 -18.229   4.367
  120   3HB   ALA  20          3HB       ALA  20   7.817 -18.265   2.606
  121    H    ASP  21           H        ASP  21   3.376 -17.628   2.748
  122    HA   ASP  21           HA       ASP  21   2.847 -20.304   1.799
  123   1HB   ASP  21          2HB       ASP  21   1.118 -18.562   2.624
  124   2HB   ASP  21          1HB       ASP  21   1.230 -17.879   1.005
  125    H    ASN  22           H        ASN  22   4.697 -17.926   0.600
  126    HA   ASN  22           HA       ASN  22   5.881 -17.851  -1.410
  127   1HB   ASN  22          2HB       ASN  22   5.138 -20.376  -1.499
  128   2HB   ASN  22          1HB       ASN  22   4.026 -19.811  -2.742
  129   1HD2  ASN  22          1HD2      ASN  22   5.319 -18.164  -4.354
  130   2HD2  ASN  22          2HD2      ASN  22   6.785 -18.799  -4.919
  131    H    ALA  23           H        ALA  23   2.754 -16.954  -0.965
  132    HA   ALA  23           HA       ALA  23   2.855 -14.985  -3.061
  133   1HB   ALA  23          1HB       ALA  23   0.911 -15.814  -4.396
  134   2HB   ALA  23          2HB       ALA  23   0.944 -17.314  -3.468
  135   3HB   ALA  23          3HB       ALA  23   2.303 -16.890  -4.508
  136    H    ALA  24           H        ALA  24   0.795 -16.792  -0.789
  137    HA   ALA  24           HA       ALA  24  -1.318 -14.882  -0.654
  138   1HB   ALA  24          1HB       ALA  24  -0.387 -16.410   1.779
  139   2HB   ALA  24          2HB       ALA  24  -1.131 -17.259   0.424
  140   3HB   ALA  24          3HB       ALA  24  -2.031 -16.012   1.283
  141    H    GLN  25           H        GLN  25   1.513 -15.273   1.482
  142    HA   GLN  25           HA       GLN  25   1.064 -12.905   2.974
  143   1HB   GLN  25          2HB       GLN  25   3.447 -13.077   3.639
  144   2HB   GLN  25          1HB       GLN  25   2.558 -14.576   3.820
  145   1HG   GLN  25          2HG       GLN  25   4.878 -13.974   2.061
  146   2HG   GLN  25          1HG       GLN  25   4.402 -15.449   2.841
  147   1HE2  GLN  25          1HE2      GLN  25   3.041 -16.913   1.711
  148   2HE2  GLN  25          2HE2      GLN  25   2.672 -16.726   0.073
  149    H    VAL  26           H        VAL  26   2.570 -13.316  -0.179
  150    HA   VAL  26           HA       VAL  26   3.635 -10.605  -0.185
  151    HB   VAL  26           HB       VAL  26   3.364 -12.759  -2.276
  152   1HG1  VAL  26          1HG1      VAL  26   2.880 -10.811  -3.571
  153   2HG1  VAL  26          2HG1      VAL  26   4.599 -11.114  -3.802
  154   3HG1  VAL  26          3HG1      VAL  26   4.067  -9.845  -2.698
  155   1HG2  VAL  26          1HG2      VAL  26   5.662 -11.275  -0.962
  156   2HG2  VAL  26          2HG2      VAL  26   5.872 -12.297  -2.375
  157   3HG2  VAL  26          3HG2      VAL  26   5.287 -12.997  -0.866
  158    H    LYS  27           H        LYS  27   0.790 -12.192  -1.668
  159    HA   LYS  27           HA       LYS  27  -0.176  -9.856  -2.991
  160   1HB   LYS  27          2HB       LYS  27  -1.572 -12.319  -1.928
  161   2HB   LYS  27          1HB       LYS  27  -2.449 -11.040  -2.768
  162   1HG   LYS  27          2HG       LYS  27  -1.372 -11.441  -4.806
  163   2HG   LYS  27          1HG       LYS  27   0.020 -12.208  -4.041
  164   1HD   LYS  27          2HD       LYS  27  -1.437 -13.854  -5.202
  165   2HD   LYS  27          1HD       LYS  27  -1.326 -14.166  -3.472
  166   1HE   LYS  27          2HE       LYS  27  -3.671 -14.307  -4.388
  167   2HE   LYS  27          1HE       LYS  27  -3.483 -13.148  -3.074
  168   1HZ   LYS  27          1HZ       LYS  27  -4.480 -12.651  -5.588
  169   2HZ   LYS  27          2HZ       LYS  27  -2.934 -11.945  -5.589
  170   3HZ   LYS  27          3HZ       LYS  27  -4.075 -11.500  -4.410
  171    H    ASP  28           H        ASP  28  -0.937 -11.154   0.252
  172    HA   ASP  28           HA       ASP  28  -2.787  -9.138   1.005
  173   1HB   ASP  28          2HB       ASP  28  -0.749 -10.429   2.837
  174   2HB   ASP  28          1HB       ASP  28  -2.330  -9.784   3.281
  175    H    ALA  29           H        ALA  29   0.711  -9.173   0.832
  176    HA   ALA  29           HA       ALA  29   1.179  -6.753   2.290
  177   1HB   ALA  29          1HB       ALA  29   2.826  -8.650   1.479
  178   2HB   ALA  29          2HB       ALA  29   3.404  -6.985   1.605
  179   3HB   ALA  29          3HB       ALA  29   2.953  -7.645   0.032
  180    H    LEU  30           H        LEU  30   0.948  -7.402  -1.225
  181    HA   LEU  30           HA       LEU  30   1.164  -4.685  -1.978
  182   1HB   LEU  30          2HB       LEU  30  -0.516  -6.699  -3.454
  183   2HB   LEU  30          1HB       LEU  30   0.333  -5.310  -4.117
  184    HG   LEU  30           HG       LEU  30   1.755  -7.628  -2.791
  185   1HD1  LEU  30          1HD1      LEU  30   1.121  -7.123  -5.710
  186   2HD1  LEU  30          2HD1      LEU  30   0.598  -8.497  -4.737
  187   3HD1  LEU  30          3HD1      LEU  30   2.301  -8.306  -5.148
  188   1HD2  LEU  30          1HD2      LEU  30   3.106  -5.629  -2.857
  189   2HD2  LEU  30          2HD2      LEU  30   2.638  -5.307  -4.526
  190   3HD2  LEU  30          3HD2      LEU  30   3.674  -6.684  -4.150
  191    H    THR  31           H        THR  31  -1.786  -6.651  -1.481
  192    HA   THR  31           HA       THR  31  -3.637  -4.530  -1.904
  193    HB   THR  31           HB       THR  31  -5.103  -5.982  -0.293
  194    HG1  THR  31           1HG      THR  31  -2.726  -7.042   0.063
  195   1HG2  THR  31          1HG2      THR  31  -3.942  -6.861  -2.934
  196   2HG2  THR  31          2HG2      THR  31  -5.541  -6.196  -2.601
  197   3HG2  THR  31          3HG2      THR  31  -5.150  -7.840  -2.101
  198    H    LYS  32           H        LYS  32  -1.772  -5.443   0.952
  199    HA   LYS  32           HA       LYS  32  -3.169  -3.808   2.833
  200   1HB   LYS  32          2HB       LYS  32  -1.527  -5.442   3.592
  201   2HB   LYS  32          1HB       LYS  32  -0.242  -4.617   2.719
  202   1HG   LYS  32          2HG       LYS  32  -1.701  -2.834   4.586
  203   2HG   LYS  32          1HG       LYS  32  -0.905  -4.178   5.394
  204   1HD   LYS  32          2HD       LYS  32   1.231  -3.577   4.395
  205   2HD   LYS  32          1HD       LYS  32   0.470  -2.303   3.446
  206   1HE   LYS  32          2HE       LYS  32   0.606  -2.430   6.471
  207   2HE   LYS  32          1HE       LYS  32   1.540  -1.346   5.438
  208   1HZ   LYS  32          1HZ       LYS  32  -1.390  -1.379   5.870
  209   2HZ   LYS  32          2HZ       LYS  32  -0.667  -0.540   4.582
  210   3HZ   LYS  32          3HZ       LYS  32  -0.302  -0.118   6.189
  211    H    MET  33           H        MET  33  -0.256  -3.131   0.861
  212    HA   MET  33           HA       MET  33  -0.054  -0.362   1.549
  213   1HB   MET  33          2HB       MET  33   0.707  -1.686  -1.070
  214   2HB   MET  33          1HB       MET  33   1.314  -0.142  -0.471
  215   1HG   MET  33          2HG       MET  33   2.124  -1.456   1.586
  216   2HG   MET  33          1HG       MET  33   1.833  -2.905   0.628
  217   1HE   MET  33          1HE       MET  33   4.313  -3.905  -0.108
  218   2HE   MET  33          2HE       MET  33   4.179  -3.155   1.479
  219   3HE   MET  33          3HE       MET  33   5.578  -2.808   0.467
  220    H    ARG  34           H        ARG  34  -1.974  -2.063  -0.890
  221    HA   ARG  34           HA       ARG  34  -2.768   0.151  -2.471
  222   1HB   ARG  34          2HB       ARG  34  -3.309  -2.167  -3.095
  223   2HB   ARG  34          1HB       ARG  34  -4.375  -2.307  -1.700
  224   1HG   ARG  34          2HG       ARG  34  -5.891  -0.688  -2.562
  225   2HG   ARG  34          1HG       ARG  34  -4.758  -0.195  -3.823
  226   1HD   ARG  34          2HD       ARG  34  -4.940  -2.420  -4.870
  227   2HD   ARG  34          1HD       ARG  34  -6.054  -2.931  -3.603
  228    HE   ARG  34           HE       ARG  34  -7.144  -0.592  -4.751
  229   1HH1  ARG  34          1HH2      ARG  34  -6.242  -3.799  -5.652
  230   2HH1  ARG  34          2HH2      ARG  34  -7.491  -3.962  -6.841
  231   1HH2  ARG  34          1HH1      ARG  34  -8.793  -0.793  -6.306
  232   2HH2  ARG  34          2HH1      ARG  34  -8.933  -2.263  -7.208
  233    H    ALA  35           H        ALA  35  -4.695  -1.290   0.188
  234    HA   ALA  35           HA       ALA  35  -6.529   0.891   0.277
  235   1HB   ALA  35          1HB       ALA  35  -5.770  -0.938   2.562
  236   2HB   ALA  35          2HB       ALA  35  -6.936  -1.343   1.303
  237   3HB   ALA  35          3HB       ALA  35  -7.257  -0.004   2.408
  238    H    ALA  36           H        ALA  36  -3.328   0.523   1.635
  239    HA   ALA  36           HA       ALA  36  -3.518   2.528   3.673
  240   1HB   ALA  36          1HB       ALA  36  -1.109   1.701   2.030
  241   2HB   ALA  36          2HB       ALA  36  -1.613   0.982   3.558
  242   3HB   ALA  36          3HB       ALA  36  -1.055   2.655   3.512
  243    H    ALA  37           H        ALA  37  -2.229   2.788   0.326
  244    HA   ALA  37           HA       ALA  37  -1.886   5.614   0.395
  245   1HB   ALA  37          1HB       ALA  37  -2.525   3.807  -1.957
  246   2HB   ALA  37          2HB       ALA  37  -0.911   4.230  -1.385
  247   3HB   ALA  37          3HB       ALA  37  -1.949   5.470  -2.088
  248    H    LEU  38           H        LEU  38  -4.668   3.612  -0.609
  249    HA   LEU  38           HA       LEU  38  -6.305   5.824  -1.417
  250   1HB   LEU  38          2HB       LEU  38  -7.029   3.064  -0.405
  251   2HB   LEU  38          1HB       LEU  38  -8.213   4.204  -1.031
  252    HG   LEU  38           HG       LEU  38  -5.775   3.382  -2.632
  253   1HD1  LEU  38          1HD1      LEU  38  -7.159   1.710  -3.749
  254   2HD1  LEU  38          2HD1      LEU  38  -8.533   2.128  -2.725
  255   3HD1  LEU  38          3HD1      LEU  38  -7.105   1.369  -2.019
  256   1HD2  LEU  38          1HD2      LEU  38  -8.429   4.703  -3.270
  257   2HD2  LEU  38          2HD2      LEU  38  -7.423   3.981  -4.522
  258   3HD2  LEU  38          3HD2      LEU  38  -6.806   5.322  -3.568
  259    H    ASP  39           H        ASP  39  -6.407   3.937   1.629
  260    HA   ASP  39           HA       ASP  39  -8.244   5.657   2.944
  261   1HB   ASP  39          2HB       ASP  39  -7.352   3.374   3.721
  262   2HB   ASP  39          1HB       ASP  39  -5.959   4.259   4.348
  263    H    ALA  40           H        ALA  40  -4.720   5.873   2.649
  264    HA   ALA  40           HA       ALA  40  -4.470   8.096   4.470
  265   1HB   ALA  40          1HB       ALA  40  -2.637   7.110   2.266
  266   2HB   ALA  40          2HB       ALA  40  -2.517   6.730   3.984
  267   3HB   ALA  40          3HB       ALA  40  -2.214   8.372   3.420
  268    H    GLN  41           H        GLN  41  -5.756   7.796   1.363
  269    HA   GLN  41           HA       GLN  41  -4.960  10.284   0.222
  270   1HB   GLN  41          2HB       GLN  41  -6.525   9.820  -1.456
  271   2HB   GLN  41          1HB       GLN  41  -6.157   8.210  -0.850
  272   1HG   GLN  41          2HG       GLN  41  -8.226   8.745   0.783
  273   2HG   GLN  41          1HG       GLN  41  -8.651   9.826  -0.513
  274   1HE2  GLN  41          1HE2      GLN  41  -9.383   6.832   0.508
  275   2HE2  GLN  41          2HE2      GLN  41  -9.665   6.066  -0.979
  276    H    LYS  42           H        LYS  42  -7.565  11.371  -0.305
  277    HA   LYS  42           HA       LYS  42  -7.883  12.907   2.171
  278   1HB   LYS  42          2HB       LYS  42  -8.929  14.566   0.943
  279   2HB   LYS  42          1HB       LYS  42  -7.902  13.840  -0.276
  280   1HG   LYS  42          2HG       LYS  42 -10.899  13.529   0.045
  281   2HG   LYS  42          1HG       LYS  42 -10.010  14.207  -1.298
  282   1HD   LYS  42          2HD       LYS  42  -8.928  11.831  -1.460
  283   2HD   LYS  42          1HD       LYS  42 -10.348  11.324  -0.540
  284   1HE   LYS  42          2HE       LYS  42 -11.033  11.062  -2.774
  285   2HE   LYS  42          1HE       LYS  42 -11.701  12.633  -2.335
  286   1HZ   LYS  42          1HZ       LYS  42 -10.430  13.627  -3.841
  287   2HZ   LYS  42          2HZ       LYS  42  -9.998  12.091  -4.424
  288   3HZ   LYS  42          3HZ       LYS  42  -9.025  12.870  -3.270
  289    H    ALA  43           H        ALA  43  -8.552  10.271   2.539
  290    HA   ALA  43           HA       ALA  43 -11.551  10.225   2.686
  291   1HB   ALA  43          1HB       ALA  43 -11.123   7.758   3.265
  292   2HB   ALA  43          2HB       ALA  43  -9.458   8.046   2.763
  293   3HB   ALA  43          3HB       ALA  43 -10.773   8.248   1.608
  294    H    THR  44           H        THR  44  -8.671   9.387   4.556
  295    HA   THR  44           HA       THR  44  -9.973  10.390   7.029
  296    HB   THR  44           HB       THR  44  -8.433   7.775   6.830
  297    HG1  THR  44           1HG      THR  44 -10.984   8.323   6.328
  298   1HG2  THR  44          1HG2      THR  44  -9.638   9.346   9.100
  299   2HG2  THR  44          2HG2      THR  44  -8.078   8.527   9.015
  300   3HG2  THR  44          3HG2      THR  44  -9.557   7.588   9.197
  301    HA   PRO  45           HA       PRO  45  -5.767  12.048   5.394
  302   1HB   PRO  45          2HB       PRO  45  -7.091  14.126   7.133
  303   2HB   PRO  45          1HB       PRO  45  -6.045  14.353   5.716
  304   1HG   PRO  45          2HG       PRO  45  -8.725  14.477   5.539
  305   2HG   PRO  45          1HG       PRO  45  -7.715  13.854   4.232
  306   1HD   PRO  45          2HD       PRO  45  -9.586  12.380   5.958
  307   2HD   PRO  45          1HD       PRO  45  -8.803  11.851   4.453
  308    HA   PRO  46           HA       PRO  46  -4.510  10.903   9.677
  309   1HB   PRO  46          2HB       PRO  46  -2.358   9.319   8.981
  310   2HB   PRO  46          1HB       PRO  46  -4.024   8.727   9.097
  311   1HG   PRO  46          2HG       PRO  46  -2.389   9.204   6.704
  312   2HG   PRO  46          1HG       PRO  46  -3.845   8.221   6.894
  313   1HD   PRO  46          2HD       PRO  46  -3.649  10.873   5.760
  314   2HD   PRO  46          1HD       PRO  46  -5.110   9.888   5.965
  315    H    LYS  47           H        LYS  47  -1.410  10.660   8.079
  316    HA   LYS  47           HA       LYS  47  -0.257  12.706   9.697
  317   1HB   LYS  47          2HB       LYS  47   1.640  12.579   7.980
  318   2HB   LYS  47          1HB       LYS  47   1.222  11.075   8.801
  319   1HG   LYS  47          2HG       LYS  47   0.049  10.237   6.918
  320   2HG   LYS  47          1HG       LYS  47  -0.015  11.824   6.151
  321   1HD   LYS  47          2HD       LYS  47   1.700  10.336   5.110
  322   2HD   LYS  47          1HD       LYS  47   2.408  11.796   5.800
  323   1HE   LYS  47          2HE       LYS  47   3.222  10.623   7.705
  324   2HE   LYS  47          1HE       LYS  47   2.235   9.205   7.349
  325   1HZ   LYS  47          1HZ       LYS  47   3.532   8.882   5.326
  326   2HZ   LYS  47          2HZ       LYS  47   4.522   8.843   6.706
  327   3HZ   LYS  47          3HZ       LYS  47   4.495  10.222   5.713
  328    H    LEU  48           H        LEU  48  -2.170  12.925   6.851
  329    HA   LEU  48           HA       LEU  48  -1.098  15.489   5.945
  330   1HB   LEU  48          2HB       LEU  48  -3.754  14.168   5.295
  331   2HB   LEU  48          1HB       LEU  48  -3.046  15.532   4.441
  332    HG   LEU  48           HG       LEU  48  -1.669  12.840   4.678
  333   1HD1  LEU  48          1HD1      LEU  48  -2.460  12.587   2.259
  334   2HD1  LEU  48          2HD1      LEU  48  -3.591  13.898   2.593
  335   3HD1  LEU  48          3HD1      LEU  48  -3.699  12.387   3.499
  336   1HD2  LEU  48          1HD2      LEU  48  -1.237  15.340   3.025
  337   2HD2  LEU  48          2HD2      LEU  48  -0.566  13.783   2.538
  338   3HD2  LEU  48          3HD2      LEU  48  -0.086  14.508   4.071
  339    H    GLU  49           H        GLU  49  -1.239  16.910   7.675
  340    HA   GLU  49           HA       GLU  49  -3.953  17.882   8.349
  341   1HB   GLU  49          2HB       GLU  49  -3.130  16.144  10.081
  342   2HB   GLU  49          1HB       GLU  49  -1.945  17.360  10.550
  343   1HG   GLU  49          2HG       GLU  49  -3.846  18.975  10.914
  344   2HG   GLU  49          1HG       GLU  49  -4.963  17.645  10.607
  345    H    ASP  50           H        ASP  50  -1.880  18.922   6.705
  346    HA   ASP  50           HA       ASP  50  -1.624  21.587   7.759
  347   1HB   ASP  50          2HB       ASP  50   0.103  20.517   9.165
  348   2HB   ASP  50          1HB       ASP  50   0.887  19.880   7.720
  349    H    LYS  51           H        LYS  51  -2.427  20.117   5.357
  350    HA   LYS  51           HA       LYS  51  -0.889  21.678   3.364
  351   1HB   LYS  51          2HB       LYS  51  -1.315  18.678   3.137
  352   2HB   LYS  51          1HB       LYS  51  -0.600  19.712   1.899
  353   1HG   LYS  51          2HG       LYS  51   1.178  20.355   3.555
  354   2HG   LYS  51          1HG       LYS  51   0.513  19.156   4.661
  355   1HD   LYS  51          2HD       LYS  51   0.833  17.433   2.836
  356   2HD   LYS  51          1HD       LYS  51   1.724  18.658   1.935
  357   1HE   LYS  51          2HE       LYS  51   3.314  17.305   3.187
  358   2HE   LYS  51          1HE       LYS  51   3.259  18.918   3.894
  359   1HZ   LYS  51          1HZ       LYS  51   3.019  17.692   5.765
  360   2HZ   LYS  51          2HZ       LYS  51   2.295  16.382   4.964
  361   3HZ   LYS  51          3HZ       LYS  51   1.385  17.768   5.325
  362    H    SER  52           H        SER  52  -3.334  19.028   3.277
  363    HA   SER  52           HA       SER  52  -5.438  19.030   2.179
  364   1HB   SER  52          2HB       SER  52  -5.332  21.003   4.127
  365   2HB   SER  52          1HB       SER  52  -5.902  21.900   2.730
  366    HG   SER  52           HG       SER  52  -7.203  20.145   4.292
  367    HA   PRO  53           HA       PRO  53  -5.333  20.809  -1.879
  368   1HB   PRO  53          2HB       PRO  53  -7.607  22.702  -1.394
  369   2HB   PRO  53          1HB       PRO  53  -7.437  21.433  -2.627
  370   1HG   PRO  53          2HG       PRO  53  -9.035  21.040  -0.574
  371   2HG   PRO  53          1HG       PRO  53  -7.969  19.731  -1.125
  372   1HD   PRO  53          2HD       PRO  53  -7.593  21.577   1.220
  373   2HD   PRO  53          1HD       PRO  53  -7.382  19.809   1.131
  374    H    ASP  54           H        ASP  54  -3.682  22.130   0.026
  375    HA   ASP  54           HA       ASP  54  -3.672  24.979  -0.888
  376   1HB   ASP  54          2HB       ASP  54  -3.760  24.356   1.621
  377   2HB   ASP  54          1HB       ASP  54  -2.086  23.822   1.427
  378    H    SER  55           H        SER  55  -1.154  22.743   0.289
  379    HA   SER  55           HA       SER  55   0.795  23.772  -1.560
  380   1HB   SER  55          2HB       SER  55   1.221  21.072  -0.348
  381   2HB   SER  55          1HB       SER  55   2.283  22.481  -0.343
  382    HG   SER  55           HG       SER  55   0.381  23.323   1.054
  383    HA   PRO  56           HA       PRO  56   0.454  21.094  -5.120
  384   1HB   PRO  56          2HB       PRO  56   2.639  19.189  -4.434
  385   2HB   PRO  56          1HB       PRO  56   2.471  20.254  -5.843
  386   1HG   PRO  56          2HG       PRO  56   4.212  20.781  -3.895
  387   2HG   PRO  56          1HG       PRO  56   3.350  22.070  -4.752
  388   1HD   PRO  56          2HD       PRO  56   2.854  20.968  -2.007
  389   2HD   PRO  56          1HD       PRO  56   2.754  22.644  -2.591
  390    H    GLU  57           H        GLU  57  -0.794  20.115  -2.516
  391    HA   GLU  57           HA       GLU  57  -0.789  17.245  -2.518
  392   1HB   GLU  57          2HB       GLU  57  -1.506  18.332  -0.528
  393   2HB   GLU  57          1HB       GLU  57  -2.675  19.323  -1.397
  394   1HG   GLU  57          2HG       GLU  57  -4.104  17.426  -1.798
  395   2HG   GLU  57          1HG       GLU  57  -2.868  16.303  -1.227
  396    H    MET  58           H        MET  58  -2.914  19.634  -4.070
  397    HA   MET  58           HA       MET  58  -4.882  17.801  -5.030
  398   1HB   MET  58          2HB       MET  58  -4.903  20.393  -4.958
  399   2HB   MET  58          1HB       MET  58  -4.073  20.307  -6.509
  400   1HG   MET  58          2HG       MET  58  -6.066  18.602  -7.071
  401   2HG   MET  58          1HG       MET  58  -6.885  19.528  -5.820
  402   1HE   MET  58          1HE       MET  58  -7.954  22.653  -7.357
  403   2HE   MET  58          2HE       MET  58  -7.104  22.209  -5.878
  404   3HE   MET  58          3HE       MET  58  -8.402  21.183  -6.480
  405    H    LYS  59           H        LYS  59  -2.089  16.819  -5.644
  406    HA   LYS  59           HA       LYS  59  -2.690  15.935  -8.316
  407   1HB   LYS  59          2HB       LYS  59  -0.557  16.911  -9.328
  408   2HB   LYS  59          1HB       LYS  59  -1.941  17.972  -9.168
  409   1HG   LYS  59          2HG       LYS  59  -0.523  19.416  -8.125
  410   2HG   LYS  59          1HG       LYS  59  -0.684  18.370  -6.729
  411   1HD   LYS  59          2HD       LYS  59   1.611  18.382  -6.930
  412   2HD   LYS  59          1HD       LYS  59   1.259  16.999  -7.944
  413   1HE   LYS  59          2HE       LYS  59   2.604  18.211  -9.405
  414   2HE   LYS  59          1HE       LYS  59   1.023  18.877  -9.835
  415   1HZ   LYS  59          1HZ       LYS  59   2.814  20.054  -7.781
  416   2HZ   LYS  59          2HZ       LYS  59   1.386  20.728  -8.409
  417   3HZ   LYS  59          3HZ       LYS  59   2.762  20.573  -9.394
  418    H    ASP  60           H        ASP  60   0.226  16.382  -6.184
  419    HA   ASP  60           HA       ASP  60   1.497  14.007  -7.082
  420   1HB   ASP  60          2HB       ASP  60   2.324  13.978  -4.536
  421   2HB   ASP  60          1HB       ASP  60   2.892  15.199  -5.663
  422    H    PHE  61           H        PHE  61  -1.280  14.502  -5.064
  423    HA   PHE  61           HA       PHE  61  -1.341  11.872  -3.881
  424   1HB   PHE  61          2HB       PHE  61  -2.731  13.278  -2.695
  425   2HB   PHE  61          1HB       PHE  61  -3.082  14.265  -4.100
  426    HD1  PHE  61           1HD      PHE  61  -5.420  14.427  -4.144
  427    HD2  PHE  61           2HD      PHE  61  -3.583  10.577  -3.625
  428    HE1  PHE  61           1HE      PHE  61  -7.629  13.359  -4.339
  429    HE2  PHE  61           2HE      PHE  61  -5.802   9.492  -3.818
  430    HZ   PHE  61           HZ       PHE  61  -7.835  10.883  -4.174
  431    H    ARG  62           H        ARG  62  -2.831  13.426  -6.698
  432    HA   ARG  62           HA       ARG  62  -4.230  11.152  -7.640
  433   1HB   ARG  62          2HB       ARG  62  -2.979  13.302  -9.376
  434   2HB   ARG  62          1HB       ARG  62  -4.367  12.299  -9.776
  435   1HG   ARG  62          2HG       ARG  62  -4.532  13.992  -7.291
  436   2HG   ARG  62          1HG       ARG  62  -4.671  14.794  -8.847
  437   1HD   ARG  62          2HD       ARG  62  -6.539  13.349  -9.472
  438   2HD   ARG  62          1HD       ARG  62  -6.359  12.430  -7.977
  439    HE   ARG  62           HE       ARG  62  -6.722  15.230  -7.405
  440   1HH1  ARG  62          1HH2      ARG  62  -8.331  12.358  -8.444
  441   2HH1  ARG  62          2HH2      ARG  62  -9.865  12.825  -7.793
  442   1HH2  ARG  62          1HH1      ARG  62  -8.725  15.851  -6.545
  443   2HH2  ARG  62          2HH1      ARG  62 -10.088  14.798  -6.718
  444    H    HIS  63           H        HIS  63  -1.085  12.441  -8.767
  445    HA   HIS  63           HA       HIS  63  -0.446  10.094 -10.299
  446   1HB   HIS  63          2HB       HIS  63   0.503  12.592 -10.334
  447   2HB   HIS  63          1HB       HIS  63   1.713  11.911  -9.253
  448    HD1  HIS  63           1HD      HIS  63   3.710  11.118 -10.509
  449    HD2  HIS  63           2HD      HIS  63   0.220  10.640 -12.740
  450    HE1  HIS  63           1HE      HIS  63   4.406  10.100 -12.723
  451    H    GLY  64           H        GLY  64   0.448  11.180  -7.039
  452   1HA   GLY  64          2HA       GLY  64   2.382   9.184  -6.480
  453   2HA   GLY  64          1HA       GLY  64   1.449  10.040  -5.257
  454    H    PHE  65           H        PHE  65  -1.113   9.146  -5.640
  455    HA   PHE  65           HA       PHE  65  -0.958   6.465  -4.594
  456   1HB   PHE  65          2HB       PHE  65  -3.084   6.874  -3.868
  457   2HB   PHE  65          1HB       PHE  65  -2.851   8.503  -4.478
  458    HD1  PHE  65           1HD      PHE  65  -4.330   9.329  -6.132
  459    HD2  PHE  65           2HD      PHE  65  -3.943   5.103  -5.573
  460    HE1  PHE  65           1HE      PHE  65  -6.170   8.960  -7.730
  461    HE2  PHE  65           2HE      PHE  65  -5.786   4.719  -7.191
  462    HZ   PHE  65           HZ       PHE  65  -6.903   6.652  -8.267
  463    H    ASP  66           H        ASP  66  -1.448   7.752  -7.805
  464    HA   ASP  66           HA       ASP  66  -2.594   5.369  -8.964
  465   1HB   ASP  66          2HB       ASP  66  -2.765   7.503 -10.127
  466   2HB   ASP  66          1HB       ASP  66  -1.009   7.634 -10.210
  467    H    ILE  67           H        ILE  67   0.754   6.589  -8.815
  468    HA   ILE  67           HA       ILE  67   1.903   4.394 -10.219
  469    HB   ILE  67           HB       ILE  67   3.074   6.223  -8.100
  470   1HG1  ILE  67          2HG1      ILE  67   3.542   6.287 -11.090
  471   2HG1  ILE  67          1HG1      ILE  67   2.144   7.098 -10.380
  472   1HG2  ILE  67          1HG2      ILE  67   5.222   5.420  -9.578
  473   2HG2  ILE  67          2HG2      ILE  67   4.261   3.947  -9.643
  474   3HG2  ILE  67          3HG2      ILE  67   4.742   4.623  -8.085
  475   1HD1  ILE  67          1HD1      ILE  67   3.516   8.553  -9.092
  476   2HD1  ILE  67          2HD1      ILE  67   4.264   8.513 -10.687
  477   3HD1  ILE  67          3HD1      ILE  67   4.955   7.570  -9.366
  478    H    LEU  68           H        LEU  68   1.372   4.892  -6.725
  479    HA   LEU  68           HA       LEU  68   2.438   2.410  -5.839
  480   1HB   LEU  68          2HB       LEU  68   0.321   4.278  -4.763
  481   2HB   LEU  68          1HB       LEU  68   0.668   2.761  -3.928
  482    HG   LEU  68           HG       LEU  68   2.824   4.779  -4.639
  483   1HD1  LEU  68          1HD1      LEU  68   2.633   5.732  -2.456
  484   2HD1  LEU  68          2HD1      LEU  68   1.507   4.483  -1.931
  485   3HD1  LEU  68          3HD1      LEU  68   0.992   5.701  -3.099
  486   1HD2  LEU  68          1HD2      LEU  68   2.676   2.301  -2.912
  487   2HD2  LEU  68          2HD2      LEU  68   3.862   3.554  -2.560
  488   3HD2  LEU  68          3HD2      LEU  68   3.888   2.738  -4.115
  489    H    VAL  69           H        VAL  69  -0.924   3.311  -6.638
  490    HA   VAL  69           HA       VAL  69  -1.949   0.637  -6.374
  491    HB   VAL  69           HB       VAL  69  -2.943   3.189  -7.647
  492   1HG1  VAL  69          1HG1      VAL  69  -5.157   1.821  -7.917
  493   2HG1  VAL  69          2HG1      VAL  69  -4.083   0.422  -7.972
  494   3HG1  VAL  69          3HG1      VAL  69  -3.922   1.709  -9.171
  495   1HG2  VAL  69          1HG2      VAL  69  -4.695   2.925  -5.912
  496   2HG2  VAL  69          2HG2      VAL  69  -3.078   2.945  -5.210
  497   3HG2  VAL  69          3HG2      VAL  69  -3.941   1.418  -5.394
  498    H    GLY  70           H        GLY  70  -0.746   2.495  -9.153
  499   1HA   GLY  70          2HA       GLY  70  -1.383   0.554 -11.156
  500   2HA   GLY  70          1HA       GLY  70  -0.143   1.796 -11.309
  501    H    GLN  71           H        GLN  71   1.252   0.747  -8.856
  502    HA   GLN  71           HA       GLN  71   2.883  -1.255 -10.260
  503   1HB   GLN  71          2HB       GLN  71   3.042   0.049  -7.529
  504   2HB   GLN  71          1HB       GLN  71   4.198  -1.159  -8.082
  505   1HG   GLN  71          2HG       GLN  71   5.011   0.227  -9.802
  506   2HG   GLN  71          1HG       GLN  71   3.615   1.294  -9.734
  507   1HE2  GLN  71          1HE2      GLN  71   3.351   2.442  -7.440
  508   2HE2  GLN  71          2HE2      GLN  71   4.802   2.971  -6.725
  509    H    ILE  72           H        ILE  72   0.507  -1.116  -7.760
  510    HA   ILE  72           HA       ILE  72   0.972  -3.662  -6.573
  511    HB   ILE  72           HB       ILE  72  -1.417  -1.836  -6.821
  512   1HG1  ILE  72          2HG1      ILE  72   0.096  -2.719  -4.350
  513   2HG1  ILE  72          1HG1      ILE  72   0.693  -1.400  -5.368
  514   1HG2  ILE  72          1HG2      ILE  72  -1.279  -4.601  -5.625
  515   2HG2  ILE  72          2HG2      ILE  72  -2.544  -3.891  -6.618
  516   3HG2  ILE  72          3HG2      ILE  72  -2.356  -3.385  -4.940
  517   1HD1  ILE  72          1HD1      ILE  72  -1.156  -1.216  -3.284
  518   2HD1  ILE  72          2HD1      ILE  72  -2.132  -1.033  -4.741
  519   3HD1  ILE  72          3HD1      ILE  72  -0.764   0.043  -4.451
  520    H    ASP  73           H        ASP  73  -0.889  -2.660  -9.427
  521    HA   ASP  73           HA       ASP  73  -1.942  -5.322  -9.903
  522   1HB   ASP  73          2HB       ASP  73  -2.952  -3.278 -10.935
  523   2HB   ASP  73          1HB       ASP  73  -1.493  -3.083 -11.907
  524    H    ASP  74           H        ASP  74   0.862  -3.447 -11.091
  525    HA   ASP  74           HA       ASP  74   1.865  -5.524 -12.808
  526   1HB   ASP  74          2HB       ASP  74   3.685  -3.570 -11.406
  527   2HB   ASP  74          1HB       ASP  74   3.800  -4.217 -13.043
  528    H    ALA  75           H        ALA  75   2.362  -4.814  -9.367
  529    HA   ALA  75           HA       ALA  75   4.419  -6.842  -9.058
  530   1HB   ALA  75          1HB       ALA  75   4.403  -4.963  -7.531
  531   2HB   ALA  75          2HB       ALA  75   4.056  -6.422  -6.604
  532   3HB   ALA  75          3HB       ALA  75   2.749  -5.320  -7.038
  533    H    LEU  76           H        LEU  76   0.929  -6.673  -8.491
  534    HA   LEU  76           HA       LEU  76   0.717  -9.191  -7.139
  535   1HB   LEU  76          2HB       LEU  76  -1.031  -7.447  -7.080
  536   2HB   LEU  76          1HB       LEU  76  -1.341  -7.691  -8.795
  537    HG   LEU  76           HG       LEU  76  -1.463 -10.183  -7.152
  538   1HD1  LEU  76          1HD1      LEU  76  -3.591  -8.042  -6.847
  539   2HD1  LEU  76          2HD1      LEU  76  -2.490  -8.579  -5.580
  540   3HD1  LEU  76          3HD1      LEU  76  -3.689  -9.692  -6.235
  541   1HD2  LEU  76          1HD2      LEU  76  -2.105 -10.181  -9.510
  542   2HD2  LEU  76          2HD2      LEU  76  -3.285  -8.902  -9.220
  543   3HD2  LEU  76          3HD2      LEU  76  -3.528 -10.503  -8.521
  544    H    LYS  77           H        LYS  77   0.109  -8.341 -10.581
  545    HA   LYS  77           HA       LYS  77  -0.437 -11.002 -11.435
  546   1HB   LYS  77          2HB       LYS  77   0.360 -10.264 -13.695
  547   2HB   LYS  77          1HB       LYS  77  -0.808  -9.160 -12.992
  548   1HG   LYS  77          2HG       LYS  77   0.743  -7.552 -13.556
  549   2HG   LYS  77          1HG       LYS  77   1.504  -8.043 -12.058
  550   1HD   LYS  77          2HD       LYS  77   3.288  -8.172 -13.554
  551   2HD   LYS  77          1HD       LYS  77   2.715  -9.833 -13.546
  552   1HE   LYS  77          2HE       LYS  77   2.540  -7.786 -15.703
  553   2HE   LYS  77          1HE       LYS  77   2.781  -9.528 -15.817
  554   1HZ   LYS  77          1HZ       LYS  77   0.200  -8.321 -15.009
  555   2HZ   LYS  77          2HZ       LYS  77   0.505  -9.923 -15.480
  556   3HZ   LYS  77          3HZ       LYS  77   0.587  -8.668 -16.620
  557    H    LEU  78           H        LEU  78   2.611  -9.252 -11.009
  558    HA   LEU  78           HA       LEU  78   4.327 -11.249 -12.066
  559   1HB   LEU  78          2HB       LEU  78   4.757  -8.770 -11.114
  560   2HB   LEU  78          1HB       LEU  78   5.207  -9.659  -9.670
  561    HG   LEU  78           HG       LEU  78   7.188  -9.278 -11.021
  562   1HD1  LEU  78          1HD1      LEU  78   8.048 -11.448 -10.985
  563   2HD1  LEU  78          2HD1      LEU  78   6.536 -12.173 -11.533
  564   3HD1  LEU  78          3HD1      LEU  78   6.681 -11.575  -9.878
  565   1HD2  LEU  78          1HD2      LEU  78   6.294 -10.959 -13.318
  566   2HD2  LEU  78          2HD2      LEU  78   7.317  -9.527 -13.296
  567   3HD2  LEU  78          3HD2      LEU  78   5.565  -9.353 -13.225
  568    H    ALA  79           H        ALA  79   3.151 -10.699  -8.752
  569    HA   ALA  79           HA       ALA  79   4.425 -12.958  -7.591
  570   1HB   ALA  79          1HB       ALA  79   2.959 -12.661  -5.750
  571   2HB   ALA  79          2HB       ALA  79   1.684 -11.992  -6.768
  572   3HB   ALA  79          3HB       ALA  79   3.131 -11.043  -6.429
  573    H    ASN  80           H        ASN  80   1.141 -12.660  -8.986
  574    HA   ASN  80           HA       ASN  80   0.471 -15.417  -8.691
  575   1HB   ASN  80          2HB       ASN  80  -0.442 -13.218 -10.526
  576   2HB   ASN  80          1HB       ASN  80  -1.000 -14.863 -10.805
  577   1HD2  ASN  80          1HD2      ASN  80  -2.265 -12.288  -9.648
  578   2HD2  ASN  80          2HD2      ASN  80  -3.070 -12.822  -8.253
  579    H    GLU  81           H        GLU  81   1.373 -13.789 -11.729
  580    HA   GLU  81           HA       GLU  81   2.124 -16.238 -13.053
  581   1HB   GLU  81          2HB       GLU  81   1.341 -13.990 -14.059
  582   2HB   GLU  81          1HB       GLU  81   3.010 -13.464 -13.857
  583   1HG   GLU  81          2HG       GLU  81   3.076 -14.306 -16.033
  584   2HG   GLU  81          1HG       GLU  81   3.556 -15.733 -15.128
  585    H    GLY  82           H        GLY  82   3.688 -15.006 -10.499
  586   1HA   GLY  82          2HA       GLY  82   6.339 -15.919 -11.510
  587   2HA   GLY  82          1HA       GLY  82   6.252 -14.356 -10.729
  588    H    LYS  83           H        LYS  83   7.882 -16.219  -9.610
  589    HA   LYS  83           HA       LYS  83   6.470 -17.711  -7.530
  590   1HB   LYS  83          2HB       LYS  83   9.390 -17.092  -8.029
  591   2HB   LYS  83          1HB       LYS  83   8.835 -17.982  -6.611
  592   1HG   LYS  83          2HG       LYS  83   7.650 -19.561  -8.268
  593   2HG   LYS  83          1HG       LYS  83   8.620 -18.781  -9.518
  594   1HD   LYS  83          2HD       LYS  83  10.665 -19.497  -8.522
  595   2HD   LYS  83          1HD       LYS  83   9.853 -19.968  -7.027
  596   1HE   LYS  83          2HE       LYS  83   9.420 -21.269  -9.733
  597   2HE   LYS  83          1HE       LYS  83  10.386 -21.945  -8.420
  598   1HZ   LYS  83          1HZ       LYS  83   7.912 -21.233  -7.364
  599   2HZ   LYS  83          2HZ       LYS  83   8.541 -22.797  -7.577
  600   3HZ   LYS  83          3HZ       LYS  83   7.602 -22.081  -8.800
  601    H    VAL  84           H        VAL  84   7.891 -17.163  -5.243
  602    HA   VAL  84           HA       VAL  84   6.834 -14.501  -4.589
  603    HB   VAL  84           HB       VAL  84   6.731 -16.739  -3.181
  604   1HG1  VAL  84          1HG1      VAL  84   8.431 -16.946  -1.483
  605   2HG1  VAL  84          2HG1      VAL  84   9.273 -15.518  -2.085
  606   3HG1  VAL  84          3HG1      VAL  84   9.217 -16.989  -3.061
  607   1HG2  VAL  84          1HG2      VAL  84   5.734 -14.612  -2.491
  608   2HG2  VAL  84          2HG2      VAL  84   7.308 -14.050  -1.923
  609   3HG2  VAL  84          3HG2      VAL  84   6.509 -15.398  -1.115
  610    H    LYS  85           H        LYS  85   9.904 -16.128  -5.051
  611    HA   LYS  85           HA       LYS  85  11.570 -14.057  -3.965
  612   1HB   LYS  85          2HB       LYS  85  11.978 -16.607  -4.997
  613   2HB   LYS  85          1HB       LYS  85  12.701 -15.593  -6.240
  614   1HG   LYS  85          2HG       LYS  85  13.903 -14.395  -4.283
  615   2HG   LYS  85          1HG       LYS  85  13.424 -15.787  -3.314
  616   1HD   LYS  85          2HD       LYS  85  14.591 -17.302  -4.825
  617   2HD   LYS  85          1HD       LYS  85  14.988 -15.968  -5.909
  618   1HE   LYS  85          2HE       LYS  85  15.888 -16.134  -3.016
  619   2HE   LYS  85          1HE       LYS  85  16.880 -16.605  -4.396
  620   1HZ   LYS  85          1HZ       LYS  85  17.404 -14.368  -3.798
  621   2HZ   LYS  85          2HZ       LYS  85  15.768 -13.908  -3.844
  622   3HZ   LYS  85          3HZ       LYS  85  16.574 -14.334  -5.277
  623    H    GLU  86           H        GLU  86  10.339 -14.737  -7.239
  624    HA   GLU  86           HA       GLU  86  11.640 -12.559  -8.558
  625   1HB   GLU  86          2HB       GLU  86   8.945 -13.794  -9.216
  626   2HB   GLU  86          1HB       GLU  86   9.961 -12.858 -10.315
  627   1HG   GLU  86          2HG       GLU  86  10.811 -15.447  -8.991
  628   2HG   GLU  86          1HG       GLU  86  10.193 -15.329 -10.639
  629    H    ALA  87           H        ALA  87   8.543 -12.807  -6.853
  630    HA   ALA  87           HA       ALA  87   7.657 -10.143  -7.502
  631   1HB   ALA  87          1HB       ALA  87   6.922 -12.179  -5.417
  632   2HB   ALA  87          2HB       ALA  87   5.928 -11.470  -6.686
  633   3HB   ALA  87          3HB       ALA  87   6.314 -10.529  -5.252
  634    H    GLN  88           H        GLN  88   9.618 -11.472  -4.858
  635    HA   GLN  88           HA       GLN  88   9.743  -9.108  -3.275
  636   1HB   GLN  88          2HB       GLN  88  10.701 -10.794  -2.052
  637   2HB   GLN  88          1HB       GLN  88  11.099 -11.709  -3.495
  638   1HG   GLN  88          2HG       GLN  88  13.122 -11.178  -2.328
  639   2HG   GLN  88          1HG       GLN  88  13.120 -10.235  -3.801
  640   1HE2  GLN  88          1HE2      GLN  88  12.910  -7.905  -3.590
  641   2HE2  GLN  88          2HE2      GLN  88  12.980  -7.126  -2.085
  642    H    ALA  89           H        ALA  89  11.814 -10.315  -5.898
  643    HA   ALA  89           HA       ALA  89  13.653  -8.156  -5.975
  644   1HB   ALA  89          1HB       ALA  89  12.624  -9.964  -8.180
  645   2HB   ALA  89          2HB       ALA  89  14.089 -10.182  -7.223
  646   3HB   ALA  89          3HB       ALA  89  13.979  -8.853  -8.379
  647    H    ALA  90           H        ALA  90  10.461  -8.522  -7.502
  648    HA   ALA  90           HA       ALA  90  10.534  -6.206  -9.144
  649   1HB   ALA  90          1HB       ALA  90   8.114  -6.321  -9.146
  650   2HB   ALA  90          2HB       ALA  90   8.114  -7.284  -7.668
  651   3HB   ALA  90          3HB       ALA  90   8.737  -7.971  -9.170
  652    H    ALA  91           H        ALA  91   9.615  -6.618  -5.733
  653    HA   ALA  91           HA       ALA  91   8.733  -3.955  -5.276
  654   1HB   ALA  91          1HB       ALA  91  10.017  -5.941  -3.384
  655   2HB   ALA  91          2HB       ALA  91   8.290  -5.718  -3.663
  656   3HB   ALA  91          3HB       ALA  91   9.227  -4.448  -2.877
  657    H    GLU  92           H        GLU  92  11.997  -5.389  -5.086
  658    HA   GLU  92           HA       GLU  92  13.287  -3.097  -3.978
  659   1HB   GLU  92          2HB       GLU  92  14.577  -4.979  -5.959
  660   2HB   GLU  92          1HB       GLU  92  15.348  -4.077  -4.652
  661   1HG   GLU  92          2HG       GLU  92  13.966  -5.378  -3.018
  662   2HG   GLU  92          1HG       GLU  92  13.390  -6.362  -4.363
  663    H    GLN  93           H        GLN  93  13.118  -4.093  -7.450
  664    HA   GLN  93           HA       GLN  93  14.275  -1.635  -8.351
  665   1HB   GLN  93          2HB       GLN  93  13.136  -2.169 -10.554
  666   2HB   GLN  93          1HB       GLN  93  14.176  -3.447  -9.925
  667   1HG   GLN  93          2HG       GLN  93  12.202  -4.580  -8.978
  668   2HG   GLN  93          1HG       GLN  93  11.174  -3.307  -9.626
  669   1HE2  GLN  93          1HE2      GLN  93  11.975  -6.390 -10.321
  670   2HE2  GLN  93          2HE2      GLN  93  11.943  -6.344 -12.017
  671    H    LEU  94           H        LEU  94  10.931  -2.570  -7.620
  672    HA   LEU  94           HA       LEU  94   9.862   0.000  -8.492
  673   1HB   LEU  94          2HB       LEU  94   8.652  -2.146  -6.740
  674   2HB   LEU  94          1HB       LEU  94   7.799  -0.695  -7.268
  675    HG   LEU  94           HG       LEU  94   9.037  -2.719  -9.155
  676   1HD1  LEU  94          1HD1      LEU  94   6.117  -2.384  -8.465
  677   2HD1  LEU  94          2HD1      LEU  94   7.150  -3.622  -7.754
  678   3HD1  LEU  94          3HD1      LEU  94   6.837  -3.625  -9.489
  679   1HD2  LEU  94          1HD2      LEU  94   7.232  -1.481 -10.668
  680   2HD2  LEU  94          2HD2      LEU  94   8.826  -0.780 -10.429
  681   3HD2  LEU  94          3HD2      LEU  94   7.457  -0.180  -9.499
  682    H    LYS  95           H        LYS  95  11.680  -1.019  -5.812
  683    HA   LYS  95           HA       LYS  95  10.433   0.619  -3.785
  684   1HB   LYS  95          2HB       LYS  95  12.057  -1.217  -3.274
  685   2HB   LYS  95          1HB       LYS  95  13.341  -0.234  -3.967
  686   1HG   LYS  95          2HG       LYS  95  11.727   1.185  -1.916
  687   2HG   LYS  95          1HG       LYS  95  12.622  -0.197  -1.295
  688   1HD   LYS  95          2HD       LYS  95  14.711   0.698  -2.174
  689   2HD   LYS  95          1HD       LYS  95  13.855   2.039  -2.936
  690   1HE   LYS  95          2HE       LYS  95  14.773   2.868  -0.869
  691   2HE   LYS  95          1HE       LYS  95  13.035   2.697  -0.633
  692   1HZ   LYS  95          1HZ       LYS  95  15.071   0.689   0.169
  693   2HZ   LYS  95          2HZ       LYS  95  13.400   0.589   0.449
  694   3HZ   LYS  95          3HZ       LYS  95  14.322   1.788   1.222
  695    H    THR  96           H        THR  96  13.361   1.157  -5.801
  696    HA   THR  96           HA       THR  96  13.578   3.920  -4.983
  697    HB   THR  96           HB       THR  96  14.742   2.525  -7.409
  698    HG1  THR  96           1HG      THR  96  15.309   1.519  -5.455
  699   1HG2  THR  96          1HG2      THR  96  15.277   5.142  -6.020
  700   2HG2  THR  96          2HG2      THR  96  15.037   4.829  -7.738
  701   3HG2  THR  96          3HG2      THR  96  16.535   4.333  -6.953
  702    H    THR  97           H        THR  97  11.850   2.245  -7.534
  703    HA   THR  97           HA       THR  97  11.276   4.768  -8.959
  704    HB   THR  97           HB       THR  97  10.752   1.851  -9.472
  705    HG1  THR  97           1HG      THR  97  12.659   3.520 -10.066
  706   1HG2  THR  97          1HG2      THR  97   9.805   2.725 -11.698
  707   2HG2  THR  97          2HG2      THR  97   9.574   4.251 -10.846
  708   3HG2  THR  97          3HG2      THR  97   8.759   2.794 -10.280
  709    H    GLY  98           H        GLY  98   9.833   2.614  -6.659
  710   1HA   GLY  98          2HA       GLY  98   7.087   3.491  -7.141
  711   2HA   GLY  98          1HA       GLY  98   7.624   2.487  -5.801
  712    H    ARG  99           H        ARG  99   6.808   3.604  -4.048
  713    HA   ARG  99           HA       ARG  99   6.432   5.368  -2.556
  714   1HB   ARG  99          2HB       ARG  99   9.292   5.813  -3.453
  715   2HB   ARG  99          1HB       ARG  99   8.548   6.725  -2.137
  716   1HG   ARG  99          2HG       ARG  99   8.007   4.577  -0.995
  717   2HG   ARG  99          1HG       ARG  99   8.875   3.715  -2.266
  718   1HD   ARG  99          2HD       ARG  99  10.956   4.736  -1.660
  719   2HD   ARG  99          1HD       ARG  99  10.154   5.901  -0.607
  720    HE   ARG  99           HE       ARG  99   9.518   3.318   0.363
  721   1HH1  ARG  99          1HH2      ARG  99  12.238   5.365  -0.152
  722   2HH1  ARG  99          2HH2      ARG  99  13.129   4.751   1.200
  723   1HH2  ARG  99          1HH1      ARG  99  10.656   2.505   2.137
  724   2HH2  ARG  99          2HH1      ARG  99  12.226   3.136   2.502
  725    H    ALA 100           H        ALA 100   8.238   7.907  -3.390
  726    HA   ALA 100           HA       ALA 100   7.892   9.903  -4.545
  727   1HB   ALA 100          1HB       ALA 100   5.729   8.643  -6.224
  728   2HB   ALA 100          2HB       ALA 100   7.409   8.178  -6.485
  729   3HB   ALA 100          3HB       ALA 100   6.922   9.861  -6.670
  730    H    GLY 101           H        GLY 101   5.556   8.107  -2.911
  731   1HA   GLY 101          2HA       GLY 101   3.475  10.164  -2.973
  732   2HA   GLY 101          1HA       GLY 101   3.437   8.684  -2.017
  733    H    ASN 102           H        ASN 102   6.411   9.893  -1.499
  734    HA   ASN 102           HA       ASN 102   5.685  11.893   0.551
  735   1HB   ASN 102          2HB       ASN 102   5.639   9.357   1.372
  736   2HB   ASN 102          1HB       ASN 102   7.387   9.574   1.438
  737   1HD2  ASN 102          1HD2      ASN 102   7.377  12.375   2.206
  738   2HD2  ASN 102          2HD2      ASN 102   6.776  12.471   3.789
  739    H    GLN 103           H        GLN 103   7.095  12.467  -1.709
  740    HA   GLN 103           HA       GLN 103   9.870  12.848  -0.705
  741   1HB   GLN 103          2HB       GLN 103   9.639  10.919  -2.344
  742   2HB   GLN 103          1HB       GLN 103   9.164  12.123  -3.550
  743   1HG   GLN 103          2HG       GLN 103  11.266  13.310  -3.256
  744   2HG   GLN 103          1HG       GLN 103  11.768  12.180  -1.998
  745   1HE2  GLN 103          1HE2      GLN 103  10.855  12.284  -5.477
  746   2HE2  GLN 103          2HE2      GLN 103  11.793  10.941  -5.920
  747    H    LYS 104           H        LYS 104   7.330  13.773  -2.989
  748    HA   LYS 104           HA       LYS 104   8.673  16.318  -3.593
  749   1HB   LYS 104          2HB       LYS 104   7.495  15.425  -5.462
  750   2HB   LYS 104          1HB       LYS 104   6.090  15.018  -4.482
  751   1HG   LYS 104          2HG       LYS 104   5.426  17.310  -4.284
  752   2HG   LYS 104          1HG       LYS 104   6.989  17.879  -4.890
  753   1HD   LYS 104          2HD       LYS 104   6.511  16.922  -7.095
  754   2HD   LYS 104          1HD       LYS 104   4.986  16.267  -6.502
  755   1HE   LYS 104          2HE       LYS 104   4.065  18.215  -7.266
  756   2HE   LYS 104          1HE       LYS 104   4.788  18.978  -5.853
  757   1HZ   LYS 104          1HZ       LYS 104   6.871  18.946  -7.484
  758   2HZ   LYS 104          2HZ       LYS 104   5.757  20.229  -7.437
  759   3HZ   LYS 104          3HZ       LYS 104   5.629  19.035  -8.636
  760    H    GLY 105           H        GLY 105   5.308  15.667  -2.721
  761   1HA   GLY 105          2HA       GLY 105   5.225  18.119  -1.094
  762   2HA   GLY 105          1HA       GLY 105   3.861  17.066  -1.486
  763    H    GLY 106           H        GLY 106   6.936  15.952  -0.246
  764   1HA   GLY 106          2HA       GLY 106   5.693  15.307   2.395
  765   2HA   GLY 106          1HA       GLY 106   6.609  14.094   1.499
  Start of MODEL    8
    1   1H    ALA   1          1HT       ALA   1  -5.882  -8.801  31.600
    2   2H    ALA   1          2HT       ALA   1  -6.477  -7.357  30.932
    3   3H    ALA   1          3HT       ALA   1  -6.869  -7.782  32.529
    4    HA   ALA   1           HA       ALA   1  -4.648  -6.322  31.577
    5   1HB   ALA   1          1HB       ALA   1  -5.383  -7.212  34.380
    6   2HB   ALA   1          2HB       ALA   1  -6.111  -5.831  33.558
    7   3HB   ALA   1          3HB       ALA   1  -4.389  -5.823  33.939
    8    H    ASP   2           H        ASP   2  -2.564  -6.979  31.299
    9    HA   ASP   2           HA       ASP   2  -0.686  -8.388  31.318
   10   1HB   ASP   2          2HB       ASP   2  -0.975  -7.680  33.778
   11   2HB   ASP   2          1HB       ASP   2  -1.677  -9.275  34.032
   12    H    LEU   3           H        LEU   3  -0.079 -10.859  31.738
   13    HA   LEU   3           HA       LEU   3  -2.220 -12.415  30.443
   14   1HB   LEU   3          2HB       LEU   3   0.483 -13.523  31.213
   15   2HB   LEU   3          1HB       LEU   3  -0.562 -13.981  29.874
   16    HG   LEU   3           HG       LEU   3   0.978 -11.390  30.163
   17   1HD1  LEU   3          1HD1      LEU   3   2.439 -13.116  29.407
   18   2HD1  LEU   3          2HD1      LEU   3   1.947 -12.247  27.954
   19   3HD1  LEU   3          3HD1      LEU   3   1.207 -13.798  28.347
   20   1HD2  LEU   3          1HD2      LEU   3  -1.015 -10.722  29.103
   21   2HD2  LEU   3          2HD2      LEU   3  -1.194 -12.255  28.249
   22   3HD2  LEU   3          3HD2      LEU   3   0.038 -11.099  27.741
   23    H    GLU   4           H        GLU   4  -0.016 -13.383  33.134
   24    HA   GLU   4           HA       GLU   4  -0.474 -14.590  35.080
   25   1HB   GLU   4          2HB       GLU   4  -3.161 -13.207  34.901
   26   2HB   GLU   4          1HB       GLU   4  -2.411 -13.879  36.347
   27   1HG   GLU   4          2HG       GLU   4  -0.461 -12.277  35.897
   28   2HG   GLU   4          1HG       GLU   4  -1.527 -11.483  34.737
   29    H    ASP   5           H        ASP   5  -1.476 -16.480  35.840
   30    HA   ASP   5           HA       ASP   5  -2.405 -18.599  35.587
   31   1HB   ASP   5          2HB       ASP   5  -4.772 -18.620  35.337
   32   2HB   ASP   5          1HB       ASP   5  -4.361 -17.106  36.142
   33    H    ASN   6           H        ASN   6  -3.453 -16.867  32.630
   34    HA   ASN   6           HA       ASN   6  -3.391 -17.498  30.395
   35   1HB   ASN   6          2HB       ASN   6  -0.893 -18.695  31.551
   36   2HB   ASN   6          1HB       ASN   6  -1.281 -18.924  29.848
   37   1HD2  ASN   6          1HD2      ASN   6   0.502 -17.572  29.161
   38   2HD2  ASN   6          2HD2      ASN   6   0.481 -15.889  29.374
   39    H    ASP   7           H        ASP   7  -3.664 -19.273  28.908
   40    HA   ASP   7           HA       ASP   7  -4.294 -21.928  30.091
   41   1HB   ASP   7          2HB       ASP   7  -6.418 -20.617  30.002
   42   2HB   ASP   7          1HB       ASP   7  -6.173 -20.378  28.273
   43    H    GLU   8           H        GLU   8  -3.803 -19.895  27.228
   44    HA   GLU   8           HA       GLU   8  -3.298 -22.221  25.497
   45   1HB   GLU   8          2HB       GLU   8  -2.805 -19.285  24.923
   46   2HB   GLU   8          1HB       GLU   8  -2.917 -20.591  23.744
   47   1HG   GLU   8          2HG       GLU   8  -5.159 -19.636  25.551
   48   2HG   GLU   8          1HG       GLU   8  -5.022 -19.329  23.819
   49    H    THR   9           H        THR   9  -1.577 -20.869  27.903
   50    HA   THR   9           HA       THR   9   0.679 -20.518  28.362
   51    HB   THR   9           HB       THR   9   0.536 -22.985  28.307
   52    HG1  THR   9           1HG      THR   9   2.531 -21.829  28.658
   53   1HG2  THR   9          1HG2      THR   9   1.285 -22.622  25.392
   54   2HG2  THR   9          2HG2      THR   9  -0.102 -23.489  26.052
   55   3HG2  THR   9          3HG2      THR   9   1.520 -24.132  26.266
   56    H    GLY  10           H        GLY  10  -0.432 -19.244  25.889
   57   1HA   GLY  10          2HA       GLY  10   2.187 -18.411  24.777
   58   2HA   GLY  10          1HA       GLY  10   1.010 -19.060  23.632
   59    H    ASN  11           H        ASN  11  -1.111 -17.949  23.539
   60    HA   ASN  11           HA       ASN  11  -2.315 -15.988  23.164
   61   1HB   ASN  11          2HB       ASN  11  -2.870 -14.861  25.119
   62   2HB   ASN  11          1HB       ASN  11  -2.171 -16.335  25.786
   63   1HD2  ASN  11          1HD2      ASN  11  -1.358 -12.931  24.980
   64   2HD2  ASN  11          2HD2      ASN  11  -0.113 -12.791  26.126
   65    H    ASP  12           H        ASP  12   0.909 -16.033  22.843
   66    HA   ASP  12           HA       ASP  12   0.947 -13.270  21.771
   67   1HB   ASP  12          2HB       ASP  12   2.965 -14.336  23.768
   68   2HB   ASP  12          1HB       ASP  12   3.184 -12.863  22.820
   69    H    ASN  13           H        ASN  13   0.965 -16.081  20.734
   70    HA   ASN  13           HA       ASN  13   3.648 -16.455  19.622
   71   1HB   ASN  13          2HB       ASN  13   0.978 -17.809  19.177
   72   2HB   ASN  13          1HB       ASN  13   2.405 -18.215  18.222
   73   1HD2  ASN  13          1HD2      ASN  13   2.205 -20.414  19.287
   74   2HD2  ASN  13          2HD2      ASN  13   2.849 -20.628  20.842
   75    H    GLY  14           H        GLY  14   0.577 -16.355  17.843
   76   1HA   GLY  14          2HA       GLY  14   0.005 -15.233  15.860
   77   2HA   GLY  14          1HA       GLY  14   1.038 -13.924  16.442
   78    H    LYS  15           H        LYS  15   1.569 -17.264  15.282
   79    HA   LYS  15           HA       LYS  15   4.038 -16.404  13.931
   80   1HB   LYS  15          2HB       LYS  15   3.998 -18.917  13.263
   81   2HB   LYS  15          1HB       LYS  15   4.235 -18.520  14.965
   82   1HG   LYS  15          2HG       LYS  15   1.942 -18.960  15.489
   83   2HG   LYS  15          1HG       LYS  15   1.500 -19.067  13.786
   84   1HD   LYS  15          2HD       LYS  15   3.481 -20.930  15.105
   85   2HD   LYS  15          1HD       LYS  15   1.758 -21.276  15.023
   86   1HE   LYS  15          2HE       LYS  15   2.052 -22.124  12.932
   87   2HE   LYS  15          1HE       LYS  15   2.617 -20.554  12.369
   88   1HZ   LYS  15          1HZ       LYS  15   4.689 -21.645  13.835
   89   2HZ   LYS  15          2HZ       LYS  15   4.608 -21.453  12.147
   90   3HZ   LYS  15          3HZ       LYS  15   4.102 -22.908  12.868
   91    H    GLY  16           H        GLY  16   0.715 -16.782  13.190
   92   1HA   GLY  16          2HA       GLY  16   1.219 -17.075  10.267
   93   2HA   GLY  16          1HA       GLY  16  -0.357 -17.168  11.056
   94    H    GLY  17           H        GLY  17   1.933 -14.652  11.849
   95   1HA   GLY  17          2HA       GLY  17  -0.037 -12.620  11.050
   96   2HA   GLY  17          1HA       GLY  17   1.468 -12.323  11.917
   97    H    GLU  18           H        GLU  18   3.489 -12.967  10.427
   98    HA   GLU  18           HA       GLU  18   3.011 -12.231   7.598
   99   1HB   GLU  18          2HB       GLU  18   3.376 -10.124   9.058
  100   2HB   GLU  18          1HB       GLU  18   5.045 -10.676   9.205
  101   1HG   GLU  18          2HG       GLU  18   5.273 -10.686   6.755
  102   2HG   GLU  18          1HG       GLU  18   3.593 -10.172   6.588
  103    H    LYS  19           H        LYS  19   3.810 -14.709   8.445
  104    HA   LYS  19           HA       LYS  19   6.724 -14.909   8.491
  105   1HB   LYS  19          2HB       LYS  19   6.379 -17.286   8.562
  106   2HB   LYS  19          1HB       LYS  19   5.137 -16.564   9.583
  107   1HG   LYS  19          2HG       LYS  19   3.608 -16.619   7.532
  108   2HG   LYS  19          1HG       LYS  19   4.821 -17.649   6.761
  109   1HD   LYS  19          2HD       LYS  19   3.462 -18.240   9.415
  110   2HD   LYS  19          1HD       LYS  19   3.021 -18.967   7.870
  111   1HE   LYS  19          2HE       LYS  19   4.465 -20.589   8.716
  112   2HE   LYS  19          1HE       LYS  19   5.599 -19.604   7.793
  113   1HZ   LYS  19          1HZ       LYS  19   6.059 -20.216  10.275
  114   2HZ   LYS  19          2HZ       LYS  19   5.057 -18.878  10.579
  115   3HZ   LYS  19          3HZ       LYS  19   6.480 -18.691   9.669
  116    H    ALA  20           H        ALA  20   7.580 -16.682   6.814
  117    HA   ALA  20           HA       ALA  20   7.037 -15.572   4.118
  118   1HB   ALA  20          1HB       ALA  20   9.085 -16.625   3.456
  119   2HB   ALA  20          2HB       ALA  20   9.092 -17.666   4.880
  120   3HB   ALA  20          3HB       ALA  20   9.400 -15.937   5.048
  121    H    ASP  21           H        ASP  21   4.807 -16.710   4.422
  122    HA   ASP  21           HA       ASP  21   4.804 -19.627   4.216
  123   1HB   ASP  21          2HB       ASP  21   2.919 -18.371   5.269
  124   2HB   ASP  21          1HB       ASP  21   2.575 -17.636   3.706
  125    H    ASN  22           H        ASN  22   5.711 -17.256   2.238
  126    HA   ASN  22           HA       ASN  22   5.998 -17.052  -0.061
  127   1HB   ASN  22          2HB       ASN  22   5.979 -19.956   0.506
  128   2HB   ASN  22          1HB       ASN  22   5.569 -19.566  -1.156
  129   1HD2  ASN  22          1HD2      ASN  22   7.194 -17.604  -1.975
  130   2HD2  ASN  22          2HD2      ASN  22   8.827 -17.957  -1.681
  131    H    ALA  23           H        ALA  23   4.404 -15.888  -0.924
  132    HA   ALA  23           HA       ALA  23   2.605 -15.637  -2.480
  133   1HB   ALA  23          1HB       ALA  23   2.516 -18.238  -2.577
  134   2HB   ALA  23          2HB       ALA  23   1.068 -17.320  -2.981
  135   3HB   ALA  23          3HB       ALA  23   1.215 -18.076  -1.396
  136    H    ALA  24           H        ALA  24   1.774 -16.876   0.788
  137    HA   ALA  24           HA       ALA  24  -0.635 -15.337   0.977
  138   1HB   ALA  24          1HB       ALA  24   0.299 -17.238   2.533
  139   2HB   ALA  24          2HB       ALA  24  -0.690 -15.956   3.234
  140   3HB   ALA  24          3HB       ALA  24   1.065 -15.907   3.397
  141    H    GLN  25           H        GLN  25   2.456 -14.666   2.646
  142    HA   GLN  25           HA       GLN  25   1.826 -11.975   3.297
  143   1HB   GLN  25          2HB       GLN  25   4.077 -11.763   3.967
  144   2HB   GLN  25          1HB       GLN  25   3.744 -13.480   4.151
  145   1HG   GLN  25          2HG       GLN  25   5.706 -13.694   2.952
  146   2HG   GLN  25          1HG       GLN  25   4.630 -13.499   1.582
  147   1HE2  GLN  25          1HE2      GLN  25   7.059 -11.761   3.560
  148   2HE2  GLN  25          2HE2      GLN  25   7.222 -10.468   2.479
  149    H    VAL  26           H        VAL  26   2.480 -13.320   0.242
  150    HA   VAL  26           HA       VAL  26   3.775 -11.022  -0.952
  151    HB   VAL  26           HB       VAL  26   2.227 -13.208  -2.353
  152   1HG1  VAL  26          1HG1      VAL  26   4.421 -11.288  -3.195
  153   2HG1  VAL  26          2HG1      VAL  26   2.789 -11.396  -3.856
  154   3HG1  VAL  26          3HG1      VAL  26   3.944 -12.697  -4.146
  155   1HG2  VAL  26          1HG2      VAL  26   4.487 -14.295  -2.496
  156   2HG2  VAL  26          2HG2      VAL  26   3.844 -14.207  -0.855
  157   3HG2  VAL  26          3HG2      VAL  26   5.090 -13.075  -1.375
  158    H    LYS  27           H        LYS  27   0.478 -12.305  -1.736
  159    HA   LYS  27           HA       LYS  27  -0.345  -9.870  -2.955
  160   1HB   LYS  27          2HB       LYS  27  -2.653 -10.705  -2.659
  161   2HB   LYS  27          1HB       LYS  27  -1.584 -11.970  -3.255
  162   1HG   LYS  27          2HG       LYS  27  -1.299 -12.442  -0.609
  163   2HG   LYS  27          1HG       LYS  27  -2.884 -11.682  -0.566
  164   1HD   LYS  27          2HD       LYS  27  -3.418 -13.939  -0.852
  165   2HD   LYS  27          1HD       LYS  27  -3.466 -13.331  -2.501
  166   1HE   LYS  27          2HE       LYS  27  -0.906 -14.042  -2.498
  167   2HE   LYS  27          1HE       LYS  27  -1.436 -15.108  -1.199
  168   1HZ   LYS  27          1HZ       LYS  27  -2.897 -14.960  -3.759
  169   2HZ   LYS  27          2HZ       LYS  27  -2.928 -16.189  -2.587
  170   3HZ   LYS  27          3HZ       LYS  27  -1.555 -15.982  -3.567
  171    H    ASP  28           H        ASP  28  -0.451 -10.938   0.407
  172    HA   ASP  28           HA       ASP  28  -2.077  -8.845   1.445
  173   1HB   ASP  28          2HB       ASP  28   0.267 -10.277   2.733
  174   2HB   ASP  28          1HB       ASP  28  -0.926  -9.304   3.595
  175    H    ALA  29           H        ALA  29   1.415  -8.982   0.764
  176    HA   ALA  29           HA       ALA  29   2.067  -6.423   1.860
  177   1HB   ALA  29          1HB       ALA  29   3.729  -8.218   1.249
  178   2HB   ALA  29          2HB       ALA  29   4.137  -6.622   0.618
  179   3HB   ALA  29          3HB       ALA  29   3.430  -7.838  -0.447
  180    H    LEU  30           H        LEU  30   1.384  -7.443  -1.491
  181    HA   LEU  30           HA       LEU  30   1.524  -4.851  -2.597
  182   1HB   LEU  30          2HB       LEU  30  -0.317  -7.062  -3.508
  183   2HB   LEU  30          1HB       LEU  30   0.379  -5.785  -4.500
  184    HG   LEU  30           HG       LEU  30   1.938  -7.963  -3.084
  185   1HD1  LEU  30          1HD1      LEU  30   0.681  -8.773  -5.040
  186   2HD1  LEU  30          2HD1      LEU  30   2.413  -8.750  -5.376
  187   3HD1  LEU  30          3HD1      LEU  30   1.374  -7.480  -6.021
  188   1HD2  LEU  30          1HD2      LEU  30   3.779  -6.963  -4.647
  189   2HD2  LEU  30          2HD2      LEU  30   3.397  -6.115  -3.153
  190   3HD2  LEU  30          3HD2      LEU  30   2.745  -5.533  -4.683
  191    H    THR  31           H        THR  31  -1.356  -6.679  -1.570
  192    HA   THR  31           HA       THR  31  -3.220  -4.557  -1.881
  193    HB   THR  31           HB       THR  31  -4.509  -5.879  -0.081
  194    HG1  THR  31           1HG      THR  31  -3.576  -7.941   0.296
  195   1HG2  THR  31          1HG2      THR  31  -5.083  -6.327  -2.330
  196   2HG2  THR  31          2HG2      THR  31  -4.676  -7.910  -1.670
  197   3HG2  THR  31          3HG2      THR  31  -3.511  -7.050  -2.676
  198    H    LYS  32           H        LYS  32  -1.027  -5.330   0.804
  199    HA   LYS  32           HA       LYS  32  -2.226  -3.649   2.761
  200   1HB   LYS  32          2HB       LYS  32  -0.486  -5.225   3.385
  201   2HB   LYS  32          1HB       LYS  32   0.687  -4.397   2.364
  202   1HG   LYS  32          2HG       LYS  32  -0.640  -2.622   4.348
  203   2HG   LYS  32          1HG       LYS  32   0.315  -3.907   5.077
  204   1HD   LYS  32          2HD       LYS  32   2.247  -3.219   3.620
  205   2HD   LYS  32          1HD       LYS  32   1.284  -1.846   3.073
  206   1HE   LYS  32          2HE       LYS  32   2.383  -2.402   5.824
  207   2HE   LYS  32          1HE       LYS  32   2.544  -0.943   4.847
  208   1HZ   LYS  32          1HZ       LYS  32  -0.095  -1.075   5.104
  209   2HZ   LYS  32          2HZ       LYS  32   0.906  -0.229   6.185
  210   3HZ   LYS  32          3HZ       LYS  32   0.368  -1.795   6.570
  211    H    MET  33           H        MET  33   0.435  -2.898   0.471
  212    HA   MET  33           HA       MET  33   0.622  -0.139   1.201
  213   1HB   MET  33          2HB       MET  33   1.149  -1.366  -1.524
  214   2HB   MET  33          1HB       MET  33   1.775   0.176  -0.935
  215   1HG   MET  33          2HG       MET  33   2.799  -1.192   1.002
  216   2HG   MET  33          1HG       MET  33   2.467  -2.609   0.009
  217   1HE   MET  33          1HE       MET  33   3.045  -1.890  -2.982
  218   2HE   MET  33          2HE       MET  33   3.458  -3.283  -1.986
  219   3HE   MET  33          3HE       MET  33   4.707  -2.482  -2.935
  220    H    ARG  34           H        ARG  34  -1.464  -1.845  -1.114
  221    HA   ARG  34           HA       ARG  34  -2.550   0.434  -2.415
  222   1HB   ARG  34          2HB       ARG  34  -3.038  -1.743  -3.298
  223   2HB   ARG  34          1HB       ARG  34  -3.754  -2.273  -1.779
  224   1HG   ARG  34          2HG       ARG  34  -5.645  -0.877  -2.059
  225   2HG   ARG  34          1HG       ARG  34  -4.864   0.072  -3.323
  226   1HD   ARG  34          2HD       ARG  34  -4.921  -1.835  -4.849
  227   2HD   ARG  34          1HD       ARG  34  -5.606  -2.858  -3.584
  228    HE   ARG  34           HE       ARG  34  -7.081  -0.977  -5.214
  229   1HH1  ARG  34          1HH2      ARG  34  -6.787  -2.449  -2.114
  230   2HH1  ARG  34          2HH2      ARG  34  -8.437  -2.171  -1.673
  231   1HH2  ARG  34          1HH1      ARG  34  -9.247  -0.594  -4.649
  232   2HH2  ARG  34          2HH1      ARG  34  -9.829  -1.120  -3.105
  233    H    ALA  35           H        ALA  35  -3.923  -1.358   0.365
  234    HA   ALA  35           HA       ALA  35  -6.041   0.456   0.877
  235   1HB   ALA  35          1HB       ALA  35  -4.545  -1.435   2.702
  236   2HB   ALA  35          2HB       ALA  35  -6.101  -1.699   1.915
  237   3HB   ALA  35          3HB       ALA  35  -5.962  -0.522   3.219
  238    H    ALA  36           H        ALA  36  -2.646   0.582   1.896
  239    HA   ALA  36           HA       ALA  36  -2.947   2.512   3.964
  240   1HB   ALA  36          1HB       ALA  36  -0.622   2.926   3.766
  241   2HB   ALA  36          2HB       ALA  36  -0.602   2.468   2.064
  242   3HB   ALA  36          3HB       ALA  36  -0.822   1.234   3.304
  243    H    ALA  37           H        ALA  37  -2.261   3.041   0.478
  244    HA   ALA  37           HA       ALA  37  -2.314   5.886   0.664
  245   1HB   ALA  37          1HB       ALA  37  -3.269   5.194  -1.923
  246   2HB   ALA  37          2HB       ALA  37  -2.200   3.881  -1.439
  247   3HB   ALA  37          3HB       ALA  37  -1.600   5.537  -1.468
  248    H    LEU  38           H        LEU  38  -4.938   3.537   0.024
  249    HA   LEU  38           HA       LEU  38  -6.953   5.511  -0.454
  250   1HB   LEU  38          2HB       LEU  38  -7.189   2.695   0.611
  251   2HB   LEU  38          1HB       LEU  38  -8.558   3.689   0.122
  252    HG   LEU  38           HG       LEU  38  -6.255   2.849  -1.676
  253   1HD1  LEU  38          1HD1      LEU  38  -8.004   1.096  -0.947
  254   2HD1  LEU  38          2HD1      LEU  38  -7.753   1.306  -2.679
  255   3HD1  LEU  38          3HD1      LEU  38  -9.157   2.032  -1.898
  256   1HD2  LEU  38          1HD2      LEU  38  -8.607   4.694  -2.040
  257   2HD2  LEU  38          2HD2      LEU  38  -8.066   3.733  -3.417
  258   3HD2  LEU  38          3HD2      LEU  38  -6.957   4.857  -2.640
  259    H    ASP  39           H        ASP  39  -5.922   3.887   2.524
  260    HA   ASP  39           HA       ASP  39  -7.919   4.978   4.233
  261   1HB   ASP  39          2HB       ASP  39  -6.193   3.143   4.759
  262   2HB   ASP  39          1HB       ASP  39  -5.071   4.463   5.100
  263    H    ALA  40           H        ALA  40  -4.555   6.131   3.800
  264    HA   ALA  40           HA       ALA  40  -4.994   8.532   5.305
  265   1HB   ALA  40          1HB       ALA  40  -2.853   9.276   4.046
  266   2HB   ALA  40          2HB       ALA  40  -2.864   7.651   3.362
  267   3HB   ALA  40          3HB       ALA  40  -2.737   7.872   5.107
  268    H    GLN  41           H        GLN  41  -6.144   7.646   2.282
  269    HA   GLN  41           HA       GLN  41  -5.884  10.118   0.858
  270   1HB   GLN  41          2HB       GLN  41  -6.723   7.636   0.208
  271   2HB   GLN  41          1HB       GLN  41  -8.288   8.387   0.376
  272   1HG   GLN  41          2HG       GLN  41  -7.833   8.821  -1.870
  273   2HG   GLN  41          1HG       GLN  41  -7.188  10.283  -1.124
  274   1HE2  GLN  41          1HE2      GLN  41  -6.065   6.942  -1.957
  275   2HE2  GLN  41          2HE2      GLN  41  -4.512   7.434  -2.441
  276    H    LYS  42           H        LYS  42  -8.846  10.101   0.307
  277    HA   LYS  42           HA       LYS  42  -9.567  12.245   2.128
  278   1HB   LYS  42          2HB       LYS  42 -11.144  10.759   0.008
  279   2HB   LYS  42          1HB       LYS  42 -11.776  12.134   0.914
  280   1HG   LYS  42          2HG       LYS  42  -9.945  13.547   0.080
  281   2HG   LYS  42          1HG       LYS  42  -9.275  12.178  -0.808
  282   1HD   LYS  42          2HD       LYS  42 -10.593  13.537  -2.340
  283   2HD   LYS  42          1HD       LYS  42 -11.413  11.999  -2.079
  284   1HE   LYS  42          2HE       LYS  42 -13.126  12.965  -0.836
  285   2HE   LYS  42          1HE       LYS  42 -12.123  14.308  -0.290
  286   1HZ   LYS  42          1HZ       LYS  42 -13.536  15.242  -1.857
  287   2HZ   LYS  42          2HZ       LYS  42 -13.403  13.924  -2.922
  288   3HZ   LYS  42          3HZ       LYS  42 -12.098  14.994  -2.720
  289    H    ALA  43           H        ALA  43  -9.032  10.167   3.754
  290    HA   ALA  43           HA       ALA  43 -11.691   9.528   4.902
  291   1HB   ALA  43          1HB       ALA  43  -9.515   7.483   4.360
  292   2HB   ALA  43          2HB       ALA  43 -11.122   7.506   3.644
  293   3HB   ALA  43          3HB       ALA  43 -10.928   7.191   5.369
  294    H    THR  44           H        THR  44 -11.282  10.904   6.613
  295    HA   THR  44           HA       THR  44 -10.251  11.774   8.509
  296    HB   THR  44           HB       THR  44  -9.627   8.837   8.568
  297    HG1  THR  44           1HG      THR  44 -11.265   8.811   9.924
  298   1HG2  THR  44          1HG2      THR  44  -9.100   9.593  11.142
  299   2HG2  THR  44          2HG2      THR  44  -8.399  10.954  10.273
  300   3HG2  THR  44          3HG2      THR  44  -7.838   9.311   9.949
  301    HA   PRO  45           HA       PRO  45  -6.448  12.157   5.656
  302   1HB   PRO  45          2HB       PRO  45  -7.090  14.947   6.581
  303   2HB   PRO  45          1HB       PRO  45  -6.476  14.397   5.006
  304   1HG   PRO  45          2HG       PRO  45  -9.024  15.015   5.290
  305   2HG   PRO  45          1HG       PRO  45  -8.547  13.605   4.330
  306   1HD   PRO  45          2HD       PRO  45  -9.773  13.692   7.064
  307   2HD   PRO  45          1HD       PRO  45  -9.955  12.481   5.777
  308    HA   PRO  46           HA       PRO  46  -4.331  12.436   9.717
  309   1HB   PRO  46          2HB       PRO  46  -2.364  10.636   9.271
  310   2HB   PRO  46          1HB       PRO  46  -4.029  10.134   9.616
  311   1HG   PRO  46          2HG       PRO  46  -2.584  10.210   7.013
  312   2HG   PRO  46          1HG       PRO  46  -3.779   9.043   7.606
  313   1HD   PRO  46          2HD       PRO  46  -4.328  11.182   5.854
  314   2HD   PRO  46          1HD       PRO  46  -5.541  10.275   6.778
  315    H    LYS  47           H        LYS  47  -2.684  12.442   6.557
  316    HA   LYS  47           HA       LYS  47  -0.720  14.446   7.630
  317   1HB   LYS  47          2HB       LYS  47  -0.360  12.543   5.293
  318   2HB   LYS  47          1HB       LYS  47   0.829  13.696   5.888
  319   1HG   LYS  47          2HG       LYS  47   0.624  12.512   8.154
  320   2HG   LYS  47          1HG       LYS  47  -0.232  11.240   7.288
  321   1HD   LYS  47          2HD       LYS  47   1.943  10.427   7.138
  322   2HD   LYS  47          1HD       LYS  47   1.872  11.377   5.656
  323   1HE   LYS  47          2HE       LYS  47   2.907  13.293   6.853
  324   2HE   LYS  47          1HE       LYS  47   3.007  12.310   8.314
  325   1HZ   LYS  47          1HZ       LYS  47   4.126  11.143   5.899
  326   2HZ   LYS  47          2HZ       LYS  47   4.701  11.102   7.497
  327   3HZ   LYS  47          3HZ       LYS  47   4.962  12.475   6.530
  328    H    LEU  48           H        LEU  48  -3.098  13.792   5.141
  329    HA   LEU  48           HA       LEU  48  -2.218  15.979   3.441
  330   1HB   LEU  48          2HB       LEU  48  -4.624  14.177   3.499
  331   2HB   LEU  48          1HB       LEU  48  -4.656  15.626   2.501
  332    HG   LEU  48           HG       LEU  48  -2.381  14.764   1.544
  333   1HD1  LEU  48          1HD1      LEU  48  -3.508  12.242   2.799
  334   2HD1  LEU  48          2HD1      LEU  48  -1.968  13.010   3.193
  335   3HD1  LEU  48          3HD1      LEU  48  -2.208  12.274   1.609
  336   1HD2  LEU  48          1HD2      LEU  48  -4.391  14.809   0.196
  337   2HD2  LEU  48          2HD2      LEU  48  -5.021  13.374   1.007
  338   3HD2  LEU  48          3HD2      LEU  48  -3.607  13.248  -0.041
  339    H    GLU  49           H        GLU  49  -3.572  16.003   6.404
  340    HA   GLU  49           HA       GLU  49  -5.378  18.284   5.965
  341   1HB   GLU  49          2HB       GLU  49  -6.315  17.031   7.661
  342   2HB   GLU  49          1HB       GLU  49  -4.757  16.344   8.110
  343   1HG   GLU  49          2HG       GLU  49  -4.189  18.245   9.439
  344   2HG   GLU  49          1HG       GLU  49  -5.485  19.216   8.739
  345    H    ASP  50           H        ASP  50  -2.141  17.635   6.628
  346    HA   ASP  50           HA       ASP  50  -1.532  20.092   8.067
  347   1HB   ASP  50          2HB       ASP  50  -0.296  17.772   7.916
  348   2HB   ASP  50          1HB       ASP  50   0.508  18.502   6.529
  349    H    LYS  51           H        LYS  51  -2.645  19.721   5.063
  350    HA   LYS  51           HA       LYS  51  -1.276  22.155   4.072
  351   1HB   LYS  51          2HB       LYS  51  -0.977  19.381   2.998
  352   2HB   LYS  51          1HB       LYS  51  -1.123  20.677   1.808
  353   1HG   LYS  51          2HG       LYS  51   0.765  21.867   2.953
  354   2HG   LYS  51          1HG       LYS  51   0.946  20.476   4.022
  355   1HD   LYS  51          2HD       LYS  51   1.340  19.025   2.059
  356   2HD   LYS  51          1HD       LYS  51   1.192  20.430   1.002
  357   1HE   LYS  51          2HE       LYS  51   3.568  19.865   1.512
  358   2HE   LYS  51          1HE       LYS  51   3.124  21.482   2.060
  359   1HZ   LYS  51          1HZ       LYS  51   4.340  19.745   3.619
  360   2HZ   LYS  51          2HZ       LYS  51   2.736  19.288   3.941
  361   3HZ   LYS  51          3HZ       LYS  51   3.241  20.886   4.223
  362    H    SER  52           H        SER  52  -3.843  19.702   3.624
  363    HA   SER  52           HA       SER  52  -5.978  19.992   2.627
  364   1HB   SER  52          2HB       SER  52  -5.486  22.130   4.297
  365   2HB   SER  52          1HB       SER  52  -5.815  22.961   2.784
  366    HG   SER  52           HG       SER  52  -7.803  22.645   3.507
  367    HA   PRO  53           HA       PRO  53  -5.574  21.205  -1.639
  368   1HB   PRO  53          2HB       PRO  53  -7.414  23.561  -1.372
  369   2HB   PRO  53          1HB       PRO  53  -7.519  22.168  -2.468
  370   1HG   PRO  53          2HG       PRO  53  -9.139  22.315  -0.405
  371   2HG   PRO  53          1HG       PRO  53  -8.360  20.769  -0.807
  372   1HD   PRO  53          2HD       PRO  53  -7.603  22.731   1.342
  373   2HD   PRO  53          1HD       PRO  53  -7.740  20.956   1.429
  374    H    ASP  54           H        ASP  54  -3.629  22.305   0.061
  375    HA   ASP  54           HA       ASP  54  -3.013  24.950  -1.168
  376   1HB   ASP  54          2HB       ASP  54  -3.421  24.798   1.389
  377   2HB   ASP  54          1HB       ASP  54  -1.875  23.940   1.460
  378    H    SER  55           H        SER  55  -1.458  24.651  -2.679
  379    HA   SER  55           HA       SER  55   0.661  24.143  -3.513
  380   1HB   SER  55          2HB       SER  55   1.106  23.818  -0.834
  381   2HB   SER  55          1HB       SER  55   1.413  22.180  -1.401
  382    HG   SER  55           HG       SER  55   2.490  24.406  -2.747
  383    HA   PRO  56           HA       PRO  56   0.282  20.354  -5.793
  384   1HB   PRO  56          2HB       PRO  56   2.625  19.021  -4.480
  385   2HB   PRO  56          1HB       PRO  56   2.288  19.270  -6.205
  386   1HG   PRO  56          2HG       PRO  56   4.077  20.757  -4.984
  387   2HG   PRO  56          1HG       PRO  56   2.950  21.488  -6.145
  388   1HD   PRO  56          2HD       PRO  56   2.885  21.580  -3.139
  389   2HD   PRO  56          1HD       PRO  56   2.545  22.866  -4.323
  390    H    GLU  57           H        GLU  57  -0.407  20.245  -2.613
  391    HA   GLU  57           HA       GLU  57  -0.413  17.623  -1.694
  392   1HB   GLU  57          2HB       GLU  57  -1.429  19.368  -0.341
  393   2HB   GLU  57          1HB       GLU  57  -2.689  19.630  -1.547
  394   1HG   GLU  57          2HG       GLU  57  -3.617  17.416  -1.123
  395   2HG   GLU  57          1HG       GLU  57  -2.277  17.026  -0.042
  396    H    MET  58           H        MET  58  -2.896  19.013  -3.865
  397    HA   MET  58           HA       MET  58  -4.330  16.579  -4.305
  398   1HB   MET  58          2HB       MET  58  -5.043  18.966  -4.885
  399   2HB   MET  58          1HB       MET  58  -4.026  18.815  -6.317
  400   1HG   MET  58          2HG       MET  58  -5.311  16.897  -7.085
  401   2HG   MET  58          1HG       MET  58  -6.273  16.909  -5.606
  402   1HE   MET  58          1HE       MET  58  -8.150  16.710  -7.292
  403   2HE   MET  58          2HE       MET  58  -9.131  18.141  -7.597
  404   3HE   MET  58          3HE       MET  58  -8.722  17.700  -5.942
  405    H    LYS  59           H        LYS  59  -1.592  18.041  -6.041
  406    HA   LYS  59           HA       LYS  59  -1.544  16.215  -8.217
  407   1HB   LYS  59          2HB       LYS  59   0.823  17.634  -6.966
  408   2HB   LYS  59          1HB       LYS  59   0.731  17.002  -8.604
  409   1HG   LYS  59          2HG       LYS  59  -1.332  19.003  -7.683
  410   2HG   LYS  59          1HG       LYS  59   0.266  19.571  -8.145
  411   1HD   LYS  59          2HD       LYS  59  -1.046  17.647 -10.028
  412   2HD   LYS  59          1HD       LYS  59  -1.759  19.251  -9.931
  413   1HE   LYS  59          2HE       LYS  59   0.512  20.236 -10.354
  414   2HE   LYS  59          1HE       LYS  59   1.135  18.601 -10.583
  415   1HZ   LYS  59          1HZ       LYS  59   0.356  19.953 -12.616
  416   2HZ   LYS  59          2HZ       LYS  59  -1.207  19.518 -12.114
  417   3HZ   LYS  59          3HZ       LYS  59  -0.072  18.317 -12.505
  418    H    ASP  60           H        ASP  60   0.624  16.165  -5.317
  419    HA   ASP  60           HA       ASP  60   1.783  13.657  -5.888
  420   1HB   ASP  60          2HB       ASP  60   1.907  13.480  -3.272
  421   2HB   ASP  60          1HB       ASP  60   2.787  14.767  -4.085
  422    H    PHE  61           H        PHE  61  -1.391  14.439  -4.673
  423    HA   PHE  61           HA       PHE  61  -1.971  11.770  -3.735
  424   1HB   PHE  61          2HB       PHE  61  -3.336  13.375  -2.736
  425   2HB   PHE  61          1HB       PHE  61  -3.533  14.293  -4.221
  426    HD1  PHE  61           1HD      PHE  61  -5.933  14.437  -4.196
  427    HD2  PHE  61           2HD      PHE  61  -3.994  10.621  -3.922
  428    HE1  PHE  61           1HE      PHE  61  -8.105  13.305  -4.567
  429    HE2  PHE  61           2HE      PHE  61  -6.158   9.488  -4.312
  430    HZ   PHE  61           HZ       PHE  61  -8.217  10.830  -4.635
  431    H    ARG  62           H        ARG  62  -2.954  13.644  -6.629
  432    HA   ARG  62           HA       ARG  62  -4.171  11.426  -7.903
  433   1HB   ARG  62          2HB       ARG  62  -2.971  13.940  -9.067
  434   2HB   ARG  62          1HB       ARG  62  -3.857  12.752 -10.021
  435   1HG   ARG  62          2HG       ARG  62  -5.641  13.167  -7.958
  436   2HG   ARG  62          1HG       ARG  62  -4.883  14.751  -8.060
  437   1HD   ARG  62          2HD       ARG  62  -5.311  14.482 -10.637
  438   2HD   ARG  62          1HD       ARG  62  -6.504  13.290 -10.127
  439    HE   ARG  62           HE       ARG  62  -6.787  15.762  -8.650
  440   1HH1  ARG  62          1HH2      ARG  62  -7.382  14.166 -11.651
  441   2HH1  ARG  62          2HH2      ARG  62  -8.783  15.114 -12.027
  442   1HH2  ARG  62          1HH1      ARG  62  -8.623  17.006  -9.133
  443   2HH2  ARG  62          2HH1      ARG  62  -9.483  16.712 -10.606
  444    H    HIS  63           H        HIS  63  -0.982  12.868  -8.644
  445    HA   HIS  63           HA       HIS  63  -0.192  10.727 -10.359
  446   1HB   HIS  63          2HB       HIS  63   0.792  13.154  -9.993
  447   2HB   HIS  63          1HB       HIS  63   1.837  12.348  -8.833
  448    HD1  HIS  63           1HD      HIS  63   3.334  13.468 -11.089
  449    HD2  HIS  63           2HD      HIS  63   1.566   9.703 -11.412
  450    HE1  HIS  63           1HE      HIS  63   4.538  12.267 -12.961
  451    H    GLY  64           H        GLY  64   0.412  11.284  -6.891
  452   1HA   GLY  64          2HA       GLY  64   2.205   9.082  -6.540
  453   2HA   GLY  64          1HA       GLY  64   1.326   9.877  -5.248
  454    H    PHE  65           H        PHE  65  -1.276   9.240  -5.608
  455    HA   PHE  65           HA       PHE  65  -1.386   6.505  -4.840
  456   1HB   PHE  65          2HB       PHE  65  -3.520   7.027  -4.232
  457   2HB   PHE  65          1HB       PHE  65  -3.196   8.644  -4.821
  458    HD1  PHE  65           1HD      PHE  65  -4.573   9.531  -6.512
  459    HD2  PHE  65           2HD      PHE  65  -4.300   5.271  -6.044
  460    HE1  PHE  65           1HE      PHE  65  -6.332   9.237  -8.222
  461    HE2  PHE  65           2HE      PHE  65  -6.063   4.979  -7.763
  462    HZ   PHE  65           HZ       PHE  65  -7.078   6.958  -8.853
  463    H    ASP  66           H        ASP  66  -1.451   7.969  -8.002
  464    HA   ASP  66           HA       ASP  66  -2.576   5.661  -9.354
  465   1HB   ASP  66          2HB       ASP  66  -2.610   7.805 -10.494
  466   2HB   ASP  66          1HB       ASP  66  -0.855   7.940 -10.369
  467    H    ILE  67           H        ILE  67   0.705   6.796  -8.656
  468    HA   ILE  67           HA       ILE  67   2.058   4.698 -10.036
  469    HB   ILE  67           HB       ILE  67   2.896   6.326  -7.618
  470   1HG1  ILE  67          2HG1      ILE  67   3.794   6.576 -10.498
  471   2HG1  ILE  67          1HG1      ILE  67   2.370   7.429  -9.901
  472   1HG2  ILE  67          1HG2      ILE  67   4.426   4.414  -9.401
  473   2HG2  ILE  67          2HG2      ILE  67   4.267   4.348  -7.647
  474   3HG2  ILE  67          3HG2      ILE  67   5.220   5.629  -8.396
  475   1HD1  ILE  67          1HD1      ILE  67   5.112   7.632  -8.618
  476   2HD1  ILE  67          2HD1      ILE  67   3.694   8.610  -8.254
  477   3HD1  ILE  67          3HD1      ILE  67   4.503   8.780  -9.809
  478    H    LEU  68           H        LEU  68   1.280   4.963  -6.540
  479    HA   LEU  68           HA       LEU  68   2.111   2.357  -5.818
  480   1HB   LEU  68          2HB       LEU  68   0.344   4.441  -4.670
  481   2HB   LEU  68          1HB       LEU  68  -0.137   2.809  -4.208
  482    HG   LEU  68           HG       LEU  68   2.213   2.368  -3.470
  483   1HD1  LEU  68          1HD1      LEU  68   3.386   4.020  -4.851
  484   2HD1  LEU  68          2HD1      LEU  68   3.691   4.350  -3.148
  485   3HD1  LEU  68          3HD1      LEU  68   2.531   5.330  -4.042
  486   1HD2  LEU  68          1HD2      LEU  68   2.000   3.565  -1.405
  487   2HD2  LEU  68          2HD2      LEU  68   0.363   3.238  -1.969
  488   3HD2  LEU  68          3HD2      LEU  68   1.059   4.843  -2.175
  489    H    VAL  69           H        VAL  69  -1.166   3.417  -6.844
  490    HA   VAL  69           HA       VAL  69  -2.261   0.780  -6.876
  491    HB   VAL  69           HB       VAL  69  -2.960   3.391  -8.214
  492   1HG1  VAL  69          1HG1      VAL  69  -4.061   0.676  -8.908
  493   2HG1  VAL  69          2HG1      VAL  69  -3.678   2.029  -9.974
  494   3HG1  VAL  69          3HG1      VAL  69  -5.118   2.090  -8.956
  495   1HG2  VAL  69          1HG2      VAL  69  -3.532   2.971  -5.837
  496   2HG2  VAL  69          2HG2      VAL  69  -4.448   1.543  -6.321
  497   3HG2  VAL  69          3HG2      VAL  69  -4.976   3.146  -6.829
  498    H    GLY  70           H        GLY  70  -0.326   2.554  -9.227
  499   1HA   GLY  70          2HA       GLY  70  -0.723   0.777 -11.443
  500   2HA   GLY  70          1HA       GLY  70   0.624   1.893 -11.261
  501    H    GLN  71           H        GLN  71   2.106   0.989  -9.219
  502    HA   GLN  71           HA       GLN  71   3.328  -1.380 -10.300
  503   1HB   GLN  71          2HB       GLN  71   4.439  -1.118  -7.751
  504   2HB   GLN  71          1HB       GLN  71   5.020  -0.293  -9.196
  505   1HG   GLN  71          2HG       GLN  71   3.821   1.672  -8.704
  506   2HG   GLN  71          1HG       GLN  71   2.800   0.862  -7.515
  507   1HE2  GLN  71          1HE2      GLN  71   3.819   3.005  -6.397
  508   2HE2  GLN  71          2HE2      GLN  71   5.213   2.686  -5.466
  509    H    ILE  72           H        ILE  72   1.190  -0.878  -7.510
  510    HA   ILE  72           HA       ILE  72   1.477  -3.518  -6.450
  511    HB   ILE  72           HB       ILE  72  -0.942  -1.682  -6.431
  512   1HG1  ILE  72          2HG1      ILE  72   1.112  -2.074  -4.244
  513   2HG1  ILE  72          1HG1      ILE  72   1.342  -0.860  -5.498
  514   1HG2  ILE  72          1HG2      ILE  72  -1.941  -3.061  -4.857
  515   2HG2  ILE  72          2HG2      ILE  72  -0.407  -3.635  -4.223
  516   3HG2  ILE  72          3HG2      ILE  72  -1.040  -4.304  -5.716
  517   1HD1  ILE  72          1HD1      ILE  72  -0.831  -1.022  -3.404
  518   2HD1  ILE  72          2HD1      ILE  72  -1.024  -0.023  -4.846
  519   3HD1  ILE  72          3HD1      ILE  72   0.289   0.301  -3.717
  520    H    ASP  73           H        ASP  73  -0.627  -2.144  -8.950
  521    HA   ASP  73           HA       ASP  73  -2.093  -4.561  -9.460
  522   1HB   ASP  73          2HB       ASP  73  -2.841  -2.348 -10.275
  523   2HB   ASP  73          1HB       ASP  73  -1.425  -2.250 -11.319
  524    H    ASP  74           H        ASP  74   0.835  -3.121 -10.908
  525    HA   ASP  74           HA       ASP  74   1.305  -5.239 -12.785
  526   1HB   ASP  74          2HB       ASP  74   3.393  -3.464 -11.533
  527   2HB   ASP  74          1HB       ASP  74   3.459  -4.251 -13.107
  528    H    ALA  75           H        ALA  75   2.399  -4.738  -9.435
  529    HA   ALA  75           HA       ALA  75   4.268  -6.926  -9.474
  530   1HB   ALA  75          1HB       ALA  75   4.377  -6.622  -7.055
  531   2HB   ALA  75          2HB       ALA  75   2.910  -5.644  -7.087
  532   3HB   ALA  75          3HB       ALA  75   4.385  -5.048  -7.849
  533    H    LEU  76           H        LEU  76   0.839  -6.681  -8.680
  534    HA   LEU  76           HA       LEU  76   0.683  -9.248  -7.394
  535   1HB   LEU  76          2HB       LEU  76  -1.045  -7.454  -7.183
  536   2HB   LEU  76          1HB       LEU  76  -1.501  -7.723  -8.861
  537    HG   LEU  76           HG       LEU  76  -1.459 -10.192  -7.184
  538   1HD1  LEU  76          1HD1      LEU  76  -3.419  -7.945  -6.643
  539   2HD1  LEU  76          2HD1      LEU  76  -2.381  -8.773  -5.483
  540   3HD1  LEU  76          3HD1      LEU  76  -3.737  -9.627  -6.217
  541   1HD2  LEU  76          1HD2      LEU  76  -2.325  -9.829  -9.610
  542   2HD2  LEU  76          2HD2      LEU  76  -3.743  -9.113  -8.845
  543   3HD2  LEU  76          3HD2      LEU  76  -3.314 -10.793  -8.514
  544    H    LYS  77           H        LYS  77   0.023  -8.218 -10.768
  545    HA   LYS  77           HA       LYS  77  -0.678 -10.814 -11.712
  546   1HB   LYS  77          2HB       LYS  77   0.022 -10.005 -13.970
  547   2HB   LYS  77          1HB       LYS  77  -1.063  -8.886 -13.150
  548   1HG   LYS  77          2HG       LYS  77   0.766  -7.445 -12.546
  549   2HG   LYS  77          1HG       LYS  77   1.956  -8.605 -13.099
  550   1HD   LYS  77          2HD       LYS  77  -0.063  -7.224 -14.872
  551   2HD   LYS  77          1HD       LYS  77   1.627  -6.765 -14.693
  552   1HE   LYS  77          2HE       LYS  77   1.832  -8.126 -16.555
  553   2HE   LYS  77          1HE       LYS  77   2.007  -9.363 -15.309
  554   1HZ   LYS  77          1HZ       LYS  77   0.073 -10.278 -15.872
  555   2HZ   LYS  77          2HZ       LYS  77   0.151  -9.348 -17.292
  556   3HZ   LYS  77          3HZ       LYS  77  -0.730  -8.787 -15.952
  557    H    LEU  78           H        LEU  78   2.476  -9.219 -11.351
  558    HA   LEU  78           HA       LEU  78   4.044 -11.247 -12.562
  559   1HB   LEU  78          2HB       LEU  78   4.637  -8.845 -11.472
  560   2HB   LEU  78          1HB       LEU  78   5.103  -9.861 -10.116
  561    HG   LEU  78           HG       LEU  78   7.043  -9.482 -11.530
  562   1HD1  LEU  78          1HD1      LEU  78   6.066 -12.306 -12.046
  563   2HD1  LEU  78          2HD1      LEU  78   6.652 -11.745 -10.478
  564   3HD1  LEU  78          3HD1      LEU  78   7.735 -11.754 -11.868
  565   1HD2  LEU  78          1HD2      LEU  78   5.332  -9.322 -13.653
  566   2HD2  LEU  78          2HD2      LEU  78   5.952 -10.956 -13.887
  567   3HD2  LEU  78          3HD2      LEU  78   7.065  -9.594 -13.822
  568    H    ALA  79           H        ALA  79   2.982 -10.830  -9.185
  569    HA   ALA  79           HA       ALA  79   4.144 -13.214  -8.162
  570   1HB   ALA  79          1HB       ALA  79   3.113 -11.499  -6.708
  571   2HB   ALA  79          2HB       ALA  79   2.387 -13.080  -6.417
  572   3HB   ALA  79          3HB       ALA  79   1.531 -11.880  -7.384
  573    H    ASN  80           H        ASN  80   0.974 -12.610  -9.680
  574    HA   ASN  80           HA       ASN  80  -0.006 -15.288  -9.517
  575   1HB   ASN  80          2HB       ASN  80  -0.507 -13.133 -11.579
  576   2HB   ASN  80          1HB       ASN  80  -1.423 -14.636 -11.470
  577   1HD2  ASN  80          1HD2      ASN  80  -3.229 -12.967 -11.064
  578   2HD2  ASN  80          2HD2      ASN  80  -3.505 -12.491  -9.460
  579    H    GLU  81           H        GLU  81   1.107 -13.725 -12.498
  580    HA   GLU  81           HA       GLU  81   1.747 -16.201 -13.819
  581   1HB   GLU  81          2HB       GLU  81   1.079 -14.267 -15.093
  582   2HB   GLU  81          1HB       GLU  81   2.368 -13.291 -14.401
  583   1HG   GLU  81          2HG       GLU  81   2.704 -14.182 -16.791
  584   2HG   GLU  81          1HG       GLU  81   4.037 -14.406 -15.670
  585    H    GLY  82           H        GLY  82   3.319 -15.054 -11.220
  586   1HA   GLY  82          2HA       GLY  82   5.946 -16.104 -12.163
  587   2HA   GLY  82          1HA       GLY  82   5.906 -14.551 -11.356
  588    H    LYS  83           H        LYS  83   7.424 -16.523 -10.255
  589    HA   LYS  83           HA       LYS  83   5.928 -17.992  -8.215
  590   1HB   LYS  83          2HB       LYS  83   8.877 -17.489  -8.684
  591   2HB   LYS  83          1HB       LYS  83   8.288 -18.386  -7.295
  592   1HG   LYS  83          2HG       LYS  83   7.018 -19.826  -9.094
  593   2HG   LYS  83          1HG       LYS  83   8.192 -19.132 -10.211
  594   1HD   LYS  83          2HD       LYS  83  10.044 -20.011  -8.913
  595   2HD   LYS  83          1HD       LYS  83   8.950 -20.552  -7.639
  596   1HE   LYS  83          2HE       LYS  83   7.817 -21.996  -9.425
  597   2HE   LYS  83          1HE       LYS  83   9.202 -21.631 -10.455
  598   1HZ   LYS  83          1HZ       LYS  83  10.564 -22.912  -9.227
  599   2HZ   LYS  83          2HZ       LYS  83   9.123 -23.688  -8.776
  600   3HZ   LYS  83          3HZ       LYS  83   9.817 -22.519  -7.758
  601    H    VAL  84           H        VAL  84   7.564 -17.490  -5.949
  602    HA   VAL  84           HA       VAL  84   6.492 -14.870  -5.137
  603    HB   VAL  84           HB       VAL  84   7.941 -17.049  -3.617
  604   1HG1  VAL  84          1HG1      VAL  84   8.507 -15.118  -2.408
  605   2HG1  VAL  84          2HG1      VAL  84   7.017 -15.623  -1.617
  606   3HG1  VAL  84          3HG1      VAL  84   6.989 -14.310  -2.793
  607   1HG2  VAL  84          1HG2      VAL  84   5.049 -16.219  -3.920
  608   2HG2  VAL  84          2HG2      VAL  84   5.586 -17.079  -2.480
  609   3HG2  VAL  84          3HG2      VAL  84   5.760 -17.826  -4.065
  610    H    LYS  85           H        LYS  85   9.522 -16.516  -5.718
  611    HA   LYS  85           HA       LYS  85  11.296 -14.503  -4.768
  612   1HB   LYS  85          2HB       LYS  85  11.962 -16.834  -5.296
  613   2HB   LYS  85          1HB       LYS  85  11.641 -16.536  -6.998
  614   1HG   LYS  85          2HG       LYS  85  13.990 -16.300  -6.729
  615   2HG   LYS  85          1HG       LYS  85  13.366 -14.663  -6.870
  616   1HD   LYS  85          2HD       LYS  85  13.561 -14.288  -4.508
  617   2HD   LYS  85          1HD       LYS  85  13.833 -16.001  -4.192
  618   1HE   LYS  85          2HE       LYS  85  15.698 -14.113  -5.657
  619   2HE   LYS  85          1HE       LYS  85  15.957 -14.821  -4.065
  620   1HZ   LYS  85          1HZ       LYS  85  16.256 -16.010  -6.691
  621   2HZ   LYS  85          2HZ       LYS  85  15.527 -17.006  -5.523
  622   3HZ   LYS  85          3HZ       LYS  85  17.071 -16.353  -5.242
  623    H    GLU  86           H        GLU  86   9.947 -15.131  -8.029
  624    HA   GLU  86           HA       GLU  86  11.189 -12.878  -9.288
  625   1HB   GLU  86          2HB       GLU  86   8.492 -14.050 -10.016
  626   2HB   GLU  86          1HB       GLU  86   9.623 -13.218 -11.082
  627   1HG   GLU  86          2HG       GLU  86  10.155 -15.858  -9.691
  628   2HG   GLU  86          1HG       GLU  86   9.727 -15.673 -11.392
  629    H    ALA  87           H        ALA  87   8.185 -13.250  -7.455
  630    HA   ALA  87           HA       ALA  87   7.065 -10.689  -8.058
  631   1HB   ALA  87          1HB       ALA  87   6.005 -12.739  -6.853
  632   2HB   ALA  87          2HB       ALA  87   5.524 -11.125  -6.335
  633   3HB   ALA  87          3HB       ALA  87   6.698 -12.044  -5.389
  634    H    GLN  88           H        GLN  88   8.802 -11.688  -5.078
  635    HA   GLN  88           HA       GLN  88   9.018  -9.068  -4.023
  636   1HB   GLN  88          2HB       GLN  88  10.426  -9.977  -2.396
  637   2HB   GLN  88          1HB       GLN  88   9.492 -11.373  -2.919
  638   1HG   GLN  88          2HG       GLN  88  11.617 -12.271  -3.028
  639   2HG   GLN  88          1HG       GLN  88  11.499 -11.634  -4.656
  640   1HE2  GLN  88          1HE2      GLN  88  11.667  -8.816  -3.231
  641   2HE2  GLN  88          2HE2      GLN  88  13.336  -8.619  -3.013
  642    H    ALA  89           H        ALA  89  10.835 -10.652  -6.530
  643    HA   ALA  89           HA       ALA  89  13.199  -9.069  -6.498
  644   1HB   ALA  89          1HB       ALA  89  13.520  -9.787  -8.771
  645   2HB   ALA  89          2HB       ALA  89  11.795 -10.089  -8.980
  646   3HB   ALA  89          3HB       ALA  89  12.751 -11.125  -7.921
  647    H    ALA  90           H        ALA  90  10.159  -8.588  -8.311
  648    HA   ALA  90           HA       ALA  90  10.848  -6.128  -9.523
  649   1HB   ALA  90          1HB       ALA  90   8.395  -5.767  -9.711
  650   2HB   ALA  90          2HB       ALA  90   8.133  -7.128  -8.621
  651   3HB   ALA  90          3HB       ALA  90   8.870  -7.396 -10.199
  652    H    ALA  91           H        ALA  91   9.651  -6.869  -6.287
  653    HA   ALA  91           HA       ALA  91   8.981  -4.180  -5.535
  654   1HB   ALA  91          1HB       ALA  91   8.390  -6.346  -4.297
  655   2HB   ALA  91          2HB       ALA  91   8.916  -4.994  -3.292
  656   3HB   ALA  91          3HB       ALA  91  10.035  -6.305  -3.661
  657    H    GLU  92           H        GLU  92  12.002  -6.010  -5.485
  658    HA   GLU  92           HA       GLU  92  13.551  -4.213  -3.924
  659   1HB   GLU  92          2HB       GLU  92  14.425  -5.972  -6.230
  660   2HB   GLU  92          1HB       GLU  92  15.491  -5.278  -5.008
  661   1HG   GLU  92          2HG       GLU  92  13.150  -6.847  -3.991
  662   2HG   GLU  92          1HG       GLU  92  14.425  -7.765  -4.781
  663    H    GLN  93           H        GLN  93  13.191  -4.371  -7.503
  664    HA   GLN  93           HA       GLN  93  14.837  -2.048  -7.924
  665   1HB   GLN  93          2HB       GLN  93  13.586  -1.890 -10.140
  666   2HB   GLN  93          1HB       GLN  93  14.399  -3.425  -9.833
  667   1HG   GLN  93          2HG       GLN  93  12.276  -4.380  -9.023
  668   2HG   GLN  93          1HG       GLN  93  11.459  -2.857  -9.366
  669   1HE2  GLN  93          1HE2      GLN  93  10.676  -2.583 -11.473
  670   2HE2  GLN  93          2HE2      GLN  93  11.073  -3.582 -12.787
  671    H    LEU  94           H        LEU  94  11.347  -2.446  -7.367
  672    HA   LEU  94           HA       LEU  94  10.813   0.399  -7.663
  673   1HB   LEU  94          2HB       LEU  94   9.215  -1.917  -6.556
  674   2HB   LEU  94          1HB       LEU  94   8.610  -0.261  -6.508
  675    HG   LEU  94           HG       LEU  94   9.604  -1.447  -9.103
  676   1HD1  LEU  94          1HD1      LEU  94   6.844  -1.749  -7.890
  677   2HD1  LEU  94          2HD1      LEU  94   7.961  -3.045  -8.318
  678   3HD1  LEU  94          3HD1      LEU  94   7.225  -2.064  -9.585
  679   1HD2  LEU  94          1HD2      LEU  94   7.658   0.759  -8.345
  680   2HD2  LEU  94          2HD2      LEU  94   7.821   0.140  -9.987
  681   3HD2  LEU  94          3HD2      LEU  94   9.188   0.927  -9.203
  682    H    LYS  95           H        LYS  95  12.051  -1.616  -5.137
  683    HA   LYS  95           HA       LYS  95  11.184   0.002  -2.903
  684   1HB   LYS  95          2HB       LYS  95  12.013  -2.196  -2.415
  685   2HB   LYS  95          1HB       LYS  95  13.504  -1.910  -3.295
  686   1HG   LYS  95          2HG       LYS  95  12.981  -0.006  -1.064
  687   2HG   LYS  95          1HG       LYS  95  13.279  -1.670  -0.573
  688   1HD   LYS  95          2HD       LYS  95  15.430  -1.710  -1.575
  689   2HD   LYS  95          1HD       LYS  95  15.111  -0.260  -2.523
  690   1HE   LYS  95          2HE       LYS  95  15.421  -0.407   0.490
  691   2HE   LYS  95          1HE       LYS  95  16.561   0.313  -0.649
  692   1HZ   LYS  95          1HZ       LYS  95  14.261   1.560  -1.269
  693   2HZ   LYS  95          2HZ       LYS  95  15.448   2.185  -0.226
  694   3HZ   LYS  95          3HZ       LYS  95  14.095   1.372   0.408
  695    H    THR  96           H        THR  96  13.836   0.122  -5.192
  696    HA   THR  96           HA       THR  96  15.318   2.219  -3.882
  697    HB   THR  96           HB       THR  96  15.266   1.471  -6.821
  698    HG1  THR  96           1HG      THR  96  16.278   0.211  -4.575
  699   1HG2  THR  96          1HG2      THR  96  17.569   2.512  -5.183
  700   2HG2  THR  96          2HG2      THR  96  16.451   3.594  -6.011
  701   3HG2  THR  96          3HG2      THR  96  17.420   2.448  -6.937
  702    H    THR  97           H        THR  97  12.760   2.082  -6.346
  703    HA   THR  97           HA       THR  97  12.792   4.985  -6.729
  704    HB   THR  97           HB       THR  97  10.664   3.070  -7.700
  705    HG1  THR  97           1HG      THR  97  12.937   3.646  -9.215
  706   1HG2  THR  97          1HG2      THR  97  10.449   4.649  -9.491
  707   2HG2  THR  97          2HG2      THR  97  11.908   5.501  -8.989
  708   3HG2  THR  97          3HG2      THR  97  10.460   5.566  -7.986
  709    H    GLY  98           H        GLY  98  10.002   2.872  -6.028
  710   1HA   GLY  98          2HA       GLY  98   8.148   3.259  -4.647
  711   2HA   GLY  98          1HA       GLY  98   9.353   3.764  -3.461
  712    H    ARG  99           H        ARG  99   7.038   4.863  -5.826
  713    HA   ARG  99           HA       ARG  99   6.193   6.993  -6.311
  714   1HB   ARG  99          2HB       ARG  99   5.476   6.870  -3.986
  715   2HB   ARG  99          1HB       ARG  99   7.060   7.422  -3.439
  716   1HG   ARG  99          2HG       ARG  99   6.710   9.611  -4.161
  717   2HG   ARG  99          1HG       ARG  99   5.557   9.132  -5.407
  718   1HD   ARG  99          2HD       ARG  99   4.708  10.312  -3.196
  719   2HD   ARG  99          1HD       ARG  99   3.782   8.993  -3.908
  720    HE   ARG  99           HE       ARG  99   5.753   8.107  -1.939
  721   1HH1  ARG  99          1HH2      ARG  99   2.572   9.284  -2.562
  722   2HH1  ARG  99          2HH2      ARG  99   1.891   8.589  -1.132
  723   1HH2  ARG  99          1HH1      ARG  99   4.878   7.192  -0.068
  724   2HH2  ARG  99          2HH1      ARG  99   3.197   7.405   0.282
  725    H    ALA 100           H        ALA 100   8.611   8.245  -4.062
  726    HA   ALA 100           HA       ALA 100  10.624   9.406  -4.469
  727   1HB   ALA 100          1HB       ALA 100  10.185   9.480  -7.437
  728   2HB   ALA 100          2HB       ALA 100  10.621   7.943  -6.694
  729   3HB   ALA 100          3HB       ALA 100  11.689   9.332  -6.525
  730    H    GLY 101           H        GLY 101   8.294  10.597  -3.791
  731   1HA   GLY 101          2HA       GLY 101   8.668  13.293  -4.839
  732   2HA   GLY 101          1HA       GLY 101   7.111  12.590  -5.274
  733    H    ASN 102           H        ASN 102   8.388  11.466  -2.300
  734    HA   ASN 102           HA       ASN 102   6.236  12.837  -0.832
  735   1HB   ASN 102          2HB       ASN 102   6.976  10.353  -0.607
  736   2HB   ASN 102          1HB       ASN 102   8.286  10.991   0.390
  737   1HD2  ASN 102          1HD2      ASN 102   7.139  12.939   1.923
  738   2HD2  ASN 102          2HD2      ASN 102   5.834  12.335   2.825
  739    H    GLN 103           H        GLN 103   8.533  14.453  -1.771
  740    HA   GLN 103           HA       GLN 103   9.534  15.424   0.883
  741   1HB   GLN 103          2HB       GLN 103  11.258  14.260  -0.577
  742   2HB   GLN 103          1HB       GLN 103  11.019  15.568  -1.744
  743   1HG   GLN 103          2HG       GLN 103  11.513  17.188   0.158
  744   2HG   GLN 103          1HG       GLN 103  12.061  15.794   1.087
  745   1HE2  GLN 103          1HE2      GLN 103  12.556  17.232  -2.193
  746   2HE2  GLN 103          2HE2      GLN 103  14.218  16.874  -2.253
  747    H    LYS 104           H        LYS 104   8.326  16.112  -2.310
  748    HA   LYS 104           HA       LYS 104   8.592  19.018  -1.920
  749   1HB   LYS 104          2HB       LYS 104   8.234  19.177  -4.202
  750   2HB   LYS 104          1HB       LYS 104   8.760  17.501  -4.148
  751   1HG   LYS 104          2HG       LYS 104   6.228  16.925  -3.825
  752   2HG   LYS 104          1HG       LYS 104   5.945  18.576  -4.385
  753   1HD   LYS 104          2HD       LYS 104   7.405  18.019  -6.402
  754   2HD   LYS 104          1HD       LYS 104   7.324  16.336  -5.884
  755   1HE   LYS 104          2HE       LYS 104   4.889  16.350  -6.063
  756   2HE   LYS 104          1HE       LYS 104   4.900  18.070  -6.456
  757   1HZ   LYS 104          1HZ       LYS 104   6.140  15.908  -8.071
  758   2HZ   LYS 104          2HZ       LYS 104   6.183  17.566  -8.445
  759   3HZ   LYS 104          3HZ       LYS 104   4.702  16.733  -8.444
  760    H    GLY 105           H        GLY 105   6.385  16.514  -1.279
  761   1HA   GLY 105          2HA       GLY 105   4.305  18.470  -0.483
  762   2HA   GLY 105          1HA       GLY 105   3.859  17.214  -1.647
  763    H    GLY 106           H        GLY 106   6.126  16.788   1.032
  764   1HA   GLY 106          2HA       GLY 106   4.381  14.625   2.095
  765   2HA   GLY 106          1HA       GLY 106   6.095  14.832   2.451
  Start of MODEL    9
    1   1H    ALA   1          1HT       ALA   1  -3.257  -6.162  13.825
    2   2H    ALA   1          2HT       ALA   1  -4.128  -5.555  15.149
    3   3H    ALA   1          3HT       ALA   1  -2.517  -5.079  14.902
    4    HA   ALA   1           HA       ALA   1  -4.475  -4.559  12.782
    5   1HB   ALA   1          1HB       ALA   1  -5.526  -3.784  14.914
    6   2HB   ALA   1          2HB       ALA   1  -5.113  -2.447  13.839
    7   3HB   ALA   1          3HB       ALA   1  -4.094  -2.807  15.232
    8    H    ASP   2           H        ASP   2  -2.811  -4.370  11.287
    9    HA   ASP   2           HA       ASP   2  -0.934  -3.458  10.221
   10   1HB   ASP   2          2HB       ASP   2  -1.355  -1.075  12.041
   11   2HB   ASP   2          1HB       ASP   2  -0.652  -1.092  10.422
   12    H    LEU   3           H        LEU   3   0.762  -4.753  10.944
   13    HA   LEU   3           HA       LEU   3   2.499  -3.599  13.042
   14   1HB   LEU   3          2HB       LEU   3   2.747  -6.093  13.905
   15   2HB   LEU   3          1HB       LEU   3   1.454  -5.071  14.519
   16    HG   LEU   3           HG       LEU   3   0.741  -6.551  12.028
   17   1HD1  LEU   3          1HD1      LEU   3   1.939  -8.385  12.898
   18   2HD1  LEU   3          2HD1      LEU   3   0.290  -8.655  13.460
   19   3HD1  LEU   3          3HD1      LEU   3   1.502  -7.998  14.561
   20   1HD2  LEU   3          1HD2      LEU   3  -0.705  -6.614  14.676
   21   2HD2  LEU   3          2HD2      LEU   3  -1.376  -6.679  13.044
   22   3HD2  LEU   3          3HD2      LEU   3  -0.740  -5.161  13.680
   23    H    GLU   4           H        GLU   4   2.454  -6.839  11.600
   24    HA   GLU   4           HA       GLU   4   4.167  -7.977  10.484
   25   1HB   GLU   4          2HB       GLU   4   4.598  -7.079   8.273
   26   2HB   GLU   4          1HB       GLU   4   2.930  -6.743   8.692
   27   1HG   GLU   4          2HG       GLU   4   3.355  -4.446   9.094
   28   2HG   GLU   4          1HG       GLU   4   5.097  -4.678   9.167
   29    H    ASP   5           H        ASP   5   6.393  -6.561   9.016
   30    HA   ASP   5           HA       ASP   5   8.629  -6.113   9.492
   31   1HB   ASP   5          2HB       ASP   5   8.976  -4.057  10.569
   32   2HB   ASP   5          1HB       ASP   5   7.305  -3.927  10.030
   33    H    ASN   6           H        ASN   6   6.876  -7.980  11.426
   34    HA   ASN   6           HA       ASN   6   8.835  -8.141  13.653
   35   1HB   ASN   6          2HB       ASN   6   6.077  -9.292  13.211
   36   2HB   ASN   6          1HB       ASN   6   7.092  -9.744  14.585
   37   1HD2  ASN   6          1HD2      ASN   6   4.604  -7.725  13.858
   38   2HD2  ASN   6          2HD2      ASN   6   4.943  -6.436  14.910
   39    H    ASP   7           H        ASP   7  10.528  -9.481  13.250
   40    HA   ASP   7           HA       ASP   7   9.975 -12.166  12.101
   41   1HB   ASP   7          2HB       ASP   7  12.199 -11.823  10.779
   42   2HB   ASP   7          1HB       ASP   7  10.721 -11.110  10.133
   43    H    GLU   8           H        GLU   8  10.333 -12.926  14.244
   44    HA   GLU   8           HA       GLU   8  11.615 -13.700  16.037
   45   1HB   GLU   8          2HB       GLU   8  13.855 -13.526  14.014
   46   2HB   GLU   8          1HB       GLU   8  13.805 -14.554  15.447
   47   1HG   GLU   8          2HG       GLU   8  11.744 -15.647  14.497
   48   2HG   GLU   8          1HG       GLU   8  12.014 -14.734  13.013
   49    H    THR   9           H        THR   9  11.384 -10.759  15.658
   50    HA   THR   9           HA       THR   9  13.982  -9.764  16.644
   51    HB   THR   9           HB       THR   9  11.392  -8.413  15.836
   52    HG1  THR   9           1HG      THR   9  12.488  -8.700  14.048
   53   1HG2  THR   9          1HG2      THR   9  12.081  -6.967  17.526
   54   2HG2  THR   9          2HG2      THR   9  12.936  -6.304  16.133
   55   3HG2  THR   9          3HG2      THR   9  13.790  -7.328  17.287
   56    H    GLY  10           H        GLY  10  11.495 -11.353  17.861
   57   1HA   GLY  10          2HA       GLY  10  11.901 -10.268  20.589
   58   2HA   GLY  10          1HA       GLY  10  10.239 -10.302  19.986
   59    H    ASN  11           H        ASN  11  10.347 -12.664  18.500
   60    HA   ASN  11           HA       ASN  11   9.813 -14.907  18.869
   61   1HB   ASN  11          2HB       ASN  11  11.701 -16.234  19.411
   62   2HB   ASN  11          1HB       ASN  11  12.349 -14.788  18.635
   63   1HD2  ASN  11          1HD2      ASN  11  11.904 -16.369  21.804
   64   2HD2  ASN  11          2HD2      ASN  11  13.092 -15.462  22.607
   65    H    ASP  12           H        ASP  12   8.991 -12.947  21.024
   66    HA   ASP  12           HA       ASP  12   8.988 -14.719  23.416
   67   1HB   ASP  12          2HB       ASP  12   9.435 -12.228  23.645
   68   2HB   ASP  12          1HB       ASP  12   7.771 -11.952  23.130
   69    H    ASN  13           H        ASN  13   7.182 -13.900  20.673
   70    HA   ASN  13           HA       ASN  13   5.013 -15.692  21.450
   71   1HB   ASN  13          2HB       ASN  13   4.251 -13.582  22.495
   72   2HB   ASN  13          1HB       ASN  13   4.396 -12.765  20.938
   73   1HD2  ASN  13          1HD2      ASN  13   2.258 -12.455  20.230
   74   2HD2  ASN  13          2HD2      ASN  13   1.077 -13.674  20.185
   75    H    GLY  14           H        GLY  14   7.131 -14.990  19.302
   76   1HA   GLY  14          2HA       GLY  14   7.289 -15.514  17.012
   77   2HA   GLY  14          1HA       GLY  14   5.565 -15.888  17.025
   78    H    LYS  15           H        LYS  15   4.672 -13.433  18.090
   79    HA   LYS  15           HA       LYS  15   3.768 -11.462  17.135
   80   1HB   LYS  15          2HB       LYS  15   6.766 -11.090  17.043
   81   2HB   LYS  15          1HB       LYS  15   5.623  -9.778  16.762
   82   1HG   LYS  15          2HG       LYS  15   5.105  -9.588  18.991
   83   2HG   LYS  15          1HG       LYS  15   5.024 -11.331  19.215
   84   1HD   LYS  15          2HD       LYS  15   7.395 -11.502  19.492
   85   2HD   LYS  15          1HD       LYS  15   7.644  -9.834  18.969
   86   1HE   LYS  15          2HE       LYS  15   7.755 -10.100  21.461
   87   2HE   LYS  15          1HE       LYS  15   6.483  -8.994  20.944
   88   1HZ   LYS  15          1HZ       LYS  15   4.962 -10.980  21.027
   89   2HZ   LYS  15          2HZ       LYS  15   5.520 -10.416  22.529
   90   3HZ   LYS  15          3HZ       LYS  15   6.206 -11.805  21.832
   91    H    GLY  16           H        GLY  16   4.312 -13.685  15.158
   92   1HA   GLY  16          2HA       GLY  16   5.069 -12.190  12.711
   93   2HA   GLY  16          1HA       GLY  16   4.732 -13.920  12.809
   94    H    GLY  17           H        GLY  17   2.480 -14.594  12.973
   95   1HA   GLY  17          2HA       GLY  17   0.199 -14.466  12.431
   96   2HA   GLY  17          1HA       GLY  17   0.283 -12.748  12.817
   97    H    GLU  18           H        GLU  18   2.623 -12.956  10.623
   98    HA   GLU  18           HA       GLU  18   0.816 -12.196   8.391
   99   1HB   GLU  18          2HB       GLU  18   2.726 -10.720   9.018
  100   2HB   GLU  18          1HB       GLU  18   3.835 -12.028   8.611
  101   1HG   GLU  18          2HG       GLU  18   3.270 -11.953   6.311
  102   2HG   GLU  18          1HG       GLU  18   1.810 -11.007   6.615
  103    H    LYS  19           H        LYS  19   2.820 -14.790   9.455
  104    HA   LYS  19           HA       LYS  19   3.491 -16.786   8.457
  105   1HB   LYS  19          2HB       LYS  19   1.623 -17.919   7.812
  106   2HB   LYS  19          1HB       LYS  19   0.759 -16.398   7.956
  107   1HG   LYS  19          2HG       LYS  19   1.339 -15.925   5.537
  108   2HG   LYS  19          1HG       LYS  19   2.003 -17.557   5.429
  109   1HD   LYS  19          2HD       LYS  19  -0.844 -16.890   6.252
  110   2HD   LYS  19          1HD       LYS  19  -0.364 -17.425   4.643
  111   1HE   LYS  19          2HE       LYS  19  -0.982 -19.456   5.593
  112   2HE   LYS  19          1HE       LYS  19   0.733 -19.439   6.001
  113   1HZ   LYS  19          1HZ       LYS  19  -1.496 -19.443   7.725
  114   2HZ   LYS  19          2HZ       LYS  19  -0.605 -18.019   7.984
  115   3HZ   LYS  19          3HZ       LYS  19   0.151 -19.536   8.122
  116    H    ALA  20           H        ALA  20   4.063 -17.814   6.305
  117    HA   ALA  20           HA       ALA  20   4.703 -15.923   4.134
  118   1HB   ALA  20          1HB       ALA  20   6.856 -17.557   5.523
  119   2HB   ALA  20          2HB       ALA  20   6.654 -15.816   5.710
  120   3HB   ALA  20          3HB       ALA  20   7.082 -16.488   4.139
  121    H    ASP  21           H        ASP  21   2.902 -17.590   3.564
  122    HA   ASP  21           HA       ASP  21   3.775 -20.316   3.065
  123   1HB   ASP  21          2HB       ASP  21   1.350 -19.445   3.486
  124   2HB   ASP  21          1HB       ASP  21   1.373 -19.022   1.776
  125    H    ASN  22           H        ASN  22   4.944 -17.727   1.824
  126    HA   ASN  22           HA       ASN  22   5.949 -17.153  -0.203
  127   1HB   ASN  22          2HB       ASN  22   5.969 -20.065  -0.062
  128   2HB   ASN  22          1HB       ASN  22   5.765 -19.563  -1.731
  129   1HD2  ASN  22          1HD2      ASN  22   7.467 -17.988  -2.582
  130   2HD2  ASN  22          2HD2      ASN  22   9.029 -18.086  -1.929
  131    H    ALA  23           H        ALA  23   4.542 -15.776  -1.156
  132    HA   ALA  23           HA       ALA  23   3.222 -15.164  -3.055
  133   1HB   ALA  23          1HB       ALA  23   3.295 -17.661  -3.781
  134   2HB   ALA  23          2HB       ALA  23   1.940 -16.668  -4.310
  135   3HB   ALA  23          3HB       ALA  23   1.735 -17.783  -2.962
  136    H    ALA  24           H        ALA  24   1.896 -16.924  -0.271
  137    HA   ALA  24           HA       ALA  24  -0.680 -15.609  -0.373
  138   1HB   ALA  24          1HB       ALA  24  -0.332 -17.651   0.970
  139   2HB   ALA  24          2HB       ALA  24  -0.888 -16.329   1.993
  140   3HB   ALA  24          3HB       ALA  24   0.813 -16.785   1.997
  141    H    GLN  25           H        GLN  25   2.104 -15.089   1.813
  142    HA   GLN  25           HA       GLN  25   1.192 -12.605   2.840
  143   1HB   GLN  25          2HB       GLN  25   3.429 -12.318   3.691
  144   2HB   GLN  25          1HB       GLN  25   3.065 -14.042   3.769
  145   1HG   GLN  25          2HG       GLN  25   4.297 -14.403   1.659
  146   2HG   GLN  25          1HG       GLN  25   4.670 -12.685   1.562
  147   1HE2  GLN  25          1HE2      GLN  25   6.975 -13.902   1.620
  148   2HE2  GLN  25          2HE2      GLN  25   7.661 -14.018   3.168
  149    H    VAL  26           H        VAL  26   2.708 -13.418  -0.187
  150    HA   VAL  26           HA       VAL  26   3.744 -10.809  -0.793
  151    HB   VAL  26           HB       VAL  26   2.842 -12.882  -2.799
  152   1HG1  VAL  26          1HG1      VAL  26   3.387 -10.781  -3.830
  153   2HG1  VAL  26          2HG1      VAL  26   4.768 -11.849  -4.084
  154   3HG1  VAL  26          3HG1      VAL  26   4.833 -10.600  -2.840
  155   1HG2  VAL  26          1HG2      VAL  26   5.112 -13.795  -2.657
  156   2HG2  VAL  26          2HG2      VAL  26   4.341 -13.881  -1.073
  157   3HG2  VAL  26          3HG2      VAL  26   5.533 -12.624  -1.410
  158    H    LYS  27           H        LYS  27   0.799 -12.415  -2.131
  159    HA   LYS  27           HA       LYS  27  -0.084 -10.101  -3.513
  160   1HB   LYS  27          2HB       LYS  27  -2.195 -11.214  -3.760
  161   2HB   LYS  27          1HB       LYS  27  -0.948 -12.461  -3.800
  162   1HG   LYS  27          2HG       LYS  27  -1.347 -12.723  -1.284
  163   2HG   LYS  27          1HG       LYS  27  -2.800 -11.751  -1.519
  164   1HD   LYS  27          2HD       LYS  27  -3.563 -13.372  -3.250
  165   2HD   LYS  27          1HD       LYS  27  -2.148 -14.367  -2.908
  166   1HE   LYS  27          2HE       LYS  27  -3.056 -15.193  -0.962
  167   2HE   LYS  27          1HE       LYS  27  -3.747 -13.637  -0.505
  168   1HZ   LYS  27          1HZ       LYS  27  -4.885 -15.763  -2.150
  169   2HZ   LYS  27          2HZ       LYS  27  -5.271 -14.162  -2.564
  170   3HZ   LYS  27          3HZ       LYS  27  -5.630 -14.747  -1.012
  171    H    ASP  28           H        ASP  28  -0.969 -11.219  -0.235
  172    HA   ASP  28           HA       ASP  28  -2.848  -9.172   0.318
  173   1HB   ASP  28          2HB       ASP  28  -2.378 -11.198   1.746
  174   2HB   ASP  28          1HB       ASP  28  -0.910 -10.391   2.303
  175    H    ALA  29           H        ALA  29   0.670  -9.158   0.390
  176    HA   ALA  29           HA       ALA  29   0.999  -6.668   1.772
  177   1HB   ALA  29          1HB       ALA  29   2.809  -8.360   1.441
  178   2HB   ALA  29          2HB       ALA  29   3.285  -6.738   0.933
  179   3HB   ALA  29          3HB       ALA  29   2.836  -7.944  -0.273
  180    H    LEU  30           H        LEU  30   0.815  -7.468  -1.695
  181    HA   LEU  30           HA       LEU  30   1.174  -4.790  -2.569
  182   1HB   LEU  30          2HB       LEU  30  -0.594  -6.794  -3.960
  183   2HB   LEU  30          1HB       LEU  30   0.357  -5.504  -4.687
  184    HG   LEU  30           HG       LEU  30   1.539  -7.885  -3.236
  185   1HD1  LEU  30          1HD1      LEU  30   0.529  -8.669  -5.270
  186   2HD1  LEU  30          2HD1      LEU  30   2.264  -8.539  -5.558
  187   3HD1  LEU  30          3HD1      LEU  30   1.173  -7.299  -6.177
  188   1HD2  LEU  30          1HD2      LEU  30   3.622  -7.048  -4.447
  189   2HD2  LEU  30          2HD2      LEU  30   3.056  -6.035  -3.119
  190   3HD2  LEU  30          3HD2      LEU  30   2.718  -5.574  -4.788
  191    H    THR  31           H        THR  31  -1.754  -6.658  -1.849
  192    HA   THR  31           HA       THR  31  -3.587  -4.500  -2.282
  193    HB   THR  31           HB       THR  31  -4.294  -6.536  -0.222
  194    HG1  THR  31           1HG      THR  31  -3.432  -8.084  -1.315
  195   1HG2  THR  31          1HG2      THR  31  -5.901  -4.975  -1.449
  196   2HG2  THR  31          2HG2      THR  31  -6.327  -6.684  -1.460
  197   3HG2  THR  31          3HG2      THR  31  -5.597  -5.951  -2.887
  198    H    LYS  32           H        LYS  32  -1.512  -5.335   0.432
  199    HA   LYS  32           HA       LYS  32  -2.863  -3.834   2.454
  200   1HB   LYS  32          2HB       LYS  32  -0.928  -5.368   2.905
  201   2HB   LYS  32          1HB       LYS  32   0.138  -4.206   2.125
  202   1HG   LYS  32          2HG       LYS  32  -1.601  -3.120   4.305
  203   2HG   LYS  32          1HG       LYS  32  -0.323  -4.219   4.809
  204   1HD   LYS  32          2HD       LYS  32   1.369  -2.838   3.731
  205   2HD   LYS  32          1HD       LYS  32   0.140  -1.772   3.073
  206   1HE   LYS  32          2HE       LYS  32  -0.229  -0.715   5.092
  207   2HE   LYS  32          1HE       LYS  32   0.117  -2.167   6.036
  208   1HZ   LYS  32          1HZ       LYS  32   1.850  -0.512   6.290
  209   2HZ   LYS  32          2HZ       LYS  32   2.130  -0.510   4.615
  210   3HZ   LYS  32          3HZ       LYS  32   2.457  -1.902   5.536
  211    H    MET  33           H        MET  33  -0.208  -2.935   0.244
  212    HA   MET  33           HA       MET  33  -0.182  -0.166   0.949
  213   1HB   MET  33          2HB       MET  33   0.486  -1.349  -1.764
  214   2HB   MET  33          1HB       MET  33   1.066   0.182  -1.106
  215   1HG   MET  33          2HG       MET  33   2.064  -1.202   0.815
  216   2HG   MET  33          1HG       MET  33   1.753  -2.616  -0.191
  217   1HE   MET  33          1HE       MET  33   5.369  -2.668  -0.985
  218   2HE   MET  33          2HE       MET  33   3.936  -3.420  -0.293
  219   3HE   MET  33          3HE       MET  33   4.794  -2.180   0.616
  220    H    ARG  34           H        ARG  34  -2.216  -2.034  -1.233
  221    HA   ARG  34           HA       ARG  34  -3.371   0.090  -2.742
  222   1HB   ARG  34          2HB       ARG  34  -3.725  -2.342  -3.220
  223   2HB   ARG  34          1HB       ARG  34  -4.745  -2.437  -1.791
  224   1HG   ARG  34          2HG       ARG  34  -6.340  -0.927  -2.689
  225   2HG   ARG  34          1HG       ARG  34  -5.271  -0.481  -4.021
  226   1HD   ARG  34          2HD       ARG  34  -5.456  -2.687  -4.992
  227   2HD   ARG  34          1HD       ARG  34  -6.355  -3.281  -3.589
  228    HE   ARG  34           HE       ARG  34  -7.574  -1.001  -5.005
  229   1HH1  ARG  34          1HH2      ARG  34  -7.339  -4.425  -4.557
  230   2HH1  ARG  34          2HH2      ARG  34  -8.890  -4.748  -5.256
  231   1HH2  ARG  34          1HH1      ARG  34  -9.593  -1.432  -5.944
  232   2HH2  ARG  34          2HH1      ARG  34 -10.163  -3.066  -6.021
  233    H    ALA  35           H        ALA  35  -4.986  -1.572  -0.023
  234    HA   ALA  35           HA       ALA  35  -6.921   0.472   0.383
  235   1HB   ALA  35          1HB       ALA  35  -7.291  -1.699   1.343
  236   2HB   ALA  35          2HB       ALA  35  -7.154  -0.562   2.682
  237   3HB   ALA  35          3HB       ALA  35  -5.796  -1.605   2.272
  238    H    ALA  36           H        ALA  36  -3.611   0.201   1.535
  239    HA   ALA  36           HA       ALA  36  -3.739   2.058   3.688
  240   1HB   ALA  36          1HB       ALA  36  -1.377   2.192   3.543
  241   2HB   ALA  36          2HB       ALA  36  -1.379   1.834   1.816
  242   3HB   ALA  36          3HB       ALA  36  -1.767   0.566   2.978
  243    H    ALA  37           H        ALA  37  -3.041   2.610   0.229
  244    HA   ALA  37           HA       ALA  37  -2.661   5.422   0.422
  245   1HB   ALA  37          1HB       ALA  37  -3.890   3.989  -1.942
  246   2HB   ALA  37          2HB       ALA  37  -2.168   3.915  -1.571
  247   3HB   ALA  37          3HB       ALA  37  -2.919   5.462  -1.958
  248    H    LEU  38           H        LEU  38  -5.618   3.501  -0.103
  249    HA   LEU  38           HA       LEU  38  -7.358   5.738  -0.517
  250   1HB   LEU  38          2HB       LEU  38  -8.181   3.150   0.809
  251   2HB   LEU  38          1HB       LEU  38  -9.154   4.220  -0.196
  252    HG   LEU  38           HG       LEU  38  -6.789   2.565  -1.119
  253   1HD1  LEU  38          1HD1      LEU  38  -8.403   1.235  -2.288
  254   2HD1  LEU  38          2HD1      LEU  38  -9.699   2.377  -1.932
  255   3HD1  LEU  38          3HD1      LEU  38  -9.003   1.403  -0.638
  256   1HD2  LEU  38          1HD2      LEU  38  -8.533   4.609  -2.510
  257   2HD2  LEU  38          2HD2      LEU  38  -7.651   3.374  -3.407
  258   3HD2  LEU  38          3HD2      LEU  38  -6.771   4.552  -2.435
  259    H    ASP  39           H        ASP  39  -6.615   3.877   2.446
  260    HA   ASP  39           HA       ASP  39  -8.281   5.376   4.185
  261   1HB   ASP  39          2HB       ASP  39  -6.963   3.184   4.617
  262   2HB   ASP  39          1HB       ASP  39  -5.619   4.244   5.052
  263    H    ALA  40           H        ALA  40  -4.826   5.857   3.397
  264    HA   ALA  40           HA       ALA  40  -4.544   8.172   5.079
  265   1HB   ALA  40          1HB       ALA  40  -2.574   6.956   4.334
  266   2HB   ALA  40          2HB       ALA  40  -2.493   8.601   3.703
  267   3HB   ALA  40          3HB       ALA  40  -2.974   7.273   2.645
  268    H    GLN  41           H        GLN  41  -6.204   7.664   2.189
  269    HA   GLN  41           HA       GLN  41  -5.814  10.234   0.948
  270   1HB   GLN  41          2HB       GLN  41  -6.808   7.907   0.089
  271   2HB   GLN  41          1HB       GLN  41  -8.333   8.642   0.557
  272   1HG   GLN  41          2HG       GLN  41  -7.373  10.711  -0.817
  273   2HG   GLN  41          1HG       GLN  41  -6.399   9.462  -1.591
  274   1HE2  GLN  41          1HE2      GLN  41  -8.117   7.308  -1.811
  275   2HE2  GLN  41          2HE2      GLN  41  -9.491   7.723  -2.718
  276    H    LYS  42           H        LYS  42  -8.757  10.526   0.589
  277    HA   LYS  42           HA       LYS  42  -9.242  12.463   2.698
  278   1HB   LYS  42          2HB       LYS  42 -11.254  11.370   0.708
  279   2HB   LYS  42          1HB       LYS  42 -11.327  12.912   1.557
  280   1HG   LYS  42          2HG       LYS  42  -8.984  12.297  -0.244
  281   2HG   LYS  42          1HG       LYS  42 -10.494  12.850  -0.949
  282   1HD   LYS  42          2HD       LYS  42  -9.410  14.406   1.382
  283   2HD   LYS  42          1HD       LYS  42  -8.578  14.563  -0.161
  284   1HE   LYS  42          2HE       LYS  42 -11.534  15.063   0.315
  285   2HE   LYS  42          1HE       LYS  42 -10.301  16.296   0.044
  286   1HZ   LYS  42          1HZ       LYS  42 -11.285  14.256  -1.855
  287   2HZ   LYS  42          2HZ       LYS  42  -9.831  15.099  -2.109
  288   3HZ   LYS  42          3HZ       LYS  42 -11.303  15.942  -2.027
  289    H    ALA  43           H        ALA  43  -8.815  10.258   4.141
  290    HA   ALA  43           HA       ALA  43 -11.539   9.562   5.156
  291   1HB   ALA  43          1HB       ALA  43  -9.443   7.424   4.720
  292   2HB   ALA  43          2HB       ALA  43 -10.717   7.764   3.549
  293   3HB   ALA  43          3HB       ALA  43 -11.134   7.205   5.169
  294    H    THR  44           H        THR  44  -8.029   9.270   5.705
  295    HA   THR  44           HA       THR  44  -8.485   9.882   8.574
  296    HB   THR  44           HB       THR  44  -6.623   7.680   7.624
  297    HG1  THR  44           1HG      THR  44  -8.240   6.281   8.399
  298   1HG2  THR  44          1HG2      THR  44  -7.765   8.139  10.381
  299   2HG2  THR  44          2HG2      THR  44  -6.261   8.896   9.862
  300   3HG2  THR  44          3HG2      THR  44  -6.387   7.139   9.924
  301    HA   PRO  45           HA       PRO  45  -5.458  12.416   5.751
  302   1HB   PRO  45          2HB       PRO  45  -6.591  14.139   7.947
  303   2HB   PRO  45          1HB       PRO  45  -6.123  14.597   6.296
  304   1HG   PRO  45          2HG       PRO  45  -8.690  14.062   7.018
  305   2HG   PRO  45          1HG       PRO  45  -8.064  13.790   5.383
  306   1HD   PRO  45          2HD       PRO  45  -8.928  11.789   7.324
  307   2HD   PRO  45          1HD       PRO  45  -8.418  11.546   5.639
  308    HA   PRO  46           HA       PRO  46  -2.710  11.587   9.373
  309   1HB   PRO  46          2HB       PRO  46  -0.740  10.237   8.022
  310   2HB   PRO  46          1HB       PRO  46  -2.218   9.466   8.623
  311   1HG   PRO  46          2HG       PRO  46  -1.449  10.101   5.857
  312   2HG   PRO  46          1HG       PRO  46  -2.644   8.946   6.458
  313   1HD   PRO  46          2HD       PRO  46  -3.124  11.602   5.399
  314   2HD   PRO  46          1HD       PRO  46  -4.321  10.425   5.981
  315    H    LYS  47           H        LYS  47  -0.266  11.621   6.902
  316    HA   LYS  47           HA       LYS  47   1.068  13.860   8.070
  317   1HB   LYS  47          2HB       LYS  47   2.414  13.777   5.869
  318   2HB   LYS  47          1HB       LYS  47   2.441  12.340   6.890
  319   1HG   LYS  47          2HG       LYS  47   0.823  11.222   5.519
  320   2HG   LYS  47          1HG       LYS  47   0.462  12.702   4.630
  321   1HD   LYS  47          2HD       LYS  47   2.809  12.717   3.779
  322   2HD   LYS  47          1HD       LYS  47   3.080  11.173   4.590
  323   1HE   LYS  47          2HE       LYS  47   1.268  10.153   3.267
  324   2HE   LYS  47          1HE       LYS  47   0.988  11.694   2.458
  325   1HZ   LYS  47          1HZ       LYS  47   3.658  10.444   2.447
  326   2HZ   LYS  47          2HZ       LYS  47   3.013  11.591   1.370
  327   3HZ   LYS  47          3HZ       LYS  47   2.479   9.977   1.320
  328    H    LEU  48           H        LEU  48  -1.722  13.871   6.252
  329    HA   LEU  48           HA       LEU  48  -1.150  16.256   4.661
  330   1HB   LEU  48          2HB       LEU  48  -3.773  14.911   5.384
  331   2HB   LEU  48          1HB       LEU  48  -3.627  16.269   4.272
  332    HG   LEU  48           HG       LEU  48  -2.185  13.622   3.895
  333   1HD1  LEU  48          1HD1      LEU  48  -3.915  13.133   2.207
  334   2HD1  LEU  48          2HD1      LEU  48  -4.730  14.645   2.601
  335   3HD1  LEU  48          3HD1      LEU  48  -4.647  13.353   3.794
  336   1HD2  LEU  48          1HD2      LEU  48  -2.495  16.146   2.259
  337   2HD2  LEU  48          2HD2      LEU  48  -2.189  14.601   1.465
  338   3HD2  LEU  48          3HD2      LEU  48  -1.029  15.238   2.621
  339    H    GLU  49           H        GLU  49  -0.263  17.495   6.466
  340    HA   GLU  49           HA       GLU  49  -2.375  19.074   7.792
  341   1HB   GLU  49          2HB       GLU  49  -0.968  18.877   9.972
  342   2HB   GLU  49          1HB       GLU  49  -2.034  17.539   9.543
  343   1HG   GLU  49          2HG       GLU  49  -0.193  16.284   8.605
  344   2HG   GLU  49          1HG       GLU  49   0.905  17.647   8.827
  345    H    ASP  50           H        ASP  50  -0.620  19.687   5.658
  346    HA   ASP  50           HA       ASP  50   0.529  22.148   6.604
  347   1HB   ASP  50          2HB       ASP  50   2.242  20.453   7.409
  348   2HB   ASP  50          1HB       ASP  50   2.551  20.074   5.712
  349    H    LYS  51           H        LYS  51  -1.178  20.953   4.475
  350    HA   LYS  51           HA       LYS  51   0.199  22.153   2.104
  351   1HB   LYS  51          2HB       LYS  51  -1.324  19.552   2.293
  352   2HB   LYS  51          1HB       LYS  51  -1.159  20.409   0.762
  353   1HG   LYS  51          2HG       LYS  51   1.199  20.175   0.748
  354   2HG   LYS  51          1HG       LYS  51   1.253  19.761   2.461
  355   1HD   LYS  51          2HD       LYS  51   0.367  17.597   2.090
  356   2HD   LYS  51          1HD       LYS  51  -0.216  18.017   0.480
  357   1HE   LYS  51          2HE       LYS  51   2.048  18.144  -0.373
  358   2HE   LYS  51          1HE       LYS  51   2.714  17.925   1.247
  359   1HZ   LYS  51          1HZ       LYS  51   1.021  15.950  -0.187
  360   2HZ   LYS  51          2HZ       LYS  51   1.737  15.739   1.341
  361   3HZ   LYS  51          3HZ       LYS  51   2.709  15.864  -0.046
  362    H    SER  52           H        SER  52  -3.034  21.025   3.263
  363    HA   SER  52           HA       SER  52  -5.142  22.054   2.937
  364   1HB   SER  52          2HB       SER  52  -3.408  23.790   4.201
  365   2HB   SER  52          1HB       SER  52  -3.941  24.775   2.845
  366    HG   SER  52           HG       SER  52  -5.246  24.109   5.092
  367    HA   PRO  53           HA       PRO  53  -5.897  23.310  -1.265
  368   1HB   PRO  53          2HB       PRO  53  -6.638  26.117  -0.506
  369   2HB   PRO  53          1HB       PRO  53  -7.584  24.907  -1.401
  370   1HG   PRO  53          2HG       PRO  53  -8.204  25.452   1.099
  371   2HG   PRO  53          1HG       PRO  53  -8.184  23.767   0.538
  372   1HD   PRO  53          2HD       PRO  53  -6.103  25.219   2.145
  373   2HD   PRO  53          1HD       PRO  53  -6.777  23.588   2.383
  374    H    ASP  54           H        ASP  54  -3.257  23.448  -0.758
  375    HA   ASP  54           HA       ASP  54  -2.197  26.065  -1.633
  376   1HB   ASP  54          2HB       ASP  54  -0.884  25.226   0.135
  377   2HB   ASP  54          1HB       ASP  54  -0.988  23.561  -0.435
  378    H    SER  55           H        SER  55  -3.449  23.382  -2.998
  379    HA   SER  55           HA       SER  55  -3.671  23.142  -5.358
  380   1HB   SER  55          2HB       SER  55  -1.986  25.042  -5.667
  381   2HB   SER  55          1HB       SER  55  -0.762  23.786  -5.789
  382    HG   SER  55           HG       SER  55  -1.902  24.533  -7.775
  383    HA   PRO  56           HA       PRO  56  -0.558  19.488  -5.389
  384   1HB   PRO  56          2HB       PRO  56   0.437  19.268  -2.612
  385   2HB   PRO  56          1HB       PRO  56   1.331  19.160  -4.140
  386   1HG   PRO  56          2HG       PRO  56   1.554  21.282  -2.499
  387   2HG   PRO  56          1HG       PRO  56   1.673  21.410  -4.264
  388   1HD   PRO  56          2HD       PRO  56  -0.640  22.126  -2.482
  389   2HD   PRO  56          1HD       PRO  56  -0.010  22.943  -3.918
  390    H    GLU  57           H        GLU  57  -2.842  20.437  -3.084
  391    HA   GLU  57           HA       GLU  57  -3.385  17.873  -1.844
  392   1HB   GLU  57          2HB       GLU  57  -4.107  20.076  -0.867
  393   2HB   GLU  57          1HB       GLU  57  -5.277  20.235  -2.178
  394   1HG   GLU  57          2HG       GLU  57  -6.553  18.384  -1.400
  395   2HG   GLU  57          1HG       GLU  57  -5.231  17.794  -0.394
  396    H    MET  58           H        MET  58  -3.041  17.300  -4.405
  397    HA   MET  58           HA       MET  58  -5.338  15.847  -5.189
  398   1HB   MET  58          2HB       MET  58  -5.362  18.639  -5.961
  399   2HB   MET  58          1HB       MET  58  -5.238  17.660  -7.418
  400   1HG   MET  58          2HG       MET  58  -7.231  16.400  -6.796
  401   2HG   MET  58          1HG       MET  58  -7.324  17.240  -5.250
  402   1HE   MET  58          1HE       MET  58  -7.685  19.862  -5.018
  403   2HE   MET  58          2HE       MET  58  -9.078  18.783  -4.940
  404   3HE   MET  58          3HE       MET  58  -9.201  20.306  -5.819
  405    H    LYS  59           H        LYS  59  -2.557  17.681  -6.426
  406    HA   LYS  59           HA       LYS  59  -1.943  15.871  -8.537
  407   1HB   LYS  59          2HB       LYS  59   0.286  17.394  -7.232
  408   2HB   LYS  59          1HB       LYS  59  -0.068  17.160  -8.935
  409   1HG   LYS  59          2HG       LYS  59  -1.945  18.874  -7.306
  410   2HG   LYS  59          1HG       LYS  59  -0.403  19.529  -7.805
  411   1HD   LYS  59          2HD       LYS  59  -2.057  20.092  -9.478
  412   2HD   LYS  59          1HD       LYS  59  -0.938  18.921 -10.156
  413   1HE   LYS  59          2HE       LYS  59  -2.567  17.337 -10.409
  414   2HE   LYS  59          1HE       LYS  59  -3.286  17.711  -8.846
  415   1HZ   LYS  59          1HZ       LYS  59  -3.620  19.279 -11.339
  416   2HZ   LYS  59          2HZ       LYS  59  -4.264  19.700  -9.823
  417   3HZ   LYS  59          3HZ       LYS  59  -4.787  18.290 -10.608
  418    H    ASP  60           H        ASP  60  -0.203  16.201  -5.367
  419    HA   ASP  60           HA       ASP  60   1.215  13.736  -5.826
  420   1HB   ASP  60          2HB       ASP  60   1.884  15.397  -4.038
  421   2HB   ASP  60          1HB       ASP  60   0.498  14.827  -3.099
  422    H    PHE  61           H        PHE  61  -2.013  14.412  -4.679
  423    HA   PHE  61           HA       PHE  61  -2.395  11.782  -3.525
  424   1HB   PHE  61          2HB       PHE  61  -3.934  13.319  -2.674
  425   2HB   PHE  61          1HB       PHE  61  -4.169  14.103  -4.226
  426    HD1  PHE  61           1HD      PHE  61  -6.577  14.013  -4.301
  427    HD2  PHE  61           2HD      PHE  61  -4.300  10.433  -3.652
  428    HE1  PHE  61           1HE      PHE  61  -8.615  12.651  -4.662
  429    HE2  PHE  61           2HE      PHE  61  -6.334   9.067  -4.038
  430    HZ   PHE  61           HZ       PHE  61  -8.493  10.179  -4.544
  431    H    ARG  62           H        ARG  62  -3.497  13.353  -6.547
  432    HA   ARG  62           HA       ARG  62  -4.473  10.970  -7.721
  433   1HB   ARG  62          2HB       ARG  62  -3.378  13.467  -9.030
  434   2HB   ARG  62          1HB       ARG  62  -4.168  12.165  -9.909
  435   1HG   ARG  62          2HG       ARG  62  -5.916  12.821  -7.735
  436   2HG   ARG  62          1HG       ARG  62  -5.395  14.356  -8.417
  437   1HD   ARG  62          2HD       ARG  62  -5.995  13.312 -10.714
  438   2HD   ARG  62          1HD       ARG  62  -6.871  12.104  -9.777
  439    HE   ARG  62           HE       ARG  62  -7.536  14.840  -9.023
  440   1HH1  ARG  62          1HH2      ARG  62  -8.092  12.219 -11.195
  441   2HH1  ARG  62          2HH2      ARG  62  -9.718  12.693 -11.559
  442   1HH2  ARG  62          1HH1      ARG  62  -9.656  15.471  -9.484
  443   2HH2  ARG  62          2HH1      ARG  62 -10.599  14.541 -10.597
  444    H    HIS  63           H        HIS  63  -1.359  12.616  -8.351
  445    HA   HIS  63           HA       HIS  63  -0.304  10.445  -9.886
  446   1HB   HIS  63          2HB       HIS  63   0.479  12.942  -9.662
  447   2HB   HIS  63          1HB       HIS  63   1.457  12.332  -8.333
  448    HD1  HIS  63           1HD      HIS  63   3.767  12.296  -9.358
  449    HD2  HIS  63           2HD      HIS  63   0.942  10.478 -11.829
  450    HE1  HIS  63           1HE      HIS  63   5.052  11.255 -11.277
  451    H    GLY  64           H        GLY  64  -0.591  10.918  -6.458
  452   1HA   GLY  64          2HA       GLY  64   1.555   9.050  -5.776
  453   2HA   GLY  64          1HA       GLY  64   0.416   9.763  -4.641
  454    H    PHE  65           H        PHE  65  -2.025   8.866  -5.354
  455    HA   PHE  65           HA       PHE  65  -1.933   6.114  -4.598
  456   1HB   PHE  65          2HB       PHE  65  -4.225   6.229  -4.390
  457   2HB   PHE  65          1HB       PHE  65  -3.886   7.952  -4.431
  458    HD1  PHE  65           1HD      PHE  65  -4.838   9.313  -6.123
  459    HD2  PHE  65           2HD      PHE  65  -4.802   5.054  -6.597
  460    HE1  PHE  65           1HE      PHE  65  -6.271   9.532  -8.131
  461    HE2  PHE  65           2HE      PHE  65  -6.238   5.269  -8.606
  462    HZ   PHE  65           HZ       PHE  65  -6.973   7.510  -9.374
  463    H    ASP  66           H        ASP  66  -1.983   7.634  -7.767
  464    HA   ASP  66           HA       ASP  66  -2.772   5.242  -9.198
  465   1HB   ASP  66          2HB       ASP  66  -2.977   7.420 -10.269
  466   2HB   ASP  66          1HB       ASP  66  -1.235   7.677 -10.135
  467    H    ILE  67           H        ILE  67   0.360   6.700  -8.390
  468    HA   ILE  67           HA       ILE  67   1.970   4.786  -9.746
  469    HB   ILE  67           HB       ILE  67   2.435   6.490  -7.289
  470   1HG1  ILE  67          2HG1      ILE  67   3.589   6.669 -10.082
  471   2HG1  ILE  67          1HG1      ILE  67   2.091   7.480  -9.610
  472   1HG2  ILE  67          1HG2      ILE  67   4.051   4.851  -6.904
  473   2HG2  ILE  67          2HG2      ILE  67   4.936   5.948  -7.958
  474   3HG2  ILE  67          3HG2      ILE  67   4.232   4.471  -8.618
  475   1HD1  ILE  67          1HD1      ILE  67   3.395   8.573  -7.731
  476   2HD1  ILE  67          2HD1      ILE  67   3.903   9.065  -9.345
  477   3HD1  ILE  67          3HD1      ILE  67   4.859   7.896  -8.437
  478    H    LEU  68           H        LEU  68   0.906   4.842  -6.342
  479    HA   LEU  68           HA       LEU  68   1.915   2.276  -5.631
  480   1HB   LEU  68          2HB       LEU  68  -0.069   4.199  -4.526
  481   2HB   LEU  68          1HB       LEU  68  -0.384   2.522  -4.089
  482    HG   LEU  68           HG       LEU  68   2.036   2.360  -3.344
  483   1HD1  LEU  68          1HD1      LEU  68   1.865   5.373  -3.659
  484   2HD1  LEU  68          2HD1      LEU  68   2.880   4.298  -4.620
  485   3HD1  LEU  68          3HD1      LEU  68   3.189   4.493  -2.895
  486   1HD2  LEU  68          1HD2      LEU  68   0.137   2.697  -1.792
  487   2HD2  LEU  68          2HD2      LEU  68   0.316   4.442  -1.973
  488   3HD2  LEU  68          3HD2      LEU  68   1.599   3.493  -1.222
  489    H    VAL  69           H        VAL  69  -1.409   3.176  -6.653
  490    HA   VAL  69           HA       VAL  69  -2.377   0.501  -6.833
  491    HB   VAL  69           HB       VAL  69  -3.214   3.105  -8.111
  492   1HG1  VAL  69          1HG1      VAL  69  -5.374   1.719  -8.664
  493   2HG1  VAL  69          2HG1      VAL  69  -4.273   0.340  -8.638
  494   3HG1  VAL  69          3HG1      VAL  69  -4.002   1.666  -9.772
  495   1HG2  VAL  69          1HG2      VAL  69  -5.214   2.698  -6.619
  496   2HG2  VAL  69          2HG2      VAL  69  -3.697   2.917  -5.748
  497   3HG2  VAL  69          3HG2      VAL  69  -4.366   1.299  -5.961
  498    H    GLY  70           H        GLY  70  -0.941   2.586  -9.354
  499   1HA   GLY  70          2HA       GLY  70  -1.253   0.757 -11.504
  500   2HA   GLY  70          1HA       GLY  70  -0.009   2.003 -11.429
  501    H    GLN  71           H        GLN  71   1.087   0.803  -8.885
  502    HA   GLN  71           HA       GLN  71   2.828  -1.168 -10.221
  503   1HB   GLN  71          2HB       GLN  71   2.884   0.061  -7.447
  504   2HB   GLN  71          1HB       GLN  71   4.122  -1.020  -8.089
  505   1HG   GLN  71          2HG       GLN  71   4.813   0.532  -9.711
  506   2HG   GLN  71          1HG       GLN  71   3.332   1.469  -9.604
  507   1HE2  GLN  71          1HE2      GLN  71   2.985   2.427  -7.190
  508   2HE2  GLN  71          2HE2      GLN  71   4.392   3.066  -6.480
  509    H    ILE  72           H        ILE  72   0.286  -1.091  -7.848
  510    HA   ILE  72           HA       ILE  72   0.733  -3.667  -6.691
  511    HB   ILE  72           HB       ILE  72  -1.725  -1.950  -7.079
  512   1HG1  ILE  72          2HG1      ILE  72  -0.325  -2.761  -4.523
  513   2HG1  ILE  72          1HG1      ILE  72   0.253  -1.401  -5.487
  514   1HG2  ILE  72          1HG2      ILE  72  -2.716  -3.563  -5.309
  515   2HG2  ILE  72          2HG2      ILE  72  -1.476  -4.694  -5.844
  516   3HG2  ILE  72          3HG2      ILE  72  -2.684  -4.112  -6.983
  517   1HD1  ILE  72          1HD1      ILE  72  -2.649  -1.300  -5.002
  518   2HD1  ILE  72          2HD1      ILE  72  -1.415  -0.058  -4.786
  519   3HD1  ILE  72          3HD1      ILE  72  -1.680  -1.261  -3.528
  520    H    ASP  73           H        ASP  73  -1.078  -2.621  -9.567
  521    HA   ASP  73           HA       ASP  73  -2.012  -5.262 -10.258
  522   1HB   ASP  73          2HB       ASP  73  -2.986  -3.186 -11.220
  523   2HB   ASP  73          1HB       ASP  73  -1.468  -2.880 -12.061
  524    H    ASP  74           H        ASP  74   0.863  -3.328 -11.177
  525    HA   ASP  74           HA       ASP  74   1.953  -5.289 -12.980
  526   1HB   ASP  74          2HB       ASP  74   3.678  -3.396 -11.390
  527   2HB   ASP  74          1HB       ASP  74   3.876  -3.952 -13.054
  528    H    ALA  75           H        ALA  75   2.722  -4.646  -9.529
  529    HA   ALA  75           HA       ALA  75   4.612  -6.820  -9.397
  530   1HB   ALA  75          1HB       ALA  75   4.086  -6.475  -6.814
  531   2HB   ALA  75          2HB       ALA  75   3.276  -5.022  -7.403
  532   3HB   ALA  75          3HB       ALA  75   4.994  -5.262  -7.714
  533    H    LEU  76           H        LEU  76   1.156  -6.587  -9.041
  534    HA   LEU  76           HA       LEU  76   0.872  -9.114  -7.642
  535   1HB   LEU  76          2HB       LEU  76  -0.849  -7.370  -7.496
  536   2HB   LEU  76          1HB       LEU  76  -1.146  -7.478  -9.228
  537    HG   LEU  76           HG       LEU  76  -1.420  -9.864  -7.382
  538   1HD1  LEU  76          1HD1      LEU  76  -3.922  -9.317  -7.525
  539   2HD1  LEU  76          2HD1      LEU  76  -3.425  -7.708  -8.047
  540   3HD1  LEU  76          3HD1      LEU  76  -2.948  -8.302  -6.457
  541   1HD2  LEU  76          1HD2      LEU  76  -1.968  -9.322 -10.262
  542   2HD2  LEU  76          2HD2      LEU  76  -3.253 -10.183  -9.419
  543   3HD2  LEU  76          3HD2      LEU  76  -1.622 -10.839  -9.441
  544    H    LYS  77           H        LYS  77   0.255  -8.156 -11.073
  545    HA   LYS  77           HA       LYS  77  -0.252 -10.825 -11.926
  546   1HB   LYS  77          2HB       LYS  77   0.491 -10.105 -14.214
  547   2HB   LYS  77          1HB       LYS  77  -0.747  -9.079 -13.511
  548   1HG   LYS  77          2HG       LYS  77   0.679  -7.414 -14.245
  549   2HG   LYS  77          1HG       LYS  77   1.416  -7.702 -12.685
  550   1HD   LYS  77          2HD       LYS  77   3.114  -7.583 -14.449
  551   2HD   LYS  77          1HD       LYS  77   3.095  -9.181 -13.728
  552   1HE   LYS  77          2HE       LYS  77   3.053  -8.751 -16.421
  553   2HE   LYS  77          1HE       LYS  77   2.374 -10.190 -15.660
  554   1HZ   LYS  77          1HZ       LYS  77   0.228  -9.311 -15.765
  555   2HZ   LYS  77          2HZ       LYS  77   0.908  -8.889 -17.263
  556   3HZ   LYS  77          3HZ       LYS  77   0.774  -7.729 -16.029
  557    H    LEU  78           H        LEU  78   2.728  -9.111 -11.240
  558    HA   LEU  78           HA       LEU  78   4.481 -11.005 -12.458
  559   1HB   LEU  78          2HB       LEU  78   4.826  -8.594 -11.190
  560   2HB   LEU  78          1HB       LEU  78   5.401  -9.689  -9.946
  561    HG   LEU  78           HG       LEU  78   7.255  -8.958 -11.380
  562   1HD1  LEU  78          1HD1      LEU  78   8.213 -11.100 -11.795
  563   2HD1  LEU  78          2HD1      LEU  78   6.633 -11.845 -12.042
  564   3HD1  LEU  78          3HD1      LEU  78   7.121 -11.314 -10.429
  565   1HD2  LEU  78          1HD2      LEU  78   6.345 -10.445 -13.790
  566   2HD2  LEU  78          2HD2      LEU  78   7.193  -8.909 -13.662
  567   3HD2  LEU  78          3HD2      LEU  78   5.445  -8.961 -13.459
  568    H    ALA  79           H        ALA  79   3.223 -10.720  -9.136
  569    HA   ALA  79           HA       ALA  79   4.452 -13.090  -8.172
  570   1HB   ALA  79          1HB       ALA  79   1.837 -11.762  -7.415
  571   2HB   ALA  79          2HB       ALA  79   3.390 -11.602  -6.594
  572   3HB   ALA  79          3HB       ALA  79   2.515 -13.133  -6.535
  573    H    ASN  80           H        ASN  80   1.204 -12.605  -9.593
  574    HA   ASN  80           HA       ASN  80   0.443 -15.352  -9.642
  575   1HB   ASN  80          2HB       ASN  80  -0.262 -13.137 -11.574
  576   2HB   ASN  80          1HB       ASN  80  -1.091 -14.688 -11.458
  577   1HD2  ASN  80          1HD2      ASN  80  -2.880 -12.952 -11.000
  578   2HD2  ASN  80          2HD2      ASN  80  -3.158 -12.584  -9.368
  579    H    GLU  81           H        GLU  81   1.390 -13.441 -12.473
  580    HA   GLU  81           HA       GLU  81   2.133 -15.736 -14.040
  581   1HB   GLU  81          2HB       GLU  81   1.326 -13.676 -15.064
  582   2HB   GLU  81          1HB       GLU  81   2.696 -12.781 -14.429
  583   1HG   GLU  81          2HG       GLU  81   3.359 -15.180 -16.079
  584   2HG   GLU  81          1HG       GLU  81   2.643 -13.827 -16.942
  585    H    GLY  82           H        GLY  82   3.730 -14.756 -11.396
  586   1HA   GLY  82          2HA       GLY  82   6.360 -15.582 -12.528
  587   2HA   GLY  82          1HA       GLY  82   6.293 -14.120 -11.578
  588    H    LYS  83           H        LYS  83   7.926 -16.121 -10.751
  589    HA   LYS  83           HA       LYS  83   6.593 -17.857  -8.830
  590   1HB   LYS  83          2HB       LYS  83   9.118 -17.826 -10.025
  591   2HB   LYS  83          1HB       LYS  83   9.488 -17.331  -8.382
  592   1HG   LYS  83          2HG       LYS  83   7.799 -19.785  -8.973
  593   2HG   LYS  83          1HG       LYS  83   9.552 -19.842  -8.919
  594   1HD   LYS  83          2HD       LYS  83   9.382 -18.777  -6.590
  595   2HD   LYS  83          1HD       LYS  83   7.660 -19.161  -6.669
  596   1HE   LYS  83          2HE       LYS  83   9.994 -21.072  -6.729
  597   2HE   LYS  83          1HE       LYS  83   8.654 -21.024  -5.582
  598   1HZ   LYS  83          1HZ       LYS  83   8.450 -22.786  -7.285
  599   2HZ   LYS  83          2HZ       LYS  83   8.352 -21.585  -8.482
  600   3HZ   LYS  83          3HZ       LYS  83   7.147 -21.699  -7.289
  601    H    VAL  84           H        VAL  84   8.105 -17.512  -6.499
  602    HA   VAL  84           HA       VAL  84   6.983 -14.968  -5.510
  603    HB   VAL  84           HB       VAL  84   8.224 -17.348  -4.116
  604   1HG1  VAL  84          1HG1      VAL  84   7.306 -14.655  -3.107
  605   2HG1  VAL  84          2HG1      VAL  84   8.746 -15.570  -2.667
  606   3HG1  VAL  84          3HG1      VAL  84   7.166 -16.078  -2.073
  607   1HG2  VAL  84          1HG2      VAL  84   5.951 -17.825  -3.446
  608   2HG2  VAL  84          2HG2      VAL  84   5.921 -17.530  -5.182
  609   3HG2  VAL  84          3HG2      VAL  84   5.387 -16.276  -4.065
  610    H    LYS  85           H        LYS  85  10.074 -16.662  -5.845
  611    HA   LYS  85           HA       LYS  85  11.709 -14.690  -4.598
  612   1HB   LYS  85          2HB       LYS  85  12.205 -17.149  -5.544
  613   2HB   LYS  85          1HB       LYS  85  12.750 -16.244  -6.953
  614   1HG   LYS  85          2HG       LYS  85  13.713 -15.841  -4.108
  615   2HG   LYS  85          1HG       LYS  85  14.613 -16.645  -5.394
  616   1HD   LYS  85          2HD       LYS  85  14.313 -14.447  -6.723
  617   2HD   LYS  85          1HD       LYS  85  13.862 -13.731  -5.176
  618   1HE   LYS  85          2HE       LYS  85  16.491 -15.053  -5.886
  619   2HE   LYS  85          1HE       LYS  85  16.220 -13.366  -5.450
  620   1HZ   LYS  85          1HZ       LYS  85  17.093 -14.818  -3.632
  621   2HZ   LYS  85          2HZ       LYS  85  15.593 -15.621  -3.637
  622   3HZ   LYS  85          3HZ       LYS  85  15.678 -13.967  -3.254
  623    H    GLU  86           H        GLU  86  10.789 -15.172  -8.023
  624    HA   GLU  86           HA       GLU  86  12.175 -12.912  -9.070
  625   1HB   GLU  86          2HB       GLU  86   9.541 -14.079 -10.037
  626   2HB   GLU  86          1HB       GLU  86  10.631 -13.060 -10.976
  627   1HG   GLU  86          2HG       GLU  86  11.588 -15.650  -9.752
  628   2HG   GLU  86          1HG       GLU  86  10.778 -15.629 -11.317
  629    H    ALA  87           H        ALA  87   8.858 -13.264  -7.824
  630    HA   ALA  87           HA       ALA  87   8.122 -10.523  -8.255
  631   1HB   ALA  87          1HB       ALA  87   6.202 -10.988  -6.999
  632   2HB   ALA  87          2HB       ALA  87   7.052 -12.096  -5.920
  633   3HB   ALA  87          3HB       ALA  87   6.659 -12.591  -7.565
  634    H    GLN  88           H        GLN  88  10.028 -12.095  -5.794
  635    HA   GLN  88           HA       GLN  88   9.928 -10.143  -3.736
  636   1HB   GLN  88          2HB       GLN  88  11.148 -12.528  -4.045
  637   2HB   GLN  88          1HB       GLN  88  12.534 -11.507  -4.369
  638   1HG   GLN  88          2HG       GLN  88  11.052 -11.960  -1.822
  639   2HG   GLN  88          1HG       GLN  88  12.768 -11.712  -2.103
  640   1HE2  GLN  88          1HE2      GLN  88  12.859  -9.179  -3.283
  641   2HE2  GLN  88          2HE2      GLN  88  12.176  -8.034  -2.234
  642    H    ALA  89           H        ALA  89  12.294 -10.562  -6.362
  643    HA   ALA  89           HA       ALA  89  13.807  -8.224  -5.957
  644   1HB   ALA  89          1HB       ALA  89  13.100  -9.379  -8.665
  645   2HB   ALA  89          2HB       ALA  89  14.314 -10.079  -7.594
  646   3HB   ALA  89          3HB       ALA  89  14.541  -8.454  -8.239
  647    H    ALA  90           H        ALA  90  10.671  -8.643  -7.563
  648    HA   ALA  90           HA       ALA  90  10.519  -6.063  -8.768
  649   1HB   ALA  90          1HB       ALA  90   8.237  -6.502  -9.059
  650   2HB   ALA  90          2HB       ALA  90   8.098  -7.352  -7.518
  651   3HB   ALA  90          3HB       ALA  90   8.886  -8.130  -8.889
  652    H    ALA  91           H        ALA  91   9.685  -7.194  -5.501
  653    HA   ALA  91           HA       ALA  91   8.716  -4.678  -4.533
  654   1HB   ALA  91          1HB       ALA  91   8.193  -6.585  -3.222
  655   2HB   ALA  91          2HB       ALA  91   9.379  -5.704  -2.260
  656   3HB   ALA  91          3HB       ALA  91   9.870  -7.122  -3.186
  657    H    GLU  92           H        GLU  92  11.942  -6.115  -4.696
  658    HA   GLU  92           HA       GLU  92  13.316  -4.265  -3.063
  659   1HB   GLU  92          2HB       GLU  92  14.282  -5.776  -5.502
  660   2HB   GLU  92          1HB       GLU  92  15.330  -4.987  -4.321
  661   1HG   GLU  92          2HG       GLU  92  14.123  -6.394  -2.544
  662   2HG   GLU  92          1HG       GLU  92  13.471  -7.327  -3.880
  663    H    GLN  93           H        GLN  93  12.779  -4.117  -6.631
  664    HA   GLN  93           HA       GLN  93  14.147  -1.600  -6.892
  665   1HB   GLN  93          2HB       GLN  93  12.767  -1.373  -9.021
  666   2HB   GLN  93          1HB       GLN  93  13.751  -2.831  -8.910
  667   1HG   GLN  93          2HG       GLN  93  11.846  -4.154  -8.266
  668   2HG   GLN  93          1HG       GLN  93  10.853  -2.711  -8.095
  669   1HE2  GLN  93          1HE2      GLN  93  11.908  -5.116 -10.334
  670   2HE2  GLN  93          2HE2      GLN  93  11.253  -4.415 -11.734
  671    H    LEU  94           H        LEU  94  10.854  -2.467  -5.995
  672    HA   LEU  94           HA       LEU  94   9.896   0.287  -6.110
  673   1HB   LEU  94          2HB       LEU  94   8.736  -2.185  -4.793
  674   2HB   LEU  94          1HB       LEU  94   7.933  -0.614  -4.827
  675    HG   LEU  94           HG       LEU  94   8.795  -2.096  -7.331
  676   1HD1  LEU  94          1HD1      LEU  94   6.521  -2.870  -7.561
  677   2HD1  LEU  94          2HD1      LEU  94   6.023  -1.977  -6.125
  678   3HD1  LEU  94          3HD1      LEU  94   7.099  -3.366  -5.971
  679   1HD2  LEU  94          1HD2      LEU  94   7.130   0.355  -6.758
  680   2HD2  LEU  94          2HD2      LEU  94   6.913  -0.553  -8.253
  681   3HD2  LEU  94          3HD2      LEU  94   8.470   0.178  -7.892
  682    H    LYS  95           H        LYS  95  11.445  -1.750  -3.707
  683    HA   LYS  95           HA       LYS  95  10.670  -0.135  -1.442
  684   1HB   LYS  95          2HB       LYS  95  12.603  -2.336  -1.981
  685   2HB   LYS  95          1HB       LYS  95  12.996  -1.314  -0.602
  686   1HG   LYS  95          2HG       LYS  95  10.212  -2.436  -0.929
  687   2HG   LYS  95          1HG       LYS  95  11.495  -3.412  -0.216
  688   1HD   LYS  95          2HD       LYS  95  11.898  -1.666   1.480
  689   2HD   LYS  95          1HD       LYS  95  10.631  -0.672   0.767
  690   1HE   LYS  95          2HE       LYS  95   8.925  -2.240   1.365
  691   2HE   LYS  95          1HE       LYS  95  10.110  -3.479   1.768
  692   1HZ   LYS  95          1HZ       LYS  95   8.983  -1.678   3.495
  693   2HZ   LYS  95          2HZ       LYS  95  10.552  -1.081   3.242
  694   3HZ   LYS  95          3HZ       LYS  95  10.325  -2.668   3.808
  695    H    THR  96           H        THR  96  13.586  -0.207  -3.491
  696    HA   THR  96           HA       THR  96  14.840   1.978  -2.068
  697    HB   THR  96           HB       THR  96  16.161   0.382  -3.414
  698    HG1  THR  96           1HG      THR  96  16.147   3.107  -4.115
  699   1HG2  THR  96          1HG2      THR  96  14.498   0.017  -5.208
  700   2HG2  THR  96          2HG2      THR  96  16.064   0.474  -5.870
  701   3HG2  THR  96          3HG2      THR  96  14.768   1.662  -5.788
  702    H    THR  97           H        THR  97  12.430   1.759  -4.565
  703    HA   THR  97           HA       THR  97  12.777   4.614  -5.292
  704    HB   THR  97           HB       THR  97  10.998   2.404  -6.355
  705    HG1  THR  97           1HG      THR  97  13.033   2.167  -7.105
  706   1HG2  THR  97          1HG2      THR  97  10.593   4.168  -8.188
  707   2HG2  THR  97          2HG2      THR  97  11.153   5.343  -6.998
  708   3HG2  THR  97          3HG2      THR  97   9.725   4.365  -6.671
  709    H    GLY  98           H        GLY  98   9.739   2.872  -5.062
  710   1HA   GLY  98          2HA       GLY  98   7.735   3.492  -4.012
  711   2HA   GLY  98          1HA       GLY  98   8.761   3.664  -2.588
  712    H    ARG  99           H        ARG  99   9.628   5.715  -5.203
  713    HA   ARG  99           HA       ARG  99   8.898   8.053  -3.626
  714   1HB   ARG  99          2HB       ARG  99  10.367   7.638  -6.224
  715   2HB   ARG  99          1HB       ARG  99   9.885   9.255  -5.715
  716   1HG   ARG  99          2HG       ARG  99  11.383   7.460  -3.804
  717   2HG   ARG  99          1HG       ARG  99  12.259   8.355  -5.042
  718   1HD   ARG  99          2HD       ARG  99  11.216  10.465  -4.208
  719   2HD   ARG  99          1HD       ARG  99  10.452   9.548  -2.913
  720    HE   ARG  99           HE       ARG  99  13.248   9.011  -2.852
  721   1HH1  ARG  99          1HH2      ARG  99  10.952  11.534  -2.397
  722   2HH1  ARG  99          2HH2      ARG  99  11.879  12.344  -1.177
  723   1HH2  ARG  99          1HH1      ARG  99  14.483  10.053  -1.269
  724   2HH2  ARG  99          2HH1      ARG  99  13.885  11.508  -0.542
  725    H    ALA 100           H        ALA 100   7.652   9.820  -4.508
  726    HA   ALA 100           HA       ALA 100   5.890   9.334  -6.786
  727   1HB   ALA 100          1HB       ALA 100   3.810   9.540  -5.386
  728   2HB   ALA 100          2HB       ALA 100   4.820   9.339  -3.952
  729   3HB   ALA 100          3HB       ALA 100   4.688   8.037  -5.136
  730    H    GLY 101           H        GLY 101   7.820  11.348  -5.601
  731   1HA   GLY 101          2HA       GLY 101   8.002  13.696  -5.816
  732   2HA   GLY 101          1HA       GLY 101   6.316  13.739  -6.332
  733    H    ASN 102           H        ASN 102   8.131  12.918  -3.339
  734    HA   ASN 102           HA       ASN 102   5.879  13.850  -1.712
  735   1HB   ASN 102          2HB       ASN 102   7.594  11.905  -1.239
  736   2HB   ASN 102          1HB       ASN 102   8.590  13.198  -0.575
  737   1HD2  ASN 102          1HD2      ASN 102   7.242  14.713   1.014
  738   2HD2  ASN 102          2HD2      ASN 102   6.209  13.900   2.088
  739    H    GLN 103           H        GLN 103   8.099  15.595  -3.363
  740    HA   GLN 103           HA       GLN 103   8.487  17.612  -1.186
  741   1HB   GLN 103          2HB       GLN 103  10.491  16.639  -2.530
  742   2HB   GLN 103          1HB       GLN 103   9.897  17.639  -3.857
  743   1HG   GLN 103          2HG       GLN 103   9.847  19.481  -1.847
  744   2HG   GLN 103          1HG       GLN 103  11.165  18.464  -1.276
  745   1HE2  GLN 103          1HE2      GLN 103  10.380  21.014  -3.438
  746   2HE2  GLN 103          2HE2      GLN 103  11.827  21.010  -4.326
  747    H    LYS 104           H        LYS 104   9.141  19.422  -3.624
  748    HA   LYS 104           HA       LYS 104   8.059  21.086  -4.825
  749   1HB   LYS 104          2HB       LYS 104   7.085  19.838  -6.461
  750   2HB   LYS 104          1HB       LYS 104   6.604  18.593  -5.324
  751   1HG   LYS 104          2HG       LYS 104   4.592  19.832  -4.720
  752   2HG   LYS 104          1HG       LYS 104   5.119  21.213  -5.690
  753   1HD   LYS 104          2HD       LYS 104   4.827  20.045  -7.735
  754   2HD   LYS 104          1HD       LYS 104   4.758  18.479  -6.930
  755   1HE   LYS 104          2HE       LYS 104   2.569  18.835  -6.144
  756   2HE   LYS 104          1HE       LYS 104   2.676  20.585  -6.351
  757   1HZ   LYS 104          1HZ       LYS 104   3.041  19.878  -8.837
  758   2HZ   LYS 104          2HZ       LYS 104   1.481  20.033  -8.185
  759   3HZ   LYS 104          3HZ       LYS 104   2.187  18.497  -8.344
  760    H    GLY 105           H        GLY 105   5.935  19.492  -2.444
  761   1HA   GLY 105          2HA       GLY 105   5.225  22.163  -1.399
  762   2HA   GLY 105          1HA       GLY 105   3.890  21.193  -2.037
  763    H    GLY 106           H        GLY 106   6.694  20.783   0.161
  764   1HA   GLY 106          2HA       GLY 106   5.019  18.985   1.866
  765   2HA   GLY 106          1HA       GLY 106   6.780  19.003   1.841
  Start of MODEL   10
    1   1H    ALA   1          1HT       ALA   1   2.473  12.252  20.710
    2   2H    ALA   1          2HT       ALA   1   3.070  10.896  21.544
    3   3H    ALA   1          3HT       ALA   1   1.807  11.823  22.208
    4    HA   ALA   1           HA       ALA   1   0.539  10.180  21.370
    5   1HB   ALA   1          1HB       ALA   1   0.055  12.316  20.107
    6   2HB   ALA   1          2HB       ALA   1  -0.392  10.843  19.248
    7   3HB   ALA   1          3HB       ALA   1   1.082  11.703  18.809
    8    H    ASP   2           H        ASP   2   0.227   8.768  19.191
    9    HA   ASP   2           HA       ASP   2   0.997   6.773  18.238
   10   1HB   ASP   2          2HB       ASP   2   2.976   7.162  16.711
   11   2HB   ASP   2          1HB       ASP   2   1.613   8.249  16.477
   12    H    LEU   3           H        LEU   3   3.237   5.512  17.792
   13    HA   LEU   3           HA       LEU   3   4.717   5.369  20.393
   14   1HB   LEU   3          2HB       LEU   3   4.143   2.989  18.608
   15   2HB   LEU   3          1HB       LEU   3   4.684   2.985  20.283
   16    HG   LEU   3           HG       LEU   3   1.982   4.012  19.366
   17   1HD1  LEU   3          1HD1      LEU   3   2.863   1.345  20.495
   18   2HD1  LEU   3          2HD1      LEU   3   1.994   1.645  18.992
   19   3HD1  LEU   3          3HD1      LEU   3   1.187   1.891  20.540
   20   1HD2  LEU   3          1HD2      LEU   3   3.276   3.542  22.063
   21   2HD2  LEU   3          2HD2      LEU   3   1.531   3.707  21.866
   22   3HD2  LEU   3          3HD2      LEU   3   2.597   5.040  21.436
   23    H    GLU   4           H        GLU   4   4.793   5.058  16.888
   24    HA   GLU   4           HA       GLU   4   6.570   5.033  15.371
   25   1HB   GLU   4          2HB       GLU   4   8.133   6.189  17.706
   26   2HB   GLU   4          1HB       GLU   4   8.627   6.208  16.016
   27   1HG   GLU   4          2HG       GLU   4   6.030   7.423  16.980
   28   2HG   GLU   4          1HG       GLU   4   7.526   8.346  16.836
   29    H    ASP   5           H        ASP   5   6.025   2.753  17.194
   30    HA   ASP   5           HA       ASP   5   8.440   1.216  16.573
   31   1HB   ASP   5          2HB       ASP   5   8.874   2.321  18.820
   32   2HB   ASP   5          1HB       ASP   5   7.507   1.400  19.447
   33    H    ASN   6           H        ASN   6   7.360  -0.648  18.839
   34    HA   ASN   6           HA       ASN   6   5.990  -2.554  18.824
   35   1HB   ASN   6          2HB       ASN   6   4.189  -0.274  18.045
   36   2HB   ASN   6          1HB       ASN   6   3.555  -1.899  18.315
   37   1HD2  ASN   6          1HD2      ASN   6   5.370   0.754  19.912
   38   2HD2  ASN   6          2HD2      ASN   6   4.952   0.304  21.492
   39    H    ASP   7           H        ASP   7   7.548  -2.498  16.512
   40    HA   ASP   7           HA       ASP   7   5.699  -3.768  14.577
   41   1HB   ASP   7          2HB       ASP   7   6.562  -2.446  12.694
   42   2HB   ASP   7          1HB       ASP   7   5.833  -1.388  13.902
   43    H    GLU   8           H        GLU   8   8.546  -3.052  12.989
   44    HA   GLU   8           HA       GLU   8   9.488  -5.794  13.324
   45   1HB   GLU   8          2HB       GLU   8  10.639  -3.476  11.742
   46   2HB   GLU   8          1HB       GLU   8  11.174  -5.153  11.634
   47   1HG   GLU   8          2HG       GLU   8   8.327  -4.270  11.106
   48   2HG   GLU   8          1HG       GLU   8   9.535  -4.477   9.839
   49    H    THR   9           H        THR   9   9.661  -3.672  15.533
   50    HA   THR   9           HA       THR   9  12.574  -3.493  15.944
   51    HB   THR   9           HB       THR   9  10.134  -2.437  17.390
   52    HG1  THR   9           1HG      THR   9  10.603  -0.745  16.276
   53   1HG2  THR   9          1HG2      THR   9  12.046  -1.162  18.701
   54   2HG2  THR   9          2HG2      THR   9  12.972  -2.615  18.334
   55   3HG2  THR   9          3HG2      THR   9  11.471  -2.731  19.256
   56    H    GLY  10           H        GLY  10  10.804  -5.986  15.968
   57   1HA   GLY  10          2HA       GLY  10  10.756  -8.018  17.125
   58   2HA   GLY  10          1HA       GLY  10  12.219  -7.464  17.946
   59    H    ASN  11           H        ASN  11   8.814  -6.396  17.927
   60    HA   ASN  11           HA       ASN  11   8.940  -5.938  20.831
   61   1HB   ASN  11          2HB       ASN  11   7.829  -4.361  19.207
   62   2HB   ASN  11          1HB       ASN  11   6.608  -5.596  18.932
   63   1HD2  ASN  11          1HD2      ASN  11   8.041  -3.567  21.519
   64   2HD2  ASN  11          2HD2      ASN  11   6.671  -3.601  22.523
   65    H    ASP  12           H        ASP  12   5.895  -6.613  20.724
   66    HA   ASP  12           HA       ASP  12   6.234  -9.485  21.436
   67   1HB   ASP  12          2HB       ASP  12   5.258  -7.858  23.113
   68   2HB   ASP  12          1HB       ASP  12   3.891  -7.656  22.021
   69    H    ASN  13           H        ASN  13   5.593  -7.887  18.739
   70    HA   ASN  13           HA       ASN  13   3.871 -10.012  17.693
   71   1HB   ASN  13          2HB       ASN  13   2.985  -7.118  17.628
   72   2HB   ASN  13          1HB       ASN  13   2.181  -8.469  16.831
   73   1HD2  ASN  13          1HD2      ASN  13   1.351 -10.243  18.322
   74   2HD2  ASN  13          2HD2      ASN  13   0.870  -9.820  19.892
   75    H    GLY  14           H        GLY  14   6.085 -10.121  16.721
   76   1HA   GLY  14          2HA       GLY  14   6.066  -8.716  14.115
   77   2HA   GLY  14          1HA       GLY  14   7.493  -8.481  15.129
   78    H    LYS  15           H        LYS  15   5.622 -11.479  14.914
   79    HA   LYS  15           HA       LYS  15   8.053 -12.971  14.319
   80   1HB   LYS  15          2HB       LYS  15   5.201 -14.001  14.183
   81   2HB   LYS  15          1HB       LYS  15   6.667 -14.944  14.423
   82   1HG   LYS  15          2HG       LYS  15   5.896 -12.797  16.402
   83   2HG   LYS  15          1HG       LYS  15   5.166 -14.395  16.495
   84   1HD   LYS  15          2HD       LYS  15   8.159 -14.186  16.286
   85   2HD   LYS  15          1HD       LYS  15   7.393 -13.854  17.832
   86   1HE   LYS  15          2HE       LYS  15   6.873 -16.381  16.244
   87   2HE   LYS  15          1HE       LYS  15   8.107 -16.260  17.500
   88   1HZ   LYS  15          1HZ       LYS  15   6.265 -15.453  18.991
   89   2HZ   LYS  15          2HZ       LYS  15   6.193 -17.093  18.544
   90   3HZ   LYS  15          3HZ       LYS  15   5.175 -15.958  17.792
   91    H    GLY  16           H        GLY  16   6.961 -10.913  12.398
   92   1HA   GLY  16          2HA       GLY  16   6.152 -12.507  10.055
   93   2HA   GLY  16          1HA       GLY  16   6.362 -10.754  10.099
   94    H    GLY  17           H        GLY  17   8.989 -11.981  11.615
   95   1HA   GLY  17          2HA       GLY  17  10.701 -11.622   9.230
   96   2HA   GLY  17          1HA       GLY  17  11.259 -11.763  10.900
   97    H    GLU  18           H        GLU  18   8.924 -14.071  10.323
   98    HA   GLU  18           HA       GLU  18  10.784 -16.106   9.254
   99   1HB   GLU  18          2HB       GLU  18  10.841 -15.841  11.904
  100   2HB   GLU  18          1HB       GLU  18   9.344 -16.768  11.818
  101   1HG   GLU  18          2HG       GLU  18  10.499 -18.532  10.541
  102   2HG   GLU  18          1HG       GLU  18  11.997 -17.602  10.606
  103    H    LYS  19           H        LYS  19   7.920 -14.720   8.932
  104    HA   LYS  19           HA       LYS  19   6.109 -16.994   8.985
  105   1HB   LYS  19          2HB       LYS  19   5.187 -14.743   9.133
  106   2HB   LYS  19          1HB       LYS  19   5.936 -14.294   7.602
  107   1HG   LYS  19          2HG       LYS  19   3.505 -14.804   7.380
  108   2HG   LYS  19          1HG       LYS  19   4.507 -15.862   6.387
  109   1HD   LYS  19          2HD       LYS  19   4.109 -17.729   7.734
  110   2HD   LYS  19          1HD       LYS  19   3.814 -16.763   9.175
  111   1HE   LYS  19          2HE       LYS  19   1.859 -16.410   6.944
  112   2HE   LYS  19          1HE       LYS  19   1.806 -17.947   7.809
  113   1HZ   LYS  19          1HZ       LYS  19   0.681 -15.604   8.630
  114   2HZ   LYS  19          2HZ       LYS  19   2.092 -15.709   9.568
  115   3HZ   LYS  19          3HZ       LYS  19   0.952 -16.971   9.596
  116    H    ALA  20           H        ALA  20   6.776 -15.088   6.064
  117    HA   ALA  20           HA       ALA  20   7.186 -15.796   3.866
  118   1HB   ALA  20          1HB       ALA  20   8.636 -18.114   5.161
  119   2HB   ALA  20          2HB       ALA  20   9.321 -16.493   5.076
  120   3HB   ALA  20          3HB       ALA  20   8.962 -17.376   3.593
  121    H    ASP  21           H        ASP  21   4.711 -16.395   4.180
  122    HA   ASP  21           HA       ASP  21   4.178 -19.281   4.175
  123   1HB   ASP  21          2HB       ASP  21   2.549 -17.523   5.036
  124   2HB   ASP  21          1HB       ASP  21   2.306 -17.038   3.358
  125    H    ASN  22           H        ASN  22   5.524 -17.137   2.150
  126    HA   ASN  22           HA       ASN  22   5.924 -17.022  -0.131
  127   1HB   ASN  22          2HB       ASN  22   5.677 -19.912   0.548
  128   2HB   ASN  22          1HB       ASN  22   5.595 -19.529  -1.165
  129   1HD2  ASN  22          1HD2      ASN  22   7.489 -18.067  -1.983
  130   2HD2  ASN  22          2HD2      ASN  22   9.005 -18.330  -1.270
  131    H    ALA  23           H        ALA  23   4.376 -15.815  -1.101
  132    HA   ALA  23           HA       ALA  23   2.710 -15.566  -2.789
  133   1HB   ALA  23          1HB       ALA  23   1.298 -17.292  -3.482
  134   2HB   ALA  23          2HB       ALA  23   1.293 -18.071  -1.904
  135   3HB   ALA  23          3HB       ALA  23   2.721 -18.174  -2.934
  136    H    ALA  24           H        ALA  24   1.557 -16.948   0.319
  137    HA   ALA  24           HA       ALA  24  -0.878 -15.424   0.277
  138   1HB   ALA  24          1HB       ALA  24  -1.323 -16.611   2.175
  139   2HB   ALA  24          2HB       ALA  24   0.120 -16.004   2.986
  140   3HB   ALA  24          3HB       ALA  24   0.229 -17.402   1.922
  141    H    GLN  25           H        GLN  25   1.885 -14.916   2.510
  142    HA   GLN  25           HA       GLN  25   1.168 -12.249   3.179
  143   1HB   GLN  25          2HB       GLN  25   3.213 -12.144   4.318
  144   2HB   GLN  25          1HB       GLN  25   2.928 -13.877   4.244
  145   1HG   GLN  25          2HG       GLN  25   5.152 -13.744   3.524
  146   2HG   GLN  25          1HG       GLN  25   4.288 -13.738   1.989
  147   1HE2  GLN  25          1HE2      GLN  25   6.413 -12.581   1.292
  148   2HE2  GLN  25          2HE2      GLN  25   6.472 -10.895   1.488
  149    H    VAL  26           H        VAL  26   2.610 -13.509   0.315
  150    HA   VAL  26           HA       VAL  26   4.042 -11.174  -0.510
  151    HB   VAL  26           HB       VAL  26   2.775 -13.347  -2.184
  152   1HG1  VAL  26          1HG1      VAL  26   3.257 -11.479  -3.601
  153   2HG1  VAL  26          2HG1      VAL  26   4.596 -12.611  -3.801
  154   3HG1  VAL  26          3HG1      VAL  26   4.793 -11.179  -2.789
  155   1HG2  VAL  26          1HG2      VAL  26   5.613 -12.997  -1.177
  156   2HG2  VAL  26          2HG2      VAL  26   5.003 -14.347  -2.135
  157   3HG2  VAL  26          3HG2      VAL  26   4.437 -14.112  -0.483
  158    H    LYS  27           H        LYS  27   0.855 -12.341  -1.729
  159    HA   LYS  27           HA       LYS  27   0.307  -9.856  -3.059
  160   1HB   LYS  27          2HB       LYS  27  -1.908 -10.715  -3.418
  161   2HB   LYS  27          1HB       LYS  27  -0.808 -12.089  -3.526
  162   1HG   LYS  27          2HG       LYS  27  -1.290 -12.482  -1.038
  163   2HG   LYS  27          1HG       LYS  27  -2.609 -11.328  -1.219
  164   1HD   LYS  27          2HD       LYS  27  -3.608 -12.705  -2.978
  165   2HD   LYS  27          1HD       LYS  27  -2.264 -13.842  -2.876
  166   1HE   LYS  27          2HE       LYS  27  -4.412 -14.462  -1.592
  167   2HE   LYS  27          1HE       LYS  27  -2.891 -14.561  -0.707
  168   1HZ   LYS  27          1HZ       LYS  27  -4.385 -12.033  -0.682
  169   2HZ   LYS  27          2HZ       LYS  27  -3.359 -12.693   0.502
  170   3HZ   LYS  27          3HZ       LYS  27  -4.930 -13.310   0.294
  171    H    ASP  28           H        ASP  28  -0.466 -11.045   0.183
  172    HA   ASP  28           HA       ASP  28  -2.307  -9.032   0.956
  173   1HB   ASP  28          2HB       ASP  28  -0.200 -10.412   2.647
  174   2HB   ASP  28          1HB       ASP  28  -1.613  -9.555   3.269
  175    H    ALA  29           H        ALA  29   1.248  -9.016   0.991
  176    HA   ALA  29           HA       ALA  29   1.535  -6.495   2.311
  177   1HB   ALA  29          1HB       ALA  29   3.385  -8.142   2.033
  178   2HB   ALA  29          2HB       ALA  29   3.832  -6.548   1.423
  179   3HB   ALA  29          3HB       ALA  29   3.375  -7.827   0.299
  180    H    LEU  30           H        LEU  30   1.486  -7.392  -1.122
  181    HA   LEU  30           HA       LEU  30   1.743  -4.739  -2.082
  182   1HB   LEU  30          2HB       LEU  30   0.269  -6.981  -3.457
  183   2HB   LEU  30          1HB       LEU  30   1.058  -5.605  -4.215
  184    HG   LEU  30           HG       LEU  30   2.507  -7.699  -2.574
  185   1HD1  LEU  30          1HD1      LEU  30   2.148  -7.371  -5.560
  186   2HD1  LEU  30          2HD1      LEU  30   1.716  -8.768  -4.577
  187   3HD1  LEU  30          3HD1      LEU  30   3.413  -8.372  -4.847
  188   1HD2  LEU  30          1HD2      LEU  30   3.782  -5.699  -2.524
  189   2HD2  LEU  30          2HD2      LEU  30   3.373  -5.297  -4.192
  190   3HD2  LEU  30          3HD2      LEU  30   4.483  -6.623  -3.849
  191    H    THR  31           H        THR  31  -1.214  -6.702  -1.608
  192    HA   THR  31           HA       THR  31  -3.047  -4.617  -2.297
  193    HB   THR  31           HB       THR  31  -4.593  -6.009  -0.655
  194    HG1  THR  31           1HG      THR  31  -2.385  -6.992   0.021
  195   1HG2  THR  31          1HG2      THR  31  -4.954  -7.667  -2.398
  196   2HG2  THR  31          2HG2      THR  31  -3.374  -7.323  -3.096
  197   3HG2  THR  31          3HG2      THR  31  -4.646  -6.101  -3.147
  198    H    LYS  32           H        LYS  32  -1.382  -5.394   0.706
  199    HA   LYS  32           HA       LYS  32  -2.900  -3.742   2.451
  200   1HB   LYS  32          2HB       LYS  32  -1.251  -5.337   3.289
  201   2HB   LYS  32          1HB       LYS  32   0.052  -4.428   2.527
  202   1HG   LYS  32          2HG       LYS  32  -1.656  -2.771   4.302
  203   2HG   LYS  32          1HG       LYS  32  -0.816  -4.064   5.150
  204   1HD   LYS  32          2HD       LYS  32   1.326  -3.284   4.408
  205   2HD   LYS  32          1HD       LYS  32   0.591  -2.159   3.264
  206   1HE   LYS  32          2HE       LYS  32  -0.012  -0.651   4.932
  207   2HE   LYS  32          1HE       LYS  32  -0.123  -1.899   6.175
  208   1HZ   LYS  32          1HZ       LYS  32   1.820  -0.762   6.676
  209   2HZ   LYS  32          2HZ       LYS  32   2.291  -0.627   5.051
  210   3HZ   LYS  32          3HZ       LYS  32   2.373  -2.130   5.840
  211    H    MET  33           H        MET  33   0.026  -2.976   0.527
  212    HA   MET  33           HA       MET  33   0.199  -0.244   1.331
  213   1HB   MET  33          2HB       MET  33   0.934  -1.446  -1.356
  214   2HB   MET  33          1HB       MET  33   1.492   0.111  -0.736
  215   1HG   MET  33          2HG       MET  33   2.337  -1.287   1.309
  216   2HG   MET  33          1HG       MET  33   2.192  -2.662   0.217
  217   1HE   MET  33          1HE       MET  33   6.005  -1.917   0.369
  218   2HE   MET  33          2HE       MET  33   4.666  -2.904   0.947
  219   3HE   MET  33          3HE       MET  33   4.951  -1.316   1.656
  220    H    ARG  34           H        ARG  34  -1.789  -1.811  -1.170
  221    HA   ARG  34           HA       ARG  34  -2.687   0.563  -2.461
  222   1HB   ARG  34          2HB       ARG  34  -3.248  -1.526  -3.486
  223   2HB   ARG  34          1HB       ARG  34  -4.037  -2.114  -2.028
  224   1HG   ARG  34          2HG       ARG  34  -5.856  -0.588  -2.271
  225   2HG   ARG  34          1HG       ARG  34  -5.007   0.335  -3.513
  226   1HD   ARG  34          2HD       ARG  34  -5.043  -1.830  -4.911
  227   2HD   ARG  34          1HD       ARG  34  -6.208  -2.434  -3.735
  228    HE   ARG  34           HE       ARG  34  -6.913   0.178  -4.849
  229   1HH1  ARG  34          1HH2      ARG  34  -7.050  -3.258  -5.116
  230   2HH1  ARG  34          2HH2      ARG  34  -8.445  -3.257  -6.143
  231   1HH2  ARG  34          1HH1      ARG  34  -8.733   0.197  -6.206
  232   2HH2  ARG  34          2HH1      ARG  34  -9.393  -1.303  -6.764
  233    H    ALA  35           H        ALA  35  -4.183  -1.249   0.231
  234    HA   ALA  35           HA       ALA  35  -6.286   0.585   0.729
  235   1HB   ALA  35          1HB       ALA  35  -6.051  -1.716   1.734
  236   2HB   ALA  35          2HB       ALA  35  -6.486  -0.464   2.898
  237   3HB   ALA  35          3HB       ALA  35  -4.825  -1.053   2.816
  238    H    ALA  36           H        ALA  36  -2.892   0.637   1.699
  239    HA   ALA  36           HA       ALA  36  -3.106   2.698   3.672
  240   1HB   ALA  36          1HB       ALA  36  -0.733   3.091   3.299
  241   2HB   ALA  36          2HB       ALA  36  -0.800   2.237   1.760
  242   3HB   ALA  36          3HB       ALA  36  -1.030   1.353   3.266
  243    H    ALA  37           H        ALA  37  -2.538   2.842   0.145
  244    HA   ALA  37           HA       ALA  37  -2.385   5.678  -0.046
  245   1HB   ALA  37          1HB       ALA  37  -1.738   4.233  -1.909
  246   2HB   ALA  37          2HB       ALA  37  -3.033   5.307  -2.435
  247   3HB   ALA  37          3HB       ALA  37  -3.388   3.624  -2.045
  248    H    LEU  38           H        LEU  38  -5.187   3.470  -0.349
  249    HA   LEU  38           HA       LEU  38  -7.111   5.568  -0.808
  250   1HB   LEU  38          2HB       LEU  38  -7.601   2.844   0.415
  251   2HB   LEU  38          1HB       LEU  38  -8.786   3.869  -0.387
  252    HG   LEU  38           HG       LEU  38  -6.319   2.711  -1.723
  253   1HD1  LEU  38          1HD1      LEU  38  -7.804   1.132  -2.791
  254   2HD1  LEU  38          2HD1      LEU  38  -9.219   1.900  -2.068
  255   3HD1  LEU  38          3HD1      LEU  38  -8.075   1.028  -1.051
  256   1HD2  LEU  38          1HD2      LEU  38  -8.630   4.422  -2.659
  257   2HD2  LEU  38          2HD2      LEU  38  -7.748   3.397  -3.792
  258   3HD2  LEU  38          3HD2      LEU  38  -6.902   4.670  -2.915
  259    H    ASP  39           H        ASP  39  -5.952   3.973   2.138
  260    HA   ASP  39           HA       ASP  39  -7.852   5.091   3.944
  261   1HB   ASP  39          2HB       ASP  39  -6.043   3.293   4.381
  262   2HB   ASP  39          1HB       ASP  39  -4.943   4.648   4.635
  263    H    ALA  40           H        ALA  40  -4.544   6.268   3.255
  264    HA   ALA  40           HA       ALA  40  -4.896   8.727   4.670
  265   1HB   ALA  40          1HB       ALA  40  -3.108   8.259   2.271
  266   2HB   ALA  40          2HB       ALA  40  -2.697   7.742   3.906
  267   3HB   ALA  40          3HB       ALA  40  -2.885   9.459   3.542
  268    H    GLN  41           H        GLN  41  -6.120   7.658   1.644
  269    HA   GLN  41           HA       GLN  41  -6.315  10.232   0.354
  270   1HB   GLN  41          2HB       GLN  41  -6.370   8.022  -0.830
  271   2HB   GLN  41          1HB       GLN  41  -7.999   7.775  -0.203
  272   1HG   GLN  41          2HG       GLN  41  -8.682   9.935  -1.265
  273   2HG   GLN  41          1HG       GLN  41  -7.084  10.041  -1.984
  274   1HE2  GLN  41          1HE2      GLN  41  -6.999   7.011  -2.464
  275   2HE2  GLN  41          2HE2      GLN  41  -8.041   6.765  -3.773
  276    H    LYS  42           H        LYS  42  -7.283  11.562   1.957
  277    HA   LYS  42           HA       LYS  42  -9.081  12.509   3.174
  278   1HB   LYS  42          2HB       LYS  42 -10.676  11.675   0.740
  279   2HB   LYS  42          1HB       LYS  42 -10.905  13.099   1.746
  280   1HG   LYS  42          2HG       LYS  42  -8.324  12.699   0.218
  281   2HG   LYS  42          1HG       LYS  42  -9.726  13.393  -0.579
  282   1HD   LYS  42          2HD       LYS  42  -8.830  14.527   2.072
  283   2HD   LYS  42          1HD       LYS  42  -7.965  14.965   0.605
  284   1HE   LYS  42          2HE       LYS  42  -9.934  15.902  -0.391
  285   2HE   LYS  42          1HE       LYS  42 -10.972  15.223   0.865
  286   1HZ   LYS  42          1HZ       LYS  42 -10.162  16.703   2.444
  287   2HZ   LYS  42          2HZ       LYS  42 -10.319  17.663   1.050
  288   3HZ   LYS  42          3HZ       LYS  42  -8.791  17.098   1.528
  289    H    ALA  43           H        ALA  43  -8.692   9.917   4.036
  290    HA   ALA  43           HA       ALA  43 -11.500   9.060   4.629
  291   1HB   ALA  43          1HB       ALA  43  -9.429   6.908   4.429
  292   2HB   ALA  43          2HB       ALA  43 -10.018   7.589   2.916
  293   3HB   ALA  43          3HB       ALA  43 -11.148   6.848   4.046
  294    H    THR  44           H        THR  44  -8.079   8.900   5.555
  295    HA   THR  44           HA       THR  44  -8.877   9.060   8.409
  296    HB   THR  44           HB       THR  44  -6.626   7.293   7.425
  297    HG1  THR  44           1HG      THR  44  -8.339   5.645   8.076
  298   1HG2  THR  44          1HG2      THR  44  -6.605   6.441   9.628
  299   2HG2  THR  44          2HG2      THR  44  -8.206   7.090   9.982
  300   3HG2  THR  44          3HG2      THR  44  -6.824   8.177   9.843
  301    HA   PRO  45           HA       PRO  45  -5.951  12.293   6.253
  302   1HB   PRO  45          2HB       PRO  45  -7.388  13.554   8.582
  303   2HB   PRO  45          1HB       PRO  45  -6.885  14.286   7.041
  304   1HG   PRO  45          2HG       PRO  45  -9.416  13.392   7.518
  305   2HG   PRO  45          1HG       PRO  45  -8.683  13.443   5.903
  306   1HD   PRO  45          2HD       PRO  45  -9.421  11.090   7.457
  307   2HD   PRO  45          1HD       PRO  45  -8.794  11.158   5.797
  308    HA   PRO  46           HA       PRO  46  -3.334  11.284   9.919
  309   1HB   PRO  46          2HB       PRO  46  -1.144  10.372   8.441
  310   2HB   PRO  46          1HB       PRO  46  -2.445   9.346   9.069
  311   1HG   PRO  46          2HG       PRO  46  -1.868  10.028   6.318
  312   2HG   PRO  46          1HG       PRO  46  -3.077   8.898   6.946
  313   1HD   PRO  46          2HD       PRO  46  -3.459  11.654   5.979
  314   2HD   PRO  46          1HD       PRO  46  -4.675  10.401   6.291
  315    H    LYS  47           H        LYS  47  -1.459  12.251   7.021
  316    HA   LYS  47           HA       LYS  47  -0.189  14.415   8.591
  317   1HB   LYS  47          2HB       LYS  47   0.257  13.796   5.657
  318   2HB   LYS  47          1HB       LYS  47   1.322  14.673   6.752
  319   1HG   LYS  47          2HG       LYS  47   1.834  12.671   7.991
  320   2HG   LYS  47          1HG       LYS  47   0.594  11.758   7.133
  321   1HD   LYS  47          2HD       LYS  47   1.809  11.910   5.056
  322   2HD   LYS  47          1HD       LYS  47   2.962  13.043   5.755
  323   1HE   LYS  47          2HE       LYS  47   3.815  10.681   5.608
  324   2HE   LYS  47          1HE       LYS  47   3.828  11.341   7.244
  325   1HZ   LYS  47          1HZ       LYS  47   2.035  10.073   7.867
  326   2HZ   LYS  47          2HZ       LYS  47   2.838   9.007   6.816
  327   3HZ   LYS  47          3HZ       LYS  47   1.471   9.865   6.281
  328    H    LEU  48           H        LEU  48  -2.827  13.950   6.503
  329    HA   LEU  48           HA       LEU  48  -2.904  16.677   5.440
  330   1HB   LEU  48          2HB       LEU  48  -5.154  14.641   5.464
  331   2HB   LEU  48          1HB       LEU  48  -4.982  16.025   4.392
  332    HG   LEU  48           HG       LEU  48  -3.175  13.583   4.446
  333   1HD1  LEU  48          1HD1      LEU  48  -5.249  14.559   2.461
  334   2HD1  LEU  48          2HD1      LEU  48  -5.313  13.078   3.418
  335   3HD1  LEU  48          3HD1      LEU  48  -4.110  13.249   2.142
  336   1HD2  LEU  48          1HD2      LEU  48  -1.772  15.371   3.807
  337   2HD2  LEU  48          2HD2      LEU  48  -3.065  16.199   2.940
  338   3HD2  LEU  48          3HD2      LEU  48  -2.345  14.736   2.265
  339    H    GLU  49           H        GLU  49  -3.044  18.093   7.152
  340    HA   GLU  49           HA       GLU  49  -5.597  18.077   8.669
  341   1HB   GLU  49          2HB       GLU  49  -3.408  16.992   9.841
  342   2HB   GLU  49          1HB       GLU  49  -3.131  18.676  10.255
  343   1HG   GLU  49          2HG       GLU  49  -5.679  17.125  10.826
  344   2HG   GLU  49          1HG       GLU  49  -4.429  17.491  12.011
  345    H    ASP  50           H        ASP  50  -3.543  19.702   6.742
  346    HA   ASP  50           HA       ASP  50  -4.718  22.282   7.258
  347   1HB   ASP  50          2HB       ASP  50  -2.999  22.037   9.145
  348   2HB   ASP  50          1HB       ASP  50  -1.763  22.116   7.888
  349    H    LYS  51           H        LYS  51  -3.513  20.136   5.231
  350    HA   LYS  51           HA       LYS  51  -2.074  22.007   3.434
  351   1HB   LYS  51          2HB       LYS  51  -2.548  19.018   3.262
  352   2HB   LYS  51          1HB       LYS  51  -1.606  19.965   2.109
  353   1HG   LYS  51          2HG       LYS  51  -0.068  20.641   3.918
  354   2HG   LYS  51          1HG       LYS  51  -1.006  19.684   5.070
  355   1HD   LYS  51          2HD       LYS  51  -0.545  17.648   3.724
  356   2HD   LYS  51          1HD       LYS  51   0.444  18.616   2.629
  357   1HE   LYS  51          2HE       LYS  51   1.969  17.612   4.172
  358   2HE   LYS  51          1HE       LYS  51   1.810  19.297   4.675
  359   1HZ   LYS  51          1HZ       LYS  51   1.101  16.916   6.076
  360   2HZ   LYS  51          2HZ       LYS  51  -0.212  17.988   5.971
  361   3HZ   LYS  51          3HZ       LYS  51   1.255  18.501   6.657
  362    H    SER  52           H        SER  52  -4.556  19.446   2.927
  363    HA   SER  52           HA       SER  52  -6.381  19.450   1.422
  364   1HB   SER  52          2HB       SER  52  -6.612  21.605   3.121
  365   2HB   SER  52          1HB       SER  52  -6.689  22.403   1.557
  366    HG   SER  52           HG       SER  52  -8.190  20.072   2.076
  367    HA   PRO  53           HA       PRO  53  -5.150  20.733  -2.637
  368   1HB   PRO  53          2HB       PRO  53  -7.348  22.737  -2.957
  369   2HB   PRO  53          1HB       PRO  53  -6.966  21.314  -3.950
  370   1HG   PRO  53          2HG       PRO  53  -9.051  21.281  -2.318
  371   2HG   PRO  53          1HG       PRO  53  -8.008  19.852  -2.474
  372   1HD   PRO  53          2HD       PRO  53  -8.053  21.891  -0.267
  373   2HD   PRO  53          1HD       PRO  53  -7.929  20.119  -0.167
  374    H    ASP  54           H        ASP  54  -4.087  22.308  -0.404
  375    HA   ASP  54           HA       ASP  54  -3.844  25.071  -1.377
  376   1HB   ASP  54          2HB       ASP  54  -3.952  24.570   1.066
  377   2HB   ASP  54          1HB       ASP  54  -2.451  23.651   0.928
  378    H    SER  55           H        SER  55  -1.232  22.961  -0.221
  379    HA   SER  55           HA       SER  55   0.588  24.003  -2.207
  380   1HB   SER  55          2HB       SER  55   0.876  22.759   0.220
  381   2HB   SER  55          1HB       SER  55   1.310  21.449  -0.867
  382    HG   SER  55           HG       SER  55   2.807  23.447  -0.117
  383    HA   PRO  56           HA       PRO  56   0.356  21.054  -5.570
  384   1HB   PRO  56          2HB       PRO  56   2.680  19.407  -4.628
  385   2HB   PRO  56          1HB       PRO  56   2.396  20.150  -6.215
  386   1HG   PRO  56          2HG       PRO  56   4.142  21.215  -4.549
  387   2HG   PRO  56          1HG       PRO  56   3.051  22.255  -5.484
  388   1HD   PRO  56          2HD       PRO  56   2.880  21.477  -2.584
  389   2HD   PRO  56          1HD       PRO  56   2.557  23.050  -3.352
  390    H    GLU  57           H        GLU  57  -0.185  20.073  -2.476
  391    HA   GLU  57           HA       GLU  57  -0.239  17.359  -2.215
  392   1HB   GLU  57          2HB       GLU  57  -1.212  18.588  -0.444
  393   2HB   GLU  57          1HB       GLU  57  -2.378  19.372  -1.513
  394   1HG   GLU  57          2HG       GLU  57  -3.675  17.394  -1.728
  395   2HG   GLU  57          1HG       GLU  57  -2.386  16.379  -1.084
  396    H    MET  58           H        MET  58  -2.752  19.157  -4.023
  397    HA   MET  58           HA       MET  58  -4.281  16.929  -4.842
  398   1HB   MET  58          2HB       MET  58  -4.737  19.456  -5.170
  399   2HB   MET  58          1HB       MET  58  -3.763  19.311  -6.634
  400   1HG   MET  58          2HG       MET  58  -5.258  17.555  -7.476
  401   2HG   MET  58          1HG       MET  58  -6.215  17.644  -6.001
  402   1HE   MET  58          1HE       MET  58  -5.797  20.612  -9.406
  403   2HE   MET  58          2HE       MET  58  -4.672  19.374  -8.851
  404   3HE   MET  58          3HE       MET  58  -4.723  20.940  -8.043
  405    H    LYS  59           H        LYS  59  -1.476  18.434  -6.466
  406    HA   LYS  59           HA       LYS  59  -1.514  16.676  -8.708
  407   1HB   LYS  59          2HB       LYS  59   0.850  18.156  -7.507
  408   2HB   LYS  59          1HB       LYS  59   0.762  17.503  -9.143
  409   1HG   LYS  59          2HG       LYS  59  -1.313  19.468  -8.162
  410   2HG   LYS  59          1HG       LYS  59   0.234  20.036  -8.778
  411   1HD   LYS  59          2HD       LYS  59  -1.117  18.014 -10.502
  412   2HD   LYS  59          1HD       LYS  59  -1.965  19.543 -10.361
  413   1HE   LYS  59          2HE       LYS  59   0.174  20.714 -10.999
  414   2HE   LYS  59          1HE       LYS  59   0.888  19.128 -11.292
  415   1HZ   LYS  59          1HZ       LYS  59  -1.605  19.265 -12.573
  416   2HZ   LYS  59          2HZ       LYS  59  -0.065  19.076 -13.266
  417   3HZ   LYS  59          3HZ       LYS  59  -0.701  20.631 -13.013
  418    H    ASP  60           H        ASP  60   0.684  16.564  -5.847
  419    HA   ASP  60           HA       ASP  60   1.784  14.033  -6.591
  420   1HB   ASP  60          2HB       ASP  60   2.359  13.861  -4.108
  421   2HB   ASP  60          1HB       ASP  60   2.981  15.277  -4.954
  422    H    PHE  61           H        PHE  61  -1.237  14.890  -5.074
  423    HA   PHE  61           HA       PHE  61  -1.740  12.303  -3.902
  424   1HB   PHE  61          2HB       PHE  61  -3.075  14.001  -2.994
  425   2HB   PHE  61          1HB       PHE  61  -3.407  14.728  -4.558
  426    HD1  PHE  61           1HD      PHE  61  -5.799  14.818  -4.326
  427    HD2  PHE  61           2HD      PHE  61  -3.710  11.093  -3.858
  428    HE1  PHE  61           1HE      PHE  61  -7.956  13.597  -4.395
  429    HE2  PHE  61           2HE      PHE  61  -5.857   9.875  -3.954
  430    HZ   PHE  61           HZ       PHE  61  -7.981  11.124  -4.216
  431    H    ARG  62           H        ARG  62  -2.922  13.915  -6.859
  432    HA   ARG  62           HA       ARG  62  -4.139  11.568  -7.883
  433   1HB   ARG  62          2HB       ARG  62  -3.116  14.041  -9.275
  434   2HB   ARG  62          1HB       ARG  62  -4.018  12.766 -10.095
  435   1HG   ARG  62          2HG       ARG  62  -5.737  13.185  -8.057
  436   2HG   ARG  62          1HG       ARG  62  -4.976  14.774  -8.072
  437   1HD   ARG  62          2HD       ARG  62  -5.422  14.538 -10.705
  438   2HD   ARG  62          1HD       ARG  62  -6.711  13.483 -10.137
  439    HE   ARG  62           HE       ARG  62  -6.677  16.000  -8.694
  440   1HH1  ARG  62          1HH2      ARG  62  -7.622  14.330 -11.563
  441   2HH1  ARG  62          2HH2      ARG  62  -8.876  15.456 -11.972
  442   1HH2  ARG  62          1HH1      ARG  62  -8.320  17.492  -9.220
  443   2HH2  ARG  62          2HH1      ARG  62  -9.268  17.239 -10.650
  444    H    HIS  63           H        HIS  63  -1.047  13.102  -8.837
  445    HA   HIS  63           HA       HIS  63  -0.206  10.904 -10.461
  446   1HB   HIS  63          2HB       HIS  63   0.707  13.330 -10.355
  447   2HB   HIS  63          1HB       HIS  63   1.717  12.743  -9.036
  448    HD1  HIS  63           1HD      HIS  63   3.987  12.360 -10.012
  449    HD2  HIS  63           2HD      HIS  63   0.976  10.969 -12.539
  450    HE1  HIS  63           1HE      HIS  63   5.148  11.228 -11.957
  451    H    GLY  64           H        GLY  64   0.465  11.633  -7.020
  452   1HA   GLY  64          2HA       GLY  64   2.337   9.478  -6.671
  453   2HA   GLY  64          1HA       GLY  64   1.515  10.318  -5.365
  454    H    PHE  65           H        PHE  65  -1.128   9.633  -5.677
  455    HA   PHE  65           HA       PHE  65  -1.114   6.906  -4.791
  456   1HB   PHE  65          2HB       PHE  65  -3.185   7.425  -4.013
  457   2HB   PHE  65          1HB       PHE  65  -2.969   9.028  -4.691
  458    HD1  PHE  65           1HD      PHE  65  -4.509   9.793  -6.288
  459    HD2  PHE  65           2HD      PHE  65  -4.052   5.565  -5.672
  460    HE1  PHE  65           1HE      PHE  65  -6.402   9.365  -7.823
  461    HE2  PHE  65           2HE      PHE  65  -5.939   5.137  -7.224
  462    HZ   PHE  65           HZ       PHE  65  -7.115   7.036  -8.295
  463    H    ASP  66           H        ASP  66  -1.346   8.321  -7.941
  464    HA   ASP  66           HA       ASP  66  -2.560   6.027  -9.242
  465   1HB   ASP  66          2HB       ASP  66  -2.534   8.289 -10.276
  466   2HB   ASP  66          1HB       ASP  66  -0.777   8.192 -10.395
  467    H    ILE  67           H        ILE  67   0.762   7.189  -8.845
  468    HA   ILE  67           HA       ILE  67   2.029   5.040 -10.215
  469    HB   ILE  67           HB       ILE  67   3.015   6.809  -7.956
  470   1HG1  ILE  67          2HG1      ILE  67   3.649   6.869 -10.912
  471   2HG1  ILE  67          1HG1      ILE  67   2.330   7.804 -10.207
  472   1HG2  ILE  67          1HG2      ILE  67   4.391   4.791  -8.009
  473   2HG2  ILE  67          2HG2      ILE  67   5.289   6.108  -8.760
  474   3HG2  ILE  67          3HG2      ILE  67   4.513   4.888  -9.766
  475   1HD1  ILE  67          1HD1      ILE  67   4.375   9.174 -10.354
  476   2HD1  ILE  67          2HD1      ILE  67   5.259   7.971  -9.414
  477   3HD1  ILE  67          3HD1      ILE  67   3.951   8.889  -8.666
  478    H    LEU  68           H        LEU  68   1.498   5.464  -6.684
  479    HA   LEU  68           HA       LEU  68   2.500   2.972  -5.862
  480   1HB   LEU  68          2HB       LEU  68   0.288   4.755  -4.828
  481   2HB   LEU  68          1HB       LEU  68   0.591   3.206  -4.040
  482    HG   LEU  68           HG       LEU  68   2.756   5.287  -4.504
  483   1HD1  LEU  68          1HD1      LEU  68   0.974   6.241  -3.102
  484   2HD1  LEU  68          2HD1      LEU  68   2.405   5.904  -2.124
  485   3HD1  LEU  68          3HD1      LEU  68   1.018   4.815  -2.058
  486   1HD2  LEU  68          1HD2      LEU  68   3.670   3.958  -2.420
  487   2HD2  LEU  68          2HD2      LEU  68   3.840   3.246  -4.020
  488   3HD2  LEU  68          3HD2      LEU  68   2.552   2.701  -2.946
  489    H    VAL  69           H        VAL  69  -0.919   3.736  -6.657
  490    HA   VAL  69           HA       VAL  69  -1.796   1.022  -6.575
  491    HB   VAL  69           HB       VAL  69  -2.811   3.581  -7.767
  492   1HG1  VAL  69          1HG1      VAL  69  -3.685   0.848  -8.670
  493   2HG1  VAL  69          2HG1      VAL  69  -3.427   2.309  -9.624
  494   3HG1  VAL  69          3HG1      VAL  69  -4.852   2.170  -8.596
  495   1HG2  VAL  69          1HG2      VAL  69  -3.218   2.547  -5.372
  496   2HG2  VAL  69          2HG2      VAL  69  -4.427   1.573  -6.205
  497   3HG2  VAL  69          3HG2      VAL  69  -4.549   3.334  -6.220
  498    H    GLY  70           H        GLY  70  -0.233   2.925  -9.103
  499   1HA   GLY  70          2HA       GLY  70  -0.664   1.132 -11.280
  500   2HA   GLY  70          1HA       GLY  70   0.648   2.300 -11.182
  501    H    GLN  71           H        GLN  71   2.104   1.340  -9.009
  502    HA   GLN  71           HA       GLN  71   3.365  -1.004 -10.241
  503   1HB   GLN  71          2HB       GLN  71   4.742  -0.570  -7.853
  504   2HB   GLN  71          1HB       GLN  71   5.148   0.169  -9.401
  505   1HG   GLN  71          2HG       GLN  71   3.984   2.146  -8.898
  506   2HG   GLN  71          1HG       GLN  71   3.103   1.399  -7.560
  507   1HE2  GLN  71          1HE2      GLN  71   4.092   3.527  -6.557
  508   2HE2  GLN  71          2HE2      GLN  71   5.608   3.327  -5.802
  509    H    ILE  72           H        ILE  72   1.146  -0.463  -7.617
  510    HA   ILE  72           HA       ILE  72   1.773  -2.872  -6.168
  511    HB   ILE  72           HB       ILE  72  -0.738  -1.186  -6.345
  512   1HG1  ILE  72          2HG1      ILE  72   1.112  -1.630  -3.989
  513   2HG1  ILE  72          1HG1      ILE  72   1.466  -0.404  -5.204
  514   1HG2  ILE  72          1HG2      ILE  72  -0.184  -3.740  -4.831
  515   2HG2  ILE  72          2HG2      ILE  72  -1.618  -3.302  -5.752
  516   3HG2  ILE  72          3HG2      ILE  72  -1.308  -2.546  -4.191
  517   1HD1  ILE  72          1HD1      ILE  72  -0.080   0.017  -2.973
  518   2HD1  ILE  72          2HD1      ILE  72  -1.318  -0.333  -4.178
  519   3HD1  ILE  72          3HD1      ILE  72  -0.177   0.982  -4.439
  520    H    ASP  73           H        ASP  73  -0.379  -2.115  -8.876
  521    HA   ASP  73           HA       ASP  73  -1.490  -4.790  -9.038
  522   1HB   ASP  73          2HB       ASP  73  -2.450  -2.596 -10.029
  523   2HB   ASP  73          1HB       ASP  73  -1.306  -2.847 -11.347
  524    H    ASP  74           H        ASP  74   1.233  -3.090 -10.581
  525    HA   ASP  74           HA       ASP  74   1.927  -5.143 -12.449
  526   1HB   ASP  74          2HB       ASP  74   3.784  -3.231 -11.010
  527   2HB   ASP  74          1HB       ASP  74   4.148  -4.113 -12.492
  528    H    ALA  75           H        ALA  75   2.842  -4.612  -9.066
  529    HA   ALA  75           HA       ALA  75   4.702  -6.816  -9.037
  530   1HB   ALA  75          1HB       ALA  75   3.340  -5.417  -6.723
  531   2HB   ALA  75          2HB       ALA  75   4.859  -4.910  -7.461
  532   3HB   ALA  75          3HB       ALA  75   4.762  -6.455  -6.614
  533    H    LEU  76           H        LEU  76   1.274  -6.436  -8.325
  534    HA   LEU  76           HA       LEU  76   1.011  -8.969  -6.983
  535   1HB   LEU  76          2HB       LEU  76  -0.606  -7.000  -6.850
  536   2HB   LEU  76          1HB       LEU  76  -1.195  -7.480  -8.435
  537    HG   LEU  76           HG       LEU  76  -1.071  -9.659  -6.366
  538   1HD1  LEU  76          1HD1      LEU  76  -1.973  -7.695  -5.102
  539   2HD1  LEU  76          2HD1      LEU  76  -3.128  -9.014  -5.286
  540   3HD1  LEU  76          3HD1      LEU  76  -3.265  -7.575  -6.298
  541   1HD2  LEU  76          1HD2      LEU  76  -3.255 -10.236  -7.424
  542   2HD2  LEU  76          2HD2      LEU  76  -1.945 -10.136  -8.596
  543   3HD2  LEU  76          3HD2      LEU  76  -3.103  -8.819  -8.459
  544    H    LYS  77           H        LYS  77   0.167  -7.975 -10.345
  545    HA   LYS  77           HA       LYS  77  -0.699 -10.554 -11.172
  546   1HB   LYS  77          2HB       LYS  77  -0.023  -9.889 -13.486
  547   2HB   LYS  77          1HB       LYS  77  -0.980  -8.652 -12.694
  548   1HG   LYS  77          2HG       LYS  77   0.701  -7.252 -13.399
  549   2HG   LYS  77          1HG       LYS  77   1.511  -7.831 -11.955
  550   1HD   LYS  77          2HD       LYS  77   3.167  -8.246 -13.522
  551   2HD   LYS  77          1HD       LYS  77   2.319  -9.782 -13.586
  552   1HE   LYS  77          2HE       LYS  77   2.168  -7.482 -15.520
  553   2HE   LYS  77          1HE       LYS  77   2.551  -9.170 -15.828
  554   1HZ   LYS  77          1HZ       LYS  77   0.292  -9.778 -15.326
  555   2HZ   LYS  77          2HZ       LYS  77   0.306  -8.597 -16.546
  556   3HZ   LYS  77          3HZ       LYS  77  -0.099  -8.170 -14.951
  557    H    LEU  78           H        LEU  78   2.524  -9.145 -10.927
  558    HA   LEU  78           HA       LEU  78   3.934 -11.280 -12.128
  559   1HB   LEU  78          2HB       LEU  78   4.725  -8.887 -11.278
  560   2HB   LEU  78          1HB       LEU  78   5.114  -9.767  -9.809
  561    HG   LEU  78           HG       LEU  78   7.115  -9.797 -11.034
  562   1HD1  LEU  78          1HD1      LEU  78   7.531 -12.092 -11.570
  563   2HD1  LEU  78          2HD1      LEU  78   5.834 -12.405 -11.893
  564   3HD1  LEU  78          3HD1      LEU  78   6.370 -12.071 -10.248
  565   1HD2  LEU  78          1HD2      LEU  78   6.619  -8.966 -13.151
  566   2HD2  LEU  78          2HD2      LEU  78   5.345 -10.138 -13.451
  567   3HD2  LEU  78          3HD2      LEU  78   7.036 -10.637 -13.523
  568    H    ALA  79           H        ALA  79   3.053 -10.703  -8.715
  569    HA   ALA  79           HA       ALA  79   4.213 -13.089  -7.686
  570   1HB   ALA  79          1HB       ALA  79   1.689 -11.632  -6.815
  571   2HB   ALA  79          2HB       ALA  79   3.312 -11.364  -6.184
  572   3HB   ALA  79          3HB       ALA  79   2.489 -12.895  -5.877
  573    H    ASN  80           H        ASN  80   0.906 -12.485  -8.887
  574    HA   ASN  80           HA       ASN  80   0.040 -15.195  -8.665
  575   1HB   ASN  80          2HB       ASN  80  -0.840 -12.844 -10.321
  576   2HB   ASN  80          1HB       ASN  80  -1.576 -14.425 -10.568
  577   1HD2  ASN  80          1HD2      ASN  80  -2.532 -11.814  -9.255
  578   2HD2  ASN  80          2HD2      ASN  80  -3.190 -12.306  -7.772
  579    H    GLU  81           H        GLU  81   0.824 -13.475 -11.695
  580    HA   GLU  81           HA       GLU  81   1.220 -15.907 -13.181
  581   1HB   GLU  81          2HB       GLU  81   0.662 -13.482 -14.002
  582   2HB   GLU  81          1HB       GLU  81   2.406 -13.249 -13.991
  583   1HG   GLU  81          2HG       GLU  81   1.899 -13.982 -16.198
  584   2HG   GLU  81          1HG       GLU  81   2.525 -15.418 -15.392
  585    H    GLY  82           H        GLY  82   3.044 -15.033 -10.695
  586   1HA   GLY  82          2HA       GLY  82   5.524 -16.131 -11.917
  587   2HA   GLY  82          1HA       GLY  82   5.640 -14.632 -11.025
  588    H    LYS  83           H        LYS  83   7.097 -16.804 -10.188
  589    HA   LYS  83           HA       LYS  83   5.648 -18.232  -8.087
  590   1HB   LYS  83          2HB       LYS  83   8.581 -17.964  -8.795
  591   2HB   LYS  83          1HB       LYS  83   8.033 -18.849  -7.374
  592   1HG   LYS  83          2HG       LYS  83   6.514 -20.165  -8.997
  593   2HG   LYS  83          1HG       LYS  83   7.497 -19.467 -10.286
  594   1HD   LYS  83          2HD       LYS  83   9.506 -20.446  -9.358
  595   2HD   LYS  83          1HD       LYS  83   8.624 -21.006  -7.936
  596   1HE   LYS  83          2HE       LYS  83   8.180 -21.910 -10.798
  597   2HE   LYS  83          1HE       LYS  83   8.900 -22.868  -9.504
  598   1HZ   LYS  83          1HZ       LYS  83   6.759 -23.575  -9.381
  599   2HZ   LYS  83          2HZ       LYS  83   6.109 -22.102  -9.927
  600   3HZ   LYS  83          3HZ       LYS  83   6.657 -22.252  -8.326
  601    H    VAL  84           H        VAL  84   7.521 -17.914  -5.937
  602    HA   VAL  84           HA       VAL  84   6.678 -15.246  -5.029
  603    HB   VAL  84           HB       VAL  84   8.038 -17.566  -3.644
  604   1HG1  VAL  84          1HG1      VAL  84   7.434 -14.760  -2.689
  605   2HG1  VAL  84          2HG1      VAL  84   8.946 -15.657  -2.550
  606   3HG1  VAL  84          3HG1      VAL  84   7.557 -16.108  -1.561
  607   1HG2  VAL  84          1HG2      VAL  84   5.870 -17.553  -2.383
  608   2HG2  VAL  84          2HG2      VAL  84   5.655 -17.857  -4.098
  609   3HG2  VAL  84          3HG2      VAL  84   5.305 -16.262  -3.436
  610    H    LYS  85           H        LYS  85   9.567 -17.022  -5.901
  611    HA   LYS  85           HA       LYS  85  11.510 -15.156  -5.015
  612   1HB   LYS  85          2HB       LYS  85  11.753 -17.576  -5.992
  613   2HB   LYS  85          1HB       LYS  85  11.797 -16.765  -7.556
  614   1HG   LYS  85          2HG       LYS  85  13.703 -15.425  -6.851
  615   2HG   LYS  85          1HG       LYS  85  13.617 -16.109  -5.230
  616   1HD   LYS  85          2HD       LYS  85  15.376 -17.205  -6.605
  617   2HD   LYS  85          1HD       LYS  85  14.127 -18.337  -6.096
  618   1HE   LYS  85          2HE       LYS  85  13.223 -18.511  -8.240
  619   2HE   LYS  85          1HE       LYS  85  13.838 -16.938  -8.745
  620   1HZ   LYS  85          1HZ       LYS  85  15.999 -18.589  -8.041
  621   2HZ   LYS  85          2HZ       LYS  85  15.630 -17.912  -9.553
  622   3HZ   LYS  85          3HZ       LYS  85  15.009 -19.437  -9.125
  623    H    GLU  86           H        GLU  86   9.978 -15.547  -8.215
  624    HA   GLU  86           HA       GLU  86  11.174 -13.233  -9.398
  625   1HB   GLU  86          2HB       GLU  86   8.500 -14.487 -10.083
  626   2HB   GLU  86          1HB       GLU  86   9.502 -13.490 -11.142
  627   1HG   GLU  86          2HG       GLU  86  10.357 -16.144  -9.950
  628   2HG   GLU  86          1HG       GLU  86   9.777 -15.926 -11.603
  629    H    ALA  87           H        ALA  87   8.300 -13.675  -7.420
  630    HA   ALA  87           HA       ALA  87   7.079 -11.148  -7.962
  631   1HB   ALA  87          1HB       ALA  87   6.902 -12.368  -5.220
  632   2HB   ALA  87          2HB       ALA  87   6.242 -13.251  -6.590
  633   3HB   ALA  87          3HB       ALA  87   5.633 -11.644  -6.212
  634    H    GLN  88           H        GLN  88   9.041 -12.054  -5.086
  635    HA   GLN  88           HA       GLN  88   9.287  -9.388  -4.148
  636   1HB   GLN  88          2HB       GLN  88  10.792 -10.207  -2.557
  637   2HB   GLN  88          1HB       GLN  88   9.807 -11.608  -2.943
  638   1HG   GLN  88          2HG       GLN  88  11.914 -12.546  -3.103
  639   2HG   GLN  88          1HG       GLN  88  11.691 -12.042  -4.770
  640   1HE2  GLN  88          1HE2      GLN  88  12.022  -9.148  -3.282
  641   2HE2  GLN  88          2HE2      GLN  88  13.709  -8.968  -3.316
  642    H    ALA  89           H        ALA  89  11.052 -11.087  -6.656
  643    HA   ALA  89           HA       ALA  89  13.362  -9.420  -6.779
  644   1HB   ALA  89          1HB       ALA  89  11.855 -10.721  -9.079
  645   2HB   ALA  89          2HB       ALA  89  13.116 -11.499  -8.121
  646   3HB   ALA  89          3HB       ALA  89  13.511 -10.119  -9.146
  647    H    ALA  90           H        ALA  90  10.190  -9.130  -8.345
  648    HA   ALA  90           HA       ALA  90  10.655  -6.718  -9.749
  649   1HB   ALA  90          1HB       ALA  90   8.691  -7.870 -10.337
  650   2HB   ALA  90          2HB       ALA  90   8.082  -6.474  -9.452
  651   3HB   ALA  90          3HB       ALA  90   8.183  -8.046  -8.659
  652    H    ALA  91           H        ALA  91   9.619  -7.310  -6.419
  653    HA   ALA  91           HA       ALA  91   8.986  -4.605  -5.752
  654   1HB   ALA  91          1HB       ALA  91   9.113  -5.316  -3.447
  655   2HB   ALA  91          2HB       ALA  91  10.096  -6.714  -3.883
  656   3HB   ALA  91          3HB       ALA  91   8.407  -6.633  -4.383
  657    H    GLU  92           H        GLU  92  12.077  -6.343  -5.800
  658    HA   GLU  92           HA       GLU  92  13.581  -4.417  -4.321
  659   1HB   GLU  92          2HB       GLU  92  14.564  -6.121  -6.632
  660   2HB   GLU  92          1HB       GLU  92  15.555  -5.386  -5.369
  661   1HG   GLU  92          2HG       GLU  92  13.995  -6.726  -3.732
  662   2HG   GLU  92          1HG       GLU  92  13.631  -7.689  -5.163
  663    H    GLN  93           H        GLN  93  12.761  -4.693  -7.750
  664    HA   GLN  93           HA       GLN  93  14.263  -2.406  -8.615
  665   1HB   GLN  93          2HB       GLN  93  11.643  -3.177  -9.891
  666   2HB   GLN  93          1HB       GLN  93  13.154  -2.679 -10.659
  667   1HG   GLN  93          2HG       GLN  93  14.143  -4.871  -9.676
  668   2HG   GLN  93          1HG       GLN  93  12.469  -5.344  -9.424
  669   1HE2  GLN  93          1HE2      GLN  93  11.730  -6.614 -11.134
  670   2HE2  GLN  93          2HE2      GLN  93  12.143  -6.394 -12.763
  671    H    LEU  94           H        LEU  94  11.025  -2.809  -7.263
  672    HA   LEU  94           HA       LEU  94  10.279  -0.022  -7.639
  673   1HB   LEU  94          2HB       LEU  94   9.101  -2.203  -5.897
  674   2HB   LEU  94          1HB       LEU  94   8.369  -0.620  -6.156
  675    HG   LEU  94           HG       LEU  94   9.004  -2.612  -8.360
  676   1HD1  LEU  94          1HD1      LEU  94   7.231  -3.484  -6.963
  677   2HD1  LEU  94          2HD1      LEU  94   6.505  -2.858  -8.442
  678   3HD1  LEU  94          3HD1      LEU  94   6.409  -1.924  -6.951
  679   1HD2  LEU  94          1HD2      LEU  94   8.952  -0.545  -9.452
  680   2HD2  LEU  94          2HD2      LEU  94   7.828   0.165  -8.294
  681   3HD2  LEU  94          3HD2      LEU  94   7.243  -0.973  -9.508
  682    H    LYS  95           H        LYS  95  12.135  -1.752  -5.268
  683    HA   LYS  95           HA       LYS  95  11.619   0.032  -3.051
  684   1HB   LYS  95          2HB       LYS  95  12.583  -2.132  -2.583
  685   2HB   LYS  95          1HB       LYS  95  13.912  -1.844  -3.702
  686   1HG   LYS  95          2HG       LYS  95  14.556  -1.562  -1.299
  687   2HG   LYS  95          1HG       LYS  95  14.825  -0.111  -2.256
  688   1HD   LYS  95          2HD       LYS  95  12.913   0.970  -1.354
  689   2HD   LYS  95          1HD       LYS  95  12.258  -0.539  -0.720
  690   1HE   LYS  95          2HE       LYS  95  14.170  -0.676   0.858
  691   2HE   LYS  95          1HE       LYS  95  14.768   0.864   0.244
  692   1HZ   LYS  95          1HZ       LYS  95  13.320   1.965   1.485
  693   2HZ   LYS  95          2HZ       LYS  95  12.952   0.504   2.267
  694   3HZ   LYS  95          3HZ       LYS  95  12.018   1.022   0.946
  695    H    THR  96           H        THR  96  14.009  -0.079  -5.665
  696    HA   THR  96           HA       THR  96  15.580   2.132  -4.776
  697    HB   THR  96           HB       THR  96  15.139   1.448  -7.684
  698    HG1  THR  96           1HG      THR  96  15.433  -0.542  -6.977
  699   1HG2  THR  96          1HG2      THR  96  17.506   1.953  -7.840
  700   2HG2  THR  96          2HG2      THR  96  17.631   2.061  -6.084
  701   3HG2  THR  96          3HG2      THR  96  16.706   3.267  -6.976
  702    H    THR  97           H        THR  97  12.754   1.876  -6.941
  703    HA   THR  97           HA       THR  97  12.644   4.803  -7.260
  704    HB   THR  97           HB       THR  97  10.947   2.499  -8.259
  705    HG1  THR  97           1HG      THR  97  11.895   2.991 -10.184
  706   1HG2  THR  97          1HG2      THR  97  10.568   5.477  -8.494
  707   2HG2  THR  97          2HG2      THR  97   9.388   4.243  -8.059
  708   3HG2  THR  97          3HG2      THR  97   9.950   4.374  -9.724
  709    H    GLY  98           H        GLY  98   9.950   2.602  -6.596
  710   1HA   GLY  98          2HA       GLY  98   8.106   2.895  -5.174
  711   2HA   GLY  98          1HA       GLY  98   9.362   3.042  -3.944
  712    H    ARG  99           H        ARG  99   9.872   5.064  -3.149
  713    HA   ARG  99           HA       ARG  99   7.915   7.188  -3.656
  714   1HB   ARG  99          2HB       ARG  99  10.335   7.072  -1.829
  715   2HB   ARG  99          1HB       ARG  99   9.159   8.386  -1.861
  716   1HG   ARG  99          2HG       ARG  99   7.360   6.710  -1.358
  717   2HG   ARG  99          1HG       ARG  99   8.612   5.485  -1.169
  718   1HD   ARG  99          2HD       ARG  99   8.241   7.996   0.483
  719   2HD   ARG  99          1HD       ARG  99   8.099   6.326   1.031
  720    HE   ARG  99           HE       ARG  99  10.607   7.783   0.555
  721   1HH1  ARG  99          1HH2      ARG  99   8.979   4.764   1.013
  722   2HH1  ARG  99          2HH2      ARG  99  10.417   3.918   1.472
  723   1HH2  ARG  99          1HH1      ARG  99  12.483   6.679   1.140
  724   2HH2  ARG  99          2HH1      ARG  99  12.394   4.995   1.539
  725    H    ALA 100           H        ALA 100   8.237   8.682  -5.224
  726    HA   ALA 100           HA       ALA 100  10.944   9.700  -5.788
  727   1HB   ALA 100          1HB       ALA 100   9.315   8.514  -8.047
  728   2HB   ALA 100          2HB       ALA 100  10.559   7.592  -7.201
  729   3HB   ALA 100          3HB       ALA 100  10.994   9.053  -8.088
  730    H    GLY 101           H        GLY 101   8.058  10.485  -4.991
  731   1HA   GLY 101          2HA       GLY 101   8.086  13.025  -6.427
  732   2HA   GLY 101          1HA       GLY 101   6.707  12.009  -6.838
  733    H    ASN 102           H        ASN 102   7.689  11.414  -3.648
  734    HA   ASN 102           HA       ASN 102   5.305  12.785  -2.619
  735   1HB   ASN 102          2HB       ASN 102   6.029  10.498  -1.840
  736   2HB   ASN 102          1HB       ASN 102   7.417  11.267  -1.064
  737   1HD2  ASN 102          1HD2      ASN 102   7.021  12.601   0.836
  738   2HD2  ASN 102          2HD2      ASN 102   5.515  12.625   1.616
  739    H    GLN 103           H        GLN 103   8.027  14.107  -3.522
  740    HA   GLN 103           HA       GLN 103   8.315  15.856  -1.111
  741   1HB   GLN 103          2HB       GLN 103  10.321  14.364  -1.893
  742   2HB   GLN 103          1HB       GLN 103  10.460  15.528  -3.210
  743   1HG   GLN 103          2HG       GLN 103  10.328  17.301  -1.251
  744   2HG   GLN 103          1HG       GLN 103  10.864  15.944  -0.255
  745   1HE2  GLN 103          1HE2      GLN 103  11.729  17.312  -3.494
  746   2HE2  GLN 103          2HE2      GLN 103  13.406  17.216  -3.244
  747    H    LYS 104           H        LYS 104  10.114  17.448  -3.079
  748    HA   LYS 104           HA       LYS 104   9.865  19.300  -4.465
  749   1HB   LYS 104          2HB       LYS 104   9.031  18.513  -6.424
  750   2HB   LYS 104          1HB       LYS 104   8.262  17.191  -5.562
  751   1HG   LYS 104          2HG       LYS 104   6.284  18.697  -5.120
  752   2HG   LYS 104          1HG       LYS 104   7.070  19.926  -6.116
  753   1HD   LYS 104          2HD       LYS 104   6.948  18.580  -8.079
  754   2HD   LYS 104          1HD       LYS 104   6.561  17.130  -7.155
  755   1HE   LYS 104          2HE       LYS 104   4.404  18.269  -6.454
  756   2HE   LYS 104          1HE       LYS 104   4.787  19.543  -7.614
  757   1HZ   LYS 104          1HZ       LYS 104   4.988  16.847  -8.643
  758   2HZ   LYS 104          2HZ       LYS 104   4.297  18.231  -9.344
  759   3HZ   LYS 104          3HZ       LYS 104   3.420  17.322  -8.209
  760    H    GLY 105           H        GLY 105   6.998  18.301  -2.654
  761   1HA   GLY 105          2HA       GLY 105   6.585  21.099  -1.827
  762   2HA   GLY 105          1HA       GLY 105   5.248  20.330  -2.689
  763    H    GLY 106           H        GLY 106   4.572  18.144  -1.759
  764   1HA   GLY 106          2HA       GLY 106   3.707  16.941   0.055
  765   2HA   GLY 106          1HA       GLY 106   5.226  17.317   0.871