*HEADER    HYDROLASE, REPLICATION                  31-JUL-06   2HW0              
*TITLE     NMR SOLUTION STRUCTURE OF THE NUCLEASE DOMAIN FROM THE                
*TITLE    2 REPLICATOR INITIATOR PROTEIN FROM PORCINE CIRCOVIRUS PCV2            
*TITLE    3 (CASP TARGET)                                                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: REPLICASE;                                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 2-116 OF REP PCV2;                                
*COMPND   5 EC: 3.1.21;                                                          
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: PORCINE CIRCOVIRUS 2;                           
*SOURCE   3 ORGANISM_COMMON: VIRUS;                                              
*SOURCE   4 GENE: REP, ORF1;                                                     
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: ROSSETA (DE3) PLYSS;                       
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET3A                                     
*KEYWDS    ALPHA+BETA                                                            
*EXPDTA    NMR, 31 STRUCTURES                                                    
*AUTHOR    S.VEGA-ROCHA, I.L.BYEON, B.GRONENBORN, A.M.GRONENBORN,                
*AUTHOR   2 R.CAMPOS-OLIVAS                                                      
*REVDAT   1   12-JUN-07 2HW0    0                                                

##### UPPER LIMITS #####

 10 GLY  QA     11 PRO  QD      3.30 
 10 GLY  QA     11 PRO  QG      5.00 
 11 PRO  HA     12 GLN  H       2.90 
 12 GLN  HA     13 PRO  QD      2.90 
 13 PRO  HA     14 HIS  H       2.90 
 14 HIS  H      14 HIS  HB3     3.80 
 14 HIS  HB3    16 ARG  H       3.30 
 14 HIS  HB2    16 ARG  H       5.50 
 14 HIS  H      17 TRP  HE1     5.00 
 14 HIS  H      17 TRP  HZ2     3.80 
 14 HIS  HD1    17 TRP  HZ2     3.30 
 14 HIS  HD1    17 TRP  HH2     5.00 
 14 HIS  HD1    17 TRP  HE1     5.50 
 15 LYS  H      16 ARG  H       3.30 
 16 ARG  H      16 ARG  HB2     3.30 
 16 ARG  HA     17 TRP  H       2.90 
 16 ARG  HB2    17 TRP  H       5.00 
 16 ARG  HB3    17 TRP  H       5.50 
 17 TRP  H      17 TRP  HB2     3.30 
 17 TRP  H      17 TRP  HD1     3.80 
 17 TRP  HE3    18 VAL  H       5.00 
 17 TRP  HB3    18 VAL  H       3.30 
 17 TRP  HB2    18 VAL  H       5.00 
 17 TRP  HA     18 VAL  H       2.90 
 18 VAL  HA     19 PHE  H       2.90 
 18 VAL  HB     19 PHE  H       2.90 
 19 PHE  HA     20 THR  H       2.90 
 19 PHE  HB3    20 THR  H       5.00 
 19 PHE  HB2    20 THR  H       3.30 
 20 THR  HA     21 LEU  H       2.90 
 20 THR  HB     21 LEU  H       3.30 
 21 LEU  H      21 LEU  HB2     3.30 
 21 LEU  H      21 LEU  HB3     3.30 
 21 LEU  H      21 LEU  QD1     5.00 
 21 LEU  H      21 LEU  QD2     5.00 
 21 LEU  HA     22 ASN  H       2.90 
 21 LEU  HB2    22 ASN  H       5.50 
 21 LEU  HB3    22 ASN  H       5.00 
 21 LEU  QD1    22 ASN  H       3.50 
 21 LEU  QD2    22 ASN  H       5.50 
 21 LEU  QD1    24 PRO  QB      5.00 
 21 LEU  QD2    24 PRO  QB      5.50 
 21 LEU  QD1    24 PRO  HA      5.50 
 21 LEU  QD2    24 PRO  HA      3.30 
 21 LEU  QD1    25 SER  H       5.50 
 21 LEU  QD2    25 SER  H       3.80 
 22 ASN  HA     23 ASN  H       3.30 
 22 ASN  H      23 ASN  H       5.50 
 24 PRO  HA     25 SER  H       2.90 
 25 SER  O      29 ARG  H       2.40 
 25 SER  O      29 ARG  N       3.20 
 25 SER  H      26 GLU  H       5.50 
 25 SER  HA     26 GLU  H       3.30 
 25 SER  H      28 GLU  H       3.80 
 25 SER  HA     28 GLU  H       5.50 
 25 SER  H      28 GLU  HB2     5.50 
 25 SER  H      28 GLU  HB3     5.00 
 25 SER  H      28 GLU  QG      5.00 
 25 SER  H      29 ARG  H       5.50 
 26 GLU  O      30 LYS  H       2.40 
 26 GLU  O      30 LYS  N       3.20 
 26 GLU  H      26 GLU  QG      3.30 
 26 GLU  H      27 ASP  H       3.30 
 26 GLU  H      28 GLU  H       5.00 
 26 GLU  HA     28 GLU  H       5.00 
 26 GLU  HA     29 ARG  H       5.00 
 26 GLU  HA     29 ARG  QB      3.30 
 26 GLU  HA     29 ARG  HG2     5.50 
 26 GLU  HA     29 ARG  HG3     5.50 
 26 GLU  HA     29 ARG  QD      3.30 
 26 GLU  QG     29 ARG  H       5.50 
 26 GLU  HA     30 LYS  H       5.00 
 26 GLU  HB3    30 LYS  QE      5.00 
 26 GLU  QG     30 LYS  QE      5.50 
 27 ASP  O      31 LYS  H       2.40 
 27 ASP  O      31 LYS  N       3.20 
 27 ASP  H      27 ASP  QB      3.30 
 27 ASP  H      28 GLU  H       2.90 
 27 ASP  QB     28 GLU  H       3.30 
 27 ASP  H      29 ARG  H       5.00 
 27 ASP  HA     29 ARG  H       5.00 
 27 ASP  H      30 LYS  H       5.50 
 27 ASP  HA     30 LYS  H       5.00 
 27 ASP  HA     30 LYS  QB      3.30 
 27 ASP  HA     31 LYS  H       5.00 
 28 GLU  O      32 ILE  H       2.40 
 28 GLU  O      32 ILE  N       3.20 
 28 GLU  H      28 GLU  HB2     3.30 
 28 GLU  H      28 GLU  HB3     3.30 
 28 GLU  H      29 ARG  H       2.90 
 28 GLU  HB2    29 ARG  H       3.30 
 28 GLU  HB3    29 ARG  H       3.30 
 28 GLU  H      30 LYS  H       5.00 
 28 GLU  HA     30 LYS  H       5.00 
 28 GLU  H      31 LYS  H       5.50 
 28 GLU  HA     31 LYS  H       5.00 
 28 GLU  HA     31 LYS  QB      3.80 
 28 GLU  HA     32 ILE  H       5.00 
 21 LEU  QD2    28 GLU  H       5.50 
 21 LEU  QD2    28 GLU  HA      5.50 
 21 LEU  QD2    28 GLU  HB2     5.50 
 21 LEU  QD2    28 GLU  HB3     5.00 
 21 LEU  QD2    28 GLU  QG      5.50 
 29 ARG  O      33 ARG  H       2.40 
 29 ARG  O      33 ARG  N       3.20 
 29 ARG  HB2    29 ARG  HE      5.50 
 29 ARG  HB3    29 ARG  HE      3.30 
 29 ARG  H      30 LYS  H       2.90 
 29 ARG  H      31 LYS  H       5.50 
 29 ARG  HA     31 LYS  H       5.50 
 29 ARG  H      32 ILE  H       5.50 
 29 ARG  HA     32 ILE  H       5.00 
 29 ARG  HA     32 ILE  HB      5.00 
 29 ARG  HA     33 ARG  H       5.00 
 29 ARG  HA     32 ILE  QD1     5.00 
 29 ARG  HA     32 ILE  QG2     5.50 
 30 LYS  O      34 ASP  H       2.40 
 30 LYS  O      34 ASP  N       3.20 
 30 LYS  H      31 LYS  H       2.90 
 30 LYS  H      32 ILE  H       5.00 
 30 LYS  HA     32 ILE  H       5.00 
 30 LYS  H      33 ARG  H       5.00 
 30 LYS  HA     33 ARG  H       5.00 
 30 LYS  HA     33 ARG  QB      3.30 
 30 LYS  HA     34 ASP  H       6.00 
 31 LYS  H      32 ILE  H       2.90 
 31 LYS  H      33 ARG  H       5.50 
 31 LYS  HA     33 ARG  H       5.50 
 31 LYS  H      34 ASP  H       5.50 
 31 LYS  HA     34 ASP  H       5.00 
 31 LYS  HA     34 ASP  QB      5.00 
 31 LYS  HA     35 LEU  H       5.00 
 32 ILE  O      35 LEU  H       2.40 
 32 ILE  H      32 ILE  HB      2.70 
 32 ILE  H      33 ARG  H       2.90 
 32 ILE  HB     33 ARG  H       2.70 
 32 ILE  H      34 ASP  H       5.00 
 32 ILE  HA     34 ASP  H       5.00 
 32 ILE  H      35 LEU  H       5.50 
 32 ILE  HA     35 LEU  H       5.00 
 32 ILE  QG2    33 ARG  HA      5.50 
 32 ILE  H      35 LEU  QD1     5.50 
 32 ILE  HA     35 LEU  HG      5.00 
 32 ILE  HA     35 LEU  QD1     3.30 
 32 ILE  HA     35 LEU  QD2     5.00 
 32 ILE  HG13   35 LEU  QD1     5.50 
 32 ILE  QG2    35 LEU  QD1     5.00 
 32 ILE  QD1    35 LEU  QD1     5.50 
 33 ARG  H      34 ASP  H       2.90 
 33 ARG  H      35 LEU  H       5.00 
 33 ARG  HA     35 LEU  H       5.00 
 34 ASP  H      35 LEU  H       2.90 
 35 LEU  H      36 PRO  HD2     5.50 
 35 LEU  H      36 PRO  HD3     5.50 
 35 LEU  HA     36 PRO  HD2     3.80 
 35 LEU  HA     36 PRO  HD3     3.30 
 35 LEU  QD2    36 PRO  HD2     3.30 
 35 LEU  QD2    36 PRO  HD3     3.30 
 35 LEU  QD2    36 PRO  QG      5.00 
 35 LEU  QD1    39 LEU  QD2     5.00 
 35 LEU  QD2    39 LEU  QD1     3.80 
 35 LEU  QD2    39 LEU  QD2     5.00 
 35 LEU  QD2    40 PHE  HZ      5.50 
 35 LEU  QD1    40 PHE  HZ      3.30 
 35 LEU  QD1    40 PHE  HE1     5.00 
 36 PRO  O      39 LEU  H       2.40 
 36 PRO  O      39 LEU  N       3.20 
 36 PRO  HA     37 ILE  H       2.90 
 36 PRO  HA     38 SER  H       5.00 
 36 PRO  HA     39 LEU  H       5.50 
 36 PRO  HB2    38 SER  H       5.50 
 36 PRO  HB3    38 SER  H       5.00 
 36 PRO  QG     39 LEU  H       3.50 
 36 PRO  QG     39 LEU  HG      5.00 
 36 PRO  QG     39 LEU  QD1     3.30 
 36 PRO  QG     39 LEU  QD2     5.00 
 36 PRO  HD2    39 LEU  QD1     5.00 
 36 PRO  HD3    39 LEU  QD1     3.80 
 37 ILE  O      40 PHE  H       2.40 
 37 ILE  O      40 PHE  N       3.20 
 37 ILE  H      37 ILE  QG2     2.70 
 37 ILE  H      37 ILE  QD1     3.50 
 37 ILE  H      38 SER  H       2.90 
 37 ILE  HB     38 SER  H       3.80 
 37 ILE  HG12   38 SER  H       3.30 
 37 ILE  HG13   38 SER  H       5.00 
 37 ILE  QG2    38 SER  H       5.00 
 37 ILE  QD1    38 SER  H       5.00 
 37 ILE  H      39 LEU  H       5.50 
 37 ILE  HA     39 LEU  H       5.00 
 37 ILE  HA     40 PHE  H       5.00 
 38 SER  H      39 LEU  H       2.90 
 38 SER  H      40 PHE  H       5.00 
 38 SER  HA     40 PHE  H       5.00 
 39 LEU  H      40 PHE  H       2.90 
 40 PHE  H      40 PHE  HB2     3.30 
 40 PHE  HA     41 ASP  H       2.90 
 40 PHE  H      41 ASP  H       5.50 
 40 PHE  HB3    41 ASP  H       5.00 
 40 PHE  HB2    41 ASP  H       5.00 
 40 PHE  HD1    41 ASP  H       5.00 
 40 PHE  HA     42 TYR  H       5.00 
 41 ASP  H      42 TYR  H       2.90 
 42 TYR  H      42 TYR  HB3     3.30 
 42 TYR  H      43 PHE  H       5.50 
 42 TYR  HA     43 PHE  H       2.90 
 42 TYR  HB3    43 PHE  H       5.00 
 42 TYR  HB2    43 PHE  H       5.00 
 42 TYR  HE1    44 ILE  QG2     3.30 
 42 TYR  HE1    44 ILE  QD1     5.00 
 43 PHE  H      43 PHE  HB2     3.30 
 43 PHE  H      44 ILE  H       5.50 
 43 PHE  HA     44 ILE  H       2.90 
 43 PHE  HB2    44 ILE  H       5.00 
 43 PHE  HB3    44 ILE  H       5.00 
 43 PHE  H      44 ILE  QG2     5.00 
 43 PHE  HD1    45 VAL  QG2     5.50 
 43 PHE  HE1    45 VAL  QG1     5.50 
 43 PHE  HE1    45 VAL  QG2     3.30 
 43 PHE  HZ     45 VAL  QG2     5.00 
 44 ILE  H      45 VAL  H       5.50 
 44 ILE  HA     45 VAL  H       2.90 
 44 ILE  HB     45 VAL  H       5.00 
 45 VAL  H      46 GLY  H       5.50 
 45 VAL  HA     46 GLY  H       2.90 
 45 VAL  HB     46 GLY  H       5.00 
 46 GLY  H      46 GLY  HA3     2.90 
 46 GLY  H      47 GLU  H       5.00 
 46 GLY  HA2    47 GLU  H       3.30 
 46 GLY  HA3    47 GLU  H       3.30 
 47 GLU  HA     48 GLU  H       2.90 
 47 GLU  H      48 GLU  H       5.50 
 48 GLU  H      49 GLY  H       5.50 
 48 GLU  HA     49 GLY  H       2.90 
 48 GLU  HA     50 ASN  H       5.00 
 49 GLY  H      50 ASN  H       3.30 
 50 ASN  H      50 ASN  HB2     2.70 
 50 ASN  H      50 ASN  HB3     3.30 
 50 ASN  H      50 ASN  HD21    5.00 
 50 ASN  H      50 ASN  HD22    5.50 
 50 ASN  HA     50 ASN  HD21    5.00 
 50 ASN  HA     50 ASN  HD22    5.50 
 50 ASN  H      51 GLU  H       5.50 
 50 ASN  HA     51 GLU  H       2.90 
 51 GLU  HA     52 GLU  H       2.90 
 51 GLU  H      52 GLU  H       5.50 
 51 GLU  H      54 ARG  H       5.50 
 52 GLU  HA     53 GLY  H       3.30 
 52 GLU  H      53 GLY  H       5.50 
 52 GLU  HA     54 ARG  H       3.30 
 52 GLU  H      54 ARG  H       5.50 
 52 GLU  QB     54 ARG  H       5.00 
 52 GLU  QG     54 ARG  H       5.00 
 53 GLY  HA3    54 ARG  H       3.30 
 53 GLY  H      54 ARG  H       5.00 
 54 ARG  H      54 ARG  HB2     3.30 
 54 ARG  H      54 ARG  HB3     2.70 
 54 ARG  HA     55 THR  H       3.30 
 54 ARG  H      55 THR  H       5.50 
 56 PRO  HA     57 HIS  H       2.90 
 57 HIS  HA     58 LEU  H       2.90 
 57 HIS  H      58 LEU  H       5.50 
 58 LEU  H      58 LEU  QD1     5.00 
 58 LEU  H      58 LEU  QD2     5.00 
 58 LEU  HA     58 LEU  QD1     5.00 
 58 LEU  HA     58 LEU  QD2     3.30 
 58 LEU  HA     59 GLN  H       2.90 
 58 LEU  QD1    59 GLN  H       5.00 
 58 LEU  QD2    59 GLN  H       3.30 
 59 GLN  HA     60 GLY  H       2.90 
 59 GLN  H      60 GLY  H       5.50 
 60 GLY  H      61 PHE  H       5.50 
 60 GLY  HA2    61 PHE  H       2.90 
 60 GLY  HA3    61 PHE  H       3.30 
 61 PHE  HA     62 ALA  H       2.90 
 61 PHE  H      62 ALA  H       5.50 
 62 ALA  HA     63 ASN  H       2.90 
 62 ALA  H      63 ASN  H       5.50 
 62 ALA  QB     64 PHE  HA      6.00 
 62 ALA  QB     64 PHE  HD1     5.50 
 62 ALA  QB     64 PHE  HE1     5.00 
 63 ASN  HB2    63 ASN  HD21    3.30 
 63 ASN  HB2    63 ASN  HD22    3.50 
 63 ASN  HA     64 PHE  H       2.90 
 63 ASN  H      64 PHE  H       5.50 
 64 PHE  H      64 PHE  HB3     3.30 
 64 PHE  HB2    65 VAL  H       5.00 
 64 PHE  HB3    65 VAL  H       5.00 
 64 PHE  HA     65 VAL  QG2     5.50 
 64 PHE  HA     65 VAL  H       2.90 
 64 PHE  H      65 VAL  H       5.50 
 64 PHE  HA     66 LYS  H       5.00 
 64 PHE  HB2    66 LYS  H       5.00 
 64 PHE  HB3    66 LYS  H       5.00 
 64 PHE  HD1    66 LYS  H       6.00 
 65 VAL  QG1    66 LYS  HA      5.00 
 65 VAL  HB     66 LYS  QD      5.00 
 65 VAL  QG1    66 LYS  QD      2.70 
 65 VAL  QG2    66 LYS  QD      3.80 
 65 VAL  H      66 LYS  H       2.90 
 66 LYS  HA     67 LYS  H       2.90 
 66 LYS  H      67 LYS  H       5.50 
 66 LYS  QG     67 LYS  H       3.30 
 66 LYS  QE     67 LYS  H       5.00 
 67 LYS  HA     68 GLN  H       2.90 
 67 LYS  H      68 GLN  H       5.50 
 69 THR  OG1    72 LYS  H       2.40 
 69 THR  OG1    72 LYS  N       3.20 
 68 GLN  HA     69 THR  H       2.90 
 68 GLN  HB2    69 THR  H       3.80 
 68 GLN  HB3    69 THR  H       5.00 
 68 GLN  HB2    69 THR  QG2     5.50 
 68 GLN  H      73 VAL  QG2     5.50 
 68 GLN  HA     73 VAL  QG2     5.00 
 68 GLN  HB2    73 VAL  QG2     3.30 
 68 GLN  HG2    73 VAL  QG2     5.50 
 69 THR  O      73 VAL  H       2.40 
 69 THR  O      73 VAL  N       3.20 
 69 THR  H      70 PHE  H       5.50 
 69 THR  HA     70 PHE  H       2.90 
 69 THR  HB     70 PHE  H       3.30 
 69 THR  HB     71 ASN  H       3.50 
 69 THR  QG2    71 ASN  H       5.50 
 69 THR  HB     71 ASN  QB      5.50 
 69 THR  QG2    71 ASN  QB      5.50 
 69 THR  HA     71 ASN  H       5.00 
 69 THR  QG2    72 LYS  H       5.50 
 69 THR  H      72 LYS  QB      3.30 
 69 THR  H      73 VAL  QG2     3.30 
 70 PHE  O      74 LYS  H       2.40 
 70 PHE  O      74 LYS  N       3.20 
 71 ASN  O      74 LYS  H       2.40 
 71 ASN  O      74 LYS  N       3.20 
 70 PHE  H      70 PHE  HB2     2.90 
 70 PHE  H      70 PHE  HB3     3.30 
 70 PHE  HA     70 PHE  QD      3.30 
 70 PHE  H      71 ASN  H       3.30 
 70 PHE  HD1    71 ASN  H       5.00 
 70 PHE  HD1    71 ASN  HA      5.50 
 70 PHE  H      72 LYS  H       5.50 
 70 PHE  H      73 VAL  H       5.50 
 70 PHE  HA     73 VAL  H       5.00 
 70 PHE  HA     73 VAL  HB      3.30 
 70 PHE  HA     73 VAL  QG1     5.50 
 70 PHE  HA     73 VAL  QG2     3.30 
 70 PHE  HA     74 LYS  H       5.50 
 70 PHE  HD1    74 LYS  QE      5.50 
 70 PHE  HE1    74 LYS  QE      2.70 
 70 PHE  HE1    74 LYS  HG2     5.50 
 70 PHE  HE1    74 LYS  QD      5.00 
 70 PHE  HZ     74 LYS  QE      5.00 
 70 PHE  HZ     74 LYS  QD      5.00 
 71 ASN  H      72 LYS  H       2.90 
 71 ASN  H      73 VAL  H       5.00 
 71 ASN  HA     73 VAL  H       5.50 
 71 ASN  H      74 LYS  H       5.50 
 71 ASN  HA     74 LYS  H       5.00 
 71 ASN  HA     74 LYS  QB      3.80 
 71 ASN  HA     75 TRP  H       6.00 
 71 ASN  HA     74 LYS  HG2     5.50 
 71 ASN  HA     74 LYS  HG3     5.00 
 72 LYS  O      75 TRP  H       2.40 
 72 LYS  O      75 TRP  N       3.20 
 72 LYS  H      73 VAL  H       2.90 
 72 LYS  H      74 LYS  H       5.00 
 72 LYS  HA     74 LYS  H       5.50 
 72 LYS  H      75 TRP  H       5.50 
 72 LYS  HA     75 TRP  H       5.50 
 72 LYS  HA     75 TRP  QB      3.80 
 72 LYS  H      73 VAL  QG2     5.00 
 72 LYS  QD     75 TRP  HE3     5.00 
 72 LYS  QE     75 TRP  HE3     5.00 
 72 LYS  QE     75 TRP  HZ3     3.80 
 73 VAL  O      76 TYR  H       2.40 
 73 VAL  O      76 TYR  N       3.20 
 73 VAL  O      77 LEU  H       2.40 
 73 VAL  O      77 LEU  N       3.20 
 73 VAL  H      74 LYS  H       2.90 
 73 VAL  H      75 TRP  H       5.50 
 73 VAL  H      76 TYR  H       6.00 
 73 VAL  HA     76 TYR  H       5.00 
 73 VAL  QG1    75 TRP  HD1     5.00 
 73 VAL  QG2    75 TRP  HD1     5.00 
 73 VAL  HA     76 TYR  HD1     5.00 
 73 VAL  QG2    76 TYR  HD1     5.50 
 73 VAL  QG1    77 LEU  QD1     3.30 
 73 VAL  QG2    77 LEU  QD1     5.00 
 74 LYS  O      78 GLY  H       2.40 
 74 LYS  O      78 GLY  N       3.20 
 74 LYS  H      74 LYS  HG2     3.30 
 74 LYS  H      74 LYS  HG3     3.30 
 74 LYS  H      75 TRP  H       2.90 
 74 LYS  HA     77 LEU  H       5.00 
 74 LYS  HA     78 GLY  H       5.00 
 74 LYS  HA     79 ALA  QB      5.50 
 74 LYS  QB     79 ALA  HA      5.00 
 74 LYS  QB     79 ALA  QB      3.30 
 74 LYS  QG     79 ALA  HA      5.00 
 74 LYS  QG     79 ALA  QB      5.00 
 74 LYS  QD     79 ALA  HA      3.30 
 74 LYS  QD     79 ALA  QB      2.70 
 74 LYS  QE     79 ALA  HA      3.30 
 74 LYS  QE     79 ALA  QB      3.30 
 75 TRP  H      75 TRP  HD1     5.00 
 75 TRP  H      75 TRP  HE3     5.50 
 75 TRP  HA     75 TRP  HD1     5.00 
 75 TRP  HA     75 TRP  HE3     5.50 
 75 TRP  HB3    75 TRP  HD1     3.80 
 75 TRP  H      76 TYR  H       3.30 
 75 TRP  HD1    76 TYR  H       5.00 
 75 TRP  QB     76 TYR  HD1     5.50 
 75 TRP  HZ3    76 TYR  HE1     5.50 
 75 TRP  HE3    76 TYR  HE1     6.00 
 76 TYR  H      76 TYR  HD1     5.00 
 76 TYR  HA     76 TYR  HD1     5.00 
 76 TYR  H      77 LEU  H       2.90 
 76 TYR  H      78 GLY  H       5.00 
 76 TYR  HA     78 GLY  H       5.50 
 76 TYR  HB3    77 LEU  QD2     5.00 
 77 LEU  H      78 GLY  H       5.00 
 77 LEU  QD1    83 ILE  QG2     3.30 
 77 LEU  QD1    83 ILE  QD1     5.00 
 78 GLY  H      78 GLY  HA3     2.90 
 78 GLY  H      79 ALA  H       5.50 
 78 GLY  HA2    79 ALA  H       3.30 
 78 GLY  HA3    79 ALA  H       2.90 
 78 GLY  HA2    80 ARG  H       5.00 
 78 GLY  HA3    80 ARG  H       5.00 
 78 GLY  HA2    81 CYS  H       5.00 
 78 GLY  HA3    81 CYS  H       5.50 
 79 ALA  H      80 ARG  H       3.30 
 79 ALA  H      81 CYS  H       5.50 
 79 ALA  HA     81 CYS  H       5.50 
 80 ARG  HA     80 ARG  HE      5.00 
 80 ARG  HB2    80 ARG  HE      5.50 
 80 ARG  HB3    80 ARG  HE      5.00 
 80 ARG  H      81 CYS  H       2.90 
 81 CYS  H      82 HIS  H       5.50 
 81 CYS  HA     82 HIS  H       2.90 
 82 HIS  H      83 ILE  H       5.50 
 82 HIS  HA     83 ILE  H       2.90 
 82 HIS  HD2    84 GLU  QG      5.00 
 83 ILE  H      83 ILE  QG2     3.80 
 83 ILE  H      83 ILE  QD1     5.00 
 83 ILE  HG12   84 GLU  H       5.00 
 83 ILE  QG2    84 GLU  H       3.80 
 83 ILE  QG2    84 GLU  HA      5.50 
 83 ILE  QD1    84 GLU  H       5.00 
 83 ILE  H      84 GLU  H       5.50 
 83 ILE  HA     84 GLU  H       2.90 
 84 GLU  H      85 LYS  H       5.50 
 84 GLU  HA     85 LYS  H       2.90 
 85 LYS  H      86 ALA  H       5.50 
 85 LYS  HA     86 ALA  H       2.90 
 86 ALA  H      87 LYS  H       5.50 
 86 ALA  HA     87 LYS  H       2.90 
 88 GLY  HA2    89 THR  H       3.30 
 88 GLY  HA3    89 THR  H       2.90 
 89 THR  O      93 ASN  H       2.40 
 89 THR  O      93 ASN  N       3.20 
 89 THR  HA     90 ASP  H       3.30 
 89 THR  HB     90 ASP  H       2.90 
 89 THR  H      91 GLN  H       5.00 
 89 THR  HA     91 GLN  H       5.00 
 89 THR  HB     91 GLN  H       3.30 
 89 THR  H      92 GLN  H       5.50 
 89 THR  HA     92 GLN  H       5.50 
 89 THR  HB     92 GLN  H       5.50 
 89 THR  H      92 GLN  HA      5.00 
 89 THR  H      92 GLN  HB2     2.70 
 89 THR  H      92 GLN  HB3     3.30 
 89 THR  H      92 GLN  QG      3.30 
 89 THR  QG2    92 GLN  HB2     5.00 
 89 THR  QG2    92 GLN  HB3     5.50 
 89 THR  QG2    92 GLN  QG      3.30 
 89 THR  QG2    92 GLN  HE21    3.30 
 89 THR  QG2    92 GLN  HE22    5.00 
 89 THR  QG2   113 GLN  QB      5.50 
 90 ASP  O      94 LYS  H       2.40 
 90 ASP  O      94 LYS  N       3.20 
 90 ASP  H      91 GLN  H       3.30 
 91 GLN  O      95 GLU  H       2.40 
 91 GLN  O      95 GLU  N       3.20 
 91 GLN  H      92 GLN  H       2.90 
 91 GLN  H      93 ASN  H       5.00 
 91 GLN  H      94 LYS  H       5.50 
 91 GLN  HA     94 LYS  H       5.00 
 91 GLN  HE21   94 LYS  QE      5.50 
 91 GLN  HE22   94 LYS  QE      5.00 
 91 GLN  HE22   94 LYS  QD      5.50 
 91 GLN  HE21   95 GLU  QG      5.00 
 91 GLN  HE22   95 GLU  QG      5.00 
 92 GLN  H      93 ASN  H       2.90 
 92 GLN  HA     93 ASN  HD21    5.50 
 92 GLN  HA     93 ASN  HD22    6.00 
 92 GLN  H      94 LYS  H       5.50 
 92 GLN  H      95 GLU  H       5.50 
 92 GLN  HA     95 GLU  H       5.00 
 92 GLN  HA     96 TYR  H       5.00 
 93 ASN  H      93 ASN  HD21    3.30 
 93 ASN  H      93 ASN  HD22    5.00 
 93 ASN  HA     93 ASN  HD21    5.00 
 93 ASN  HA     93 ASN  HD22    5.00 
 93 ASN  H      94 LYS  H       2.90 
 93 ASN  H      95 GLU  H       5.50 
 93 ASN  HA     95 GLU  H       5.50 
 93 ASN  H      96 TYR  H       5.50 
 93 ASN  HA     96 TYR  H       5.00 
 93 ASN  HA     96 TYR  QB      3.30 
 94 LYS  O      98 SER  H       2.40 
 94 LYS  O      98 SER  N       3.20 
 94 LYS  H      95 GLU  H       2.90 
 94 LYS  H      96 TYR  H       5.00 
 95 GLU  H      96 TYR  H       2.90 
 95 GLU  HA     98 SER  H       5.00 
 96 TYR  O      99 LYS  H       2.40 
 96 TYR  O      99 LYS  N       3.20 
 96 TYR  H      97 CYS  H       2.90 
 96 TYR  H      98 SER  H       5.00 
 96 TYR  H      99 LYS  H       5.50 
 96 TYR  HE1    99 LYS  QE      5.00 
 97 CYS  H      98 SER  H       3.30 
 98 SER  O     101 GLY  H       2.40 
 98 SER  O     101 GLY  N       3.20 
 98 SER  H      99 LYS  H       2.90 
 98 SER  HA    103 LEU  QD1     5.00 
 98 SER  HA    103 LEU  QD2     3.30 
 98 SER  QB    103 LEU  QD1     6.00 
 98 SER  QB    103 LEU  QD2     5.00 
 99 LYS  H     100 GLU  H       2.90 
 99 LYS  H     101 GLY  H       5.50 
 99 LYS  HA    101 GLY  H       5.00 
100 GLU  H     101 GLY  H       3.30 
101 GLY  H     102 ASN  H       5.00 
101 GLY  HA2   102 ASN  H       3.30 
102 ASN  H     103 LEU  H       5.50 
102 ASN  HA    103 LEU  H       2.90 
103 LEU  H     103 LEU  QD1     5.00 
103 LEU  H     103 LEU  QD2     3.30 
103 LEU  HA    104 LEU  H       2.90 
103 LEU  H     104 LEU  H       5.50 
104 LEU  H     105 MET  H       2.90 
105 MET  HA    106 GLU  H       2.90 
105 MET  H     106 GLU  H       5.50 
105 MET  QG    106 GLU  H       3.30 
105 MET  QG    107 CYS  H       5.50 
105 MET  QG    107 CYS  QB      5.00 
106 GLU  HA    107 CYS  H       2.90 
106 GLU  H     107 CYS  H       5.50 
107 CYS  H     108 GLY  H       5.50 
107 CYS  HA    108 GLY  H       2.90 
108 GLY  H     109 ALA  H       5.50 
108 GLY  HA2   109 ALA  H       2.90 
108 GLY  HA3   109 ALA  H       2.90 
109 ALA  H     110 PRO  HD3     5.50 
109 ALA  HA    110 PRO  HD2     3.30 
109 ALA  HA    110 PRO  HG2     5.50 
109 ALA  QB    110 PRO  HD2     3.30 
109 ALA  QB    110 PRO  HD3     5.00 
109 ALA  QB    110 PRO  HG2     5.00 
109 ALA  QB    110 PRO  HG3     5.50 
110 PRO  HA    111 ARG  H       2.90 
110 PRO  HD3   111 ARG  H       5.50 
 19 PHE  HD1    45 VAL  QG1     5.50 
 19 PHE  HD1    45 VAL  QG2     5.50 
 19 PHE  HE1    45 VAL  QG1     5.50 
 19 PHE  HE1    45 VAL  QG2     5.00 
 19 PHE  HZ     45 VAL  QG1     5.50 
 19 PHE  HZ     45 VAL  QG2     5.00 
 14 HIS  O      68 GLN  H       2.40 
 14 HIS  O      68 GLN  N       3.20 
 14 HIS  H      68 GLN  O       2.40 
 14 HIS  N      68 GLN  O       3.20 
 17 TRP  HE1    68 GLN  O       2.40 
 17 TRP  NE1    68 GLN  O       3.20 
 12 GLN  HA     69 THR  QG2     5.50 
 12 GLN  HA     69 THR  HB      5.50 
 13 PRO  QG     69 THR  HA      5.50 
 13 PRO  HA     69 THR  HA      3.30 
 13 PRO  HA     69 THR  HB      5.50 
 13 PRO  QG     69 THR  HB      5.50 
 13 PRO  HA     69 THR  QG2     3.30 
 13 PRO  QD     69 THR  QG2     5.50 
 13 PRO  QG     69 THR  QG2     3.30 
 13 PRO  HB2    69 THR  HB      5.50 
 13 PRO  HA     69 THR  H       5.50 
 13 PRO  HA     70 PHE  H       5.50 
 14 HIS  HA     67 LYS  QD      5.00 
 14 HIS  HA     67 LYS  QE      5.00 
 14 HIS  H      67 LYS  HA      5.50 
 14 HIS  H      68 GLN  HA      5.50 
 14 HIS  H      68 GLN  H       3.30 
 14 HIS  H      69 THR  HA      3.80 
 14 HIS  H      69 THR  QG2     5.00 
 15 LYS  O      64 PHE  H       2.40 
 15 LYS  O      64 PHE  N       3.20 
 17 TRP  H      62 ALA  O       2.40 
 17 TRP  N      62 ALA  O       3.20 
 17 TRP  O      62 ALA  H       2.40 
 17 TRP  O      62 ALA  N       3.20 
 19 PHE  H      60 GLY  O       2.40 
 19 PHE  N      60 GLY  O       3.20 
 19 PHE  O      60 GLY  H       2.40 
 19 PHE  O      60 GLY  N       3.20 
 21 LEU  O      58 LEU  H       2.40 
 21 LEU  O      58 LEU  N       3.20 
 21 LEU  H      58 LEU  O       2.40 
 21 LEU  N      58 LEU  O       3.20 
 23 ASN  H      56 PRO  O       2.40 
 23 ASN  N      56 PRO  O       3.20 
 15 LYS  HB2    64 PHE  H       5.00 
 15 LYS  HB3    64 PHE  H       5.00 
 15 LYS  HG2    64 PHE  H       5.50 
 15 LYS  HG3    64 PHE  H       5.50 
 15 LYS  HA     67 LYS  HA      5.00 
 15 LYS  HB3    67 LYS  HA      5.00 
 15 LYS  HA     67 LYS  H       5.50 
 15 LYS  HA     67 LYS  QD      5.50 
 15 LYS  HA     68 GLN  H       5.00 
 16 ARG  QG     64 PHE  H       5.50 
 17 TRP  HE1    68 GLN  H       5.00 
 17 TRP  HZ2    69 THR  HA      5.00 
 16 ARG  HA     63 ASN  HA      3.30 
 16 ARG  HA     64 PHE  H       5.00 
 17 TRP  H      62 ALA  H       5.00 
 17 TRP  H      62 ALA  QB      5.00 
 17 TRP  HD1    62 ALA  QB      6.00 
 17 TRP  H      63 ASN  HA      3.30 
 17 TRP  HD1    64 PHE  HD1     3.30 
 17 TRP  HE1    64 PHE  HD1     5.50 
 17 TRP  HD1    64 PHE  HE1     5.00 
 17 TRP  HE1    64 PHE  HE1     6.00 
 18 VAL  QG1    59 GLN  HE22    5.00 
 18 VAL  QG2    59 GLN  HE21    5.00 
 18 VAL  QG2    59 GLN  HE22    5.50 
 18 VAL  HA     60 GLY  H       6.00 
 18 VAL  HA     61 PHE  HA      3.30 
 18 VAL  HA     61 PHE  HB2     5.00 
 18 VAL  QG1    61 PHE  HA      3.30 
 18 VAL  QG2    61 PHE  HA      5.00 
 18 VAL  QG1    61 PHE  HB2     5.00 
 18 VAL  QG1    61 PHE  HB3     5.00 
 18 VAL  QG1    61 PHE  HD1     5.00 
 18 VAL  HA     62 ALA  H       3.30 
 19 PHE  H      60 GLY  H       5.00 
 19 PHE  HD1    60 GLY  H       5.00 
 19 PHE  HE1    60 GLY  H       5.50 
 19 PHE  H      61 PHE  HA      3.80 
 19 PHE  HE1    61 PHE  H       5.00 
 19 PHE  HD1    61 PHE  H       5.50 
 19 PHE  HD1    62 ALA  QB      5.00 
 19 PHE  HD1    62 ALA  H       5.50 
 20 THR  HB     57 HIS  HD2     5.00 
 20 THR  QG2    57 HIS  HD2     5.50 
 20 THR  HA     58 LEU  H       5.50 
 20 THR  HA     59 GLN  HA      3.30 
 20 THR  HB     59 GLN  HA      5.00 
 20 THR  QG2    59 GLN  HA      3.30 
 20 THR  QG2    59 GLN  HE21    3.30 
 20 THR  QG2    59 GLN  HE22    2.70 
 20 THR  HA     60 GLY  H       5.00 
 20 THR  QG2    60 GLY  H       3.30 
 21 LEU  H      57 HIS  HA      5.50 
 21 LEU  H      58 LEU  H       5.00 
 21 LEU  H      58 LEU  QD2     5.00 
 21 LEU  H      59 GLN  HA      5.00 
 22 ASN  HA     57 HIS  HA      3.30 
 22 ASN  HA     57 HIS  HB2     3.30 
 22 ASN  HA     57 HIS  HB3     5.00 
 22 ASN  HA     58 LEU  H       5.00 
 23 ASN  H      55 THR  QG2     5.00 
 23 ASN  HA     55 THR  QG2     5.00 
 23 ASN  HB2    55 THR  QG2     5.00 
 23 ASN  HB3    55 THR  QG2     5.00 
 23 ASN  HD21   55 THR  QG2     3.30 
 23 ASN  HD22   55 THR  QG2     3.30 
 23 ASN  HD22   56 PRO  HD3     5.00 
 23 ASN  H      57 HIS  HA      5.00 
 23 ASN  H      57 HIS  HB2     5.00 
 23 ASN  H      57 HIS  HB3     5.50 
 24 PRO  QD     57 HIS  HA      3.50 
 24 PRO  QD     58 LEU  H       5.00 
 18 VAL  H      84 GLU  O       2.40 
 18 VAL  N      84 GLU  O       3.20 
 18 VAL  O      84 GLU  H       2.40 
 18 VAL  O      84 GLU  N       3.20 
 20 THR  H      82 HIS  O       2.40 
 20 THR  N      82 HIS  O       3.20 
 20 THR  O      82 HIS  H       2.40 
 20 THR  O      82 HIS  N       3.20 
 14 HIS  HE1    85 LYS  QD      3.30 
 14 HIS  HE1    85 LYS  QB      5.50 
 16 ARG  HA     86 ALA  QB      5.50 
 16 ARG  HB2    86 ALA  QB      5.00 
 16 ARG  HB3    86 ALA  QB      3.50 
 17 TRP  HE3    83 ILE  QG2     5.00 
 17 TRP  HA     84 GLU  H       5.50 
 17 TRP  HE3    84 GLU  H       5.00 
 17 TRP  HE3    84 GLU  HA      5.50 
 17 TRP  HZ3    84 GLU  HA      5.00 
 17 TRP  HA     85 LYS  HA      3.30 
 17 TRP  HZ3    85 LYS  H       5.00 
 17 TRP  HA     86 ALA  H       3.30 
 17 TRP  HA     86 ALA  QB      5.00 
 18 VAL  H      83 ILE  QG2     5.00 
 18 VAL  H      84 GLU  H       3.80 
 18 VAL  QG2    84 GLU  H       3.30 
 18 VAL  QG2    84 GLU  HA      5.50 
 18 VAL  QG2    84 GLU  HB2     5.00 
 18 VAL  QG2    84 GLU  HB3     3.30 
 18 VAL  QG2    84 GLU  QG      5.00 
 18 VAL  QG2    85 LYS  H       5.50 
 18 VAL  H      85 LYS  H       5.50 
 18 VAL  H      85 LYS  HA      3.50 
 18 VAL  H      86 ALA  H       5.00 
 18 VAL  H      86 ALA  HA      5.50 
 18 VAL  H      86 ALA  QB      5.00 
 18 VAL  HA     86 ALA  QB      5.50 
 18 VAL  HB     86 ALA  QB      5.50 
 18 VAL  QG1    86 ALA  H       5.00 
 18 VAL  QG2    86 ALA  H       5.00 
 18 VAL  HB     86 ALA  HA      5.50 
 18 VAL  QG1    86 ALA  HA      3.30 
 18 VAL  QG2    86 ALA  HA      3.30 
 18 VAL  QG1    86 ALA  QB      2.70 
 18 VAL  QG2    86 ALA  QB      3.30 
 19 PHE  HA     82 HIS  H       5.50 
 19 PHE  HA     83 ILE  HA      3.30 
 19 PHE  HA     83 ILE  QG2     5.00 
 19 PHE  HB2    83 ILE  HA      5.00 
 19 PHE  HB3    83 ILE  HA      5.50 
 19 PHE  HB2    83 ILE  QG2     5.00 
 19 PHE  HB3    83 ILE  QG2     5.50 
 19 PHE  HD1    83 ILE  HA      5.50 
 19 PHE  HD1    83 ILE  QG2     5.00 
 19 PHE  HA     84 GLU  H       3.80 
 19 PHE  QB     84 GLU  H       5.00 
 20 THR  H      82 HIS  H       5.00 
 20 THR  QG2    82 HIS  HD2     5.00 
 20 THR  H      82 HIS  HB2     5.00 
 20 THR  H      82 HIS  HB3     5.50 
 20 THR  HB     82 HIS  HB2     6.00 
 20 THR  HB     82 HIS  HB3     5.50 
 20 THR  H      83 ILE  HA      5.00 
 20 THR  H      83 ILE  QG2     5.00 
 20 THR  H      81 CYS  HA      5.50 
 21 LEU  QD1    80 ARG  HA      3.80 
 21 LEU  QD1    80 ARG  HB2     3.30 
 21 LEU  QD1    80 ARG  HB3     5.50 
 21 LEU  QD1    80 ARG  HE      5.00 
 21 LEU  HA     81 CYS  HA      5.00 
 21 LEU  QD1    81 CYS  HA      3.30 
 21 LEU  QD1    81 CYS  H       3.30 
 21 LEU  QD2    81 CYS  H       5.50 
 21 LEU  HA     82 HIS  H       5.00 
 21 LEU  QD1    82 HIS  H       5.00 
 22 ASN  H      81 CYS  HA      5.50 
 42 TYR  O      63 ASN  H       2.40 
 42 TYR  O      63 ASN  N       3.20 
 44 ILE  H      61 PHE  O       2.40 
 44 ILE  N      61 PHE  O       3.20 
 44 ILE  O      61 PHE  H       2.40 
 44 ILE  O      61 PHE  N       3.20 
 46 GLY  H      59 GLN  O       2.40 
 46 GLY  N      59 GLN  O       3.20 
 46 GLY  O      59 GLN  H       2.40 
 46 GLY  O      59 GLN  N       3.20 
 39 LEU  QD2    64 PHE  HD1     5.50 
 39 LEU  QD2    64 PHE  HE1     5.50 
 39 LEU  HA     65 VAL  QG2     5.50 
 39 LEU  QD2    65 VAL  QG2     5.00 
 40 PHE  HA     64 PHE  HA      3.30 
 40 PHE  HA     65 VAL  H       3.30 
 40 PHE  HB3    65 VAL  H       5.50 
 40 PHE  H      65 VAL  QG1     6.00 
 40 PHE  H      65 VAL  QG2     3.30 
 40 PHE  HA     65 VAL  QG2     5.00 
 40 PHE  H      65 VAL  HB      5.50 
 41 ASP  H      64 PHE  HA      5.00 
 41 ASP  H      65 VAL  HA      5.00 
 41 ASP  H      65 VAL  QG2     3.30 
 41 ASP  HA     65 VAL  QG2     5.00 
 41 ASP  HB3    65 VAL  QG2     5.50 
 42 TYR  H      63 ASN  H       5.00 
 42 TYR  H      63 ASN  HA      5.50 
 42 TYR  H      64 PHE  HA      5.50 
 42 TYR  H      65 VAL  QG2     5.50 
 43 PHE  HA     62 ALA  HA      3.30 
 43 PHE  HA     62 ALA  QB      5.00 
 43 PHE  HD1    62 ALA  HA      3.30 
 43 PHE  HD1    62 ALA  QB      2.70 
 43 PHE  HE1    62 ALA  QB      3.30 
 43 PHE  HA     63 ASN  H       5.00 
 43 PHE  HD1    63 ASN  H       5.00 
 44 ILE  H      61 PHE  H       3.50 
 44 ILE  QG2    61 PHE  H       3.30 
 44 ILE  QG2    61 PHE  HA      5.50 
 44 ILE  QG2    61 PHE  HB2     5.00 
 44 ILE  QG2    61 PHE  HB3     3.30 
 44 ILE  QG2    61 PHE  HD1     3.30 
 44 ILE  H      62 ALA  HA      5.00 
 44 ILE  H      62 ALA  QB      5.00 
 45 VAL  HA     61 PHE  H       3.30 
 45 VAL  HA     60 GLY  HA2     3.30 
 45 VAL  HA     60 GLY  HA3     3.30 
 45 VAL  QG2    60 GLY  HA2     5.50 
 45 VAL  QG2    60 GLY  HA3     5.50 
 46 GLY  H      59 GLN  H       5.00 
 46 GLY  H      60 GLY  HA3     5.00 
 47 GLU  HA     58 LEU  HA      3.30 
 47 GLU  HA     58 LEU  QD2     3.80 
 47 GLU  QG     58 LEU  QD2     5.00 
 47 GLU  HA     59 GLN  H       5.00 
 48 GLU  H      56 PRO  HA      5.50 
 48 GLU  H      57 HIS  H       5.00 
 48 GLU  H      58 LEU  HA      5.00 
 48 GLU  H      58 LEU  QD2     5.00 
 49 GLY  HA2    56 PRO  HA      3.30 
 49 GLY  HA3    56 PRO  HA      5.00 
 49 GLY  H      56 PRO  HA      5.50 
 49 GLY  HA2    57 HIS  H       5.00 
 49 GLY  HA3    57 HIS  H       5.00 
 50 ASN  H      56 PRO  HA      5.50 
 43 PHE  H     107 CYS  O       2.40 
 43 PHE  N     107 CYS  O       3.20 
 43 PHE  O     107 CYS  H       2.40 
 43 PHE  O     107 CYS  N       3.20 
 45 VAL  H     105 MET  O       2.40 
 45 VAL  N     105 MET  O       3.20 
 41 ASP  HA    111 ARG  QG      5.50 
 41 ASP  HA    111 ARG  QD      5.50 
 41 ASP  HB2   111 ARG  QG      5.00 
 41 ASP  HB3   111 ARG  QG      5.00 
 41 ASP  HB3   111 ARG  QD      5.50 
 42 TYR  HD1   107 CYS  H       5.50 
 42 TYR  HE1   106 GLU  QG      5.00 
 42 TYR  HA    108 GLY  HA2     5.00 
 42 TYR  HA    108 GLY  HA3     5.00 
 42 TYR  HA    108 GLY  H       5.50 
 42 TYR  HA    109 ALA  H       5.00 
 42 TYR  HB2   109 ALA  H       5.00 
 42 TYR  HB3   109 ALA  H       5.00 
 42 TYR  HD1   109 ALA  H       3.30 
 42 TYR  HD1   110 PRO  HA      5.00 
 43 PHE  HD1   105 MET  QE      5.00 
 43 PHE  HE1   105 MET  QE      3.30 
 43 PHE  HE1   105 MET  QG      5.00 
 43 PHE  H     107 CYS  H       5.00 
 43 PHE  H     107 CYS  HA      5.50 
 43 PHE  HD1   107 CYS  H       5.50 
 43 PHE  HB2   107 CYS  H       5.00 
 43 PHE  HB3   107 CYS  H       5.00 
 43 PHE  H     108 GLY  HA2     5.50 
 43 PHE  H     108 GLY  HA3     5.50 
 44 ILE  QG2   103 LEU  QD1     5.50 
 44 ILE  QG2   103 LEU  QD2     5.50 
 44 ILE  QD1   103 LEU  QD1     2.70 
 44 ILE  QD1   103 LEU  QD2     3.30 
 44 ILE  HA    106 GLU  HA      3.30 
 44 ILE  HA    106 GLU  HG2     5.50 
 44 ILE  HB    106 GLU  HA      5.00 
 44 ILE  QG2   106 GLU  HA      5.50 
 44 ILE  QD1   106 GLU  HA      5.00 
 44 ILE  HA    107 CYS  H       3.30 
 44 ILE  HB    107 CYS  H       5.50 
 45 VAL  H     103 LEU  QD1     5.00 
 45 VAL  HB    104 LEU  QB      5.00 
 45 VAL  H     105 MET  H       3.30 
 45 VAL  QG1   105 MET  HB2     5.00 
 45 VAL  QG1   105 MET  HB3     5.50 
 45 VAL  QG2   105 MET  HB2     5.50 
 45 VAL  QG2   105 MET  HB3     5.00 
 45 VAL  H     106 GLU  HA      5.00 
 46 GLY  HA2   103 LEU  HA      3.30 
 46 GLY  HA3   103 LEU  HA      3.30 
 46 GLY  HA2   104 LEU  H       5.00 
 46 GLY  HA3   104 LEU  H       5.00 
 46 GLY  HA2   105 MET  H       6.00 
 46 GLY  HA3   105 MET  H       5.50 
 47 GLU  H     102 ASN  HB2     5.00 
 47 GLU  H     102 ASN  HB3     5.00 
 47 GLU  QB    102 ASN  HB3     5.50 
 47 GLU  QB    102 ASN  HD21    3.30 
 47 GLU  QB    102 ASN  HD22    5.00 
 47 GLU  QG    102 ASN  HD21    5.00 
 47 GLU  QG    102 ASN  HD22    5.00 
 47 GLU  H     103 LEU  HA      5.00 
 31 LYS  QE     78 GLY  H       5.50 
 31 LYS  QE     78 GLY  HA2     5.50 
 31 LYS  QE     78 GLY  HA3     5.00 
 31 LYS  QE     79 ALA  H       6.00 
 32 ILE  QD1    77 LEU  HA      3.50 
 32 ILE  QD1    77 LEU  QD2     5.00 
 32 ILE  QG2    77 LEU  QD2     5.00 
 35 LEU  QD2    76 TYR  HA      5.50 
 35 LEU  QD2    76 TYR  HB2     5.50 
 35 LEU  QD2    76 TYR  HB3     5.50 
 35 LEU  QD2    76 TYR  HD1     5.00 
 35 LEU  QD2    76 TYR  HE1     5.00 
 39 LEU  QD1    76 TYR  HE1     5.00 
 39 LEU  QD2    76 TYR  HD1     5.00 
 39 LEU  QD2    76 TYR  HE1     3.30 
 19 PHE  HE1    32 ILE  QD1     5.00 
 21 LEU  QD1    32 ILE  QD1     5.00 
 21 LEU  QD2    32 ILE  QD1     5.50 
 32 ILE  QG2    43 PHE  HE1     3.80 
 32 ILE  QG2    43 PHE  HZ      3.30 
 35 LEU  QD1    43 PHE  HE1     5.00 
 35 LEU  QD1    43 PHE  HZ      5.00 
 32 ILE  QG2    45 VAL  QG1     3.30 
 32 ILE  QG2    45 VAL  QG2     2.70 
 32 ILE  QD1    45 VAL  QG1     3.80 
 32 ILE  QD1    45 VAL  QG2     5.00 
 29 ARG  H      58 LEU  QD1     5.50 
 29 ARG  HA     58 LEU  QD1     5.00 
 29 ARG  QB     58 LEU  QD1     5.50 
 29 ARG  QD     58 LEU  QD2     5.50 
 29 ARG  HE     58 LEU  QD2     5.00 
 32 ILE  H      58 LEU  QD1     5.00 
 32 ILE  HB     58 LEU  QD1     5.00 
 32 ILE  QG2    58 LEU  QD1     3.80 
 32 ILE  QD1    58 LEU  QD1     3.30 
 33 ARG  H      58 LEU  QD1     5.00 
 17 TRP  HH2    70 PHE  H       5.00 
 17 TRP  HZ2    70 PHE  H       5.00 
 17 TRP  HZ3    70 PHE  HD1     3.80 
 17 TRP  HZ3    70 PHE  HA      5.50 
 17 TRP  HH2    70 PHE  HD1     3.80 
 17 TRP  HH2    70 PHE  HA      3.30 
 17 TRP  HH2    70 PHE  HB2     5.50 
 17 TRP  HH2    70 PHE  HB3     5.50 
 17 TRP  HE1    73 VAL  QG1     5.00 
 17 TRP  HE1    73 VAL  QG2     3.30 
 17 TRP  HZ2    73 VAL  QG2     5.50 
 17 TRP  HD1    73 VAL  QG2     5.00 
 18 VAL  H      77 LEU  QD1     5.50 
 19 PHE  HD1    77 LEU  QD1     5.00 
 21 LEU  QD1    79 ALA  QB      6.00 
 21 LEU  QD1    80 ARG  H       5.00 
 64 PHE  HE1    73 VAL  QG1     3.30 
 64 PHE  HE1    73 VAL  QG2     3.30 
 64 PHE  HE1    75 TRP  HD1     5.00 
 43 PHE  HD1    77 LEU  QD2     6.00 
 43 PHE  HE1    77 LEU  QD2     5.00 
 43 PHE  HZ     77 LEU  QD2     5.00 
 70 PHE  HA     83 ILE  QD1     5.00 
 70 PHE  HD1    83 ILE  QG2     5.00 
 70 PHE  HD1    83 ILE  QD1     3.30 
 70 PHE  HE1    83 ILE  QG2     5.00 
 70 PHE  HE1    83 ILE  HA      5.50 
 70 PHE  HE1    83 ILE  QD1     5.00 
 73 VAL  H      83 ILE  QD1     5.00 
 73 VAL  HB     83 ILE  QG2     5.50 
 73 VAL  HB     83 ILE  QD1     3.30 
 73 VAL  QG1    83 ILE  QG2     3.30 
 73 VAL  QG1    83 ILE  QD1     2.70 
 73 VAL  QG1    83 ILE  HG13    5.00 
 73 VAL  QG2    83 ILE  QG2     5.00 
 73 VAL  QG2    83 ILE  QD1     5.00 
 74 LYS  HA     83 ILE  QD1     3.30 
 74 LYS  QB     83 ILE  QD1     5.50 
 74 LYS  HG2    83 ILE  QD1     5.00 
 74 LYS  HG3    83 ILE  QD1     3.30 
 74 LYS  QD     83 ILE  QD1     3.30 
 74 LYS  QE     83 ILE  QD1     3.30 
 74 LYS  QE     83 ILE  HG12    3.30 
 74 LYS  QE     83 ILE  HG13    5.50 
 74 LYS  QE     83 ILE  QG2     5.00 
 74 LYS  QE     83 ILE  H       5.00 
 33 ARG  HA    105 MET  HB2     5.00 
 33 ARG  HA    105 MET  QG      5.00 
 33 ARG  HA    105 MET  QE      3.30 
 33 ARG  HD2   104 LEU  QD1     5.00 
 33 ARG  HD2   104 LEU  QD2     5.50 
 33 ARG  HD3   104 LEU  QD1     3.30 
 33 ARG  HD3   104 LEU  QD2     5.00 
 33 ARG  QG    104 LEU  QD1     5.50 
 33 ARG  QB    104 LEU  QD1     5.50 
 35 LEU  QD1   105 MET  QE      5.00 
 35 LEU  H     105 MET  QE      5.00 
 37 ILE  H     107 CYS  QB      5.50 
 37 ILE  HA    107 CYS  QB      5.50 
 37 ILE  HB    107 CYS  QB      5.50 
 37 ILE  QG2   107 CYS  HA      5.00 
 37 ILE  QD1   107 CYS  HA      5.50 
 37 ILE  QG2   107 CYS  QB      3.30 
 37 ILE  QD1   107 CYS  QB      5.00 
 37 ILE  QD1   108 GLY  H       5.00 
 37 ILE  QG2   108 GLY  H       3.50 
 42 TYR  HE1    94 LYS  HA      5.00 
 42 TYR  HE1    94 LYS  QB      5.00 
 42 TYR  HE1    94 LYS  QD      5.50 
 42 TYR  HE1    94 LYS  QE      5.50 
 44 ILE  QG2    94 LYS  HA      3.30 
 44 ILE  QD1    94 LYS  HA      3.30 
 44 ILE  QD1    97 CYS  H       5.00 
 44 ILE  QG2    97 CYS  H       5.00 
 44 ILE  QD1    97 CYS  HA      5.50 
 44 ILE  QD1    97 CYS  QB      3.30 
 44 ILE  QG2    97 CYS  QB      5.50 
 44 ILE  QD1    98 SER  H       5.00 
 44 ILE  QD1    98 SER  HA      5.00 
 44 ILE  QD1    98 SER  QB      3.30 
 59 GLN  HG2    96 TYR  HE1     5.00 
 59 GLN  HG3    96 TYR  HE1     5.00 
 59 GLN  HE21   96 TYR  HE1     5.00 
 59 GLN  HE22   96 TYR  HE1     3.30 
 59 GLN  HE21   96 TYR  HD1     5.50 
 59 GLN  HE22   96 TYR  HD1     5.00 
 59 GLN  HG2    97 CYS  HA      5.00 
 59 GLN  HG3    97 CYS  HA      3.30 
 61 PHE  HD1    86 ALA  QB      5.00 
 61 PHE  HE1    86 ALA  QB      5.00 
 61 PHE  HZ     86 ALA  QB      5.50 
 61 PHE  HD1    90 ASP  HA      5.50 
 63 ASN  HD21  111 ARG  QG      3.30 
 63 ASN  HD22  111 ARG  QG      3.30 
 63 ASN  HD21  111 ARG  QB      5.00 
 63 ASN  HD22  111 ARG  QB      5.00 
 86 ALA  QB     93 ASN  HD21    5.00 
 86 ALA  QB     93 ASN  HD22    3.30 
 87 LYS  QG     93 ASN  HD21    5.50 
 87 LYS  QG     93 ASN  HD22    5.50 
 88 GLY  HA2    93 ASN  HD21    5.50 
 88 GLY  HA2    93 ASN  HD22    5.50 
 88 GLY  HA3    93 ASN  HD22    5.50 
 90 ASP  HB2   110 PRO  HA      5.00 
 90 ASP  HB3   110 PRO  HA      5.00 
 90 ASP  HB3   110 PRO  HB2     5.00 
 90 ASP  HB2   111 ARG  H       5.00 
 90 ASP  HB3   111 ARG  H       5.00 


##### LOWER LIMITS #####

#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
#interstrand b1-b5:
#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~

  14   HIS  O    68  GLN  H     1.8 # hbond,68HN protected
  14   HIS  O    68  GLN  N     2.7 # hbond,68HN protected

  14   HIS  H    68   GLN  O    1.8 # hbond,14H NOT protected
  14   HIS  N    68   GLN  O    2.7 # hbond,14H NOT protected

  17   TRP  HE1  68   GLN  O    1.8 # hbond,17HNe protected
  17   TRP  NE1  68   GLN  O    2.7 # hbond,17HNe protected


#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
#interstrand b2-b4:
#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
  15   LYS  O    64   PHE  H     1.8 # hbond
  15   LYS  O    64   PHE  N     2.7 # hbond
  17   TRP  H    62   ALA  O     1.8 # hbond
  17   TRP  N    62   ALA  O     2.7 # hbond
  17   TRP  O    62   ALA  H     1.8 # hbond
  17   TRP  O    62   ALA  N     2.7 # hbond
  19   PHE  H    60   GLY  O     1.8 # hbond
  19   PHE  N    60   GLY  O     2.7 # hbond
  19   PHE  O    60   GLY  H     1.8 # hbond
  19   PHE  O    60   GLY  N     2.7 # hbond
  21   LEU  O    58   LEU  H     1.8 # hbond
  21   LEU  O    58   LEU  N     2.7 # hbond
  21   LEU  H    58   LEU  O     1.8 # hbond
  21   LEU  N    58   LEU  O     2.7 # hbond
  23   ASN  H    56   PRO  O     1.8 # hbond,23HN NOT protected
  23   ASN  N    56   PRO  O     2.7 # hbond,23HN NOT protected

#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
#helix a1:
#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~

  25  SER  O    29  ARG  H     1.8 # 
  25  SER  O    29  ARG  N     2.7 # 

  26  GLU  O     30  LYS  H     1.8 #   test hbond, but could also be CO27!!
  26  GLU  O     30  LYS  N     2.7 #   test hbond, but could also be CO27!!

  27  ASP  O     31  LYS  H     1.8 #   test hbond, but could also be HN30!!
  27  ASP  O     31  LYS  N     2.7 #   test hbond, but could also be HN30!!

  28  GLU  O     32  ILE  H     1.8 # hbond
  28  GLU  O     32  ILE  N     2.7 # hbond

  29  ARG  O     33  ARG  H     1.8 # hbond
  29  ARG  O     33  ARG  N     2.7 # hbond

  30  LYS  O     34  ASP  H     1.8 # hbond
  30  LYS  O     34  ASP  N     2.7 # hbond

  32  ILE  O     35  LEU  H     1.8  # testOK
  32  ILE  O     35  LEU  N     2.7  # testOK

#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
#turn a1-b3:
#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~

  36  PRO  O     39  LEU  H     1.8 # hbond
  36  PRO  O     39  LEU  N     2.7 # hbond

  37  ILE  O     40  PHE  H     1.8 # hbond
  37  ILE  O     40  PHE  N     2.7 # hbond

#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
#interstrand b2-b6:
#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
  18   VAL  H    84   GLU  O     1.8 # hbond
  18   VAL  N    84   GLU  O     2.7 # hbond
  18   VAL  O    84   GLU  H     1.8 # hbond
  18   VAL  O    84   GLU  N     2.7 # hbond
  20   THR  H    82   HIS  O     1.8 # hbond
  20   THR  N    82   HIS  O     2.7 # hbond
  20   THR  O    82   HIS  H     1.8 # hbond
  20   THR  O    82   HIS  N     2.7 # hbond

#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
#interstrand b3-b4:
#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
##  42   TYR  H    63   ASN  O     1.8 # hbond
##  42   TYR  N    63   ASN  O     2.7 # hbond
  42   TYR  O    63   ASN  H     1.8 # hbond
  42   TYR  O    63   ASN  N     2.7 # hbond

  44   ILE  H    61   PHE  O     1.8 # hbond
  44   ILE  N    61   PHE  O     2.7 # hbond
  44   ILE  O    61   PHE  H     1.8 # hbond
  44   ILE  O    61   PHE  N     2.7 # hbond

  46   GLY  H    59   GLN  O     1.8 # hbond
  46   GLY  N    59   GLN  O     2.7 # hbond
  46   GLY  O    59   GLN  H     1.8 # hbond
  46   GLY  O    59   GLN  N     2.7 # hbond

#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
#helix a2:
#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~

  69  THR OG1   72  LYS  H     1.8 # Capping T69-HN72, seen in all 3D but not protected
  69  THR OG1   72  LYS  N     2.7 # Capping T69-HN72, seen in all 3D but not protected

  69  THR  O    73  VAL  H     1.8 # hbond, HNprotected.
  69  THR  O    73  VAL  N     2.7 # hbond, HNprotected.

  70  PHE  O    74  LYS  H     1.8 # BIFhbond, HNprotected.
  70  PHE  O    74  LYS  N     2.7 # BIFhbond, HNprotected.
  71  ASN  O 74  LYS  H     1.8 # BIFhbond, HNprotected.
  71  ASN  O 74  LYS  N     2.7 # BIFhbond, HNprotected.

  72  LYS  O    75  TRP  H     1.8 # 3_10, hbond, HNprotected.
  72  LYS  O    75  TRP  N     2.7 # 3_10, hbond, HNprotected.

  73  VAL  O    76  TYR  H     1.8 # BIFhbond, HNprotected.
  73  VAL  O    76  TYR  N     2.7 # BIFhbond, HNprotected.
  73  VAL  O    77  LEU  H     1.8 # BIFhbond, HNprotected.
  73  VAL  O    77  LEU  N     2.7 # BIFhbond, HNprotected.

  74  LYS  O    78  GLY  H     1.8 # hbond
  74  LYS  O    78  GLY  N     2.7 # hbond

#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
#interstrand b3-b7:
#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
  43   PHE  H   107   CYS  O     1.8 # hbond
  43   PHE  N   107   CYS  O     2.7 # hbond
  43   PHE  O   107   CYS  H     1.8 # hbond
  43   PHE  O   107   CYS  N     2.7 # hbond
  45   VAL  H   105   MET  O     1.8 # hbond
  45   VAL  N   105   MET  O     2.7 # hbond

#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
#helix a3:
#~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
#None protected but impose those present in 25/30 3Ds

  89  THR  O 93  ASN  H     1.8 # Not protected but consistent
  89  THR  O 93  ASN  N     2.7 # Not protected but consistent
  90  ASP  O    94  LYS  H     1.8 # Not protected but consistent
  90  ASP  O    94  LYS  N     2.7 # Not protected but consistent
  91  GLN  O 95  GLU  H     1.8 #  Not protected but consistent
  91  GLN  O 95  GLU  N     2.7 #  Not protected but consistent


  94  LYS  O 98  SER  H     1.8 #  Not protected but consistent
  94  LYS  O 98  SER  N     2.7 #  Not protected but consistent

  96  TYR  O 99  LYS  H     1.8 # 3_10,Not protected but consistent
  96  TYR  O 99  LYS  N     2.7 # 3_10,Not protected but consistent

  98  SER  O 101  GLY  H    1.8 # 3_10,Not protected but consistent
  98  SER  O 101  GLY  N    2.7 # 3_10,Not protected but consistent

#VanderWaals violations to be corrected:

   35 LEU HA     36  PRO CD         2.60 20.0 ##force


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   PRO   2           HA       PRO   2  13.503 -13.995  18.812
    2   1HB   PRO   2          1HB       PRO   2  11.569 -12.434  17.720
    3   2HB   PRO   2          2HB       PRO   2  11.261 -14.072  18.311
    4   1HG   PRO   2          1HG       PRO   2  10.739 -11.446  19.651
    5   2HG   PRO   2          2HG       PRO   2   9.710 -12.889  19.574
    6   1HD   PRO   2          1HD       PRO   2  11.210 -12.282  21.745
    7   2HD   PRO   2          2HD       PRO   2  10.863 -13.954  21.261
    8    H    SER   3           H        SER   3  15.320 -12.976  18.217
    9    HA   SER   3           HA       SER   3  15.301 -10.030  18.141
   10   1HB   SER   3          1HB       SER   3  17.938 -11.311  18.066
   11   2HB   SER   3          2HB       SER   3  17.365  -9.968  19.054
   12    HG   SER   3           HG       SER   3  16.470 -11.438  20.486
   13    H    LYS   4           H        LYS   4  15.821  -9.019  16.273
   14    HA   LYS   4           HA       LYS   4  16.750 -10.669  14.022
   15   1HB   LYS   4          1HB       LYS   4  14.472  -8.690  14.039
   16   2HB   LYS   4          2HB       LYS   4  15.237  -9.252  12.558
   17   1HG   LYS   4          1HG       LYS   4  14.044 -11.117  12.564
   18   2HG   LYS   4          2HG       LYS   4  14.496 -11.475  14.232
   19   1HD   LYS   4          1HD       LYS   4  12.723 -10.033  15.050
   20   2HD   LYS   4          2HD       LYS   4  12.302  -9.578  13.397
   21   1HE   LYS   4          1HE       LYS   4  12.333 -12.443  13.691
   22   2HE   LYS   4          2HE       LYS   4  11.275 -11.708  14.893
   23   1HZ   LYS   4          1HZ       LYS   4  10.387 -10.386  12.884
   24   2HZ   LYS   4          2HZ       LYS   4   9.886 -11.987  13.094
   25   3HZ   LYS   4          3HZ       LYS   4  11.082 -11.617  11.956
   26    H    LYS   5           H        LYS   5  17.964  -9.577  12.431
   27    HA   LYS   5           HA       LYS   5  19.065  -7.000  13.342
   28   1HB   LYS   5          1HB       LYS   5  20.330  -9.285  11.837
   29   2HB   LYS   5          2HB       LYS   5  21.063  -7.687  11.904
   30   1HG   LYS   5          1HG       LYS   5  20.335  -8.635  14.538
   31   2HG   LYS   5          2HG       LYS   5  21.416  -9.758  13.708
   32   1HD   LYS   5          1HD       LYS   5  22.628  -7.423  13.128
   33   2HD   LYS   5          2HD       LYS   5  21.906  -7.015  14.687
   34   1HE   LYS   5          1HE       LYS   5  22.932  -9.160  15.563
   35   2HE   LYS   5          2HE       LYS   5  23.843  -9.231  14.056
   36   1HZ   LYS   5          1HZ       LYS   5  24.532  -7.862  16.341
   37   2HZ   LYS   5          2HZ       LYS   5  24.050  -6.663  15.251
   38   3HZ   LYS   5          3HZ       LYS   5  25.277  -7.747  14.826
   39    H    ASN   6           H        ASN   6  18.816  -5.276  12.074
   40    HA   ASN   6           HA       ASN   6  18.045  -5.715   9.263
   41   1HB   ASN   6          1HB       ASN   6  16.729  -3.580   9.469
   42   2HB   ASN   6          2HB       ASN   6  16.101  -4.922  10.421
   43   1HD2  ASN   6          1HD2      ASN   6  15.803  -4.641  12.529
   44   2HD2  ASN   6          2HD2      ASN   6  16.339  -3.273  13.438
   45    H    GLY   7           H        GLY   7  18.662  -4.038   7.764
   46   1HA   GLY   7          1HA       GLY   7  20.464  -1.957   8.566
   47   2HA   GLY   7          2HA       GLY   7  21.302  -3.309   7.817
   48    H    ARG   8           H        ARG   8  21.887  -2.586   5.865
   49    HA   ARG   8           HA       ARG   8  19.754  -1.573   4.109
   50   1HB   ARG   8          1HB       ARG   8  21.278   0.020   3.113
   51   2HB   ARG   8          2HB       ARG   8  21.215   0.285   4.851
   52   1HG   ARG   8          1HG       ARG   8  23.340  -0.724   5.168
   53   2HG   ARG   8          2HG       ARG   8  23.373  -1.318   3.507
   54   1HD   ARG   8          1HD       ARG   8  23.540   0.923   2.652
   55   2HD   ARG   8          2HD       ARG   8  23.318   1.598   4.266
   56    HE   ARG   8           HE       ARG   8  25.529   1.174   4.721
   57   1HH1  ARG   8          1HH1      ARG   8  24.600  -0.475   1.800
   58   2HH1  ARG   8          2HH1      ARG   8  26.222  -0.921   1.381
   59   1HH2  ARG   8          1HH2      ARG   8  27.668   0.594   4.182
   60   2HH2  ARG   8          2HH2      ARG   8  27.965  -0.313   2.737
   61    H    SER   9           H        SER   9  20.847  -4.254   4.434
   62    HA   SER   9           HA       SER   9  22.559  -4.742   2.168
   63   1HB   SER   9          1HB       SER   9  21.123  -7.024   3.377
   64   2HB   SER   9          2HB       SER   9  22.841  -6.824   3.036
   65    HG   SER   9           HG       SER   9  22.781  -5.299   4.884
   66    H    GLY  10           H        GLY  10  22.011  -5.545   0.192
   67   1HA   GLY  10          1HA       GLY  10  20.669  -5.834  -1.654
   68   2HA   GLY  10          2HA       GLY  10  19.716  -6.850  -0.581
   69    HA   PRO  11           HA       PRO  11  16.432  -4.004  -1.392
   70   1HB   PRO  11          1HB       PRO  11  14.682  -4.977   0.441
   71   2HB   PRO  11          2HB       PRO  11  15.024  -5.794  -1.089
   72   1HG   PRO  11          1HG       PRO  11  16.113  -6.355   1.643
   73   2HG   PRO  11          2HG       PRO  11  15.551  -7.496   0.406
   74   1HD   PRO  11          1HD       PRO  11  18.175  -6.978   0.826
   75   2HD   PRO  11          2HD       PRO  11  17.526  -7.380  -0.776
   76    H    GLN  12           H        GLN  12  15.931  -2.029  -0.639
   77    HA   GLN  12           HA       GLN  12  16.534  -1.432   2.182
   78   1HB   GLN  12          1HB       GLN  12  17.210   0.038  -0.319
   79   2HB   GLN  12          2HB       GLN  12  16.828   0.986   1.113
   80   1HG   GLN  12          1HG       GLN  12  18.642   0.123   2.309
   81   2HG   GLN  12          2HG       GLN  12  18.864  -1.211   1.177
   82   1HE2  GLN  12          1HE2      GLN  12  20.210  -0.958  -0.496
   83   2HE2  GLN  12          2HE2      GLN  12  21.022   0.513  -0.900
   84    HA   PRO  13           HA       PRO  13  12.482   0.162   2.701
   85   1HB   PRO  13          1HB       PRO  13  12.900   2.333   4.275
   86   2HB   PRO  13          2HB       PRO  13  13.061   0.675   4.864
   87   1HG   PRO  13          1HG       PRO  13  15.189   2.585   3.980
   88   2HG   PRO  13          2HG       PRO  13  15.175   1.494   5.378
   89   1HD   PRO  13          1HD       PRO  13  16.492   0.909   3.086
   90   2HD   PRO  13          2HD       PRO  13  15.758  -0.341   4.110
   91    H    HIS  14           H        HIS  14  11.017   1.668   1.926
   92    HA   HIS  14           HA       HIS  14  12.074   4.025   0.542
   93   1HB   HIS  14          1HB       HIS  14  10.254   1.950  -0.691
   94   2HB   HIS  14          2HB       HIS  14  10.564   3.533  -1.397
   95    HD1  HIS  14           1HD      HIS  14  12.128   0.191  -0.844
   96    HD2  HIS  14           2HD      HIS  14  13.088   3.840  -2.586
   97    HE1  HIS  14           1HE      HIS  14  14.211  -0.232  -2.188
   98    H    LYS  15           H        LYS  15  10.036   5.284  -0.388
   99    HA   LYS  15           HA       LYS  15   8.202   5.569   1.889
  100   1HB   LYS  15          1HB       LYS  15   7.733   7.830   0.850
  101   2HB   LYS  15          2HB       LYS  15   9.358   7.602   1.486
  102   1HG   LYS  15          1HG       LYS  15   9.255   6.828  -1.277
  103   2HG   LYS  15          2HG       LYS  15   8.629   8.465  -1.068
  104   1HD   LYS  15          1HD       LYS  15  10.709   8.897   0.345
  105   2HD   LYS  15          2HD       LYS  15  11.333   7.383  -0.317
  106   1HE   LYS  15          1HE       LYS  15  10.957   8.311  -2.600
  107   2HE   LYS  15          2HE       LYS  15  10.519   9.847  -1.854
  108   1HZ   LYS  15          1HZ       LYS  15  12.949   9.391  -2.643
  109   2HZ   LYS  15          2HZ       LYS  15  13.086   8.619  -1.144
  110   3HZ   LYS  15          3HZ       LYS  15  12.660  10.254  -1.217
  111    H    ARG  16           H        ARG  16   8.072   3.712  -0.549
  112    HA   ARG  16           HA       ARG  16   5.257   4.257  -1.131
  113   1HB   ARG  16          1HB       ARG  16   7.198   3.463  -3.301
  114   2HB   ARG  16          2HB       ARG  16   5.509   3.919  -3.484
  115   1HG   ARG  16          1HG       ARG  16   5.991   6.193  -2.929
  116   2HG   ARG  16          2HG       ARG  16   7.653   5.783  -2.498
  117   1HD   ARG  16          1HD       ARG  16   6.801   5.030  -5.219
  118   2HD   ARG  16          2HD       ARG  16   6.918   6.760  -4.901
  119    HE   ARG  16           HE       ARG  16   9.238   5.463  -3.966
  120   1HH1  ARG  16          1HH1      ARG  16   7.648   6.369  -6.927
  121   2HH1  ARG  16          2HH1      ARG  16   9.120   6.495  -7.832
  122   1HH2  ARG  16          1HH2      ARG  16  11.182   5.624  -5.146
  123   2HH2  ARG  16          2HH2      ARG  16  11.130   6.070  -6.818
  124    H    TRP  17           H        TRP  17   4.067   2.505  -0.787
  125    HA   TRP  17           HA       TRP  17   5.114  -0.135  -1.405
  126   1HB   TRP  17          1HB       TRP  17   4.341   0.741   1.373
  127   2HB   TRP  17          2HB       TRP  17   4.320  -0.952   0.888
  128    HD1  TRP  17           HD       TRP  17   6.678   1.851   1.853
  129    HE1  TRP  17           1HE      TRP  17   9.067   0.915   2.053
  130    HE3  TRP  17           3HE      TRP  17   5.894  -2.801  -0.117
  131    HZ2  TRP  17           2HZ      TRP  17  10.439  -1.478   1.453
  132    HZ3  TRP  17           3HZ      TRP  17   7.797  -4.352  -0.270
  133    HH2  TRP  17           HH       TRP  17  10.022  -3.703   0.500
  134    H    VAL  18           H        VAL  18   3.565  -1.510  -2.093
  135    HA   VAL  18           HA       VAL  18   0.788  -0.538  -1.990
  136    HB   VAL  18           HB       VAL  18   0.358  -1.912  -3.962
  137   1HG1  VAL  18          1HG1      VAL  18   2.685  -0.014  -4.136
  138   2HG1  VAL  18          2HG1      VAL  18   1.902  -0.701  -5.560
  139   3HG1  VAL  18          3HG1      VAL  18   0.982   0.316  -4.450
  140   1HG2  VAL  18          1HG2      VAL  18   3.095  -2.496  -4.678
  141   2HG2  VAL  18          2HG2      VAL  18   2.644  -3.291  -3.170
  142   3HG2  VAL  18          3HG2      VAL  18   1.693  -3.565  -4.630
  143    H    PHE  19           H        PHE  19  -0.909  -2.203  -1.893
  144    HA   PHE  19           HA       PHE  19  -0.081  -4.664  -0.528
  145   1HB   PHE  19          1HB       PHE  19  -1.979  -4.359   1.077
  146   2HB   PHE  19          2HB       PHE  19  -0.684  -3.183   1.269
  147    HD1  PHE  19           1HD      PHE  19  -0.991  -0.874   0.352
  148    HD2  PHE  19           2HD      PHE  19  -4.177  -3.685   0.598
  149    HE1  PHE  19           1HE      PHE  19  -2.619   0.958   0.138
  150    HE2  PHE  19           2HE      PHE  19  -5.810  -1.859   0.384
  151    HZ   PHE  19           HZ       PHE  19  -5.034   0.467   0.153
  152    H    THR  20           H        THR  20  -1.387  -6.437  -0.871
  153    HA   THR  20           HA       THR  20  -3.864  -6.135  -2.363
  154    HB   THR  20           HB       THR  20  -3.224  -7.624  -4.168
  155    HG1  THR  20           1HG      THR  20  -0.747  -7.932  -4.232
  156   1HG2  THR  20          1HG2      THR  20  -2.801  -5.163  -4.374
  157   2HG2  THR  20          2HG2      THR  20  -1.780  -6.165  -5.405
  158   3HG2  THR  20          3HG2      THR  20  -1.125  -5.471  -3.922
  159    H    LEU  21           H        LEU  21  -5.317  -7.579  -1.694
  160    HA   LEU  21           HA       LEU  21  -4.412 -10.158  -0.643
  161   1HB   LEU  21          1HB       LEU  21  -4.640  -8.664   1.279
  162   2HB   LEU  21          2HB       LEU  21  -6.296  -8.299   0.801
  163    HG   LEU  21           HG       LEU  21  -6.324 -11.037   1.041
  164   1HD1  LEU  21          1HD1      LEU  21  -4.731  -9.964   3.359
  165   2HD1  LEU  21          2HD1      LEU  21  -4.034 -10.891   2.032
  166   3HD1  LEU  21          3HD1      LEU  21  -5.244 -11.628   3.081
  167   1HD2  LEU  21          1HD2      LEU  21  -7.916 -10.633   2.607
  168   2HD2  LEU  21          2HD2      LEU  21  -7.769  -8.998   1.962
  169   3HD2  LEU  21          3HD2      LEU  21  -6.939  -9.435   3.456
  170    H    ASN  22           H        ASN  22  -5.740 -11.833  -1.115
  171    HA   ASN  22           HA       ASN  22  -7.934 -11.312  -2.925
  172   1HB   ASN  22          1HB       ASN  22  -6.582 -13.123  -3.593
  173   2HB   ASN  22          2HB       ASN  22  -6.552 -13.811  -1.973
  174   1HD2  ASN  22          1HD2      ASN  22  -7.380 -15.777  -2.352
  175   2HD2  ASN  22          2HD2      ASN  22  -8.960 -16.068  -2.988
  176    H    ASN  23           H        ASN  23 -10.068 -11.552  -2.522
  177    HA   ASN  23           HA       ASN  23 -11.985 -11.575  -1.288
  178   1HB   ASN  23          1HB       ASN  23 -11.643 -13.982  -1.487
  179   2HB   ASN  23          2HB       ASN  23 -10.597 -13.973  -0.071
  180   1HD2  ASN  23          1HD2      ASN  23 -13.712 -12.414  -0.711
  181   2HD2  ASN  23          2HD2      ASN  23 -14.544 -13.140   0.617
  182    HA   PRO  24           HA       PRO  24  -9.857  -9.486   2.314
  183   1HB   PRO  24          1HB       PRO  24 -10.859  -7.014   1.810
  184   2HB   PRO  24          2HB       PRO  24  -9.355  -7.605   1.096
  185   1HG   PRO  24          1HG       PRO  24 -12.099  -7.484  -0.095
  186   2HG   PRO  24          2HG       PRO  24 -10.540  -7.074  -0.834
  187   1HD   PRO  24          1HD       PRO  24 -11.796  -9.429  -1.296
  188   2HD   PRO  24          2HD       PRO  24 -10.028  -9.277  -1.277
  189    H    SER  25           H        SER  25 -10.826  -9.174   4.257
  190    HA   SER  25           HA       SER  25 -13.711  -9.583   4.378
  191   1HB   SER  25          1HB       SER  25 -11.439 -10.134   6.128
  192   2HB   SER  25          2HB       SER  25 -12.798  -9.412   6.990
  193    HG   SER  25           HG       SER  25 -13.482 -11.411   6.982
  194    H    GLU  26           H        GLU  26 -15.046  -8.283   5.804
  195    HA   GLU  26           HA       GLU  26 -14.843  -5.543   5.304
  196   1HB   GLU  26          1HB       GLU  26 -16.608  -7.308   6.808
  197   2HB   GLU  26          2HB       GLU  26 -16.435  -5.731   7.566
  198   1HG   GLU  26          1HG       GLU  26 -16.966  -4.742   5.293
  199   2HG   GLU  26          2HG       GLU  26 -17.452  -6.369   4.819
  200    H    ASP  27           H        ASP  27 -13.613  -7.489   7.917
  201    HA   ASP  27           HA       ASP  27 -13.066  -5.336   9.706
  202   1HB   ASP  27          1HB       ASP  27 -12.779  -8.200   9.695
  203   2HB   ASP  27          2HB       ASP  27 -11.282  -7.456  10.248
  204    H    GLU  28           H        GLU  28 -11.044  -7.226   7.469
  205    HA   GLU  28           HA       GLU  28  -8.652  -5.823   7.981
  206   1HB   GLU  28          1HB       GLU  28  -9.449  -7.994   6.386
  207   2HB   GLU  28          2HB       GLU  28  -8.774  -6.814   5.273
  208   1HG   GLU  28          1HG       GLU  28  -7.043  -8.309   5.969
  209   2HG   GLU  28          2HG       GLU  28  -6.738  -6.719   6.664
  210    H    ARG  29           H        ARG  29 -11.069  -5.480   5.395
  211    HA   ARG  29           HA       ARG  29  -9.820  -3.390   4.015
  212   1HB   ARG  29          1HB       ARG  29 -12.588  -4.469   4.173
  213   2HB   ARG  29          2HB       ARG  29 -12.383  -2.871   3.468
  214   1HG   ARG  29          1HG       ARG  29 -11.141  -3.672   1.686
  215   2HG   ARG  29          2HG       ARG  29 -10.706  -5.160   2.530
  216   1HD   ARG  29          1HD       ARG  29 -12.305  -5.746   0.877
  217   2HD   ARG  29          2HD       ARG  29 -13.132  -5.802   2.432
  218    HE   ARG  29           HE       ARG  29 -13.389  -3.288   1.058
  219   1HH1  ARG  29          1HH1      ARG  29 -14.701  -6.486   1.471
  220   2HH1  ARG  29          2HH1      ARG  29 -16.288  -6.045   0.933
  221   1HH2  ARG  29          1HH2      ARG  29 -15.475  -2.695   0.348
  222   2HH2  ARG  29          2HH2      ARG  29 -16.727  -3.890   0.294
  223    H    LYS  30           H        LYS  30 -11.981  -3.375   6.792
  224    HA   LYS  30           HA       LYS  30 -12.393  -0.563   6.844
  225   1HB   LYS  30          1HB       LYS  30 -13.892  -2.200   7.954
  226   2HB   LYS  30          2HB       LYS  30 -12.615  -2.553   9.110
  227   1HG   LYS  30          1HG       LYS  30 -12.676  -0.219   9.868
  228   2HG   LYS  30          2HG       LYS  30 -13.994   0.098   8.739
  229   1HD   LYS  30          1HD       LYS  30 -14.631  -2.208  10.306
  230   2HD   LYS  30          2HD       LYS  30 -14.159  -0.888  11.379
  231   1HE   LYS  30          1HE       LYS  30 -15.754   0.457   9.697
  232   2HE   LYS  30          2HE       LYS  30 -16.492  -1.139   9.578
  233   1HZ   LYS  30          1HZ       LYS  30 -17.555   0.076  11.318
  234   2HZ   LYS  30          2HZ       LYS  30 -16.077   0.447  12.052
  235   3HZ   LYS  30          3HZ       LYS  30 -16.634  -1.150  12.031
  236    H    LYS  31           H        LYS  31 -10.052  -2.728   8.340
  237    HA   LYS  31           HA       LYS  31  -8.886  -0.884  10.111
  238   1HB   LYS  31          1HB       LYS  31  -8.409  -3.196  10.415
  239   2HB   LYS  31          2HB       LYS  31  -7.814  -3.363   8.768
  240   1HG   LYS  31          1HG       LYS  31  -5.901  -1.937   9.322
  241   2HG   LYS  31          2HG       LYS  31  -6.493  -1.801  10.979
  242   1HD   LYS  31          1HD       LYS  31  -5.727  -3.836  11.540
  243   2HD   LYS  31          2HD       LYS  31  -6.259  -4.557  10.019
  244   1HE   LYS  31          1HE       LYS  31  -3.848  -4.676  10.192
  245   2HE   LYS  31          2HE       LYS  31  -4.303  -3.573   8.895
  246   1HZ   LYS  31          1HZ       LYS  31  -4.039  -2.184  11.356
  247   2HZ   LYS  31          2HZ       LYS  31  -3.233  -1.926   9.891
  248   3HZ   LYS  31          3HZ       LYS  31  -2.621  -3.039  11.008
  249    H    ILE  32           H        ILE  32  -7.877  -1.876   6.840
  250    HA   ILE  32           HA       ILE  32  -5.727  -0.049   6.662
  251    HB   ILE  32           HB       ILE  32  -7.276  -1.609   4.622
  252   1HG1  ILE  32          1HG1      ILE  32  -4.344  -1.622   5.364
  253   2HG1  ILE  32          2HG1      ILE  32  -5.546  -2.694   6.075
  254   1HG2  ILE  32          1HG2      ILE  32  -5.493  -0.769   2.986
  255   2HG2  ILE  32          2HG2      ILE  32  -6.832   0.312   3.369
  256   3HG2  ILE  32          3HG2      ILE  32  -5.259   0.554   4.128
  257   1HD1  ILE  32          1HD1      ILE  32  -4.015  -3.210   3.855
  258   2HD1  ILE  32          2HD1      ILE  32  -5.473  -4.077   4.340
  259   3HD1  ILE  32          3HD1      ILE  32  -5.577  -2.756   3.175
  260    H    ARG  33           H        ARG  33  -9.118   0.134   5.689
  261    HA   ARG  33           HA       ARG  33  -8.881   2.648   4.371
  262   1HB   ARG  33          1HB       ARG  33 -10.708   1.194   3.792
  263   2HB   ARG  33          2HB       ARG  33 -11.269   1.155   5.458
  264   1HG   ARG  33          1HG       ARG  33 -11.985   3.416   5.360
  265   2HG   ARG  33          2HG       ARG  33 -11.185   3.665   3.806
  266   1HD   ARG  33          1HD       ARG  33 -13.246   3.280   2.980
  267   2HD   ARG  33          2HD       ARG  33 -12.793   1.590   3.194
  268    HE   ARG  33           HE       ARG  33 -14.340   1.424   4.873
  269   1HH1  ARG  33          1HH1      ARG  33 -13.743   4.787   4.196
  270   2HH1  ARG  33          2HH1      ARG  33 -15.027   5.354   5.213
  271   1HH2  ARG  33          1HH2      ARG  33 -16.034   2.159   6.214
  272   2HH2  ARG  33          2HH2      ARG  33 -16.328   3.859   6.361
  273    H    ASP  34           H        ASP  34  -9.153   1.687   7.655
  274    HA   ASP  34           HA       ASP  34  -9.981   4.365   8.502
  275   1HB   ASP  34          1HB       ASP  34 -11.076   2.321   9.480
  276   2HB   ASP  34          2HB       ASP  34  -9.531   1.924  10.228
  277    H    LEU  35           H        LEU  35  -7.213   3.130   7.566
  278    HA   LEU  35           HA       LEU  35  -5.434   3.518   9.724
  279   1HB   LEU  35          1HB       LEU  35  -5.156   3.356   6.758
  280   2HB   LEU  35          2HB       LEU  35  -3.782   3.891   7.725
  281    HG   LEU  35           HG       LEU  35  -5.195   1.250   8.084
  282   1HD1  LEU  35          1HD1      LEU  35  -2.614   1.884   6.662
  283   2HD1  LEU  35          2HD1      LEU  35  -4.112   1.337   5.910
  284   3HD1  LEU  35          3HD1      LEU  35  -3.232   0.268   7.002
  285   1HD2  LEU  35          1HD2      LEU  35  -4.092   2.077  10.096
  286   2HD2  LEU  35          2HD2      LEU  35  -2.597   2.310   9.190
  287   3HD2  LEU  35          3HD2      LEU  35  -3.237   0.684   9.431
  288    HA   PRO  36           HA       PRO  36  -4.882   7.863   9.976
  289   1HB   PRO  36          1HB       PRO  36  -2.204   8.093  10.357
  290   2HB   PRO  36          2HB       PRO  36  -3.301   7.475  11.597
  291   1HG   PRO  36          1HG       PRO  36  -1.540   5.968   9.702
  292   2HG   PRO  36          2HG       PRO  36  -1.826   5.684  11.428
  293   1HD   PRO  36          1HD       PRO  36  -3.043   4.232   9.493
  294   2HD   PRO  36          2HD       PRO  36  -3.821   4.592  11.048
  295    H    ILE  37           H        ILE  37  -5.142   9.169   8.280
  296    HA   ILE  37           HA       ILE  37  -3.855   8.796   5.779
  297    HB   ILE  37           HB       ILE  37  -4.805  11.074   5.244
  298   1HG1  ILE  37          1HG1      ILE  37  -6.086  10.776   7.968
  299   2HG1  ILE  37          2HG1      ILE  37  -4.769  11.887   7.609
  300   1HG2  ILE  37          1HG2      ILE  37  -7.188   9.773   6.178
  301   2HG2  ILE  37          2HG2      ILE  37  -6.571   9.932   4.535
  302   3HG2  ILE  37          3HG2      ILE  37  -6.049   8.585   5.546
  303   1HD1  ILE  37          1HD1      ILE  37  -6.338  13.386   7.161
  304   2HD1  ILE  37          2HD1      ILE  37  -6.663  12.470   5.691
  305   3HD1  ILE  37          3HD1      ILE  37  -7.609  12.163   7.147
  306    H    SER  38           H        SER  38  -3.208  10.828   8.564
  307    HA   SER  38           HA       SER  38  -1.318  12.538   7.339
  308   1HB   SER  38          1HB       SER  38  -1.852  11.768  10.203
  309   2HB   SER  38          2HB       SER  38  -0.540  12.864   9.769
  310    HG   SER  38           HG       SER  38  -2.170  14.232  10.040
  311    H    LEU  39           H        LEU  39  -1.150   9.290   8.465
  312    HA   LEU  39           HA       LEU  39   1.666   9.172   8.887
  313   1HB   LEU  39          1HB       LEU  39  -0.395   7.545   9.504
  314   2HB   LEU  39          2HB       LEU  39   0.247   6.713   8.090
  315    HG   LEU  39           HG       LEU  39   2.218   7.462  10.158
  316   1HD1  LEU  39          1HD1      LEU  39   0.321   6.756  11.536
  317   2HD1  LEU  39          2HD1      LEU  39   1.644   5.593  11.599
  318   3HD1  LEU  39          3HD1      LEU  39   0.218   5.253  10.619
  319   1HD2  LEU  39          1HD2      LEU  39   2.244   4.726   9.403
  320   2HD2  LEU  39          2HD2      LEU  39   3.388   5.998   8.973
  321   3HD2  LEU  39          3HD2      LEU  39   1.983   5.692   7.950
  322    H    PHE  40           H        PHE  40  -0.416   8.857   6.118
  323    HA   PHE  40           HA       PHE  40   1.958   8.349   4.449
  324   1HB   PHE  40          1HB       PHE  40  -0.803   7.459   3.653
  325   2HB   PHE  40          2HB       PHE  40   0.752   6.913   3.032
  326    HD1  PHE  40           2HD      PHE  40  -1.640   6.656   5.799
  327    HD2  PHE  40           1HD      PHE  40   2.011   5.214   4.153
  328    HE1  PHE  40           2HE      PHE  40  -1.689   4.758   7.364
  329    HE2  PHE  40           1HE      PHE  40   1.968   3.313   5.715
  330    HZ   PHE  40           HZ       PHE  40   0.116   3.083   7.324
  331    H    ASP  41           H        ASP  41   2.421  10.090   3.294
  332    HA   ASP  41           HA       ASP  41   0.859  12.344   2.978
  333   1HB   ASP  41          1HB       ASP  41   3.373  11.406   2.006
  334   2HB   ASP  41          2HB       ASP  41   2.485  12.101   0.653
  335    H    TYR  42           H        TYR  42   0.815   9.374   1.169
  336    HA   TYR  42           HA       TYR  42  -1.493  10.371  -0.334
  337   1HB   TYR  42          1HB       TYR  42   0.410  10.582  -1.850
  338   2HB   TYR  42          2HB       TYR  42   0.850   8.901  -1.562
  339    HD1  TYR  42           1HD      TYR  42  -2.597  10.158  -2.041
  340    HD2  TYR  42           2HD      TYR  42   0.686   8.087  -3.783
  341    HE1  TYR  42           1HE      TYR  42  -4.034   9.468  -3.914
  342    HE2  TYR  42           2HE      TYR  42  -0.741   7.392  -5.661
  343    HH   TYR  42           HH       TYR  42  -4.132   8.424  -5.873
  344    H    PHE  43           H        PHE  43  -3.156   9.030  -0.158
  345    HA   PHE  43           HA       PHE  43  -2.644   6.161   0.214
  346   1HB   PHE  43          1HB       PHE  43  -3.363   7.685   2.315
  347   2HB   PHE  43          2HB       PHE  43  -4.958   7.307   1.674
  348    HD1  PHE  43           1HD      PHE  43  -3.834   4.539   0.574
  349    HD2  PHE  43           2HD      PHE  43  -3.919   6.467   4.368
  350    HE1  PHE  43           1HE      PHE  43  -3.759   2.345   1.687
  351    HE2  PHE  43           2HE      PHE  43  -3.843   4.277   5.486
  352    HZ   PHE  43           HZ       PHE  43  -3.762   2.213   4.146
  353    H    ILE  44           H        ILE  44  -3.554   5.122  -1.421
  354    HA   ILE  44           HA       ILE  44  -6.250   5.905  -2.273
  355    HB   ILE  44           HB       ILE  44  -4.971   6.899  -3.979
  356   1HG1  ILE  44          1HG1      ILE  44  -5.303   4.326  -5.401
  357   2HG1  ILE  44          2HG1      ILE  44  -6.726   4.912  -4.547
  358   1HG2  ILE  44          1HG2      ILE  44  -2.794   6.144  -3.643
  359   2HG2  ILE  44          2HG2      ILE  44  -3.258   4.449  -3.783
  360   3HG2  ILE  44          3HG2      ILE  44  -3.221   5.473  -5.217
  361   1HD1  ILE  44          1HD1      ILE  44  -5.626   5.761  -7.049
  362   2HD1  ILE  44          2HD1      ILE  44  -7.159   6.194  -6.292
  363   3HD1  ILE  44          3HD1      ILE  44  -5.703   7.119  -5.925
  364    H    VAL  45           H        VAL  45  -7.538   4.213  -2.034
  365    HA   VAL  45           HA       VAL  45  -6.445   1.523  -2.548
  366    HB   VAL  45           HB       VAL  45  -8.741   1.992  -0.673
  367   1HG1  VAL  45          1HG1      VAL  45  -8.684  -0.235  -0.697
  368   2HG1  VAL  45          2HG1      VAL  45  -7.154  -0.254  -1.575
  369   3HG1  VAL  45          3HG1      VAL  45  -7.160  -0.123   0.184
  370   1HG2  VAL  45          1HG2      VAL  45  -7.147   3.346   0.362
  371   2HG2  VAL  45          2HG2      VAL  45  -6.947   1.784   1.155
  372   3HG2  VAL  45          3HG2      VAL  45  -5.812   2.289  -0.097
  373    H    GLY  46           H        GLY  46  -7.626   0.149  -3.803
  374   1HA   GLY  46          1HA       GLY  46 -10.268   1.088  -4.720
  375   2HA   GLY  46          2HA       GLY  46  -9.046   0.590  -5.881
  376    H    GLU  47           H        GLU  47 -11.779  -0.463  -5.146
  377    HA   GLU  47           HA       GLU  47 -11.058  -3.186  -4.326
  378   1HB   GLU  47          1HB       GLU  47 -12.875  -2.137  -3.070
  379   2HB   GLU  47          2HB       GLU  47 -13.765  -1.860  -4.562
  380   1HG   GLU  47          1HG       GLU  47 -14.769  -3.800  -4.226
  381   2HG   GLU  47          2HG       GLU  47 -13.228  -4.586  -4.560
  382    H    GLU  48           H        GLU  48 -11.191  -4.882  -5.679
  383    HA   GLU  48           HA       GLU  48 -12.256  -4.381  -8.381
  384   1HB   GLU  48          1HB       GLU  48  -9.775  -4.632  -8.275
  385   2HB   GLU  48          2HB       GLU  48 -10.005  -6.255  -7.639
  386   1HG   GLU  48          1HG       GLU  48 -11.539  -6.256  -9.921
  387   2HG   GLU  48          2HG       GLU  48 -10.140  -5.284 -10.372
  388    H    GLY  49           H        GLY  49 -14.184  -5.354  -8.482
  389   1HA   GLY  49          1HA       GLY  49 -14.317  -8.219  -8.130
  390   2HA   GLY  49          2HA       GLY  49 -15.277  -7.312  -6.971
  391    H    ASN  50           H        ASN  50 -14.701  -7.544 -10.477
  392    HA   ASN  50           HA       ASN  50 -17.567  -6.989 -10.877
  393   1HB   ASN  50          1HB       ASN  50 -15.398  -5.629 -11.937
  394   2HB   ASN  50          2HB       ASN  50 -15.887  -6.700 -13.247
  395   1HD2  ASN  50          1HD2      ASN  50 -17.212  -4.411 -10.896
  396   2HD2  ASN  50          2HD2      ASN  50 -18.432  -3.776 -11.941
  397    H    GLU  51           H        GLU  51 -16.454  -9.582 -10.289
  398    HA   GLU  51           HA       GLU  51 -17.233 -10.967 -12.762
  399   1HB   GLU  51          1HB       GLU  51 -14.684 -11.088 -11.415
  400   2HB   GLU  51          2HB       GLU  51 -15.450 -12.670 -11.412
  401   1HG   GLU  51          1HG       GLU  51 -15.702 -12.555 -13.838
  402   2HG   GLU  51          2HG       GLU  51 -14.929 -10.971 -13.842
  403    H    GLU  52           H        GLU  52 -19.051 -12.027 -12.367
  404    HA   GLU  52           HA       GLU  52 -19.979 -12.630  -9.755
  405   1HB   GLU  52          1HB       GLU  52 -21.333 -12.233 -11.921
  406   2HB   GLU  52          2HB       GLU  52 -21.029 -13.933 -12.252
  407   1HG   GLU  52          1HG       GLU  52 -22.235 -14.625 -10.353
  408   2HG   GLU  52          2HG       GLU  52 -22.273 -12.992  -9.689
  409    H    GLY  53           H        GLY  53 -20.071 -14.545  -8.637
  410   1HA   GLY  53          1HA       GLY  53 -19.776 -16.852  -8.292
  411   2HA   GLY  53          2HA       GLY  53 -18.974 -16.960  -9.852
  412    H    ARG  54           H        ARG  54 -17.388 -14.479  -8.873
  413    HA   ARG  54           HA       ARG  54 -15.411 -16.038  -7.345
  414   1HB   ARG  54          1HB       ARG  54 -14.793 -15.257  -9.679
  415   2HB   ARG  54          2HB       ARG  54 -14.839 -13.615  -9.048
  416   1HG   ARG  54          1HG       ARG  54 -12.872 -13.829  -7.988
  417   2HG   ARG  54          2HG       ARG  54 -13.194 -15.497  -7.505
  418   1HD   ARG  54          1HD       ARG  54 -12.864 -16.015 -10.029
  419   2HD   ARG  54          2HD       ARG  54 -12.052 -14.450 -10.064
  420    HE   ARG  54           HE       ARG  54 -10.291 -15.366  -8.908
  421   1HH1  ARG  54          1HH1      ARG  54 -13.001 -17.549  -8.830
  422   2HH1  ARG  54          2HH1      ARG  54 -12.092 -18.860  -8.153
  423   1HH2  ARG  54          1HH2      ARG  54  -9.084 -17.084  -8.015
  424   2HH2  ARG  54          2HH2      ARG  54  -9.866 -18.594  -7.689
  425    H    THR  55           H        THR  55 -14.148 -14.906  -5.754
  426    HA   THR  55           HA       THR  55 -15.750 -13.027  -4.252
  427    HB   THR  55           HB       THR  55 -13.406 -13.204  -2.860
  428    HG1  THR  55           1HG      THR  55 -12.762 -15.404  -3.027
  429   1HG2  THR  55          1HG2      THR  55 -14.626 -15.198  -1.708
  430   2HG2  THR  55          2HG2      THR  55 -15.928 -14.814  -2.834
  431   3HG2  THR  55          3HG2      THR  55 -15.366 -13.597  -1.689
  432    HA   PRO  56           HA       PRO  56 -13.741  -9.282  -5.344
  433   1HB   PRO  56          1HB       PRO  56 -13.636  -7.972  -2.968
  434   2HB   PRO  56          2HB       PRO  56 -15.139  -8.216  -3.865
  435   1HG   PRO  56          1HG       PRO  56 -14.056  -9.748  -1.533
  436   2HG   PRO  56          2HG       PRO  56 -15.714  -9.197  -1.837
  437   1HD   PRO  56          1HD       PRO  56 -14.918 -11.746  -2.289
  438   2HD   PRO  56          2HD       PRO  56 -16.167 -10.948  -3.268
  439    H    HIS  57           H        HIS  57 -11.842  -7.907  -4.950
  440    HA   HIS  57           HA       HIS  57  -9.710  -9.168  -3.391
  441   1HB   HIS  57          1HB       HIS  57  -9.284 -10.078  -5.544
  442   2HB   HIS  57          2HB       HIS  57  -9.596  -8.538  -6.339
  443    HD1  HIS  57           1HD      HIS  57  -7.588  -7.201  -6.898
  444    HD2  HIS  57           2HD      HIS  57  -6.829  -9.956  -3.882
  445    HE1  HIS  57           1HE      HIS  57  -5.121  -7.032  -6.438
  446    H    LEU  58           H        LEU  58  -8.298  -7.754  -2.471
  447    HA   LEU  58           HA       LEU  58  -8.947  -4.919  -2.753
  448   1HB   LEU  58          1HB       LEU  58  -8.440  -6.497  -0.563
  449   2HB   LEU  58          2HB       LEU  58  -6.912  -5.650  -0.791
  450    HG   LEU  58           HG       LEU  58  -9.621  -4.421  -0.299
  451   1HD1  LEU  58          1HD1      LEU  58  -7.090  -4.596   1.318
  452   2HD1  LEU  58          2HD1      LEU  58  -8.678  -5.247   1.720
  453   3HD1  LEU  58          3HD1      LEU  58  -8.420  -3.502   1.698
  454   1HD2  LEU  58          1HD2      LEU  58  -7.898  -2.363  -0.123
  455   2HD2  LEU  58          2HD2      LEU  58  -8.802  -2.758  -1.587
  456   3HD2  LEU  58          3HD2      LEU  58  -7.131  -3.297  -1.409
  457    H    GLN  59           H        GLN  59  -7.611  -3.453  -3.631
  458    HA   GLN  59           HA       GLN  59  -4.787  -4.016  -3.962
  459   1HB   GLN  59          1HB       GLN  59  -5.553  -5.058  -5.957
  460   2HB   GLN  59          2HB       GLN  59  -6.675  -3.748  -6.296
  461   1HG   GLN  59          1HG       GLN  59  -4.807  -3.602  -7.788
  462   2HG   GLN  59          2HG       GLN  59  -4.763  -2.242  -6.667
  463   1HE2  GLN  59          1HE2      GLN  59  -3.197  -2.215  -5.026
  464   2HE2  GLN  59          2HE2      GLN  59  -1.761  -3.170  -5.134
  465    H    GLY  60           H        GLY  60  -3.895  -2.222  -3.189
  466   1HA   GLY  60          1HA       GLY  60  -4.659   0.346  -4.334
  467   2HA   GLY  60          2HA       GLY  60  -4.882   0.180  -2.598
  468    H    PHE  61           H        PHE  61  -3.279   2.145  -3.291
  469    HA   PHE  61           HA       PHE  61  -0.599   1.117  -2.655
  470   1HB   PHE  61          1HB       PHE  61  -0.389   1.677  -4.942
  471   2HB   PHE  61          2HB       PHE  61  -1.351   3.140  -4.756
  472    HD1  PHE  61           2HD      PHE  61   1.691   1.736  -3.102
  473    HD2  PHE  61           1HD      PHE  61  -0.131   5.049  -5.057
  474    HE1  PHE  61           2HE      PHE  61   3.750   3.045  -2.796
  475    HE2  PHE  61           1HE      PHE  61   1.926   6.364  -4.754
  476    HZ   PHE  61           HZ       PHE  61   3.870   5.362  -3.622
  477    H    ALA  62           H        ALA  62   0.560   2.280  -1.178
  478    HA   ALA  62           HA       ALA  62  -0.597   4.796  -0.198
  479   1HB   ALA  62          1HB       ALA  62   0.352   3.636   2.100
  480   2HB   ALA  62          2HB       ALA  62  -1.341   3.711   1.609
  481   3HB   ALA  62          3HB       ALA  62  -0.382   2.275   1.251
  482    H    ASN  63           H        ASN  63   0.872   6.358  -0.050
  483    HA   ASN  63           HA       ASN  63   3.692   5.673  -0.311
  484   1HB   ASN  63          1HB       ASN  63   2.704   7.413  -1.776
  485   2HB   ASN  63          2HB       ASN  63   2.354   8.387  -0.352
  486   1HD2  ASN  63          1HD2      ASN  63   4.300   8.338  -2.830
  487   2HD2  ASN  63          2HD2      ASN  63   5.770   8.926  -2.137
  488    H    PHE  64           H        PHE  64   4.842   5.367   1.470
  489    HA   PHE  64           HA       PHE  64   4.000   6.238   4.042
  490   1HB   PHE  64          1HB       PHE  64   6.100   4.573   2.936
  491   2HB   PHE  64          2HB       PHE  64   6.713   5.594   4.233
  492    HD1  PHE  64           2HD      PHE  64   5.579   5.512   6.476
  493    HD2  PHE  64           1HD      PHE  64   4.798   2.682   3.394
  494    HE1  PHE  64           2HE      PHE  64   4.639   3.965   8.140
  495    HE2  PHE  64           1HE      PHE  64   3.854   1.130   5.053
  496    HZ   PHE  64           HZ       PHE  64   3.775   1.770   7.431
  497    H    VAL  65           H        VAL  65   4.403   8.074   5.095
  498    HA   VAL  65           HA       VAL  65   5.545  10.303   3.838
  499    HB   VAL  65           HB       VAL  65   4.987   9.789   6.759
  500   1HG1  VAL  65          1HG1      VAL  65   6.195  12.120   5.380
  501   2HG1  VAL  65          2HG1      VAL  65   5.012  12.443   6.649
  502   3HG1  VAL  65          3HG1      VAL  65   6.461  11.504   7.011
  503   1HG2  VAL  65          1HG2      VAL  65   3.491  11.546   4.827
  504   2HG2  VAL  65          2HG2      VAL  65   3.079   9.853   5.102
  505   3HG2  VAL  65          3HG2      VAL  65   2.985  11.010   6.429
  506    H    LYS  66           H        LYS  66   6.957   7.759   5.712
  507    HA   LYS  66           HA       LYS  66   9.566   9.113   5.529
  508   1HB   LYS  66          1HB       LYS  66  10.173   7.802   7.619
  509   2HB   LYS  66          2HB       LYS  66   9.059   9.145   7.838
  510   1HG   LYS  66          1HG       LYS  66   7.846   6.500   7.347
  511   2HG   LYS  66          2HG       LYS  66   8.667   6.723   8.893
  512   1HD   LYS  66          1HD       LYS  66   6.821   8.868   7.997
  513   2HD   LYS  66          2HD       LYS  66   6.103   7.348   8.536
  514   1HE   LYS  66          1HE       LYS  66   6.957   7.566  10.687
  515   2HE   LYS  66          2HE       LYS  66   8.201   8.708  10.183
  516   1HZ   LYS  66          1HZ       LYS  66   5.287   9.272  10.294
  517   2HZ   LYS  66          2HZ       LYS  66   6.486  10.368   9.822
  518   3HZ   LYS  66          3HZ       LYS  66   6.436   9.803  11.416
  519    H    LYS  67           H        LYS  67  11.277   7.185   6.185
  520    HA   LYS  67           HA       LYS  67  10.977   5.293   3.996
  521   1HB   LYS  67          1HB       LYS  67  13.282   6.071   5.772
  522   2HB   LYS  67          2HB       LYS  67  13.375   4.696   4.681
  523   1HG   LYS  67          1HG       LYS  67  12.562   7.367   3.629
  524   2HG   LYS  67          2HG       LYS  67  14.266   7.017   3.932
  525   1HD   LYS  67          1HD       LYS  67  13.229   4.787   2.567
  526   2HD   LYS  67          2HD       LYS  67  12.609   6.213   1.731
  527   1HE   LYS  67          1HE       LYS  67  15.171   6.954   2.086
  528   2HE   LYS  67          2HE       LYS  67  15.374   5.206   1.987
  529   1HZ   LYS  67          1HZ       LYS  67  15.258   6.837  -0.133
  530   2HZ   LYS  67          2HZ       LYS  67  13.644   6.346  -0.030
  531   3HZ   LYS  67          3HZ       LYS  67  14.870   5.191  -0.182
  532    H    GLN  68           H        GLN  68  10.288   3.283   4.278
  533    HA   GLN  68           HA       GLN  68  10.752   1.962   6.857
  534   1HB   GLN  68          1HB       GLN  68   8.131   1.988   5.350
  535   2HB   GLN  68          2HB       GLN  68   8.474   0.998   6.763
  536   1HG   GLN  68          1HG       GLN  68   8.488   4.007   6.704
  537   2HG   GLN  68          2HG       GLN  68   7.171   3.001   7.305
  538   1HE2  GLN  68          1HE2      GLN  68   8.056   4.754   9.031
  539   2HE2  GLN  68          2HE2      GLN  68   9.059   4.038  10.241
  540    H    THR  69           H        THR  69  10.781  -0.341   6.773
  541    HA   THR  69           HA       THR  69  11.660  -1.338   4.173
  542    HB   THR  69           HB       THR  69  12.733  -3.106   5.295
  543    HG1  THR  69           1HG      THR  69  12.249  -3.654   7.449
  544   1HG2  THR  69          1HG2      THR  69  13.847  -0.970   5.673
  545   2HG2  THR  69          2HG2      THR  69  14.037  -2.019   7.079
  546   3HG2  THR  69          3HG2      THR  69  12.869  -0.699   7.114
  547    H    PHE  70           H        PHE  70  11.103  -3.733   3.772
  548    HA   PHE  70           HA       PHE  70   8.336  -3.937   3.344
  549   1HB   PHE  70          1HB       PHE  70   9.609  -5.197   1.859
  550   2HB   PHE  70          2HB       PHE  70  10.630  -5.854   3.135
  551    HD1  PHE  70           1HD      PHE  70   7.204  -5.990   1.724
  552    HD2  PHE  70           2HD      PHE  70  10.172  -7.939   4.071
  553    HE1  PHE  70           1HE      PHE  70   5.828  -8.029   1.766
  554    HE2  PHE  70           2HE      PHE  70   8.801  -9.981   4.116
  555    HZ   PHE  70           HZ       PHE  70   6.626 -10.028   2.962
  556    H    ASN  71           H        ASN  71  10.413  -5.727   5.622
  557    HA   ASN  71           HA       ASN  71   8.345  -7.129   6.895
  558   1HB   ASN  71          1HB       ASN  71  11.137  -6.955   7.129
  559   2HB   ASN  71          2HB       ASN  71  10.509  -6.526   8.717
  560   1HD2  ASN  71          1HD2      ASN  71  11.649  -9.004   7.021
  561   2HD2  ASN  71          2HD2      ASN  71  10.785 -10.315   7.744
  562    H    LYS  72           H        LYS  72   9.840  -4.007   7.626
  563    HA   LYS  72           HA       LYS  72   8.471  -3.536  10.047
  564   1HB   LYS  72          1HB       LYS  72  10.505  -2.304   8.849
  565   2HB   LYS  72          2HB       LYS  72   9.215  -1.246   8.291
  566   1HG   LYS  72          1HG       LYS  72   9.930  -1.861  11.151
  567   2HG   LYS  72          2HG       LYS  72  10.191  -0.341  10.291
  568   1HD   LYS  72          1HD       LYS  72   7.718  -0.178   9.984
  569   2HD   LYS  72          2HD       LYS  72   7.547  -1.594  11.024
  570   1HE   LYS  72          1HE       LYS  72   8.858   1.006  11.812
  571   2HE   LYS  72          2HE       LYS  72   7.220   0.520  12.245
  572   1HZ   LYS  72          1HZ       LYS  72   9.112   0.124  13.914
  573   2HZ   LYS  72          2HZ       LYS  72   9.517  -1.194  12.934
  574   3HZ   LYS  72          3HZ       LYS  72   7.990  -1.117  13.660
  575    H    VAL  73           H        VAL  73   7.793  -2.459   6.724
  576    HA   VAL  73           HA       VAL  73   5.518  -0.958   7.210
  577    HB   VAL  73           HB       VAL  73   6.286  -2.628   4.824
  578   1HG1  VAL  73          1HG1      VAL  73   3.920  -2.558   4.710
  579   2HG1  VAL  73          2HG1      VAL  73   3.878  -0.863   5.199
  580   3HG1  VAL  73          3HG1      VAL  73   4.510  -1.310   3.613
  581   1HG2  VAL  73          1HG2      VAL  73   7.122  -0.690   3.910
  582   2HG2  VAL  73          2HG2      VAL  73   6.074   0.348   4.876
  583   3HG2  VAL  73          3HG2      VAL  73   7.471  -0.431   5.619
  584    H    LYS  74           H        LYS  74   5.941  -4.396   7.253
  585    HA   LYS  74           HA       LYS  74   3.261  -5.190   6.878
  586   1HB   LYS  74          1HB       LYS  74   5.426  -6.570   8.476
  587   2HB   LYS  74          2HB       LYS  74   3.945  -7.314   7.889
  588   1HG   LYS  74          1HG       LYS  74   5.030  -6.288   5.597
  589   2HG   LYS  74          2HG       LYS  74   6.456  -6.787   6.507
  590   1HD   LYS  74          1HD       LYS  74   6.053  -8.826   5.669
  591   2HD   LYS  74          2HD       LYS  74   4.758  -8.908   6.865
  592   1HE   LYS  74          1HE       LYS  74   3.135  -8.215   5.273
  593   2HE   LYS  74          2HE       LYS  74   4.376  -7.784   4.098
  594   1HZ   LYS  74          1HZ       LYS  74   4.992 -10.165   4.027
  595   2HZ   LYS  74          2HZ       LYS  74   3.422  -9.863   3.474
  596   3HZ   LYS  74          3HZ       LYS  74   3.665 -10.516   5.016
  597    H    TRP  75           H        TRP  75   4.712  -3.494   9.397
  598    HA   TRP  75           HA       TRP  75   3.228  -4.496  11.602
  599   1HB   TRP  75          1HB       TRP  75   4.127  -2.706  12.839
  600   2HB   TRP  75          2HB       TRP  75   5.365  -3.071  11.639
  601    HD1  TRP  75           HD       TRP  75   4.139  -1.467   9.178
  602    HE1  TRP  75           1HE      TRP  75   4.171   1.107   9.207
  603    HE3  TRP  75           3HE      TRP  75   4.609  -0.717  14.212
  604    HZ2  TRP  75           2HZ      TRP  75   4.371   3.181  11.111
  605    HZ3  TRP  75           3HZ      TRP  75   4.714   1.592  15.056
  606    HH2  TRP  75           HH       TRP  75   4.597   3.500  13.536
  607    H    TYR  76           H        TYR  76   2.448  -2.426   8.986
  608    HA   TYR  76           HA       TYR  76  -0.013  -1.563  10.357
  609   1HB   TYR  76          1HB       TYR  76   1.852  -0.175   8.579
  610   2HB   TYR  76          2HB       TYR  76   0.169  -0.002   8.092
  611    HD1  TYR  76           2HD      TYR  76  -1.150   0.003  10.763
  612    HD2  TYR  76           1HD      TYR  76   2.384   1.949   9.409
  613    HE1  TYR  76           2HE      TYR  76  -1.465   1.749  12.467
  614    HE2  TYR  76           1HE      TYR  76   2.079   3.699  11.108
  615    HH   TYR  76           HH       TYR  76   0.194   3.419  13.718
  616    H    LEU  77           H        LEU  77   1.249  -2.524   7.170
  617    HA   LEU  77           HA       LEU  77  -1.343  -2.995   6.071
  618   1HB   LEU  77          1HB       LEU  77   1.434  -3.723   5.179
  619   2HB   LEU  77          2HB       LEU  77  -0.004  -4.170   4.264
  620    HG   LEU  77           HG       LEU  77   0.754  -1.326   4.918
  621   1HD1  LEU  77          1HD1      LEU  77   1.756  -1.114   2.825
  622   2HD1  LEU  77          2HD1      LEU  77   1.088  -2.638   2.244
  623   3HD1  LEU  77          3HD1      LEU  77   2.381  -2.644   3.442
  624   1HD2  LEU  77          1HD2      LEU  77  -0.832  -0.858   3.050
  625   2HD2  LEU  77          2HD2      LEU  77  -1.587  -1.552   4.485
  626   3HD2  LEU  77          3HD2      LEU  77  -1.281  -2.563   3.072
  627    H    GLY  78           H        GLY  78   0.584  -4.728   8.218
  628   1HA   GLY  78          1HA       GLY  78   0.301  -6.795   9.186
  629   2HA   GLY  78          2HA       GLY  78  -1.232  -6.906   8.332
  630    H    ALA  79           H        ALA  79   0.639  -9.033   8.782
  631    HA   ALA  79           HA       ALA  79   2.094  -9.524   6.364
  632   1HB   ALA  79          1HB       ALA  79   1.739 -11.964   7.675
  633   2HB   ALA  79          2HB       ALA  79   3.135 -10.890   7.771
  634   3HB   ALA  79          3HB       ALA  79   1.834 -10.753   8.953
  635    H    ARG  80           H        ARG  80  -1.112 -10.205   7.526
  636    HA   ARG  80           HA       ARG  80  -1.862 -12.350   5.948
  637   1HB   ARG  80          1HB       ARG  80  -3.565  -9.958   6.671
  638   2HB   ARG  80          2HB       ARG  80  -4.158 -11.538   6.175
  639   1HG   ARG  80          1HG       ARG  80  -2.418 -11.951   8.359
  640   2HG   ARG  80          2HG       ARG  80  -3.489 -10.613   8.780
  641   1HD   ARG  80          1HD       ARG  80  -4.491 -12.699   9.470
  642   2HD   ARG  80          2HD       ARG  80  -5.424 -12.006   8.145
  643    HE   ARG  80           HE       ARG  80  -3.647 -13.712   6.947
  644   1HH1  ARG  80          1HH1      ARG  80  -6.119 -13.994   9.382
  645   2HH1  ARG  80          2HH1      ARG  80  -6.501 -15.637   8.990
  646   1HH2  ARG  80          1HH2      ARG  80  -4.140 -15.877   6.423
  647   2HH2  ARG  80          2HH2      ARG  80  -5.373 -16.708   7.308
  648    H    CYS  81           H        CYS  81  -1.808  -8.905   5.132
  649    HA   CYS  81           HA       CYS  81  -2.663  -9.488   2.408
  650   1HB   CYS  81          1HB       CYS  81  -1.918  -6.786   3.520
  651   2HB   CYS  81          2HB       CYS  81  -2.928  -7.143   2.125
  652    HG   CYS  81           HG       CYS  81  -3.763  -6.867   5.330
  653    H    HIS  82           H        HIS  82  -1.333  -9.614   0.713
  654    HA   HIS  82           HA       HIS  82   1.494  -9.605   1.115
  655   1HB   HIS  82          1HB       HIS  82   0.115 -11.036  -0.531
  656   2HB   HIS  82          2HB       HIS  82   0.154  -9.621  -1.579
  657    HD1  HIS  82           1HD      HIS  82   2.555 -11.997   0.147
  658    HD2  HIS  82           2HD      HIS  82   2.403  -9.406  -3.098
  659    HE1  HIS  82           1HE      HIS  82   4.716 -12.345  -1.092
  660    H    ILE  83           H        ILE  83   2.879  -7.974   0.920
  661    HA   ILE  83           HA       ILE  83   1.957  -5.517  -0.419
  662    HB   ILE  83           HB       ILE  83   3.456  -4.256   1.017
  663   1HG1  ILE  83          1HG1      ILE  83   4.104  -6.928   2.283
  664   2HG1  ILE  83          2HG1      ILE  83   5.200  -5.958   1.306
  665   1HG2  ILE  83          1HG2      ILE  83   1.197  -4.611   1.807
  666   2HG2  ILE  83          2HG2      ILE  83   1.669  -6.137   2.553
  667   3HG2  ILE  83          3HG2      ILE  83   2.316  -4.617   3.171
  668   1HD1  ILE  83          1HD1      ILE  83   5.702  -5.710   3.655
  669   2HD1  ILE  83          2HD1      ILE  83   5.110  -4.186   2.994
  670   3HD1  ILE  83          3HD1      ILE  83   4.047  -5.193   3.977
  671    H    GLU  84           H        GLU  84   3.410  -4.367  -1.725
  672    HA   GLU  84           HA       GLU  84   6.015  -5.531  -2.282
  673   1HB   GLU  84          1HB       GLU  84   3.774  -6.148  -3.892
  674   2HB   GLU  84          2HB       GLU  84   4.757  -5.018  -4.812
  675   1HG   GLU  84          1HG       GLU  84   6.725  -6.535  -4.264
  676   2HG   GLU  84          2HG       GLU  84   5.521  -7.713  -3.744
  677    H    LYS  85           H        LYS  85   7.262  -4.176  -3.840
  678    HA   LYS  85           HA       LYS  85   6.981  -1.410  -3.126
  679   1HB   LYS  85          1HB       LYS  85   8.944  -2.935  -4.827
  680   2HB   LYS  85          2HB       LYS  85   8.995  -1.181  -4.702
  681   1HG   LYS  85          1HG       LYS  85   9.279  -1.376  -2.272
  682   2HG   LYS  85          2HG       LYS  85   9.269  -3.135  -2.426
  683   1HD   LYS  85          1HD       LYS  85  11.187  -1.644  -4.124
  684   2HD   LYS  85          2HD       LYS  85  11.520  -1.691  -2.391
  685   1HE   LYS  85          1HE       LYS  85  11.725  -4.012  -2.371
  686   2HE   LYS  85          2HE       LYS  85  10.852  -4.197  -3.892
  687   1HZ   LYS  85          1HZ       LYS  85  13.655  -3.508  -3.429
  688   2HZ   LYS  85          2HZ       LYS  85  12.893  -2.813  -4.769
  689   3HZ   LYS  85          3HZ       LYS  85  12.968  -4.497  -4.618
  690    H    ALA  86           H        ALA  86   6.155   0.223  -4.292
  691    HA   ALA  86           HA       ALA  86   4.837  -0.432  -6.804
  692   1HB   ALA  86          1HB       ALA  86   3.294   0.986  -6.082
  693   2HB   ALA  86          2HB       ALA  86   4.266   1.299  -4.643
  694   3HB   ALA  86          3HB       ALA  86   4.472   2.299  -6.081
  695    H    LYS  87           H        LYS  87   5.006   0.993  -8.663
  696    HA   LYS  87           HA       LYS  87   7.392   2.657  -8.821
  697   1HB   LYS  87          1HB       LYS  87   8.372   1.517 -10.656
  698   2HB   LYS  87          2HB       LYS  87   8.024   0.286  -9.449
  699   1HG   LYS  87          1HG       LYS  87   5.751   0.193 -10.891
  700   2HG   LYS  87          2HG       LYS  87   6.903   0.671 -12.140
  701   1HD   LYS  87          1HD       LYS  87   8.178  -1.265 -11.872
  702   2HD   LYS  87          2HD       LYS  87   7.497  -1.604 -10.279
  703   1HE   LYS  87          1HE       LYS  87   5.483  -2.377 -11.177
  704   2HE   LYS  87          2HE       LYS  87   5.780  -1.610 -12.737
  705   1HZ   LYS  87          1HZ       LYS  87   6.129  -4.171 -12.385
  706   2HZ   LYS  87          2HZ       LYS  87   7.651  -3.673 -11.841
  707   3HZ   LYS  87          3HZ       LYS  87   7.144  -3.284 -13.407
  708    H    GLY  88           H        GLY  88   7.270   4.265 -10.358
  709   1HA   GLY  88          1HA       GLY  88   6.254   4.966 -12.521
  710   2HA   GLY  88          2HA       GLY  88   4.731   4.379 -11.869
  711    H    THR  89           H        THR  89   4.426   6.772 -12.687
  712    HA   THR  89           HA       THR  89   5.195   8.756 -10.718
  713    HB   THR  89           HB       THR  89   4.147  10.385 -12.146
  714    HG1  THR  89           1HG      THR  89   2.998   9.661 -14.035
  715   1HG2  THR  89          1HG2      THR  89   5.281   9.878 -14.336
  716   2HG2  THR  89          2HG2      THR  89   5.684   8.292 -13.679
  717   3HG2  THR  89          3HG2      THR  89   6.316   9.750 -12.914
  718    H    ASP  90           H        ASP  90   3.344  10.355 -10.106
  719    HA   ASP  90           HA       ASP  90   1.649   9.094  -8.309
  720   1HB   ASP  90          1HB       ASP  90   0.567  11.228  -8.018
  721   2HB   ASP  90          2HB       ASP  90   2.288  11.511  -8.270
  722    H    GLN  91           H        GLN  91   1.031  10.135 -11.627
  723    HA   GLN  91           HA       GLN  91  -1.742   9.513 -11.605
  724   1HB   GLN  91          1HB       GLN  91   0.282  10.159 -13.698
  725   2HB   GLN  91          2HB       GLN  91  -1.234   9.429 -14.206
  726   1HG   GLN  91          1HG       GLN  91  -0.890  12.006 -12.692
  727   2HG   GLN  91          2HG       GLN  91  -1.392  11.818 -14.372
  728   1HE2  GLN  91          1HE2      GLN  91  -3.435  10.780 -14.781
  729   2HE2  GLN  91          2HE2      GLN  91  -4.704  10.898 -13.615
  730    H    GLN  92           H        GLN  92   1.164   7.714 -12.421
  731    HA   GLN  92           HA       GLN  92  -0.079   5.512 -13.659
  732   1HB   GLN  92          1HB       GLN  92   2.576   6.088 -12.487
  733   2HB   GLN  92          2HB       GLN  92   2.136   4.389 -12.598
  734   1HG   GLN  92          1HG       GLN  92   1.455   5.397 -15.073
  735   2HG   GLN  92          2HG       GLN  92   2.950   6.241 -14.672
  736   1HE2  GLN  92          1HE2      GLN  92   4.840   5.173 -14.775
  737   2HE2  GLN  92          2HE2      GLN  92   5.001   3.507 -15.198
  738    H    ASN  93           H        ASN  93   0.743   6.178 -10.286
  739    HA   ASN  93           HA       ASN  93  -0.149   3.614  -9.356
  740   1HB   ASN  93          1HB       ASN  93   0.719   6.158  -8.009
  741   2HB   ASN  93          2HB       ASN  93   0.007   4.844  -7.077
  742   1HD2  ASN  93          1HD2      ASN  93   2.182   4.749  -9.862
  743   2HD2  ASN  93          2HD2      ASN  93   3.456   3.902  -9.059
  744    H    LYS  94           H        LYS  94  -1.448   6.915  -9.287
  745    HA   LYS  94           HA       LYS  94  -3.798   6.338  -7.862
  746   1HB   LYS  94          1HB       LYS  94  -2.952   8.622  -8.224
  747   2HB   LYS  94          2HB       LYS  94  -3.324   8.486  -9.937
  748   1HG   LYS  94          1HG       LYS  94  -5.693   8.285  -9.424
  749   2HG   LYS  94          2HG       LYS  94  -5.336   8.379  -7.698
  750   1HD   LYS  94          1HD       LYS  94  -4.818  10.619  -7.791
  751   2HD   LYS  94          2HD       LYS  94  -4.370  10.554  -9.497
  752   1HE   LYS  94          1HE       LYS  94  -6.566  10.668 -10.210
  753   2HE   LYS  94          2HE       LYS  94  -7.201  10.046  -8.687
  754   1HZ   LYS  94          1HZ       LYS  94  -5.860  12.672  -8.812
  755   2HZ   LYS  94          2HZ       LYS  94  -6.952  12.095  -7.657
  756   3HZ   LYS  94          3HZ       LYS  94  -7.500  12.516  -9.202
  757    H    GLU  95           H        GLU  95  -3.131   6.388 -11.344
  758    HA   GLU  95           HA       GLU  95  -5.798   5.756 -12.113
  759   1HB   GLU  95          1HB       GLU  95  -3.169   5.576 -13.586
  760   2HB   GLU  95          2HB       GLU  95  -4.720   5.211 -14.331
  761   1HG   GLU  95          1HG       GLU  95  -4.848   7.757 -13.029
  762   2HG   GLU  95          2HG       GLU  95  -3.456   7.701 -14.110
  763    H    TYR  96           H        TYR  96  -2.894   3.860 -11.499
  764    HA   TYR  96           HA       TYR  96  -3.725   1.400 -12.500
  765   1HB   TYR  96          1HB       TYR  96  -1.438   1.735 -11.810
  766   2HB   TYR  96          2HB       TYR  96  -1.935   2.035 -10.148
  767    HD1  TYR  96           1HD      TYR  96  -2.717   0.176  -8.732
  768    HD2  TYR  96           2HD      TYR  96  -1.235  -0.498 -12.663
  769    HE1  TYR  96           1HE      TYR  96  -2.455  -2.215  -8.218
  770    HE2  TYR  96           2HE      TYR  96  -0.971  -2.891 -12.160
  771    HH   TYR  96           HH       TYR  96  -1.140  -4.478 -10.620
  772    H    CYS  97           H        CYS  97  -4.174   2.783  -9.261
  773    HA   CYS  97           HA       CYS  97  -5.555   0.546  -8.202
  774   1HB   CYS  97          1HB       CYS  97  -5.606   3.437  -7.313
  775   2HB   CYS  97          2HB       CYS  97  -6.191   2.070  -6.371
  776    HG   CYS  97           HG       CYS  97  -3.090   1.484  -7.267
  777    H    SER  98           H        SER  98  -6.574   3.443  -9.898
  778    HA   SER  98           HA       SER  98  -9.375   3.005  -9.423
  779   1HB   SER  98          1HB       SER  98  -8.336   5.267  -9.821
  780   2HB   SER  98          2HB       SER  98  -8.115   4.799 -11.507
  781    HG   SER  98           HG       SER  98 -10.101   6.001 -10.946
  782    H    LYS  99           H        LYS  99  -7.088   1.676 -11.508
  783    HA   LYS  99           HA       LYS  99  -8.499   1.292 -13.881
  784   1HB   LYS  99          1HB       LYS  99  -6.113   0.782 -13.637
  785   2HB   LYS  99          2HB       LYS  99  -6.500  -0.553 -12.561
  786   1HG   LYS  99          1HG       LYS  99  -7.716  -1.645 -14.412
  787   2HG   LYS  99          2HG       LYS  99  -7.207  -0.335 -15.479
  788   1HD   LYS  99          1HD       LYS  99  -5.737  -2.243 -15.748
  789   2HD   LYS  99          2HD       LYS  99  -4.854  -0.903 -15.015
  790   1HE   LYS  99          1HE       LYS  99  -4.650  -1.961 -13.003
  791   2HE   LYS  99          2HE       LYS  99  -6.154  -2.860 -13.199
  792   1HZ   LYS  99          1HZ       LYS  99  -4.250  -4.326 -13.323
  793   2HZ   LYS  99          2HZ       LYS  99  -3.595  -3.427 -14.596
  794   3HZ   LYS  99          3HZ       LYS  99  -5.039  -4.278 -14.818
  795    H    GLU 100           H        GLU 100  -8.946  -0.116 -10.774
  796    HA   GLU 100           HA       GLU 100 -10.289  -2.486 -11.622
  797   1HB   GLU 100          1HB       GLU 100 -10.477  -1.065  -8.960
  798   2HB   GLU 100          2HB       GLU 100 -10.932  -2.731  -9.290
  799   1HG   GLU 100          1HG       GLU 100  -8.724  -3.424  -9.512
  800   2HG   GLU 100          2HG       GLU 100  -8.135  -1.779  -9.754
  801    H    GLY 101           H        GLY 101 -11.188   0.801 -11.397
  802   1HA   GLY 101          1HA       GLY 101 -13.158   1.771 -12.164
  803   2HA   GLY 101          2HA       GLY 101 -13.865   0.167 -12.296
  804    H    ASN 102           H        ASN 102 -12.604   0.185  -9.310
  805    HA   ASN 102           HA       ASN 102 -14.914   1.503  -8.064
  806   1HB   ASN 102          1HB       ASN 102 -14.628  -1.270  -8.283
  807   2HB   ASN 102          2HB       ASN 102 -14.148  -0.898  -6.630
  808   1HD2  ASN 102          1HD2      ASN 102 -15.814  -1.407  -5.396
  809   2HD2  ASN 102          2HD2      ASN 102 -17.446  -0.902  -5.647
  810    H    LEU 103           H        LEU 103 -14.310   2.862  -6.519
  811    HA   LEU 103           HA       LEU 103 -11.597   2.650  -5.437
  812   1HB   LEU 103          1HB       LEU 103 -13.294   4.814  -6.210
  813   2HB   LEU 103          2HB       LEU 103 -12.885   4.986  -4.505
  814    HG   LEU 103           HG       LEU 103 -11.383   6.214  -6.079
  815   1HD1  LEU 103          1HD1      LEU 103  -9.330   4.663  -5.002
  816   2HD1  LEU 103          2HD1      LEU 103 -10.681   4.489  -3.882
  817   3HD1  LEU 103          3HD1      LEU 103 -10.075   6.095  -4.290
  818   1HD2  LEU 103          1HD2      LEU 103 -10.314   5.215  -7.763
  819   2HD2  LEU 103          2HD2      LEU 103 -11.423   3.866  -7.518
  820   3HD2  LEU 103          3HD2      LEU 103  -9.831   3.849  -6.759
  821    H    LEU 104           H        LEU 104 -11.200   2.135  -3.373
  822    HA   LEU 104           HA       LEU 104 -13.498   1.643  -1.624
  823   1HB   LEU 104          1HB       LEU 104 -11.804  -0.157  -2.131
  824   2HB   LEU 104          2HB       LEU 104 -10.645   0.786  -1.196
  825    HG   LEU 104           HG       LEU 104 -12.064   0.526   0.796
  826   1HD1  LEU 104          1HD1      LEU 104 -14.176  -0.129   0.662
  827   2HD1  LEU 104          2HD1      LEU 104 -13.693  -1.644  -0.101
  828   3HD1  LEU 104          3HD1      LEU 104 -14.012  -0.221  -1.093
  829   1HD2  LEU 104          1HD2      LEU 104 -10.241  -1.081   0.226
  830   2HD2  LEU 104          2HD2      LEU 104 -11.463  -2.134  -0.488
  831   3HD2  LEU 104          3HD2      LEU 104 -11.519  -1.759   1.235
  832    H    MET 105           H        MET 105 -10.644   3.597  -1.947
  833    HA   MET 105           HA       MET 105 -11.518   5.322   0.175
  834   1HB   MET 105          1HB       MET 105 -10.403   3.928   1.671
  835   2HB   MET 105          2HB       MET 105  -9.128   3.546   0.521
  836   1HG   MET 105          1HG       MET 105  -7.904   5.352   1.069
  837   2HG   MET 105          2HG       MET 105  -9.320   6.369   1.327
  838   1HE   MET 105          1HE       MET 105  -7.250   3.317   3.428
  839   2HE   MET 105          2HE       MET 105  -6.523   4.644   2.523
  840   3HE   MET 105          3HE       MET 105  -6.588   4.709   4.284
  841    H    GLU 106           H        GLU 106 -10.830   7.377  -0.141
  842    HA   GLU 106           HA       GLU 106  -8.625   7.826  -2.031
  843   1HB   GLU 106          1HB       GLU 106 -11.108   8.070  -2.922
  844   2HB   GLU 106          2HB       GLU 106 -10.995   9.635  -2.129
  845   1HG   GLU 106          1HG       GLU 106  -8.708   9.696  -3.501
  846   2HG   GLU 106          2HG       GLU 106  -9.640   8.631  -4.551
  847    H    CYS 107           H        CYS 107  -7.128   8.738  -0.766
  848    HA   CYS 107           HA       CYS 107  -7.737  11.275   0.488
  849   1HB   CYS 107          1HB       CYS 107  -7.078   8.804   2.031
  850   2HB   CYS 107          2HB       CYS 107  -6.429  10.341   2.591
  851    HG   CYS 107           HG       CYS 107  -9.152  11.459   2.523
  852    H    GLY 108           H        GLY 108  -5.593  12.063   1.646
  853   1HA   GLY 108          1HA       GLY 108  -3.346  12.566   1.484
  854   2HA   GLY 108          2HA       GLY 108  -3.137  11.103   0.531
  855    H    ALA 109           H        ALA 109  -1.609  12.899  -0.405
  856    HA   ALA 109           HA       ALA 109  -3.054  14.349  -2.523
  857   1HB   ALA 109          1HB       ALA 109  -1.877  16.080  -1.751
  858   2HB   ALA 109          2HB       ALA 109  -0.786  15.042  -0.833
  859   3HB   ALA 109          3HB       ALA 109  -0.489  15.335  -2.546
  860    HA   PRO 110           HA       PRO 110  -1.229  11.933  -5.699
  861   1HB   PRO 110          1HB       PRO 110  -0.694  13.789  -7.607
  862   2HB   PRO 110          2HB       PRO 110  -2.335  13.262  -7.212
  863   1HG   PRO 110          1HG       PRO 110  -0.868  15.716  -6.326
  864   2HG   PRO 110          2HG       PRO 110  -2.549  15.552  -6.866
  865   1HD   PRO 110          1HD       PRO 110  -1.868  15.713  -4.251
  866   2HD   PRO 110          2HD       PRO 110  -3.263  14.772  -4.817
  867    H    ARG 111           H        ARG 111   0.677  11.496  -4.306
  868    HA   ARG 111           HA       ARG 111   3.032  13.079  -4.541
  869   1HB   ARG 111          1HB       ARG 111   2.324  10.444  -3.367
  870   2HB   ARG 111          2HB       ARG 111   4.020  10.717  -3.747
  871   1HG   ARG 111          1HG       ARG 111   2.324  12.491  -2.002
  872   2HG   ARG 111          2HG       ARG 111   3.469  11.279  -1.425
  873   1HD   ARG 111          1HD       ARG 111   4.057  13.791  -2.978
  874   2HD   ARG 111          2HD       ARG 111   4.563  13.393  -1.335
  875    HE   ARG 111           HE       ARG 111   5.636  11.428  -2.922
  876   1HH1  ARG 111          1HH1      ARG 111   5.821  14.901  -2.768
  877   2HH1  ARG 111          2HH1      ARG 111   7.433  14.974  -3.399
  878   1HH2  ARG 111          1HH2      ARG 111   7.759  11.511  -3.754
  879   2HH2  ARG 111          2HH2      ARG 111   8.534  13.044  -3.961
  880    H    SER 112           H        SER 112   4.330  13.229  -6.236
  881    HA   SER 112           HA       SER 112   4.445  10.969  -8.125
  882   1HB   SER 112          1HB       SER 112   4.817  12.533  -9.914
  883   2HB   SER 112          2HB       SER 112   3.411  13.090  -9.006
  884    HG   SER 112           HG       SER 112   6.067  14.073  -8.816
  885    H    GLN 113           H        GLN 113   6.511  10.785  -9.325
  886    HA   GLN 113           HA       GLN 113   8.729  11.029  -7.467
  887   1HB   GLN 113          1HB       GLN 113   8.054   9.033  -9.115
  888   2HB   GLN 113          2HB       GLN 113   9.125   9.917 -10.195
  889   1HG   GLN 113          1HG       GLN 113  10.733   9.866  -8.126
  890   2HG   GLN 113          2HG       GLN 113   9.741   8.485  -7.665
  891   1HE2  GLN 113          1HE2      GLN 113  12.509   9.289  -9.124
  892   2HE2  GLN 113          2HE2      GLN 113  12.687   7.965 -10.219
  893    H    GLY 114           H        GLY 114  10.818  11.870  -8.141
  894   1HA   GLY 114          1HA       GLY 114  10.727  13.793 -10.356
  895   2HA   GLY 114          2HA       GLY 114  11.108  14.391  -8.747
  896    H    GLN 115           H        GLN 115  12.613  14.044 -11.414
  897    HA   GLN 115           HA       GLN 115  15.160  13.574 -10.245
  898   1HB   GLN 115          1HB       GLN 115  14.074  11.229 -10.675
  899   2HB   GLN 115          2HB       GLN 115  14.509  11.545 -12.349
  900   1HG   GLN 115          1HG       GLN 115  16.861  11.985 -11.487
  901   2HG   GLN 115          2HG       GLN 115  16.317  11.258  -9.976
  902   1HE2  GLN 115          1HE2      GLN 115  18.263   9.919 -10.839
  903   2HE2  GLN 115          2HE2      GLN 115  17.830   8.500 -11.724
  904    H    ARG 116           H        ARG 116  13.511  13.264 -13.395
  905    HA   ARG 116           HA       ARG 116  13.984  14.138 -15.446
  906   1HB   ARG 116          1HB       ARG 116  15.028  16.497 -13.874
  907   2HB   ARG 116          2HB       ARG 116  14.401  16.506 -15.517
  908   1HG   ARG 116          1HG       ARG 116  12.186  16.090 -14.763
  909   2HG   ARG 116          2HG       ARG 116  12.744  15.766 -13.121
  910   1HD   ARG 116          1HD       ARG 116  13.227  18.015 -12.716
  911   2HD   ARG 116          2HD       ARG 116  13.244  18.414 -14.434
  912    HE   ARG 116           HE       ARG 116  10.690  17.633 -14.005
  913   1HH1  ARG 116          1HH1      ARG 116  12.784  19.934 -12.442
  914   2HH1  ARG 116          2HH1      ARG 116  11.491  20.985 -11.969
  915   1HH2  ARG 116          1HH2      ARG 116   8.979  19.009 -13.388
  916   2HH2  ARG 116          2HH2      ARG 116   9.327  20.458 -12.507
  Start of MODEL    2
    1    HA   PRO   2           HA       PRO   2  26.575  -1.176  21.661
    2   1HB   PRO   2          1HB       PRO   2  28.986  -2.306  22.193
    3   2HB   PRO   2          2HB       PRO   2  28.528  -0.700  22.775
    4   1HG   PRO   2          1HG       PRO   2  28.493  -3.320  24.223
    5   2HG   PRO   2          2HG       PRO   2  29.038  -1.732  24.795
    6   1HD   PRO   2          1HD       PRO   2  26.618  -2.762  25.440
    7   2HD   PRO   2          2HD       PRO   2  26.893  -1.019  25.245
    8    H    SER   3           H        SER   3  25.070  -2.718  20.688
    9    HA   SER   3           HA       SER   3  26.314  -5.350  20.221
   10   1HB   SER   3          1HB       SER   3  23.732  -4.765  21.192
   11   2HB   SER   3          2HB       SER   3  23.515  -5.315  19.531
   12    HG   SER   3           HG       SER   3  23.603  -7.185  20.567
   13    H    LYS   4           H        LYS   4  24.760  -2.555  18.818
   14    HA   LYS   4           HA       LYS   4  24.554  -1.805  16.680
   15   1HB   LYS   4          1HB       LYS   4  26.845  -3.645  16.005
   16   2HB   LYS   4          2HB       LYS   4  26.414  -2.127  15.229
   17   1HG   LYS   4          1HG       LYS   4  26.848  -1.201  17.681
   18   2HG   LYS   4          2HG       LYS   4  27.890  -2.624  17.746
   19   1HD   LYS   4          1HD       LYS   4  28.798  -1.783  15.480
   20   2HD   LYS   4          2HD       LYS   4  28.051  -0.246  15.926
   21   1HE   LYS   4          1HE       LYS   4  29.507  -1.222  18.167
   22   2HE   LYS   4          2HE       LYS   4  30.552  -1.309  16.749
   23   1HZ   LYS   4          1HZ       LYS   4  29.619   1.093  16.374
   24   2HZ   LYS   4          2HZ       LYS   4  30.926   0.822  17.413
   25   3HZ   LYS   4          3HZ       LYS   4  29.373   1.037  18.047
   26    H    LYS   5           H        LYS   5  24.776  -2.836  14.211
   27    HA   LYS   5           HA       LYS   5  23.216  -5.328  14.230
   28   1HB   LYS   5          1HB       LYS   5  22.614  -3.018  12.386
   29   2HB   LYS   5          2HB       LYS   5  21.664  -4.478  12.628
   30   1HG   LYS   5          1HG       LYS   5  20.447  -3.361  14.099
   31   2HG   LYS   5          2HG       LYS   5  21.862  -3.297  15.152
   32   1HD   LYS   5          1HD       LYS   5  22.506  -1.178  14.307
   33   2HD   LYS   5          2HD       LYS   5  21.360  -1.286  12.968
   34   1HE   LYS   5          1HE       LYS   5  20.049  -0.024  14.285
   35   2HE   LYS   5          2HE       LYS   5  19.703  -1.548  15.102
   36   1HZ   LYS   5          1HZ       LYS   5  20.977   0.748  16.124
   37   2HZ   LYS   5          2HZ       LYS   5  22.052  -0.555  16.198
   38   3HZ   LYS   5          3HZ       LYS   5  20.536  -0.668  16.938
   39    H    ASN   6           H        ASN   6  23.004  -6.148  11.856
   40    HA   ASN   6           HA       ASN   6  25.676  -5.954  10.633
   41   1HB   ASN   6          1HB       ASN   6  25.048  -8.183  11.575
   42   2HB   ASN   6          2HB       ASN   6  23.716  -8.249  10.424
   43   1HD2  ASN   6          1HD2      ASN   6  26.592  -9.494  10.951
   44   2HD2  ASN   6          2HD2      ASN   6  27.182  -9.682   9.338
   45    H    GLY   7           H        GLY   7  25.873  -5.440   8.516
   46   1HA   GLY   7          1HA       GLY   7  23.368  -4.840   7.078
   47   2HA   GLY   7          2HA       GLY   7  24.897  -4.013   6.818
   48    H    ARG   8           H        ARG   8  22.903  -6.648   5.925
   49    HA   ARG   8           HA       ARG   8  25.002  -7.629   4.103
   50   1HB   ARG   8          1HB       ARG   8  22.859  -9.071   5.619
   51   2HB   ARG   8          2HB       ARG   8  23.434  -9.731   4.094
   52   1HG   ARG   8          1HG       ARG   8  25.502 -10.233   4.928
   53   2HG   ARG   8          2HG       ARG   8  25.437  -8.963   6.151
   54   1HD   ARG   8          1HD       ARG   8  23.784 -10.262   7.406
   55   2HD   ARG   8          2HD       ARG   8  23.850 -11.528   6.181
   56    HE   ARG   8           HE       ARG   8  25.719 -11.084   8.300
   57   1HH1  ARG   8          1HH1      ARG   8  25.352 -12.326   5.068
   58   2HH1  ARG   8          2HH1      ARG   8  26.700 -13.407   5.191
   59   1HH2  ARG   8          1HH2      ARG   8  27.496 -12.504   8.474
   60   2HH2  ARG   8          2HH2      ARG   8  27.918 -13.508   7.129
   61    H    SER   9           H        SER   9  24.127  -8.601   2.067
   62    HA   SER   9           HA       SER   9  22.585  -6.714   0.673
   63   1HB   SER   9          1HB       SER   9  23.022  -9.583  -0.170
   64   2HB   SER   9          2HB       SER   9  22.741  -8.187  -1.210
   65    HG   SER   9           HG       SER   9  24.806  -7.875  -1.198
   66    H    GLY  10           H        GLY  10  20.503  -6.931  -0.307
   67   1HA   GLY  10          1HA       GLY  10  18.588  -8.732  -0.287
   68   2HA   GLY  10          2HA       GLY  10  18.632  -8.362   1.431
   69    HA   PRO  11           HA       PRO  11  15.695  -5.471  -0.807
   70   1HB   PRO  11          1HB       PRO  11  13.496  -6.120   0.647
   71   2HB   PRO  11          2HB       PRO  11  13.960  -6.977  -0.827
   72   1HG   PRO  11          1HG       PRO  11  14.416  -7.740   2.032
   73   2HG   PRO  11          2HG       PRO  11  13.896  -8.754   0.672
   74   1HD   PRO  11          1HD       PRO  11  16.449  -8.722   1.573
   75   2HD   PRO  11          2HD       PRO  11  16.042  -8.992  -0.134
   76    H    GLN  12           H        GLN  12  15.578  -3.437  -0.090
   77    HA   GLN  12           HA       GLN  12  15.889  -2.959   2.794
   78   1HB   GLN  12          1HB       GLN  12  16.915  -1.635   0.381
   79   2HB   GLN  12          2HB       GLN  12  16.298  -0.527   1.600
   80   1HG   GLN  12          1HG       GLN  12  17.762  -1.686   3.265
   81   2HG   GLN  12          2HG       GLN  12  18.480  -2.568   1.919
   82   1HE2  GLN  12          1HE2      GLN  12  18.247   0.453   3.566
   83   2HE2  GLN  12          2HE2      GLN  12  19.491   1.271   2.690
   84    HA   PRO  13           HA       PRO  13  11.937  -1.102   3.193
   85   1HB   PRO  13          1HB       PRO  13  12.438   1.003   4.832
   86   2HB   PRO  13          2HB       PRO  13  12.462  -0.675   5.388
   87   1HG   PRO  13          1HG       PRO  13  14.749   1.103   4.632
   88   2HG   PRO  13          2HG       PRO  13  14.605  -0.013   6.002
   89   1HD   PRO  13          1HD       PRO  13  15.971  -0.640   3.750
   90   2HD   PRO  13          2HD       PRO  13  15.112  -1.857   4.715
   91    H    HIS  14           H        HIS  14  10.617   0.461   2.325
   92    HA   HIS  14           HA       HIS  14  11.879   2.792   1.067
   93   1HB   HIS  14          1HB       HIS  14  10.022   0.833  -0.290
   94   2HB   HIS  14          2HB       HIS  14  10.401   2.425  -0.940
   95    HD1  HIS  14           1HD      HIS  14  11.788  -0.995  -0.525
   96    HD2  HIS  14           2HD      HIS  14  13.037   2.709  -1.933
   97    HE1  HIS  14           1HE      HIS  14  13.921  -1.437  -1.782
   98    H    LYS  15           H        LYS  15   9.973   4.196   0.074
   99    HA   LYS  15           HA       LYS  15   8.053   4.554   2.268
  100   1HB   LYS  15          1HB       LYS  15   7.772   6.856   1.254
  101   2HB   LYS  15          2HB       LYS  15   9.348   6.518   1.957
  102   1HG   LYS  15          1HG       LYS  15   9.329   5.795  -0.821
  103   2HG   LYS  15          2HG       LYS  15   8.790   7.463  -0.613
  104   1HD   LYS  15          1HD       LYS  15  11.185   6.562   0.903
  105   2HD   LYS  15          2HD       LYS  15  11.355   6.844  -0.831
  106   1HE   LYS  15          1HE       LYS  15  11.419   9.041  -0.507
  107   2HE   LYS  15          2HE       LYS  15   9.877   8.993   0.347
  108   1HZ   LYS  15          1HZ       LYS  15  10.909   9.295   2.270
  109   2HZ   LYS  15          2HZ       LYS  15  12.346   9.564   1.421
  110   3HZ   LYS  15          3HZ       LYS  15  11.977   8.014   1.987
  111    H    ARG  16           H        ARG  16   7.951   2.777  -0.254
  112    HA   ARG  16           HA       ARG  16   5.196   3.504  -0.945
  113   1HB   ARG  16          1HB       ARG  16   7.351   2.786  -2.941
  114   2HB   ARG  16          2HB       ARG  16   5.640   2.928  -3.321
  115   1HG   ARG  16          1HG       ARG  16   5.948   5.077  -3.732
  116   2HG   ARG  16          2HG       ARG  16   6.366   5.318  -2.034
  117   1HD   ARG  16          1HD       ARG  16   8.243   6.134  -3.090
  118   2HD   ARG  16          2HD       ARG  16   8.711   4.463  -2.782
  119    HE   ARG  16           HE       ARG  16   7.481   4.832  -5.344
  120   1HH1  ARG  16          1HH1      ARG  16  10.467   5.044  -3.567
  121   2HH1  ARG  16          2HH1      ARG  16  11.467   4.840  -4.968
  122   1HH2  ARG  16          1HH2      ARG  16   8.786   4.562  -7.195
  123   2HH2  ARG  16          2HH2      ARG  16  10.509   4.567  -7.031
  124    H    TRP  17           H        TRP  17   3.880   1.837  -0.657
  125    HA   TRP  17           HA       TRP  17   4.764  -0.864  -1.273
  126   1HB   TRP  17          1HB       TRP  17   3.903   0.009   1.485
  127   2HB   TRP  17          2HB       TRP  17   3.868  -1.673   0.963
  128    HD1  TRP  17           HD       TRP  17   6.239   1.055   2.102
  129    HE1  TRP  17           1HE      TRP  17   8.591   0.057   2.408
  130    HE3  TRP  17           3HE      TRP  17   5.447  -3.543   0.013
  131    HZ2  TRP  17           2HZ      TRP  17   9.933  -2.360   1.839
  132    HZ3  TRP  17           3HZ      TRP  17   7.317  -5.140  -0.067
  133    HH2  TRP  17           HH       TRP  17   9.513  -4.559   0.827
  134    H    VAL  18           H        VAL  18   3.151  -2.115  -2.043
  135    HA   VAL  18           HA       VAL  18   0.445  -0.957  -2.020
  136    HB   VAL  18           HB       VAL  18  -0.003  -2.263  -4.036
  137   1HG1  VAL  18          1HG1      VAL  18   1.939  -1.171  -5.459
  138   2HG1  VAL  18          2HG1      VAL  18   0.685  -0.188  -4.699
  139   3HG1  VAL  18          3HG1      VAL  18   2.267  -0.347  -3.935
  140   1HG2  VAL  18          1HG2      VAL  18   1.254  -3.975  -4.708
  141   2HG2  VAL  18          2HG2      VAL  18   2.725  -3.003  -4.657
  142   3HG2  VAL  18          3HG2      VAL  18   2.150  -3.808  -3.198
  143    H    PHE  19           H        PHE  19  -1.363  -2.500  -2.014
  144    HA   PHE  19           HA       PHE  19  -0.751  -5.040  -0.678
  145   1HB   PHE  19          1HB       PHE  19  -2.690  -4.637   0.861
  146   2HB   PHE  19          2HB       PHE  19  -1.321  -3.563   1.130
  147    HD1  PHE  19           1HD      PHE  19  -1.428  -1.216   0.285
  148    HD2  PHE  19           2HD      PHE  19  -4.811  -3.798   0.290
  149    HE1  PHE  19           1HE      PHE  19  -2.912   0.733   0.055
  150    HE2  PHE  19           2HE      PHE  19  -6.300  -1.854   0.059
  151    HZ   PHE  19           HZ       PHE  19  -5.351   0.416  -0.060
  152    H    THR  20           H        THR  20  -2.167  -6.713  -1.099
  153    HA   THR  20           HA       THR  20  -4.553  -6.212  -2.683
  154    HB   THR  20           HB       THR  20  -3.948  -7.723  -4.482
  155    HG1  THR  20           1HG      THR  20  -1.369  -7.869  -3.276
  156   1HG2  THR  20          1HG2      THR  20  -3.311  -5.276  -4.577
  157   2HG2  THR  20          2HG2      THR  20  -2.410  -6.343  -5.654
  158   3HG2  THR  20          3HG2      THR  20  -1.674  -5.775  -4.157
  159    H    LEU  21           H        LEU  21  -6.135  -7.557  -2.102
  160    HA   LEU  21           HA       LEU  21  -5.463 -10.203  -1.043
  161   1HB   LEU  21          1HB       LEU  21  -5.680  -8.710   0.883
  162   2HB   LEU  21          2HB       LEU  21  -7.284  -8.231   0.332
  163    HG   LEU  21           HG       LEU  21  -7.558 -10.938   0.536
  164   1HD1  LEU  21          1HD1      LEU  21  -5.251 -11.003   1.546
  165   2HD1  LEU  21          2HD1      LEU  21  -6.533 -11.720   2.520
  166   3HD1  LEU  21          3HD1      LEU  21  -5.915 -10.117   2.919
  167   1HD2  LEU  21          1HD2      LEU  21  -8.825  -8.821   1.496
  168   2HD2  LEU  21          2HD2      LEU  21  -8.015  -9.316   2.983
  169   3HD2  LEU  21          3HD2      LEU  21  -9.090 -10.438   2.148
  170    H    ASN  22           H        ASN  22  -6.878 -11.777  -1.598
  171    HA   ASN  22           HA       ASN  22  -8.961 -11.073  -3.485
  172   1HB   ASN  22          1HB       ASN  22  -8.990 -13.334  -4.107
  173   2HB   ASN  22          2HB       ASN  22  -7.302 -13.040  -3.696
  174   1HD2  ASN  22          1HD2      ASN  22  -6.512 -13.804  -1.685
  175   2HD2  ASN  22          2HD2      ASN  22  -7.279 -15.127  -0.882
  176    H    ASN  23           H        ASN  23 -11.115 -11.185  -3.154
  177    HA   ASN  23           HA       ASN  23 -13.070 -11.135  -1.982
  178   1HB   ASN  23          1HB       ASN  23 -12.871 -13.549  -2.289
  179   2HB   ASN  23          2HB       ASN  23 -11.885 -13.672  -0.835
  180   1HD2  ASN  23          1HD2      ASN  23 -14.844 -11.842  -1.476
  181   2HD2  ASN  23          2HD2      ASN  23 -15.782 -12.588  -0.232
  182    HA   PRO  24           HA       PRO  24 -10.933  -9.366   1.784
  183   1HB   PRO  24          1HB       PRO  24 -11.743  -6.809   1.367
  184   2HB   PRO  24          2HB       PRO  24 -10.258  -7.471   0.675
  185   1HG   PRO  24          1HG       PRO  24 -12.941  -7.103  -0.599
  186   2HG   PRO  24          2HG       PRO  24 -11.332  -6.770  -1.265
  187   1HD   PRO  24          1HD       PRO  24 -12.730  -9.005  -1.882
  188   2HD   PRO  24          2HD       PRO  24 -10.957  -8.981  -1.796
  189    H    SER  25           H        SER  25 -11.938  -8.896   3.710
  190    HA   SER  25           HA       SER  25 -14.832  -9.246   3.746
  191   1HB   SER  25          1HB       SER  25 -12.720  -9.314   5.904
  192   2HB   SER  25          2HB       SER  25 -14.446  -9.378   6.262
  193    HG   SER  25           HG       SER  25 -12.957 -11.212   4.688
  194    H    GLU  26           H        GLU  26 -16.186  -7.882   5.091
  195    HA   GLU  26           HA       GLU  26 -15.951  -5.171   4.514
  196   1HB   GLU  26          1HB       GLU  26 -17.783  -6.864   5.921
  197   2HB   GLU  26          2HB       GLU  26 -17.501  -5.414   6.875
  198   1HG   GLU  26          1HG       GLU  26 -17.882  -4.255   4.520
  199   2HG   GLU  26          2HG       GLU  26 -18.805  -5.730   4.238
  200    H    ASP  27           H        ASP  27 -14.726  -7.023   7.199
  201    HA   ASP  27           HA       ASP  27 -14.092  -4.731   8.818
  202   1HB   ASP  27          1HB       ASP  27 -13.462  -7.668   9.005
  203   2HB   ASP  27          2HB       ASP  27 -12.726  -6.503  10.102
  204    H    GLU  28           H        GLU  28 -12.341  -6.894   6.643
  205    HA   GLU  28           HA       GLU  28  -9.753  -5.930   7.155
  206   1HB   GLU  28          1HB       GLU  28 -10.885  -7.864   5.511
  207   2HB   GLU  28          2HB       GLU  28 -10.166  -6.721   4.384
  208   1HG   GLU  28          1HG       GLU  28  -8.507  -8.315   4.793
  209   2HG   GLU  28          2HG       GLU  28  -8.048  -6.913   5.757
  210    H    ARG  29           H        ARG  29 -12.101  -5.023   4.641
  211    HA   ARG  29           HA       ARG  29 -10.475  -3.005   3.492
  212   1HB   ARG  29          1HB       ARG  29 -13.476  -3.361   3.395
  213   2HB   ARG  29          2HB       ARG  29 -12.548  -2.282   2.362
  214   1HG   ARG  29          1HG       ARG  29 -11.887  -3.940   1.009
  215   2HG   ARG  29          2HG       ARG  29 -11.640  -5.068   2.343
  216   1HD   ARG  29          1HD       ARG  29 -13.431  -5.815   0.855
  217   2HD   ARG  29          2HD       ARG  29 -14.038  -5.462   2.472
  218    HE   ARG  29           HE       ARG  29 -14.265  -3.253   0.649
  219   1HH1  ARG  29          1HH1      ARG  29 -15.771  -6.167   1.816
  220   2HH1  ARG  29          2HH1      ARG  29 -17.371  -5.675   1.369
  221   1HH2  ARG  29          1HH2      ARG  29 -16.366  -2.594   0.055
  222   2HH2  ARG  29          2HH2      ARG  29 -17.708  -3.642   0.366
  223    H    LYS  30           H        LYS  30 -12.766  -3.053   6.128
  224    HA   LYS  30           HA       LYS  30 -13.098  -0.238   6.348
  225   1HB   LYS  30          1HB       LYS  30 -13.768  -2.617   7.992
  226   2HB   LYS  30          2HB       LYS  30 -13.661  -1.079   8.839
  227   1HG   LYS  30          1HG       LYS  30 -15.365  -0.123   7.476
  228   2HG   LYS  30          2HG       LYS  30 -15.363  -1.521   6.398
  229   1HD   LYS  30          1HD       LYS  30 -16.854  -2.555   7.683
  230   2HD   LYS  30          2HD       LYS  30 -15.795  -2.398   9.087
  231   1HE   LYS  30          1HE       LYS  30 -17.987  -1.366   9.472
  232   2HE   LYS  30          2HE       LYS  30 -16.682  -0.182   9.536
  233   1HZ   LYS  30          1HZ       LYS  30 -18.271  -0.654   7.083
  234   2HZ   LYS  30          2HZ       LYS  30 -17.262   0.657   7.437
  235   3HZ   LYS  30          3HZ       LYS  30 -18.732   0.476   8.255
  236    H    LYS  31           H        LYS  31 -10.946  -2.579   7.898
  237    HA   LYS  31           HA       LYS  31  -9.751  -0.813   9.732
  238   1HB   LYS  31          1HB       LYS  31  -9.453  -3.150  10.066
  239   2HB   LYS  31          2HB       LYS  31  -8.788  -3.367   8.452
  240   1HG   LYS  31          1HG       LYS  31  -6.809  -2.078   9.100
  241   2HG   LYS  31          2HG       LYS  31  -7.475  -1.888  10.724
  242   1HD   LYS  31          1HD       LYS  31  -6.827  -3.941  11.335
  243   2HD   LYS  31          2HD       LYS  31  -7.426  -4.663   9.840
  244   1HE   LYS  31          1HE       LYS  31  -5.042  -4.993   9.994
  245   2HE   LYS  31          2HE       LYS  31  -5.394  -3.868   8.684
  246   1HZ   LYS  31          1HZ       LYS  31  -4.788  -2.808  11.355
  247   2HZ   LYS  31          2HZ       LYS  31  -4.525  -2.108   9.838
  248   3HZ   LYS  31          3HZ       LYS  31  -3.516  -3.353  10.382
  249    H    ILE  32           H        ILE  32  -8.638  -1.890   6.523
  250    HA   ILE  32           HA       ILE  32  -6.348  -0.251   6.446
  251    HB   ILE  32           HB       ILE  32  -7.958  -1.628   4.322
  252   1HG1  ILE  32          1HG1      ILE  32  -5.079  -1.916   5.206
  253   2HG1  ILE  32          2HG1      ILE  32  -6.407  -2.916   5.782
  254   1HG2  ILE  32          1HG2      ILE  32  -6.120  -0.926   2.730
  255   2HG2  ILE  32          2HG2      ILE  32  -7.284   0.321   3.175
  256   3HG2  ILE  32          3HG2      ILE  32  -5.687   0.300   3.921
  257   1HD1  ILE  32          1HD1      ILE  32  -4.777  -3.355   3.561
  258   2HD1  ILE  32          2HD1      ILE  32  -6.216  -4.257   4.037
  259   3HD1  ILE  32          3HD1      ILE  32  -6.355  -2.903   2.917
  260    H    ARG  33           H        ARG  33  -9.664   0.259   5.333
  261    HA   ARG  33           HA       ARG  33  -9.137   2.774   4.100
  262   1HB   ARG  33          1HB       ARG  33 -11.046   1.524   3.367
  263   2HB   ARG  33          2HB       ARG  33 -11.693   1.447   5.001
  264   1HG   ARG  33          1HG       ARG  33 -12.032   3.879   4.965
  265   2HG   ARG  33          2HG       ARG  33 -11.427   3.923   3.308
  266   1HD   ARG  33          1HD       ARG  33 -13.768   3.903   3.107
  267   2HD   ARG  33          2HD       ARG  33 -13.261   2.250   2.760
  268    HE   ARG  33           HE       ARG  33 -13.830   2.408   5.483
  269   1HH1  ARG  33          1HH1      ARG  33 -15.495   2.675   2.437
  270   2HH1  ARG  33          2HH1      ARG  33 -17.008   2.113   3.066
  271   1HH2  ARG  33          1HH2      ARG  33 -15.817   1.667   6.323
  272   2HH2  ARG  33          2HH2      ARG  33 -17.190   1.541   5.277
  273    H    ASP  34           H        ASP  34  -9.682   1.754   7.334
  274    HA   ASP  34           HA       ASP  34 -10.351   4.457   8.226
  275   1HB   ASP  34          1HB       ASP  34 -10.340   1.775   9.600
  276   2HB   ASP  34          2HB       ASP  34 -10.511   3.281  10.497
  277    H    LEU  35           H        LEU  35  -7.627   3.083   7.355
  278    HA   LEU  35           HA       LEU  35  -5.914   3.327   9.592
  279   1HB   LEU  35          1HB       LEU  35  -5.525   3.176   6.637
  280   2HB   LEU  35          2HB       LEU  35  -4.162   3.608   7.667
  281    HG   LEU  35           HG       LEU  35  -5.760   1.062   7.920
  282   1HD1  LEU  35          1HD1      LEU  35  -3.782  -0.022   6.939
  283   2HD1  LEU  35          2HD1      LEU  35  -3.088   1.567   6.620
  284   3HD1  LEU  35          3HD1      LEU  35  -4.577   1.076   5.812
  285   1HD2  LEU  35          1HD2      LEU  35  -3.912   0.352   9.354
  286   2HD2  LEU  35          2HD2      LEU  35  -4.713   1.784  10.000
  287   3HD2  LEU  35          3HD2      LEU  35  -3.161   1.938   9.175
  288    HA   PRO  36           HA       PRO  36  -5.099   7.626   9.912
  289   1HB   PRO  36          1HB       PRO  36  -2.428   7.683  10.396
  290   2HB   PRO  36          2HB       PRO  36  -3.608   7.124  11.587
  291   1HG   PRO  36          1HG       PRO  36  -1.874   5.525   9.743
  292   2HG   PRO  36          2HG       PRO  36  -2.244   5.245  11.455
  293   1HD   PRO  36          1HD       PRO  36  -3.474   3.890   9.459
  294   2HD   PRO  36          2HD       PRO  36  -4.287   4.285  10.987
  295    H    ILE  37           H        ILE  37  -5.210   8.961   8.223
  296    HA   ILE  37           HA       ILE  37  -3.856   8.528   5.768
  297    HB   ILE  37           HB       ILE  37  -4.641  10.858   5.214
  298   1HG1  ILE  37          1HG1      ILE  37  -5.993  10.646   7.912
  299   2HG1  ILE  37          2HG1      ILE  37  -4.620  11.690   7.561
  300   1HG2  ILE  37          1HG2      ILE  37  -7.141   9.750   6.057
  301   2HG2  ILE  37          2HG2      ILE  37  -6.439   9.813   4.441
  302   3HG2  ILE  37          3HG2      ILE  37  -6.074   8.458   5.508
  303   1HD1  ILE  37          1HD1      ILE  37  -6.335  12.463   5.629
  304   2HD1  ILE  37          2HD1      ILE  37  -7.459  12.019   6.913
  305   3HD1  ILE  37          3HD1      ILE  37  -6.209  13.226   7.213
  306    H    SER  38           H        SER  38  -3.188  10.494   8.596
  307    HA   SER  38           HA       SER  38  -1.153  12.096   7.468
  308   1HB   SER  38          1HB       SER  38  -2.380  11.783  10.011
  309   2HB   SER  38          2HB       SER  38  -0.638  11.645  10.248
  310    HG   SER  38           HG       SER  38  -2.125  13.796   9.200
  311    H    LEU  39           H        LEU  39  -1.223   8.824   8.529
  312    HA   LEU  39           HA       LEU  39   1.570   8.529   9.034
  313   1HB   LEU  39          1HB       LEU  39  -0.613   7.024   9.561
  314   2HB   LEU  39          2HB       LEU  39   0.041   6.165   8.168
  315    HG   LEU  39           HG       LEU  39   1.922   6.800  10.372
  316   1HD1  LEU  39          1HD1      LEU  39  -0.084   6.065  11.573
  317   2HD1  LEU  39          2HD1      LEU  39   1.217   4.881  11.678
  318   3HD1  LEU  39          3HD1      LEU  39  -0.137   4.607  10.582
  319   1HD2  LEU  39          1HD2      LEU  39   2.861   4.674   9.749
  320   2HD2  LEU  39          2HD2      LEU  39   2.584   5.628   8.292
  321   3HD2  LEU  39          3HD2      LEU  39   1.477   4.321   8.715
  322    H    PHE  40           H        PHE  40  -0.454   8.368   6.208
  323    HA   PHE  40           HA       PHE  40   1.928   7.734   4.595
  324   1HB   PHE  40          1HB       PHE  40  -0.859   7.027   3.713
  325   2HB   PHE  40          2HB       PHE  40   0.676   6.388   3.131
  326    HD1  PHE  40           2HD      PHE  40  -1.804   6.264   5.831
  327    HD2  PHE  40           1HD      PHE  40   1.787   4.599   4.265
  328    HE1  PHE  40           2HE      PHE  40  -2.019   4.359   7.373
  329    HE2  PHE  40           1HE      PHE  40   1.577   2.690   5.804
  330    HZ   PHE  40           HZ       PHE  40  -0.327   2.569   7.361
  331    H    ASP  41           H        ASP  41   2.529   9.462   3.485
  332    HA   ASP  41           HA       ASP  41   1.114  11.807   3.152
  333   1HB   ASP  41          1HB       ASP  41   3.607  10.765   2.290
  334   2HB   ASP  41          2HB       ASP  41   2.811  11.445   0.873
  335    H    TYR  42           H        TYR  42   0.981   8.875   1.276
  336    HA   TYR  42           HA       TYR  42  -1.214  10.031  -0.289
  337   1HB   TYR  42          1HB       TYR  42   0.758  10.104  -1.729
  338   2HB   TYR  42          2HB       TYR  42   1.059   8.395  -1.435
  339    HD1  TYR  42           1HD      TYR  42  -2.260   9.915  -2.040
  340    HD2  TYR  42           2HD      TYR  42   0.917   7.595  -3.660
  341    HE1  TYR  42           1HE      TYR  42  -3.673   9.340  -3.970
  342    HE2  TYR  42           2HE      TYR  42  -0.486   7.014  -5.595
  343    HH   TYR  42           HH       TYR  42  -3.717   8.398  -6.004
  344    H    PHE  43           H        PHE  43  -2.975   8.814  -0.177
  345    HA   PHE  43           HA       PHE  43  -2.686   5.916   0.201
  346   1HB   PHE  43          1HB       PHE  43  -3.366   7.480   2.284
  347   2HB   PHE  43          2HB       PHE  43  -4.960   7.226   1.582
  348    HD1  PHE  43           1HD      PHE  43  -3.986   4.384   0.507
  349    HD2  PHE  43           2HD      PHE  43  -4.113   6.301   4.305
  350    HE1  PHE  43           1HE      PHE  43  -4.120   2.187   1.607
  351    HE2  PHE  43           2HE      PHE  43  -4.246   4.107   5.412
  352    HZ   PHE  43           HZ       PHE  43  -4.249   2.047   4.063
  353    H    ILE  44           H        ILE  44  -3.607   4.949  -1.472
  354    HA   ILE  44           HA       ILE  44  -6.212   5.919  -2.411
  355    HB   ILE  44           HB       ILE  44  -4.804   6.843  -4.058
  356   1HG1  ILE  44          1HG1      ILE  44  -5.259   4.340  -5.551
  357   2HG1  ILE  44          2HG1      ILE  44  -6.669   4.963  -4.702
  358   1HG2  ILE  44          1HG2      ILE  44  -3.124   5.311  -5.263
  359   2HG2  ILE  44          2HG2      ILE  44  -2.701   5.925  -3.666
  360   3HG2  ILE  44          3HG2      ILE  44  -3.282   4.270  -3.848
  361   1HD1  ILE  44          1HD1      ILE  44  -5.146   6.931  -6.269
  362   2HD1  ILE  44          2HD1      ILE  44  -5.985   5.682  -7.189
  363   3HD1  ILE  44          3HD1      ILE  44  -6.887   6.719  -6.085
  364    H    VAL  45           H        VAL  45  -7.615   4.312  -2.237
  365    HA   VAL  45           HA       VAL  45  -6.687   1.564  -2.767
  366    HB   VAL  45           HB       VAL  45  -8.976   2.142  -0.916
  367   1HG1  VAL  45          1HG1      VAL  45  -9.039  -0.075  -0.832
  368   2HG1  VAL  45          2HG1      VAL  45  -7.632  -0.179  -1.893
  369   3HG1  VAL  45          3HG1      VAL  45  -7.415  -0.080  -0.145
  370   1HG2  VAL  45          1HG2      VAL  45  -6.056   2.366  -0.340
  371   2HG2  VAL  45          2HG2      VAL  45  -7.396   3.352   0.245
  372   3HG2  VAL  45          3HG2      VAL  45  -7.140   1.736   0.901
  373    H    GLY  46           H        GLY  46  -8.200   0.131  -3.732
  374   1HA   GLY  46          1HA       GLY  46 -10.701   1.259  -4.722
  375   2HA   GLY  46          2HA       GLY  46  -9.508   0.822  -5.936
  376    H    GLU  47           H        GLU  47 -12.260  -0.225  -4.814
  377    HA   GLU  47           HA       GLU  47 -11.530  -3.014  -4.367
  378   1HB   GLU  47          1HB       GLU  47 -13.227  -2.044  -2.906
  379   2HB   GLU  47          2HB       GLU  47 -14.216  -1.627  -4.299
  380   1HG   GLU  47          1HG       GLU  47 -15.109  -3.588  -3.255
  381   2HG   GLU  47          2HG       GLU  47 -14.435  -4.025  -4.824
  382    H    GLU  48           H        GLU  48 -11.794  -4.609  -5.820
  383    HA   GLU  48           HA       GLU  48 -12.913  -3.866  -8.440
  384   1HB   GLU  48          1HB       GLU  48 -10.437  -4.582  -8.166
  385   2HB   GLU  48          2HB       GLU  48 -11.085  -6.206  -7.984
  386   1HG   GLU  48          1HG       GLU  48 -12.159  -6.015 -10.177
  387   2HG   GLU  48          2HG       GLU  48 -11.475  -4.401 -10.361
  388    H    GLY  49           H        GLY  49 -14.541  -5.032  -9.315
  389   1HA   GLY  49          1HA       GLY  49 -15.206  -7.672  -8.879
  390   2HA   GLY  49          2HA       GLY  49 -16.032  -6.774  -7.615
  391    H    ASN  50           H        ASN  50 -15.557  -6.785 -11.141
  392    HA   ASN  50           HA       ASN  50 -18.364  -5.931 -11.410
  393   1HB   ASN  50          1HB       ASN  50 -16.113  -4.554 -12.290
  394   2HB   ASN  50          2HB       ASN  50 -16.711  -5.359 -13.738
  395   1HD2  ASN  50          1HD2      ASN  50 -18.236  -3.826 -10.921
  396   2HD2  ASN  50          2HD2      ASN  50 -19.267  -2.784 -11.836
  397    H    GLU  51           H        GLU  51 -17.338  -8.639 -11.257
  398    HA   GLU  51           HA       GLU  51 -18.287  -9.589 -13.868
  399   1HB   GLU  51          1HB       GLU  51 -15.715  -9.702 -13.513
  400   2HB   GLU  51          2HB       GLU  51 -16.085 -11.037 -12.431
  401   1HG   GLU  51          1HG       GLU  51 -17.436 -11.952 -14.453
  402   2HG   GLU  51          2HG       GLU  51 -16.427 -10.848 -15.386
  403    H    GLU  52           H        GLU  52 -20.212 -10.416 -13.313
  404    HA   GLU  52           HA       GLU  52 -20.973 -11.460 -10.866
  405   1HB   GLU  52          1HB       GLU  52 -22.223 -11.015 -13.256
  406   2HB   GLU  52          2HB       GLU  52 -22.220 -12.772 -13.184
  407   1HG   GLU  52          1HG       GLU  52 -23.383 -12.746 -11.087
  408   2HG   GLU  52          2HG       GLU  52 -23.262 -10.990 -10.996
  409    H    GLY  53           H        GLY  53 -21.084 -13.512  -9.980
  410   1HA   GLY  53          1HA       GLY  53 -20.755 -15.842  -9.914
  411   2HA   GLY  53          2HA       GLY  53 -19.913 -15.744 -11.453
  412    H    ARG  54           H        ARG  54 -18.378 -13.385 -10.195
  413    HA   ARG  54           HA       ARG  54 -16.415 -15.074  -8.795
  414   1HB   ARG  54          1HB       ARG  54 -15.775 -13.989 -11.006
  415   2HB   ARG  54          2HB       ARG  54 -15.848 -12.448 -10.163
  416   1HG   ARG  54          1HG       ARG  54 -13.969 -12.877  -8.925
  417   2HG   ARG  54          2HG       ARG  54 -14.171 -14.627  -9.026
  418   1HD   ARG  54          1HD       ARG  54 -13.636 -13.096 -11.524
  419   2HD   ARG  54          2HD       ARG  54 -12.304 -13.383 -10.405
  420    HE   ARG  54           HE       ARG  54 -13.778 -15.761 -11.018
  421   1HH1  ARG  54          1HH1      ARG  54 -11.253 -13.629 -12.112
  422   2HH1  ARG  54          2HH1      ARG  54 -10.454 -14.845 -13.053
  423   1HH2  ARG  54          1HH2      ARG  54 -12.736 -17.371 -12.253
  424   2HH2  ARG  54          2HH2      ARG  54 -11.299 -16.973 -13.133
  425    H    THR  55           H        THR  55 -15.068 -13.933  -7.167
  426    HA   THR  55           HA       THR  55 -16.785 -12.262  -5.492
  427    HB   THR  55           HB       THR  55 -14.503 -12.744  -4.019
  428    HG1  THR  55           1HG      THR  55 -13.953 -14.882  -4.380
  429   1HG2  THR  55          1HG2      THR  55 -16.585 -14.827  -3.858
  430   2HG2  THR  55          2HG2      THR  55 -17.161 -13.163  -3.747
  431   3HG2  THR  55          3HG2      THR  55 -15.952 -13.756  -2.609
  432    HA   PRO  56           HA       PRO  56 -14.514  -8.546  -6.036
  433   1HB   PRO  56          1HB       PRO  56 -14.522  -7.500  -3.531
  434   2HB   PRO  56          2HB       PRO  56 -15.964  -7.561  -4.552
  435   1HG   PRO  56          1HG       PRO  56 -15.137  -9.388  -2.329
  436   2HG   PRO  56          2HG       PRO  56 -16.738  -8.713  -2.686
  437   1HD   PRO  56          1HD       PRO  56 -16.041 -11.243  -3.354
  438   2HD   PRO  56          2HD       PRO  56 -17.169 -10.276  -4.325
  439    H    HIS  57           H        HIS  57 -12.543  -7.422  -5.540
  440    HA   HIS  57           HA       HIS  57 -10.624  -8.857  -3.858
  441   1HB   HIS  57          1HB       HIS  57 -10.181  -9.765  -6.036
  442   2HB   HIS  57          2HB       HIS  57 -10.213  -8.164  -6.770
  443    HD1  HIS  57           1HD      HIS  57  -7.987 -10.569  -5.096
  444    HD2  HIS  57           2HD      HIS  57  -7.913  -6.553  -6.158
  445    HE1  HIS  57           1HE      HIS  57  -5.577  -9.872  -4.921
  446    H    LEU  58           H        LEU  58  -9.132  -7.570  -2.862
  447    HA   LEU  58           HA       LEU  58  -9.576  -4.694  -3.093
  448   1HB   LEU  58          1HB       LEU  58  -9.214  -6.363  -0.938
  449   2HB   LEU  58          2HB       LEU  58  -7.637  -5.596  -1.109
  450    HG   LEU  58           HG       LEU  58 -10.286  -4.236  -0.636
  451   1HD1  LEU  58          1HD1      LEU  58  -9.400  -5.177   1.370
  452   2HD1  LEU  58          2HD1      LEU  58  -9.099  -3.440   1.409
  453   3HD1  LEU  58          3HD1      LEU  58  -7.789  -4.554   1.017
  454   1HD2  LEU  58          1HD2      LEU  58  -9.261  -2.694  -1.999
  455   2HD2  LEU  58          2HD2      LEU  58  -7.637  -3.172  -1.506
  456   3HD2  LEU  58          3HD2      LEU  58  -8.643  -2.215  -0.419
  457    H    GLN  59           H        GLN  59  -8.138  -3.305  -3.926
  458    HA   GLN  59           HA       GLN  59  -5.346  -4.036  -4.204
  459   1HB   GLN  59          1HB       GLN  59  -6.128  -4.981  -6.239
  460   2HB   GLN  59          2HB       GLN  59  -7.161  -3.596  -6.569
  461   1HG   GLN  59          1HG       GLN  59  -5.253  -3.534  -8.019
  462   2HG   GLN  59          2HG       GLN  59  -5.154  -2.203  -6.866
  463   1HE2  GLN  59          1HE2      GLN  59  -3.617  -2.291  -5.207
  464   2HE2  GLN  59          2HE2      GLN  59  -2.243  -3.335  -5.300
  465    H    GLY  60           H        GLY  60  -4.340  -2.320  -3.396
  466   1HA   GLY  60          1HA       GLY  60  -4.912   0.314  -4.490
  467   2HA   GLY  60          2HA       GLY  60  -5.201   0.130  -2.767
  468    H    PHE  61           H        PHE  61  -3.447   1.999  -3.389
  469    HA   PHE  61           HA       PHE  61  -0.864   0.785  -2.680
  470   1HB   PHE  61          1HB       PHE  61  -0.546   1.367  -4.950
  471   2HB   PHE  61          2HB       PHE  61  -1.411   2.889  -4.765
  472    HD1  PHE  61           2HD      PHE  61   1.464   1.258  -3.025
  473    HD2  PHE  61           1HD      PHE  61  -0.046   4.706  -5.012
  474    HE1  PHE  61           2HE      PHE  61   3.599   2.415  -2.630
  475    HE2  PHE  61           1HE      PHE  61   2.087   5.869  -4.621
  476    HZ   PHE  61           HZ       PHE  61   3.912   4.724  -3.428
  477    H    ALA  62           H        ALA  62   0.315   1.840  -1.142
  478    HA   ALA  62           HA       ALA  62  -0.705   4.412  -0.154
  479   1HB   ALA  62          1HB       ALA  62  -1.621   3.260   1.550
  480   2HB   ALA  62          2HB       ALA  62  -0.591   1.852   1.291
  481   3HB   ALA  62          3HB       ALA  62   0.030   3.249   2.170
  482    H    ASN  63           H        ASN  63   0.855   5.872   0.074
  483    HA   ASN  63           HA       ASN  63   3.635   5.000  -0.092
  484   1HB   ASN  63          1HB       ASN  63   2.814   6.795  -1.600
  485   2HB   ASN  63          2HB       ASN  63   2.490   7.800  -0.190
  486   1HD2  ASN  63          1HD2      ASN  63   4.490   7.642  -2.602
  487   2HD2  ASN  63          2HD2      ASN  63   5.981   8.109  -1.865
  488    H    PHE  64           H        PHE  64   4.683   4.625   1.738
  489    HA   PHE  64           HA       PHE  64   3.798   5.566   4.270
  490   1HB   PHE  64          1HB       PHE  64   5.795   3.738   3.262
  491   2HB   PHE  64          2HB       PHE  64   6.471   4.746   4.538
  492    HD1  PHE  64           2HD      PHE  64   5.099   4.916   6.720
  493    HD2  PHE  64           1HD      PHE  64   4.555   1.866   3.801
  494    HE1  PHE  64           2HE      PHE  64   4.023   3.492   8.413
  495    HE2  PHE  64           1HE      PHE  64   3.477   0.438   5.490
  496    HZ   PHE  64           HZ       PHE  64   3.211   1.250   7.800
  497    H    VAL  65           H        VAL  65   4.295   7.366   5.350
  498    HA   VAL  65           HA       VAL  65   5.618   9.517   4.134
  499    HB   VAL  65           HB       VAL  65   4.956   9.047   7.042
  500   1HG1  VAL  65          1HG1      VAL  65   6.306  11.303   5.669
  501   2HG1  VAL  65          2HG1      VAL  65   5.111  11.697   6.906
  502   3HG1  VAL  65          3HG1      VAL  65   6.503  10.693   7.312
  503   1HG2  VAL  65          1HG2      VAL  65   3.099   9.196   5.319
  504   2HG2  VAL  65          2HG2      VAL  65   3.013  10.332   6.665
  505   3HG2  VAL  65          3HG2      VAL  65   3.584  10.876   5.087
  506    H    LYS  66           H        LYS  66   6.801   6.885   6.041
  507    HA   LYS  66           HA       LYS  66   9.499   8.063   5.938
  508   1HB   LYS  66          1HB       LYS  66   9.951   6.719   8.051
  509   2HB   LYS  66          2HB       LYS  66   8.937   8.145   8.230
  510   1HG   LYS  66          1HG       LYS  66   7.546   5.590   7.719
  511   2HG   LYS  66          2HG       LYS  66   8.328   5.773   9.291
  512   1HD   LYS  66          1HD       LYS  66   6.674   8.034   8.309
  513   2HD   LYS  66          2HD       LYS  66   5.831   6.577   8.839
  514   1HE   LYS  66          1HE       LYS  66   7.923   7.322  10.690
  515   2HE   LYS  66          2HE       LYS  66   6.785   8.645  10.442
  516   1HZ   LYS  66          1HZ       LYS  66   5.215   7.580  11.577
  517   2HZ   LYS  66          2HZ       LYS  66   6.430   6.537  12.119
  518   3HZ   LYS  66          3HZ       LYS  66   5.487   6.113  10.780
  519    H    LYS  67           H        LYS  67  11.053   6.025   6.660
  520    HA   LYS  67           HA       LYS  67  10.720   4.161   4.457
  521   1HB   LYS  67          1HB       LYS  67  12.912   5.404   5.425
  522   2HB   LYS  67          2HB       LYS  67  13.019   3.885   6.305
  523   1HG   LYS  67          1HG       LYS  67  14.170   3.243   4.484
  524   2HG   LYS  67          2HG       LYS  67  12.555   2.942   3.837
  525   1HD   LYS  67          1HD       LYS  67  12.809   4.514   2.277
  526   2HD   LYS  67          2HD       LYS  67  13.329   5.702   3.474
  527   1HE   LYS  67          1HE       LYS  67  15.556   5.221   3.182
  528   2HE   LYS  67          2HE       LYS  67  15.240   3.575   2.637
  529   1HZ   LYS  67          1HZ       LYS  67  15.926   5.546   1.001
  530   2HZ   LYS  67          2HZ       LYS  67  14.244   5.701   0.925
  531   3HZ   LYS  67          3HZ       LYS  67  14.976   4.233   0.514
  532    H    GLN  68           H        GLN  68   9.903   2.189   4.669
  533    HA   GLN  68           HA       GLN  68  10.078   0.844   7.272
  534   1HB   GLN  68          1HB       GLN  68   7.589   1.002   5.564
  535   2HB   GLN  68          2HB       GLN  68   7.761   0.045   7.029
  536   1HG   GLN  68          1HG       GLN  68   7.988   3.043   6.896
  537   2HG   GLN  68          2HG       GLN  68   6.544   2.155   7.379
  538   1HE2  GLN  68          1HE2      GLN  68   8.836   3.936   8.631
  539   2HE2  GLN  68          2HE2      GLN  68   9.091   3.160  10.153
  540    H    THR  69           H        THR  69  10.019  -1.446   7.186
  541    HA   THR  69           HA       THR  69  11.019  -2.502   4.661
  542    HB   THR  69           HB       THR  69  11.808  -4.390   5.878
  543    HG1  THR  69           1HG      THR  69  11.144  -4.843   7.967
  544   1HG2  THR  69          1HG2      THR  69  13.136  -2.368   6.203
  545   2HG2  THR  69          2HG2      THR  69  13.163  -3.367   7.656
  546   3HG2  THR  69          3HG2      THR  69  12.146  -1.927   7.594
  547    H    PHE  70           H        PHE  70  10.330  -4.805   4.125
  548    HA   PHE  70           HA       PHE  70   7.591  -4.830   3.520
  549   1HB   PHE  70          1HB       PHE  70   8.890  -6.113   2.074
  550   2HB   PHE  70          2HB       PHE  70   9.776  -6.879   3.389
  551    HD1  PHE  70           1HD      PHE  70   6.530  -6.794   1.629
  552    HD2  PHE  70           2HD      PHE  70   9.051  -8.912   4.326
  553    HE1  PHE  70           1HE      PHE  70   5.031  -8.741   1.497
  554    HE2  PHE  70           2HE      PHE  70   7.556 -10.862   4.198
  555    HZ   PHE  70           HZ       PHE  70   5.544 -10.778   2.781
  556    H    ASN  71           H        ASN  71   9.399  -6.856   5.833
  557    HA   ASN  71           HA       ASN  71   7.154  -8.135   6.928
  558   1HB   ASN  71          1HB       ASN  71   9.749  -8.588   7.174
  559   2HB   ASN  71          2HB       ASN  71   9.558  -7.608   8.625
  560   1HD2  ASN  71          1HD2      ASN  71   9.151 -10.660   7.214
  561   2HD2  ASN  71          2HD2      ASN  71   8.365 -11.436   8.543
  562    H    LYS  72           H        LYS  72   8.826  -5.159   7.828
  563    HA   LYS  72           HA       LYS  72   7.419  -4.680  10.227
  564   1HB   LYS  72          1HB       LYS  72   9.458  -3.499   9.849
  565   2HB   LYS  72          2HB       LYS  72   8.873  -2.843   8.326
  566   1HG   LYS  72          1HG       LYS  72   8.902  -1.177  10.127
  567   2HG   LYS  72          2HG       LYS  72   7.280  -1.453   9.489
  568   1HD   LYS  72          1HD       LYS  72   6.817  -2.960  11.383
  569   2HD   LYS  72          2HD       LYS  72   8.423  -2.615  12.030
  570   1HE   LYS  72          1HE       LYS  72   6.587  -0.346  11.420
  571   2HE   LYS  72          2HE       LYS  72   6.308  -1.302  12.876
  572   1HZ   LYS  72          1HZ       LYS  72   8.001   0.793  12.689
  573   2HZ   LYS  72          2HZ       LYS  72   9.053  -0.519  12.511
  574   3HZ   LYS  72          3HZ       LYS  72   8.069  -0.404  13.882
  575    H    VAL  73           H        VAL  73   6.919  -3.445   6.927
  576    HA   VAL  73           HA       VAL  73   4.726  -1.819   7.402
  577    HB   VAL  73           HB       VAL  73   5.452  -3.448   4.973
  578   1HG1  VAL  73          1HG1      VAL  73   3.118  -3.189   4.763
  579   2HG1  VAL  73          2HG1      VAL  73   3.168  -1.534   5.374
  580   3HG1  VAL  73          3HG1      VAL  73   3.828  -1.908   3.782
  581   1HG2  VAL  73          1HG2      VAL  73   6.771  -1.376   5.907
  582   2HG2  VAL  73          2HG2      VAL  73   6.490  -1.563   4.176
  583   3HG2  VAL  73          3HG2      VAL  73   5.476  -0.473   5.120
  584    H    LYS  74           H        LYS  74   4.933  -5.276   7.320
  585    HA   LYS  74           HA       LYS  74   2.228  -5.890   6.824
  586   1HB   LYS  74          1HB       LYS  74   4.251  -7.447   8.446
  587   2HB   LYS  74          2HB       LYS  74   2.743  -8.082   7.800
  588   1HG   LYS  74          1HG       LYS  74   3.918  -7.091   5.556
  589   2HG   LYS  74          2HG       LYS  74   5.318  -7.633   6.485
  590   1HD   LYS  74          1HD       LYS  74   4.891  -9.689   5.737
  591   2HD   LYS  74          2HD       LYS  74   3.454  -9.681   6.761
  592   1HE   LYS  74          1HE       LYS  74   3.662  -8.944   3.850
  593   2HE   LYS  74          2HE       LYS  74   2.746 -10.268   4.570
  594   1HZ   LYS  74          1HZ       LYS  74   2.104  -7.423   4.430
  595   2HZ   LYS  74          2HZ       LYS  74   1.622  -8.254   5.822
  596   3HZ   LYS  74          3HZ       LYS  74   1.087  -8.769   4.302
  597    H    TRP  75           H        TRP  75   3.685  -4.379   9.459
  598    HA   TRP  75           HA       TRP  75   2.047  -5.354  11.565
  599   1HB   TRP  75          1HB       TRP  75   3.017  -3.681  12.903
  600   2HB   TRP  75          2HB       TRP  75   4.272  -4.075  11.732
  601    HD1  TRP  75           HD       TRP  75   3.270  -2.297   9.301
  602    HE1  TRP  75           1HE      TRP  75   3.450   0.266   9.443
  603    HE3  TRP  75           3HE      TRP  75   3.531  -1.783  14.381
  604    HZ2  TRP  75           2HZ      TRP  75   3.674   2.245  11.444
  605    HZ3  TRP  75           3HZ      TRP  75   3.728   0.480  15.328
  606    HH2  TRP  75           HH       TRP  75   3.798   2.450  13.889
  607    H    TYR  76           H        TYR  76   1.514  -3.148   9.000
  608    HA   TYR  76           HA       TYR  76  -0.934  -2.162  10.308
  609   1HB   TYR  76          1HB       TYR  76   1.090  -0.850   8.653
  610   2HB   TYR  76          2HB       TYR  76  -0.554  -0.552   8.098
  611    HD1  TYR  76           2HD      TYR  76  -1.987  -0.539  10.712
  612    HD2  TYR  76           1HD      TYR  76   1.716   1.214   9.566
  613    HE1  TYR  76           2HE      TYR  76  -2.267   1.175  12.454
  614    HE2  TYR  76           1HE      TYR  76   1.448   2.932  11.306
  615    HH   TYR  76           HH       TYR  76   0.265   3.273  13.389
  616    H    LEU  77           H        LEU  77   0.383  -3.120   7.143
  617    HA   LEU  77           HA       LEU  77  -2.182  -3.363   5.922
  618   1HB   LEU  77          1HB       LEU  77   0.564  -4.302   5.138
  619   2HB   LEU  77          2HB       LEU  77  -0.862  -4.605   4.148
  620    HG   LEU  77           HG       LEU  77   0.100  -1.851   4.909
  621   1HD1  LEU  77          1HD1      LEU  77   0.427  -3.038   2.190
  622   2HD1  LEU  77          2HD1      LEU  77   1.635  -3.345   3.436
  623   3HD1  LEU  77          3HD1      LEU  77   1.283  -1.690   2.938
  624   1HD2  LEU  77          1HD2      LEU  77  -1.360  -1.178   3.028
  625   2HD2  LEU  77          2HD2      LEU  77  -2.246  -1.918   4.362
  626   3HD2  LEU  77          3HD2      LEU  77  -1.915  -2.847   2.900
  627    H    GLY  78           H        GLY  78  -0.508  -5.292   8.112
  628   1HA   GLY  78          1HA       GLY  78  -1.013  -7.343   9.020
  629   2HA   GLY  78          2HA       GLY  78  -2.498  -7.317   8.080
  630    H    ALA  79           H        ALA  79  -0.783  -9.580   8.597
  631    HA   ALA  79           HA       ALA  79   0.742 -10.140   6.241
  632   1HB   ALA  79          1HB       ALA  79   0.232 -11.410   8.788
  633   2HB   ALA  79          2HB       ALA  79   0.197 -12.573   7.462
  634   3HB   ALA  79          3HB       ALA  79   1.620 -11.560   7.711
  635    H    ARG  80           H        ARG  80  -2.556 -10.609   7.235
  636    HA   ARG  80           HA       ARG  80  -3.375 -12.677   5.590
  637   1HB   ARG  80          1HB       ARG  80  -4.996 -10.194   6.165
  638   2HB   ARG  80          2HB       ARG  80  -5.606 -11.800   5.789
  639   1HG   ARG  80          1HG       ARG  80  -3.994 -12.179   8.016
  640   2HG   ARG  80          2HG       ARG  80  -4.842 -10.663   8.328
  641   1HD   ARG  80          1HD       ARG  80  -6.152 -12.481   9.197
  642   2HD   ARG  80          2HD       ARG  80  -6.976 -11.803   7.794
  643    HE   ARG  80           HE       ARG  80  -5.321 -13.988   7.053
  644   1HH1  ARG  80          1HH1      ARG  80  -8.363 -13.202   8.552
  645   2HH1  ARG  80          2HH1      ARG  80  -9.115 -14.699   8.113
  646   1HH2  ARG  80          1HH2      ARG  80  -6.300 -15.963   6.468
  647   2HH2  ARG  80          2HH2      ARG  80  -7.941 -16.270   6.928
  648    H    CYS  81           H        CYS  81  -3.049  -9.233   4.833
  649    HA   CYS  81           HA       CYS  81  -3.806  -9.721   2.062
  650   1HB   CYS  81          1HB       CYS  81  -2.941  -7.099   3.283
  651   2HB   CYS  81          2HB       CYS  81  -3.857  -7.347   1.801
  652    HG   CYS  81           HG       CYS  81  -4.928  -7.110   4.944
  653    H    HIS  82           H        HIS  82  -2.409  -9.905   0.425
  654    HA   HIS  82           HA       HIS  82   0.389 -10.108   0.962
  655   1HB   HIS  82          1HB       HIS  82  -1.006 -11.413  -0.773
  656   2HB   HIS  82          2HB       HIS  82  -0.817  -9.990  -1.793
  657    HD1  HIS  82           1HD      HIS  82   1.476 -12.312   0.176
  658    HD2  HIS  82           2HD      HIS  82   1.360 -10.159  -3.375
  659    HE1  HIS  82           1HE      HIS  82   3.625 -12.857  -1.011
  660    H    ILE  83           H        ILE  83   1.901  -8.585   0.846
  661    HA   ILE  83           HA       ILE  83   1.208  -6.037  -0.462
  662    HB   ILE  83           HB       ILE  83   2.788  -4.941   1.037
  663   1HG1  ILE  83          1HG1      ILE  83   3.107  -7.649   2.349
  664   2HG1  ILE  83          2HG1      ILE  83   4.312  -6.887   1.318
  665   1HG2  ILE  83          1HG2      ILE  83   0.717  -6.654   2.394
  666   2HG2  ILE  83          2HG2      ILE  83   1.560  -5.323   3.184
  667   3HG2  ILE  83          3HG2      ILE  83   0.526  -5.009   1.790
  668   1HD1  ILE  83          1HD1      ILE  83   4.889  -6.585   3.635
  669   2HD1  ILE  83          2HD1      ILE  83   4.466  -5.029   2.920
  670   3HD1  ILE  83          3HD1      ILE  83   3.315  -5.862   3.964
  671    H    GLU  84           H        GLU  84   2.776  -4.973  -1.706
  672    HA   GLU  84           HA       GLU  84   5.296  -6.323  -2.238
  673   1HB   GLU  84          1HB       GLU  84   3.103  -6.840  -3.869
  674   2HB   GLU  84          2HB       GLU  84   4.010  -5.618  -4.751
  675   1HG   GLU  84          1HG       GLU  84   5.763  -7.652  -3.708
  676   2HG   GLU  84          2HG       GLU  84   4.482  -8.356  -4.694
  677    H    LYS  85           H        LYS  85   6.683  -5.030  -3.728
  678    HA   LYS  85           HA       LYS  85   6.588  -2.265  -2.952
  679   1HB   LYS  85          1HB       LYS  85   8.722  -3.454  -3.064
  680   2HB   LYS  85          2HB       LYS  85   8.488  -3.742  -4.783
  681   1HG   LYS  85          1HG       LYS  85   8.910  -1.545  -5.346
  682   2HG   LYS  85          2HG       LYS  85   8.512  -0.947  -3.733
  683   1HD   LYS  85          1HD       LYS  85  10.788  -0.791  -3.641
  684   2HD   LYS  85          2HD       LYS  85  10.590  -2.447  -3.064
  685   1HE   LYS  85          1HE       LYS  85  10.828  -3.132  -5.519
  686   2HE   LYS  85          2HE       LYS  85  11.422  -1.494  -5.789
  687   1HZ   LYS  85          1HZ       LYS  85  13.369  -1.958  -4.820
  688   2HZ   LYS  85          2HZ       LYS  85  12.962  -3.578  -5.091
  689   3HZ   LYS  85          3HZ       LYS  85  12.670  -2.874  -3.581
  690    H    ALA  86           H        ALA  86   5.929  -0.553  -4.110
  691    HA   ALA  86           HA       ALA  86   4.676  -1.060  -6.691
  692   1HB   ALA  86          1HB       ALA  86   3.199   0.444  -6.006
  693   2HB   ALA  86          2HB       ALA  86   4.112   0.640  -4.510
  694   3HB   ALA  86          3HB       ALA  86   4.461   1.671  -5.897
  695    H    LYS  87           H        LYS  87   5.021   0.391  -8.502
  696    HA   LYS  87           HA       LYS  87   7.503   1.913  -8.511
  697   1HB   LYS  87          1HB       LYS  87   8.509   0.751 -10.318
  698   2HB   LYS  87          2HB       LYS  87   8.033  -0.478  -9.153
  699   1HG   LYS  87          1HG       LYS  87   5.833  -0.291 -10.793
  700   2HG   LYS  87          2HG       LYS  87   7.189  -0.086 -11.905
  701   1HD   LYS  87          1HD       LYS  87   8.101  -2.171 -11.358
  702   2HD   LYS  87          2HD       LYS  87   7.154  -2.295  -9.873
  703   1HE   LYS  87          1HE       LYS  87   5.609  -3.441 -10.981
  704   2HE   LYS  87          2HE       LYS  87   5.322  -2.034 -12.004
  705   1HZ   LYS  87          1HZ       LYS  87   7.543  -3.891 -12.574
  706   2HZ   LYS  87          2HZ       LYS  87   6.761  -2.820 -13.623
  707   3HZ   LYS  87          3HZ       LYS  87   5.975  -4.228 -13.113
  708    H    GLY  88           H        GLY  88   7.548   3.551 -10.021
  709   1HA   GLY  88          1HA       GLY  88   6.678   4.337 -12.222
  710   2HA   GLY  88          2HA       GLY  88   5.094   3.838 -11.645
  711    H    THR  89           H        THR  89   4.940   6.244 -12.427
  712    HA   THR  89           HA       THR  89   5.751   8.155 -10.398
  713    HB   THR  89           HB       THR  89   4.971   9.867 -11.848
  714    HG1  THR  89           1HG      THR  89   3.410   9.564 -13.284
  715   1HG2  THR  89          1HG2      THR  89   6.004   7.738 -13.716
  716   2HG2  THR  89          2HG2      THR  89   7.030   8.585 -12.557
  717   3HG2  THR  89          3HG2      THR  89   6.216   9.484 -13.838
  718    H    ASP  90           H        ASP  90   3.974   9.859  -9.851
  719    HA   ASP  90           HA       ASP  90   2.119   8.685  -8.157
  720   1HB   ASP  90          1HB       ASP  90   1.176  10.872  -7.864
  721   2HB   ASP  90          2HB       ASP  90   2.913  11.068  -8.081
  722    H    GLN  91           H        GLN  91   1.731   9.794 -11.488
  723    HA   GLN  91           HA       GLN  91  -1.072   9.347 -11.610
  724   1HB   GLN  91          1HB       GLN  91   1.038   9.641 -13.745
  725   2HB   GLN  91          2HB       GLN  91  -0.668   9.428 -14.113
  726   1HG   GLN  91          1HG       GLN  91   0.499  11.682 -12.496
  727   2HG   GLN  91          2HG       GLN  91   0.019  11.774 -14.189
  728   1HE2  GLN  91          1HE2      GLN  91  -2.232  11.448 -14.694
  729   2HE2  GLN  91          2HE2      GLN  91  -3.439  11.880 -13.536
  730    H    GLN  92           H        GLN  92   1.754   7.377 -12.305
  731    HA   GLN  92           HA       GLN  92   0.441   5.269 -13.630
  732   1HB   GLN  92          1HB       GLN  92   3.062   5.652 -12.299
  733   2HB   GLN  92          2HB       GLN  92   2.519   3.991 -12.495
  734   1HG   GLN  92          1HG       GLN  92   3.984   4.980 -14.323
  735   2HG   GLN  92          2HG       GLN  92   2.518   4.135 -14.818
  736   1HE2  GLN  92          1HE2      GLN  92   4.267   7.038 -14.915
  737   2HE2  GLN  92          2HE2      GLN  92   3.098   7.996 -15.751
  738    H    ASN  93           H        ASN  93   1.128   5.853 -10.212
  739    HA   ASN  93           HA       ASN  93   0.026   3.340  -9.363
  740   1HB   ASN  93          1HB       ASN  93   1.002   5.802  -7.940
  741   2HB   ASN  93          2HB       ASN  93   0.154   4.533  -7.062
  742   1HD2  ASN  93          1HD2      ASN  93   2.453   4.317  -9.738
  743   2HD2  ASN  93          2HD2      ASN  93   3.622   3.371  -8.888
  744    H    LYS  94           H        LYS  94  -1.048   6.720  -9.312
  745    HA   LYS  94           HA       LYS  94  -3.496   6.293  -8.004
  746   1HB   LYS  94          1HB       LYS  94  -2.315   8.508  -8.482
  747   2HB   LYS  94          2HB       LYS  94  -3.022   8.417 -10.090
  748   1HG   LYS  94          1HG       LYS  94  -5.081   7.971  -8.182
  749   2HG   LYS  94          2HG       LYS  94  -4.177   9.411  -7.710
  750   1HD   LYS  94          1HD       LYS  94  -5.312   8.912 -10.461
  751   2HD   LYS  94          2HD       LYS  94  -6.080   9.903  -9.218
  752   1HE   LYS  94          1HE       LYS  94  -4.201  11.425  -9.222
  753   2HE   LYS  94          2HE       LYS  94  -3.335  10.399 -10.364
  754   1HZ   LYS  94          1HZ       LYS  94  -5.981  11.483 -11.068
  755   2HZ   LYS  94          2HZ       LYS  94  -4.721  10.999 -12.087
  756   3HZ   LYS  94          3HZ       LYS  94  -4.603  12.451 -11.227
  757    H    GLU  95           H        GLU  95  -2.668   6.334 -11.452
  758    HA   GLU  95           HA       GLU  95  -5.334   5.886 -12.347
  759   1HB   GLU  95          1HB       GLU  95  -2.661   5.545 -13.708
  760   2HB   GLU  95          2HB       GLU  95  -4.199   5.302 -14.523
  761   1HG   GLU  95          1HG       GLU  95  -3.627   7.875 -13.118
  762   2HG   GLU  95          2HG       GLU  95  -2.989   7.573 -14.733
  763    H    TYR  96           H        TYR  96  -2.589   3.798 -11.629
  764    HA   TYR  96           HA       TYR  96  -3.524   1.409 -12.703
  765   1HB   TYR  96          1HB       TYR  96  -1.261   1.574 -11.903
  766   2HB   TYR  96          2HB       TYR  96  -1.810   1.912 -10.265
  767    HD1  TYR  96           1HD      TYR  96  -2.782   0.115  -8.887
  768    HD2  TYR  96           2HD      TYR  96  -1.174  -0.670 -12.747
  769    HE1  TYR  96           1HE      TYR  96  -2.711  -2.287  -8.363
  770    HE2  TYR  96           2HE      TYR  96  -1.100  -3.074 -12.234
  771    HH   TYR  96           HH       TYR  96  -2.727  -4.555 -10.120
  772    H    CYS  97           H        CYS  97  -4.053   2.786  -9.475
  773    HA   CYS  97           HA       CYS  97  -5.620   0.629  -8.513
  774   1HB   CYS  97          1HB       CYS  97  -4.462   2.308  -7.068
  775   2HB   CYS  97          2HB       CYS  97  -5.650   3.504  -7.573
  776    HG   CYS  97           HG       CYS  97  -6.405   0.629  -5.875
  777    H    SER  98           H        SER  98  -6.393   3.651 -10.147
  778    HA   SER  98           HA       SER  98  -9.227   3.359  -9.845
  779   1HB   SER  98          1HB       SER  98  -7.956   5.547 -10.192
  780   2HB   SER  98          2HB       SER  98  -7.829   5.086 -11.889
  781    HG   SER  98           HG       SER  98  -9.700   6.067 -11.982
  782    H    LYS  99           H        LYS  99  -6.928   1.913 -11.835
  783    HA   LYS  99           HA       LYS  99  -8.237   1.648 -14.282
  784   1HB   LYS  99          1HB       LYS  99  -5.898   0.980 -13.893
  785   2HB   LYS  99          2HB       LYS  99  -6.449  -0.363 -12.899
  786   1HG   LYS  99          1HG       LYS  99  -7.773  -0.528 -15.401
  787   2HG   LYS  99          2HG       LYS  99  -6.052  -0.278 -15.703
  788   1HD   LYS  99          1HD       LYS  99  -7.241  -2.408 -13.924
  789   2HD   LYS  99          2HD       LYS  99  -6.604  -2.660 -15.551
  790   1HE   LYS  99          1HE       LYS  99  -5.086  -1.813 -13.090
  791   2HE   LYS  99          2HE       LYS  99  -4.923  -3.323 -13.985
  792   1HZ   LYS  99          1HZ       LYS  99  -4.064  -0.612 -14.788
  793   2HZ   LYS  99          2HZ       LYS  99  -4.265  -1.845 -15.928
  794   3HZ   LYS  99          3HZ       LYS  99  -3.137  -2.023 -14.680
  795    H    GLU 100           H        GLU 100  -8.948   0.252 -11.223
  796    HA   GLU 100           HA       GLU 100 -10.385  -2.026 -12.161
  797   1HB   GLU 100          1HB       GLU 100 -10.510  -0.578  -9.510
  798   2HB   GLU 100          2HB       GLU 100 -11.263  -2.131  -9.844
  799   1HG   GLU 100          1HG       GLU 100  -9.366  -3.233  -9.511
  800   2HG   GLU 100          2HG       GLU 100  -8.449  -2.122 -10.527
  801    H    GLY 101           H        GLY 101 -11.088   1.310 -11.979
  802   1HA   GLY 101          1HA       GLY 101 -12.943   2.408 -12.848
  803   2HA   GLY 101          2HA       GLY 101 -13.736   0.853 -13.044
  804    H    ASN 102           H        ASN 102 -12.656   0.790  -9.981
  805    HA   ASN 102           HA       ASN 102 -14.974   2.215  -8.873
  806   1HB   ASN 102          1HB       ASN 102 -14.741  -0.590  -9.053
  807   2HB   ASN 102          2HB       ASN 102 -14.452  -0.183  -7.364
  808   1HD2  ASN 102          1HD2      ASN 102 -16.349  -1.009  -6.600
  809   2HD2  ASN 102          2HD2      ASN 102 -17.895  -0.322  -6.952
  810    H    LEU 103           H        LEU 103 -14.403   3.545  -7.291
  811    HA   LEU 103           HA       LEU 103 -11.770   3.222  -6.055
  812   1HB   LEU 103          1HB       LEU 103 -13.285   5.442  -6.947
  813   2HB   LEU 103          2HB       LEU 103 -13.100   5.593  -5.201
  814    HG   LEU 103           HG       LEU 103 -11.371   6.793  -6.534
  815   1HD1  LEU 103          1HD1      LEU 103 -10.669   6.453  -4.378
  816   2HD1  LEU 103          2HD1      LEU 103  -9.414   5.595  -5.271
  817   3HD1  LEU 103          3HD1      LEU 103 -10.730   4.696  -4.516
  818   1HD2  LEU 103          1HD2      LEU 103 -11.269   4.382  -7.949
  819   2HD2  LEU 103          2HD2      LEU 103  -9.735   4.493  -7.085
  820   3HD2  LEU 103          3HD2      LEU 103 -10.237   5.796  -8.162
  821    H    LEU 104           H        LEU 104 -11.477   2.848  -3.922
  822    HA   LEU 104           HA       LEU 104 -13.897   2.394  -2.315
  823   1HB   LEU 104          1HB       LEU 104 -12.460   0.442  -2.675
  824   2HB   LEU 104          2HB       LEU 104 -11.107   1.309  -1.952
  825    HG   LEU 104           HG       LEU 104 -12.536   1.426   0.163
  826   1HD1  LEU 104          1HD1      LEU 104 -14.449   0.239   0.366
  827   2HD1  LEU 104          2HD1      LEU 104 -13.930  -1.006  -0.770
  828   3HD1  LEU 104          3HD1      LEU 104 -14.538   0.537  -1.370
  829   1HD2  LEU 104          1HD2      LEU 104 -10.921  -0.034   0.647
  830   2HD2  LEU 104          2HD2      LEU 104 -10.968  -0.749  -0.964
  831   3HD2  LEU 104          3HD2      LEU 104 -12.100  -1.292   0.276
  832    H    MET 105           H        MET 105 -10.678   3.852  -2.245
  833    HA   MET 105           HA       MET 105 -11.607   5.721  -0.214
  834   1HB   MET 105          1HB       MET 105 -10.656   4.203   1.280
  835   2HB   MET 105          2HB       MET 105  -9.364   3.768   0.169
  836   1HG   MET 105          1HG       MET 105  -8.041   5.460   0.829
  837   2HG   MET 105          2HG       MET 105  -9.389   6.573   1.046
  838   1HE   MET 105          1HE       MET 105  -7.456   3.499   2.683
  839   2HE   MET 105          2HE       MET 105  -6.611   5.047   2.708
  840   3HE   MET 105          3HE       MET 105  -7.157   4.316   4.218
  841    H    GLU 106           H        GLU 106 -10.761   7.726  -0.449
  842    HA   GLU 106           HA       GLU 106  -8.462   8.055  -2.251
  843   1HB   GLU 106          1HB       GLU 106 -11.057   8.646  -2.987
  844   2HB   GLU 106          2HB       GLU 106 -10.437  10.201  -2.452
  845   1HG   GLU 106          1HG       GLU 106  -8.412   9.616  -3.972
  846   2HG   GLU 106          2HG       GLU 106  -9.539   8.485  -4.719
  847    H    CYS 107           H        CYS 107  -6.939   8.802  -0.912
  848    HA   CYS 107           HA       CYS 107  -7.397  11.336   0.421
  849   1HB   CYS 107          1HB       CYS 107  -6.888   8.771   1.879
  850   2HB   CYS 107          2HB       CYS 107  -6.221  10.269   2.517
  851    HG   CYS 107           HG       CYS 107  -9.017  11.373   2.233
  852    H    GLY 108           H        GLY 108  -5.230  11.940   1.638
  853   1HA   GLY 108          1HA       GLY 108  -2.962  12.330   1.516
  854   2HA   GLY 108          2HA       GLY 108  -2.815  10.856   0.571
  855    H    ALA 109           H        ALA 109  -1.159  12.571  -0.315
  856    HA   ALA 109           HA       ALA 109  -2.458  14.086  -2.480
  857   1HB   ALA 109          1HB       ALA 109   0.110  14.986  -2.459
  858   2HB   ALA 109          2HB       ALA 109  -1.232  15.745  -1.602
  859   3HB   ALA 109          3HB       ALA 109  -0.157  14.636  -0.752
  860    HA   PRO 110           HA       PRO 110  -0.655  11.571  -5.592
  861   1HB   PRO 110          1HB       PRO 110   0.037  13.391  -7.484
  862   2HB   PRO 110          2HB       PRO 110  -1.641  12.950  -7.142
  863   1HG   PRO 110          1HG       PRO 110  -0.081  15.330  -6.212
  864   2HG   PRO 110          2HG       PRO 110  -1.749  15.249  -6.807
  865   1HD   PRO 110          1HD       PRO 110  -1.148  15.384  -4.170
  866   2HD   PRO 110          2HD       PRO 110  -2.569  14.513  -4.782
  867    H    ARG 111           H        ARG 111   1.182  11.001  -4.185
  868    HA   ARG 111           HA       ARG 111   3.618  12.469  -4.296
  869   1HB   ARG 111          1HB       ARG 111   2.799   9.775  -3.295
  870   2HB   ARG 111          2HB       ARG 111   4.512  10.120  -3.495
  871   1HG   ARG 111          1HG       ARG 111   2.599  11.740  -1.827
  872   2HG   ARG 111          2HG       ARG 111   3.727  10.532  -1.209
  873   1HD   ARG 111          1HD       ARG 111   5.073  12.318  -0.927
  874   2HD   ARG 111          2HD       ARG 111   5.413  12.071  -2.639
  875    HE   ARG 111           HE       ARG 111   3.179  13.742  -2.408
  876   1HH1  ARG 111          1HH1      ARG 111   6.600  13.771  -1.765
  877   2HH1  ARG 111          2HH1      ARG 111   6.760  15.482  -1.988
  878   1HH2  ARG 111          1HH2      ARG 111   3.376  15.995  -2.704
  879   2HH2  ARG 111          2HH2      ARG 111   4.926  16.746  -2.521
  880    H    SER 112           H        SER 112   4.976  12.605  -5.944
  881    HA   SER 112           HA       SER 112   5.005  10.428  -7.930
  882   1HB   SER 112          1HB       SER 112   4.306  12.895  -8.533
  883   2HB   SER 112          2HB       SER 112   6.048  13.166  -8.552
  884    HG   SER 112           HG       SER 112   5.254  12.561 -10.610
  885    H    GLN 113           H        GLN 113   6.978   9.685  -8.722
  886    HA   GLN 113           HA       GLN 113   9.213  10.068  -6.897
  887   1HB   GLN 113          1HB       GLN 113   8.457   7.786  -7.614
  888   2HB   GLN 113          2HB       GLN 113   9.002   8.174  -9.240
  889   1HG   GLN 113          1HG       GLN 113  10.958   8.533  -7.054
  890   2HG   GLN 113          2HG       GLN 113  10.509   6.879  -7.469
  891   1HE2  GLN 113          1HE2      GLN 113  12.864   8.911  -7.928
  892   2HE2  GLN 113          2HE2      GLN 113  13.315   8.575  -9.562
  893    H    GLY 114           H        GLY 114   9.717  12.238  -7.581
  894   1HA   GLY 114          1HA       GLY 114  11.892  12.489  -9.230
  895   2HA   GLY 114          2HA       GLY 114  10.512  12.766 -10.284
  896    H    GLN 115           H        GLN 115  11.803  14.870 -10.409
  897    HA   GLN 115           HA       GLN 115  10.406  16.821  -8.821
  898   1HB   GLN 115          1HB       GLN 115  12.348  17.896  -7.866
  899   2HB   GLN 115          2HB       GLN 115  12.310  16.214  -7.353
  900   1HG   GLN 115          1HG       GLN 115  13.823  16.155  -9.659
  901   2HG   GLN 115          2HG       GLN 115  14.315  17.653  -8.871
  902   1HE2  GLN 115          1HE2      GLN 115  15.026  14.491  -9.143
  903   2HE2  GLN 115          2HE2      GLN 115  15.809  14.222  -7.628
  904    H    ARG 116           H        ARG 116  11.324  19.107  -9.411
  905    HA   ARG 116           HA       ARG 116  11.555  19.144 -12.330
  906   1HB   ARG 116          1HB       ARG 116   9.749  20.429 -11.005
  907   2HB   ARG 116          2HB       ARG 116  11.045  21.545 -10.594
  908   1HG   ARG 116          1HG       ARG 116  10.116  22.548 -12.441
  909   2HG   ARG 116          2HG       ARG 116  11.437  21.624 -13.159
  910   1HD   ARG 116          1HD       ARG 116   8.949  20.115 -12.928
  911   2HD   ARG 116          2HD       ARG 116   8.808  21.547 -13.947
  912    HE   ARG 116           HE       ARG 116  11.106  20.290 -14.770
  913   1HH1  ARG 116          1HH1      ARG 116   7.739  19.445 -14.508
  914   2HH1  ARG 116          2HH1      ARG 116   7.780  18.335 -15.837
  915   1HH2  ARG 116          1HH2      ARG 116  11.172  18.831 -16.522
  916   2HH2  ARG 116          2HH2      ARG 116   9.733  17.986 -16.982
  Start of MODEL    3
    1    HA   PRO   2           HA       PRO   2  34.067   0.886  21.631
    2   1HB   PRO   2          1HB       PRO   2  31.373   1.075  21.362
    3   2HB   PRO   2          2HB       PRO   2  32.158   0.651  22.887
    4   1HG   PRO   2          1HG       PRO   2  31.080   3.293  21.982
    5   2HG   PRO   2          2HG       PRO   2  30.932   2.507  23.565
    6   1HD   PRO   2          1HD       PRO   2  32.725   4.477  23.079
    7   2HD   PRO   2          2HD       PRO   2  33.041   3.161  24.227
    8    H    SER   3           H        SER   3  32.392   0.306  19.695
    9    HA   SER   3           HA       SER   3  32.337   2.395  17.679
   10   1HB   SER   3          1HB       SER   3  34.117  -0.019  17.520
   11   2HB   SER   3          2HB       SER   3  33.459   0.695  16.048
   12    HG   SER   3           HG       SER   3  35.183   1.910  16.253
   13    H    LYS   4           H        LYS   4  31.080   1.816  15.804
   14    HA   LYS   4           HA       LYS   4  29.433  -0.593  16.105
   15   1HB   LYS   4          1HB       LYS   4  28.524   2.241  16.089
   16   2HB   LYS   4          2HB       LYS   4  27.542   1.070  15.219
   17   1HG   LYS   4          1HG       LYS   4  26.596   0.451  17.117
   18   2HG   LYS   4          2HG       LYS   4  28.169  -0.040  17.749
   19   1HD   LYS   4          1HD       LYS   4  28.421   2.558  18.159
   20   2HD   LYS   4          2HD       LYS   4  26.657   2.493  18.156
   21   1HE   LYS   4          1HE       LYS   4  27.286   0.378  19.755
   22   2HE   LYS   4          2HE       LYS   4  28.584   1.509  20.137
   23   1HZ   LYS   4          1HZ       LYS   4  26.233   2.977  20.089
   24   2HZ   LYS   4          2HZ       LYS   4  27.165   2.571  21.440
   25   3HZ   LYS   4          3HZ       LYS   4  25.887   1.571  20.964
   26    H    LYS   5           H        LYS   5  29.867  -1.721  14.325
   27    HA   LYS   5           HA       LYS   5  30.246  -0.309  11.784
   28   1HB   LYS   5          1HB       LYS   5  31.557  -2.491  12.968
   29   2HB   LYS   5          2HB       LYS   5  30.633  -3.169  11.634
   30   1HG   LYS   5          1HG       LYS   5  31.929  -2.204  10.073
   31   2HG   LYS   5          2HG       LYS   5  32.130  -0.718  11.005
   32   1HD   LYS   5          1HD       LYS   5  33.435  -3.134  12.096
   33   2HD   LYS   5          2HD       LYS   5  34.107  -2.495  10.594
   34   1HE   LYS   5          1HE       LYS   5  33.757  -0.232  12.099
   35   2HE   LYS   5          2HE       LYS   5  34.217  -1.425  13.313
   36   1HZ   LYS   5          1HZ       LYS   5  36.300  -1.487  12.558
   37   2HZ   LYS   5          2HZ       LYS   5  35.938  -0.045  11.753
   38   3HZ   LYS   5          3HZ       LYS   5  35.830  -1.521  10.933
   39    H    ASN   6           H        ASN   6  29.413  -1.607   9.824
   40    HA   ASN   6           HA       ASN   6  26.865  -2.930  10.343
   41   1HB   ASN   6          1HB       ASN   6  27.102  -0.206   9.413
   42   2HB   ASN   6          2HB       ASN   6  26.323  -1.205   8.189
   43   1HD2  ASN   6          1HD2      ASN   6  24.455  -2.448   8.842
   44   2HD2  ASN   6          2HD2      ASN   6  23.429  -1.840  10.092
   45    H    GLY   7           H        GLY   7  25.860  -3.504   8.057
   46   1HA   GLY   7          1HA       GLY   7  27.015  -3.830   5.703
   47   2HA   GLY   7          2HA       GLY   7  27.983  -4.944   6.658
   48    H    ARG   8           H        ARG   8  25.085  -4.491   4.932
   49    HA   ARG   8           HA       ARG   8  24.392  -7.273   5.283
   50   1HB   ARG   8          1HB       ARG   8  22.020  -6.747   5.886
   51   2HB   ARG   8          2HB       ARG   8  23.184  -6.392   7.155
   52   1HG   ARG   8          1HG       ARG   8  23.151  -4.002   6.356
   53   2HG   ARG   8          2HG       ARG   8  21.773  -4.451   5.349
   54   1HD   ARG   8          1HD       ARG   8  20.527  -5.132   7.319
   55   2HD   ARG   8          2HD       ARG   8  21.916  -4.773   8.344
   56    HE   ARG   8           HE       ARG   8  21.432  -2.421   7.088
   57   1HH1  ARG   8          1HH1      ARG   8  19.462  -4.617   8.936
   58   2HH1  ARG   8          2HH1      ARG   8  18.415  -3.375   9.541
   59   1HH2  ARG   8          1HH2      ARG   8  20.061  -0.777   7.877
   60   2HH2  ARG   8          2HH2      ARG   8  18.756  -1.192   8.937
   61    H    SER   9           H        SER   9  22.691  -7.964   3.790
   62    HA   SER   9           HA       SER   9  22.300  -6.114   1.536
   63   1HB   SER   9          1HB       SER   9  23.310  -8.951   1.463
   64   2HB   SER   9          2HB       SER   9  22.531  -8.217   0.062
   65    HG   SER   9           HG       SER   9  24.735  -7.052   1.410
   66    H    GLY  10           H        GLY  10  20.738  -7.462  -0.111
   67   1HA   GLY  10          1HA       GLY  10  18.753  -8.764  -0.289
   68   2HA   GLY  10          2HA       GLY  10  18.572  -8.674   1.456
   69    HA   PRO  11           HA       PRO  11  15.599  -5.685  -0.477
   70   1HB   PRO  11          1HB       PRO  11  13.480  -6.447   1.040
   71   2HB   PRO  11          2HB       PRO  11  13.912  -7.245  -0.477
   72   1HG   PRO  11          1HG       PRO  11  14.504  -8.078   2.336
   73   2HG   PRO  11          2HG       PRO  11  13.962  -9.066   0.968
   74   1HD   PRO  11          1HD       PRO  11  16.547  -8.980   1.769
   75   2HD   PRO  11          2HD       PRO  11  16.081  -9.212   0.071
   76    H    GLN  12           H        GLN  12  15.017  -3.727   0.368
   77    HA   GLN  12           HA       GLN  12  15.513  -3.318   3.243
   78   1HB   GLN  12          1HB       GLN  12  16.106  -0.921   2.491
   79   2HB   GLN  12          2HB       GLN  12  17.291  -2.194   2.235
   80   1HG   GLN  12          1HG       GLN  12  15.417  -1.726   0.015
   81   2HG   GLN  12          2HG       GLN  12  16.553  -0.422   0.356
   82   1HE2  GLN  12          1HE2      GLN  12  16.107  -3.026  -1.506
   83   2HE2  GLN  12          2HE2      GLN  12  17.746  -3.496  -1.788
   84    HA   PRO  13           HA       PRO  13  11.510  -1.568   3.628
   85   1HB   PRO  13          1HB       PRO  13  11.933   0.401   5.448
   86   2HB   PRO  13          2HB       PRO  13  11.952  -1.316   5.868
   87   1HG   PRO  13          1HG       PRO  13  14.249   0.530   5.342
   88   2HG   PRO  13          2HG       PRO  13  14.066  -0.694   6.612
   89   1HD   PRO  13          1HD       PRO  13  15.517  -1.129   4.368
   90   2HD   PRO  13          2HD       PRO  13  14.635  -2.425   5.200
   91    H    HIS  14           H        HIS  14  10.273  -0.114   2.581
   92    HA   HIS  14           HA       HIS  14  11.558   2.351   1.603
   93   1HB   HIS  14          1HB       HIS  14   9.449   0.821   0.080
   94   2HB   HIS  14          2HB       HIS  14  10.454   2.147  -0.500
   95    HD1  HIS  14           1HD      HIS  14  10.178  -1.360  -0.793
   96    HD2  HIS  14           2HD      HIS  14  13.375   1.255  -0.343
   97    HE1  HIS  14           1HE      HIS  14  12.200  -2.628  -1.585
   98    H    LYS  15           H        LYS  15   9.686   3.849   0.685
   99    HA   LYS  15           HA       LYS  15   7.766   4.124   2.891
  100   1HB   LYS  15          1HB       LYS  15   7.538   6.486   2.004
  101   2HB   LYS  15          2HB       LYS  15   9.101   6.075   2.697
  102   1HG   LYS  15          1HG       LYS  15   9.077   5.512  -0.121
  103   2HG   LYS  15          2HG       LYS  15   8.590   7.180   0.187
  104   1HD   LYS  15          1HD       LYS  15  10.687   6.976   1.870
  105   2HD   LYS  15          2HD       LYS  15  11.191   5.851   0.607
  106   1HE   LYS  15          1HE       LYS  15  12.035   8.074   0.134
  107   2HE   LYS  15          2HE       LYS  15  10.838   7.609  -1.074
  108   1HZ   LYS  15          1HZ       LYS  15   9.735   9.008   1.190
  109   2HZ   LYS  15          2HZ       LYS  15   9.480   9.256  -0.464
  110   3HZ   LYS  15          3HZ       LYS  15  10.834   9.932   0.293
  111    H    ARG  16           H        ARG  16   7.606   2.463   0.318
  112    HA   ARG  16           HA       ARG  16   4.879   3.292  -0.347
  113   1HB   ARG  16          1HB       ARG  16   6.984   2.614  -2.409
  114   2HB   ARG  16          2HB       ARG  16   5.284   2.913  -2.744
  115   1HG   ARG  16          1HG       ARG  16   5.528   5.207  -1.928
  116   2HG   ARG  16          2HG       ARG  16   7.238   4.904  -1.612
  117   1HD   ARG  16          1HD       ARG  16   5.890   4.738  -4.306
  118   2HD   ARG  16          2HD       ARG  16   6.887   6.077  -3.739
  119    HE   ARG  16           HE       ARG  16   8.419   3.776  -3.517
  120   1HH1  ARG  16          1HH1      ARG  16   6.885   5.630  -6.033
  121   2HH1  ARG  16          2HH1      ARG  16   8.046   5.193  -7.242
  122   1HH2  ARG  16          1HH2      ARG  16   9.953   3.192  -5.101
  123   2HH2  ARG  16          2HH2      ARG  16   9.790   3.805  -6.712
  124    H    TRP  17           H        TRP  17   3.514   1.632  -0.261
  125    HA   TRP  17           HA       TRP  17   4.373  -1.040  -0.999
  126   1HB   TRP  17          1HB       TRP  17   3.477  -0.327   1.795
  127   2HB   TRP  17          2HB       TRP  17   3.436  -1.973   1.169
  128    HD1  TRP  17           HD       TRP  17   5.817   0.661   2.501
  129    HE1  TRP  17           1HE      TRP  17   8.152  -0.381   2.788
  130    HE3  TRP  17           3HE      TRP  17   5.007  -3.805   0.147
  131    HZ2  TRP  17           2HZ      TRP  17   9.477  -2.779   2.106
  132    HZ3  TRP  17           3HZ      TRP  17   6.861  -5.417   0.008
  133    HH2  TRP  17           HH       TRP  17   9.049  -4.913   0.967
  134    H    VAL  18           H        VAL  18   2.752  -2.219  -1.862
  135    HA   VAL  18           HA       VAL  18   0.066  -1.016  -1.817
  136    HB   VAL  18           HB       VAL  18  -0.371  -2.201  -3.907
  137   1HG1  VAL  18          1HG1      VAL  18   1.328  -1.012  -5.338
  138   2HG1  VAL  18          2HG1      VAL  18   0.475   0.000  -4.171
  139   3HG1  VAL  18          3HG1      VAL  18   2.127  -0.524  -3.843
  140   1HG2  VAL  18          1HG2      VAL  18   2.343  -2.969  -4.531
  141   2HG2  VAL  18          2HG2      VAL  18   1.741  -3.831  -3.115
  142   3HG2  VAL  18          3HG2      VAL  18   0.855  -3.910  -4.638
  143    H    PHE  19           H        PHE  19  -1.769  -2.527  -1.929
  144    HA   PHE  19           HA       PHE  19  -1.224  -5.142  -0.712
  145   1HB   PHE  19          1HB       PHE  19  -3.185  -4.787   0.808
  146   2HB   PHE  19          2HB       PHE  19  -1.810  -3.743   1.155
  147    HD1  PHE  19           1HD      PHE  19  -1.873  -1.358   0.395
  148    HD2  PHE  19           2HD      PHE  19  -5.287  -3.896   0.264
  149    HE1  PHE  19           1HE      PHE  19  -3.331   0.618   0.231
  150    HE2  PHE  19           2HE      PHE  19  -6.750  -1.925   0.099
  151    HZ   PHE  19           HZ       PHE  19  -5.773   0.335   0.081
  152    H    THR  20           H        THR  20  -2.656  -6.768  -1.245
  153    HA   THR  20           HA       THR  20  -4.998  -6.149  -2.853
  154    HB   THR  20           HB       THR  20  -4.380  -7.569  -4.715
  155    HG1  THR  20           1HG      THR  20  -2.008  -8.196  -4.703
  156   1HG2  THR  20          1HG2      THR  20  -3.690  -5.148  -4.693
  157   2HG2  THR  20          2HG2      THR  20  -2.745  -6.183  -5.764
  158   3HG2  THR  20          3HG2      THR  20  -2.082  -5.684  -4.208
  159    H    LEU  21           H        LEU  21  -6.614  -7.496  -2.376
  160    HA   LEU  21           HA       LEU  21  -6.005 -10.198  -1.427
  161   1HB   LEU  21          1HB       LEU  21  -6.262  -8.781   0.556
  162   2HB   LEU  21          2HB       LEU  21  -7.850  -8.275  -0.016
  163    HG   LEU  21           HG       LEU  21  -8.165 -10.970   0.064
  164   1HD1  LEU  21          1HD1      LEU  21  -7.155 -11.889   1.992
  165   2HD1  LEU  21          2HD1      LEU  21  -6.518 -10.324   2.496
  166   3HD1  LEU  21          3HD1      LEU  21  -5.857 -11.127   1.072
  167   1HD2  LEU  21          1HD2      LEU  21  -9.717 -10.510   1.649
  168   2HD2  LEU  21          2HD2      LEU  21  -9.353  -8.851   1.174
  169   3HD2  LEU  21          3HD2      LEU  21  -8.607  -9.540   2.616
  170    H    ASN  22           H        ASN  22  -7.423 -11.726  -2.093
  171    HA   ASN  22           HA       ASN  22  -9.436 -10.913  -4.010
  172   1HB   ASN  22          1HB       ASN  22  -9.504 -13.165  -4.698
  173   2HB   ASN  22          2HB       ASN  22  -7.816 -12.886  -4.280
  174   1HD2  ASN  22          1HD2      ASN  22  -9.908 -15.203  -4.216
  175   2HD2  ASN  22          2HD2      ASN  22  -9.561 -15.971  -2.708
  176    H    ASN  23           H        ASN  23 -11.594 -10.961  -3.734
  177    HA   ASN  23           HA       ASN  23 -13.581 -10.918  -2.616
  178   1HB   ASN  23          1HB       ASN  23 -13.364 -13.339  -3.057
  179   2HB   ASN  23          2HB       ASN  23 -12.542 -13.538  -1.513
  180   1HD2  ASN  23          1HD2      ASN  23 -15.559 -12.399  -2.953
  181   2HD2  ASN  23          2HD2      ASN  23 -16.569 -12.855  -1.628
  182    HA   PRO  24           HA       PRO  24 -11.509  -9.432   1.305
  183   1HB   PRO  24          1HB       PRO  24 -12.236  -6.833   1.015
  184   2HB   PRO  24          2HB       PRO  24 -10.750  -7.497   0.327
  185   1HG   PRO  24          1HG       PRO  24 -13.385  -6.978  -0.997
  186   2HG   PRO  24          2HG       PRO  24 -11.748  -6.655  -1.598
  187   1HD   PRO  24          1HD       PRO  24 -13.188  -8.810  -2.382
  188   2HD   PRO  24          2HD       PRO  24 -11.418  -8.841  -2.247
  189    H    SER  25           H        SER  25 -12.554  -9.019   3.227
  190    HA   SER  25           HA       SER  25 -15.454  -9.307   3.168
  191   1HB   SER  25          1HB       SER  25 -13.333 -10.061   4.990
  192   2HB   SER  25          2HB       SER  25 -14.611  -9.192   5.839
  193    HG   SER  25           HG       SER  25 -15.994 -10.764   5.410
  194    H    GLU  26           H        GLU  26 -16.818  -7.979   4.541
  195    HA   GLU  26           HA       GLU  26 -16.526  -5.253   4.095
  196   1HB   GLU  26          1HB       GLU  26 -18.379  -4.941   5.641
  197   2HB   GLU  26          2HB       GLU  26 -18.673  -6.338   4.615
  198   1HG   GLU  26          1HG       GLU  26 -17.393  -7.391   6.830
  199   2HG   GLU  26          2HG       GLU  26 -18.467  -6.161   7.494
  200    H    ASP  27           H        ASP  27 -15.366  -7.237   6.713
  201    HA   ASP  27           HA       ASP  27 -14.714  -5.026   8.434
  202   1HB   ASP  27          1HB       ASP  27 -14.059  -7.970   8.514
  203   2HB   ASP  27          2HB       ASP  27 -13.446  -6.831   9.709
  204    H    GLU  28           H        GLU  28 -12.982  -7.116   6.179
  205    HA   GLU  28           HA       GLU  28 -10.379  -6.239   6.765
  206   1HB   GLU  28          1HB       GLU  28 -11.601  -7.987   4.913
  207   2HB   GLU  28          2HB       GLU  28 -10.646  -6.852   3.971
  208   1HG   GLU  28          1HG       GLU  28  -9.689  -8.658   6.174
  209   2HG   GLU  28          2HG       GLU  28  -9.289  -8.744   4.459
  210    H    ARG  29           H        ARG  29 -12.674  -5.152   4.273
  211    HA   ARG  29           HA       ARG  29 -10.990  -3.109   3.257
  212   1HB   ARG  29          1HB       ARG  29 -14.004  -3.289   3.097
  213   2HB   ARG  29          2HB       ARG  29 -12.955  -2.334   2.058
  214   1HG   ARG  29          1HG       ARG  29 -12.121  -4.219   0.964
  215   2HG   ARG  29          2HG       ARG  29 -12.685  -5.312   2.230
  216   1HD   ARG  29          1HD       ARG  29 -14.017  -5.327   0.089
  217   2HD   ARG  29          2HD       ARG  29 -14.941  -5.066   1.567
  218    HE   ARG  29           HE       ARG  29 -14.155  -2.606   0.369
  219   1HH1  ARG  29          1HH1      ARG  29 -16.457  -5.208   0.146
  220   2HH1  ARG  29          2HH1      ARG  29 -17.677  -4.238  -0.610
  221   1HH2  ARG  29          1HH2      ARG  29 -15.753  -1.318  -0.626
  222   2HH2  ARG  29          2HH2      ARG  29 -17.275  -2.026  -1.049
  223    H    LYS  30           H        LYS  30 -13.336  -3.249   5.843
  224    HA   LYS  30           HA       LYS  30 -13.614  -0.442   6.206
  225   1HB   LYS  30          1HB       LYS  30 -14.349  -2.887   7.731
  226   2HB   LYS  30          2HB       LYS  30 -14.265  -1.376   8.628
  227   1HG   LYS  30          1HG       LYS  30 -15.910  -0.370   7.204
  228   2HG   LYS  30          2HG       LYS  30 -15.907  -1.776   6.137
  229   1HD   LYS  30          1HD       LYS  30 -16.677  -3.148   8.086
  230   2HD   LYS  30          2HD       LYS  30 -16.858  -1.647   8.996
  231   1HE   LYS  30          1HE       LYS  30 -18.186  -1.156   6.616
  232   2HE   LYS  30          2HE       LYS  30 -18.592  -2.830   6.991
  233   1HZ   LYS  30          1HZ       LYS  30 -20.110  -1.998   8.360
  234   2HZ   LYS  30          2HZ       LYS  30 -19.491  -0.429   8.242
  235   3HZ   LYS  30          3HZ       LYS  30 -18.845  -1.509   9.371
  236    H    LYS  31           H        LYS  31 -11.543  -2.908   7.671
  237    HA   LYS  31           HA       LYS  31 -10.352  -1.268   9.621
  238   1HB   LYS  31          1HB       LYS  31 -10.111  -3.627   9.834
  239   2HB   LYS  31          2HB       LYS  31  -9.413  -3.771   8.226
  240   1HG   LYS  31          1HG       LYS  31  -7.425  -2.559   8.989
  241   2HG   LYS  31          2HG       LYS  31  -8.125  -2.447  10.606
  242   1HD   LYS  31          1HD       LYS  31  -7.547  -4.551  11.112
  243   2HD   LYS  31          2HD       LYS  31  -8.098  -5.167   9.553
  244   1HE   LYS  31          1HE       LYS  31  -5.728  -5.548   9.769
  245   2HE   LYS  31          2HE       LYS  31  -6.011  -4.329   8.528
  246   1HZ   LYS  31          1HZ       LYS  31  -4.172  -3.772  10.047
  247   2HZ   LYS  31          2HZ       LYS  31  -5.266  -3.720  11.336
  248   3HZ   LYS  31          3HZ       LYS  31  -5.405  -2.613  10.064
  249    H    ILE  32           H        ILE  32  -9.193  -2.199   6.382
  250    HA   ILE  32           HA       ILE  32  -6.865  -0.620   6.434
  251    HB   ILE  32           HB       ILE  32  -8.479  -1.818   4.207
  252   1HG1  ILE  32          1HG1      ILE  32  -5.616  -2.245   5.086
  253   2HG1  ILE  32          2HG1      ILE  32  -6.976  -3.223   5.628
  254   1HG2  ILE  32          1HG2      ILE  32  -7.746   0.124   3.135
  255   2HG2  ILE  32          2HG2      ILE  32  -6.199   0.116   3.980
  256   3HG2  ILE  32          3HG2      ILE  32  -6.524  -1.079   2.724
  257   1HD1  ILE  32          1HD1      ILE  32  -5.371  -3.689   3.431
  258   2HD1  ILE  32          2HD1      ILE  32  -6.913  -4.464   3.793
  259   3HD1  ILE  32          3HD1      ILE  32  -6.863  -3.047   2.745
  260    H    ARG  33           H        ARG  33 -10.145   0.051   5.298
  261    HA   ARG  33           HA       ARG  33  -9.523   2.624   4.238
  262   1HB   ARG  33          1HB       ARG  33 -11.446   1.470   3.385
  263   2HB   ARG  33          2HB       ARG  33 -12.136   1.316   4.996
  264   1HG   ARG  33          1HG       ARG  33 -12.578   3.656   5.111
  265   2HG   ARG  33          2HG       ARG  33 -11.674   3.952   3.625
  266   1HD   ARG  33          1HD       ARG  33 -13.755   3.914   2.727
  267   2HD   ARG  33          2HD       ARG  33 -13.441   2.179   2.695
  268    HE   ARG  33           HE       ARG  33 -15.108   1.905   4.226
  269   1HH1  ARG  33          1HH1      ARG  33 -14.056   5.222   4.308
  270   2HH1  ARG  33          2HH1      ARG  33 -15.290   5.723   5.417
  271   1HH2  ARG  33          1HH2      ARG  33 -16.738   2.551   5.686
  272   2HH2  ARG  33          2HH2      ARG  33 -16.814   4.202   6.200
  273    H    ASP  34           H        ASP  34 -10.172   1.414   7.387
  274    HA   ASP  34           HA       ASP  34 -10.803   4.068   8.437
  275   1HB   ASP  34          1HB       ASP  34 -10.870   1.302   9.631
  276   2HB   ASP  34          2HB       ASP  34 -11.019   2.748  10.626
  277    H    LEU  35           H        LEU  35  -8.087   2.707   7.526
  278    HA   LEU  35           HA       LEU  35  -6.414   2.780   9.807
  279   1HB   LEU  35          1HB       LEU  35  -5.971   2.793   6.856
  280   2HB   LEU  35          2HB       LEU  35  -4.620   3.139   7.934
  281    HG   LEU  35           HG       LEU  35  -6.268   0.613   8.011
  282   1HD1  LEU  35          1HD1      LEU  35  -3.574   1.158   6.774
  283   2HD1  LEU  35          2HD1      LEU  35  -5.055   0.703   5.932
  284   3HD1  LEU  35          3HD1      LEU  35  -4.270  -0.445   7.017
  285   1HD2  LEU  35          1HD2      LEU  35  -4.460  -0.212   9.435
  286   2HD2  LEU  35          2HD2      LEU  35  -5.246   1.197  10.147
  287   3HD2  LEU  35          3HD2      LEU  35  -3.676   1.366   9.360
  288    HA   PRO  36           HA       PRO  36  -5.526   7.036  10.395
  289   1HB   PRO  36          1HB       PRO  36  -2.865   7.012  10.931
  290   2HB   PRO  36          2HB       PRO  36  -4.078   6.408  12.065
  291   1HG   PRO  36          1HG       PRO  36  -2.338   4.885  10.163
  292   2HG   PRO  36          2HG       PRO  36  -2.747   4.514  11.848
  293   1HD   PRO  36          1HD       PRO  36  -3.962   3.302   9.754
  294   2HD   PRO  36          2HD       PRO  36  -4.798   3.623  11.287
  295    H    ILE  37           H        ILE  37  -5.578   8.470   8.784
  296    HA   ILE  37           HA       ILE  37  -4.185   8.154   6.334
  297    HB   ILE  37           HB       ILE  37  -4.907  10.539   5.917
  298   1HG1  ILE  37          1HG1      ILE  37  -6.368  10.167   8.539
  299   2HG1  ILE  37          2HG1      ILE  37  -4.943  11.181   8.334
  300   1HG2  ILE  37          1HG2      ILE  37  -7.446   9.410   6.611
  301   2HG2  ILE  37          2HG2      ILE  37  -6.701   9.587   5.024
  302   3HG2  ILE  37          3HG2      ILE  37  -6.380   8.149   5.992
  303   1HD1  ILE  37          1HD1      ILE  37  -6.434  12.810   8.011
  304   2HD1  ILE  37          2HD1      ILE  37  -6.567  12.140   6.385
  305   3HD1  ILE  37          3HD1      ILE  37  -7.734  11.682   7.626
  306    H    SER  38           H        SER  38  -3.533   9.937   9.284
  307    HA   SER  38           HA       SER  38  -1.439  11.552   8.284
  308   1HB   SER  38          1HB       SER  38  -1.395  10.663  11.130
  309   2HB   SER  38          2HB       SER  38  -1.168  12.275  10.451
  310    HG   SER  38           HG       SER  38  -3.286  11.511  11.603
  311    H    LEU  39           H        LEU  39  -1.607   8.233   9.180
  312    HA   LEU  39           HA       LEU  39   1.163   7.843   9.734
  313   1HB   LEU  39          1HB       LEU  39  -1.049   6.366  10.146
  314   2HB   LEU  39          2HB       LEU  39  -0.426   5.581   8.696
  315    HG   LEU  39           HG       LEU  39   1.493   5.998  10.912
  316   1HD1  LEU  39          1HD1      LEU  39   0.714   4.081  12.152
  317   2HD1  LEU  39          2HD1      LEU  39  -0.640   3.872  11.041
  318   3HD1  LEU  39          3HD1      LEU  39  -0.563   5.296  12.079
  319   1HD2  LEU  39          1HD2      LEU  39   1.256   4.455   8.532
  320   2HD2  LEU  39          2HD2      LEU  39   1.403   3.355   9.903
  321   3HD2  LEU  39          3HD2      LEU  39   2.631   4.593   9.628
  322    H    PHE  40           H        PHE  40  -0.782   7.890   6.850
  323    HA   PHE  40           HA       PHE  40   1.630   7.288   5.269
  324   1HB   PHE  40          1HB       PHE  40  -1.146   6.705   4.270
  325   2HB   PHE  40          2HB       PHE  40   0.389   6.059   3.698
  326    HD1  PHE  40           2HD      PHE  40  -2.180   5.845   6.305
  327    HD2  PHE  40           1HD      PHE  40   1.427   4.186   4.770
  328    HE1  PHE  40           2HE      PHE  40  -2.489   3.863   7.730
  329    HE2  PHE  40           1HE      PHE  40   1.123   2.201   6.192
  330    HZ   PHE  40           HZ       PHE  40  -0.837   2.038   7.675
  331    H    ASP  41           H        ASP  41   2.304   9.054   4.267
  332    HA   ASP  41           HA       ASP  41   0.959  11.453   4.034
  333   1HB   ASP  41          1HB       ASP  41   3.458  10.444   3.254
  334   2HB   ASP  41          2HB       ASP  41   2.734  11.084   1.782
  335    H    TYR  42           H        TYR  42   0.780   8.629   2.010
  336    HA   TYR  42           HA       TYR  42  -1.342   9.925   0.460
  337   1HB   TYR  42          1HB       TYR  42   0.661  10.055  -0.931
  338   2HB   TYR  42          2HB       TYR  42   0.932   8.327  -0.736
  339    HD1  TYR  42           1HD      TYR  42  -2.362   9.908  -1.308
  340    HD2  TYR  42           2HD      TYR  42   0.839   7.688  -3.021
  341    HE1  TYR  42           1HE      TYR  42  -3.737   9.473  -3.300
  342    HE2  TYR  42           2HE      TYR  42  -0.528   7.248  -5.018
  343    HH   TYR  42           HH       TYR  42  -2.568   7.401  -5.923
  344    H    PHE  43           H        PHE  43  -3.125   8.735   0.451
  345    HA   PHE  43           HA       PHE  43  -2.891   5.814   0.657
  346   1HB   PHE  43          1HB       PHE  43  -3.604   7.263   2.812
  347   2HB   PHE  43          2HB       PHE  43  -5.182   7.076   2.055
  348    HD1  PHE  43           1HD      PHE  43  -4.229   4.288   0.837
  349    HD2  PHE  43           2HD      PHE  43  -4.413   5.977   4.740
  350    HE1  PHE  43           1HE      PHE  43  -4.423   2.033   1.800
  351    HE2  PHE  43           2HE      PHE  43  -4.606   3.724   5.709
  352    HZ   PHE  43           HZ       PHE  43  -4.611   1.748   4.239
  353    H    ILE  44           H        ILE  44  -3.783   4.965  -1.094
  354    HA   ILE  44           HA       ILE  44  -6.342   6.040  -2.044
  355    HB   ILE  44           HB       ILE  44  -4.873   7.024  -3.599
  356   1HG1  ILE  44          1HG1      ILE  44  -5.338   4.603  -5.228
  357   2HG1  ILE  44          2HG1      ILE  44  -6.757   5.236  -4.400
  358   1HG2  ILE  44          1HG2      ILE  44  -2.798   6.049  -3.201
  359   2HG2  ILE  44          2HG2      ILE  44  -3.402   4.418  -3.483
  360   3HG2  ILE  44          3HG2      ILE  44  -3.187   5.525  -4.839
  361   1HD1  ILE  44          1HD1      ILE  44  -5.283   7.355  -5.669
  362   2HD1  ILE  44          2HD1      ILE  44  -5.699   6.087  -6.822
  363   3HD1  ILE  44          3HD1      ILE  44  -6.966   6.869  -5.876
  364    H    VAL  45           H        VAL  45  -7.781   4.457  -1.997
  365    HA   VAL  45           HA       VAL  45  -6.887   1.717  -2.623
  366    HB   VAL  45           HB       VAL  45  -9.258   2.293  -0.873
  367   1HG1  VAL  45          1HG1      VAL  45  -9.413   0.080  -0.789
  368   2HG1  VAL  45          2HG1      VAL  45  -8.096  -0.028  -1.958
  369   3HG1  VAL  45          3HG1      VAL  45  -7.747  -0.051  -0.229
  370   1HG2  VAL  45          1HG2      VAL  45  -6.361   2.233  -0.102
  371   2HG2  VAL  45          2HG2      VAL  45  -7.607   3.394   0.357
  372   3HG2  VAL  45          3HG2      VAL  45  -7.622   1.768   1.039
  373    H    GLY  46           H        GLY  46  -8.087   0.530  -4.042
  374   1HA   GLY  46          1HA       GLY  46 -10.569   1.748  -5.067
  375   2HA   GLY  46          2HA       GLY  46  -9.309   1.233  -6.179
  376    H    GLU  47           H        GLU  47 -12.210   0.374  -5.353
  377    HA   GLU  47           HA       GLU  47 -11.749  -2.442  -4.787
  378   1HB   GLU  47          1HB       GLU  47 -13.572  -1.436  -3.596
  379   2HB   GLU  47          2HB       GLU  47 -14.265  -0.801  -5.082
  380   1HG   GLU  47          1HG       GLU  47 -14.900  -2.967  -5.812
  381   2HG   GLU  47          2HG       GLU  47 -13.974  -3.739  -4.527
  382    H    GLU  48           H        GLU  48 -11.900  -4.060  -6.232
  383    HA   GLU  48           HA       GLU  48 -12.413  -3.314  -9.024
  384   1HB   GLU  48          1HB       GLU  48 -10.235  -4.313  -8.625
  385   2HB   GLU  48          2HB       GLU  48 -10.981  -5.699  -7.843
  386   1HG   GLU  48          1HG       GLU  48 -12.085  -5.369 -10.460
  387   2HG   GLU  48          2HG       GLU  48 -10.325  -5.386 -10.552
  388    H    GLY  49           H        GLY  49 -14.133  -4.067 -10.096
  389   1HA   GLY  49          1HA       GLY  49 -15.437  -6.529  -9.287
  390   2HA   GLY  49          2HA       GLY  49 -16.387  -5.072  -9.038
  391    H    ASN  50           H        ASN  50 -14.726  -7.008 -11.481
  392    HA   ASN  50           HA       ASN  50 -15.605  -5.609 -13.744
  393   1HB   ASN  50          1HB       ASN  50 -13.964  -7.738 -13.333
  394   2HB   ASN  50          2HB       ASN  50 -15.373  -8.540 -14.023
  395   1HD2  ASN  50          1HD2      ASN  50 -12.685  -8.141 -15.110
  396   2HD2  ASN  50          2HD2      ASN  50 -12.903  -7.328 -16.618
  397    H    GLU  51           H        GLU  51 -16.920  -7.311 -15.402
  398    HA   GLU  51           HA       GLU  51 -19.595  -6.885 -14.826
  399   1HB   GLU  51          1HB       GLU  51 -20.083  -8.477 -16.641
  400   2HB   GLU  51          2HB       GLU  51 -18.813  -7.344 -17.081
  401   1HG   GLU  51          1HG       GLU  51 -17.363  -9.401 -16.064
  402   2HG   GLU  51          2HG       GLU  51 -18.726 -10.254 -16.785
  403    H    GLU  52           H        GLU  52 -21.261  -8.757 -14.779
  404    HA   GLU  52           HA       GLU  52 -21.211  -9.955 -12.292
  405   1HB   GLU  52          1HB       GLU  52 -23.123  -9.672 -14.091
  406   2HB   GLU  52          2HB       GLU  52 -22.672 -11.317 -14.514
  407   1HG   GLU  52          1HG       GLU  52 -22.880 -11.519 -11.823
  408   2HG   GLU  52          2HG       GLU  52 -24.098 -10.293 -12.168
  409    H    GLY  53           H        GLY  53 -21.005 -12.171 -11.632
  410   1HA   GLY  53          1HA       GLY  53 -20.249 -14.391 -11.887
  411   2HA   GLY  53          2HA       GLY  53 -19.539 -13.947 -13.433
  412    H    ARG  54           H        ARG  54 -18.308 -11.525 -12.145
  413    HA   ARG  54           HA       ARG  54 -15.935 -12.904 -11.154
  414   1HB   ARG  54          1HB       ARG  54 -15.716 -11.220 -12.961
  415   2HB   ARG  54          2HB       ARG  54 -16.320  -9.989 -11.859
  416   1HG   ARG  54          1HG       ARG  54 -14.255  -9.619 -11.166
  417   2HG   ARG  54          2HG       ARG  54 -14.168 -11.276 -10.566
  418   1HD   ARG  54          1HD       ARG  54 -13.575 -10.453 -13.405
  419   2HD   ARG  54          2HD       ARG  54 -12.350 -10.676 -12.157
  420    HE   ARG  54           HE       ARG  54 -13.845 -13.013 -12.261
  421   1HH1  ARG  54          1HH1      ARG  54 -11.737 -11.187 -14.345
  422   2HH1  ARG  54          2HH1      ARG  54 -11.184 -12.576 -15.219
  423   1HH2  ARG  54          1HH2      ARG  54 -13.124 -14.850 -13.404
  424   2HH2  ARG  54          2HH2      ARG  54 -11.973 -14.659 -14.684
  425    H    THR  55           H        THR  55 -15.184 -12.759  -9.115
  426    HA   THR  55           HA       THR  55 -16.928 -11.648  -7.105
  427    HB   THR  55           HB       THR  55 -14.649 -12.440  -5.769
  428    HG1  THR  55           1HG      THR  55 -13.642 -13.905  -6.920
  429   1HG2  THR  55          1HG2      THR  55 -16.576 -14.588  -6.374
  430   2HG2  THR  55          2HG2      THR  55 -17.276 -13.088  -5.765
  431   3HG2  THR  55          3HG2      THR  55 -16.053 -13.937  -4.821
  432    HA   PRO  56           HA       PRO  56 -14.916  -7.825  -6.328
  433   1HB   PRO  56          1HB       PRO  56 -15.048  -7.650  -3.622
  434   2HB   PRO  56          2HB       PRO  56 -16.462  -7.465  -4.666
  435   1HG   PRO  56          1HG       PRO  56 -15.551  -9.860  -3.118
  436   2HG   PRO  56          2HG       PRO  56 -17.188  -9.205  -3.305
  437   1HD   PRO  56          1HD       PRO  56 -16.300 -11.334  -4.723
  438   2HD   PRO  56          2HD       PRO  56 -17.475 -10.175  -5.376
  439    H    HIS  57           H        HIS  57 -12.898  -7.030  -6.035
  440    HA   HIS  57           HA       HIS  57 -10.998  -8.556  -4.404
  441   1HB   HIS  57          1HB       HIS  57 -10.518  -9.367  -6.586
  442   2HB   HIS  57          2HB       HIS  57 -10.643  -7.758  -7.291
  443    HD1  HIS  57           1HD      HIS  57  -8.503  -6.540  -7.601
  444    HD2  HIS  57           2HD      HIS  57  -8.162  -9.611  -4.823
  445    HE1  HIS  57           1HE      HIS  57  -6.062  -6.637  -7.001
  446    H    LEU  58           H        LEU  58  -9.527  -7.339  -3.312
  447    HA   LEU  58           HA       LEU  58  -9.905  -4.445  -3.431
  448   1HB   LEU  58          1HB       LEU  58  -9.624  -6.231  -1.339
  449   2HB   LEU  58          2HB       LEU  58  -8.056  -5.431  -1.417
  450    HG   LEU  58           HG       LEU  58 -10.744  -4.137  -0.984
  451   1HD1  LEU  58          1HD1      LEU  58  -9.948  -5.124   1.021
  452   2HD1  LEU  58          2HD1      LEU  58  -9.606  -3.398   1.130
  453   3HD1  LEU  58          3HD1      LEU  58  -8.310  -4.529   0.742
  454   1HD2  LEU  58          1HD2      LEU  58  -8.060  -2.969  -1.623
  455   2HD2  LEU  58          2HD2      LEU  58  -9.229  -2.077  -0.648
  456   3HD2  LEU  58          3HD2      LEU  58  -9.641  -2.564  -2.292
  457    H    GLN  59           H        GLN  59  -8.382  -3.044  -4.099
  458    HA   GLN  59           HA       GLN  59  -5.610  -3.838  -4.325
  459   1HB   GLN  59          1HB       GLN  59  -6.339  -4.685  -6.425
  460   2HB   GLN  59          2HB       GLN  59  -7.319  -3.259  -6.739
  461   1HG   GLN  59          1HG       GLN  59  -5.354  -3.195  -8.110
  462   2HG   GLN  59          2HG       GLN  59  -5.262  -1.916  -6.900
  463   1HE2  GLN  59          1HE2      GLN  59  -3.809  -2.140  -5.168
  464   2HE2  GLN  59          2HE2      GLN  59  -2.458  -3.213  -5.260
  465    H    GLY  60           H        GLY  60  -4.629  -2.180  -3.372
  466   1HA   GLY  60          1HA       GLY  60  -5.099   0.510  -4.391
  467   2HA   GLY  60          2HA       GLY  60  -5.441   0.258  -2.686
  468    H    PHE  61           H        PHE  61  -3.638   2.114  -3.156
  469    HA   PHE  61           HA       PHE  61  -1.096   0.815  -2.452
  470   1HB   PHE  61          1HB       PHE  61  -0.710   1.520  -4.676
  471   2HB   PHE  61          2HB       PHE  61  -1.553   3.045  -4.425
  472    HD1  PHE  61           2HD      PHE  61   1.255   1.258  -2.728
  473    HD2  PHE  61           1HD      PHE  61  -0.158   4.852  -4.518
  474    HE1  PHE  61           2HE      PHE  61   3.398   2.352  -2.215
  475    HE2  PHE  61           1HE      PHE  61   1.984   5.952  -4.008
  476    HZ   PHE  61           HZ       PHE  61   3.765   4.702  -2.854
  477    H    ALA  62           H        ALA  62   0.067   1.765  -0.832
  478    HA   ALA  62           HA       ALA  62  -0.936   4.293   0.278
  479   1HB   ALA  62          1HB       ALA  62  -0.257   2.950   2.541
  480   2HB   ALA  62          2HB       ALA  62  -1.900   3.101   1.915
  481   3HB   ALA  62          3HB       ALA  62  -0.950   1.657   1.561
  482    H    ASN  63           H        ASN  63   0.645   5.707   0.622
  483    HA   ASN  63           HA       ASN  63   3.411   4.792   0.478
  484   1HB   ASN  63          1HB       ASN  63   2.669   6.687  -0.942
  485   2HB   ASN  63          2HB       ASN  63   2.315   7.613   0.514
  486   1HD2  ASN  63          1HD2      ASN  63   4.395   7.540  -1.843
  487   2HD2  ASN  63          2HD2      ASN  63   5.866   7.948  -1.034
  488    H    PHE  64           H        PHE  64   4.405   4.290   2.308
  489    HA   PHE  64           HA       PHE  64   3.472   5.108   4.868
  490   1HB   PHE  64          1HB       PHE  64   5.443   3.281   3.810
  491   2HB   PHE  64          2HB       PHE  64   6.115   4.198   5.154
  492    HD1  PHE  64           2HD      PHE  64   4.703   4.286   7.312
  493    HD2  PHE  64           1HD      PHE  64   4.130   1.423   4.215
  494    HE1  PHE  64           2HE      PHE  64   3.546   2.804   8.900
  495    HE2  PHE  64           1HE      PHE  64   2.972  -0.063   5.797
  496    HZ   PHE  64           HZ       PHE  64   2.680   0.627   8.144
  497    H    VAL  65           H        VAL  65   3.967   6.846   6.039
  498    HA   VAL  65           HA       VAL  65   5.402   9.010   4.981
  499    HB   VAL  65           HB       VAL  65   4.635   8.438   7.846
  500   1HG1  VAL  65          1HG1      VAL  65   6.087  10.683   6.599
  501   2HG1  VAL  65          2HG1      VAL  65   4.800  11.118   7.725
  502   3HG1  VAL  65          3HG1      VAL  65   6.128  10.085   8.257
  503   1HG2  VAL  65          1HG2      VAL  65   2.822   8.649   6.083
  504   2HG2  VAL  65          2HG2      VAL  65   2.708   9.743   7.462
  505   3HG2  VAL  65          3HG2      VAL  65   3.320  10.332   5.916
  506    H    LYS  66           H        LYS  66   6.436   6.241   6.763
  507    HA   LYS  66           HA       LYS  66   9.161   7.354   6.864
  508   1HB   LYS  66          1HB       LYS  66   7.631   5.849   8.952
  509   2HB   LYS  66          2HB       LYS  66   9.379   5.676   8.872
  510   1HG   LYS  66          1HG       LYS  66   9.161   7.381  10.386
  511   2HG   LYS  66          2HG       LYS  66   9.357   8.283   8.881
  512   1HD   LYS  66          1HD       LYS  66   7.551   9.326   9.935
  513   2HD   LYS  66          2HD       LYS  66   6.792   8.249   8.761
  514   1HE   LYS  66          1HE       LYS  66   5.624   7.347  10.420
  515   2HE   LYS  66          2HE       LYS  66   7.132   6.736  11.099
  516   1HZ   LYS  66          1HZ       LYS  66   6.601   7.993  12.846
  517   2HZ   LYS  66          2HZ       LYS  66   5.470   8.911  11.987
  518   3HZ   LYS  66          3HZ       LYS  66   7.113   9.309  11.913
  519    H    LYS  67           H        LYS  67  10.663   5.267   7.464
  520    HA   LYS  67           HA       LYS  67  10.361   3.549   5.141
  521   1HB   LYS  67          1HB       LYS  67  12.585   3.698   7.185
  522   2HB   LYS  67          2HB       LYS  67  12.626   2.774   5.689
  523   1HG   LYS  67          1HG       LYS  67  12.084   5.683   5.498
  524   2HG   LYS  67          2HG       LYS  67  13.725   5.169   5.897
  525   1HD   LYS  67          1HD       LYS  67  13.419   3.555   3.876
  526   2HD   LYS  67          2HD       LYS  67  12.130   4.670   3.416
  527   1HE   LYS  67          1HE       LYS  67  13.597   6.165   2.666
  528   2HE   LYS  67          2HE       LYS  67  14.515   6.105   4.170
  529   1HZ   LYS  67          1HZ       LYS  67  15.800   4.318   3.373
  530   2HZ   LYS  67          2HZ       LYS  67  15.747   5.436   2.105
  531   3HZ   LYS  67          3HZ       LYS  67  14.778   4.050   2.051
  532    H    GLN  68           H        GLN  68   9.397   1.639   5.235
  533    HA   GLN  68           HA       GLN  68   9.531   0.106   7.740
  534   1HB   GLN  68          1HB       GLN  68   7.083   0.291   5.980
  535   2HB   GLN  68          2HB       GLN  68   7.223  -0.574   7.504
  536   1HG   GLN  68          1HG       GLN  68   7.210   2.394   7.058
  537   2HG   GLN  68          2HG       GLN  68   6.040   1.419   7.946
  538   1HE2  GLN  68          1HE2      GLN  68   7.747   3.738   8.717
  539   2HE2  GLN  68          2HE2      GLN  68   8.589   3.218  10.133
  540    H    THR  69           H        THR  69   9.453  -2.168   7.512
  541    HA   THR  69           HA       THR  69  10.488  -3.085   4.947
  542    HB   THR  69           HB       THR  69  11.235  -5.047   6.059
  543    HG1  THR  69           1HG      THR  69  10.244  -5.835   7.767
  544   1HG2  THR  69          1HG2      THR  69  11.540  -2.697   7.933
  545   2HG2  THR  69          2HG2      THR  69  12.578  -3.082   6.560
  546   3HG2  THR  69          3HG2      THR  69  12.530  -4.155   7.959
  547    H    PHE  70           H        PHE  70   9.778  -5.351   4.271
  548    HA   PHE  70           HA       PHE  70   7.056  -5.295   3.598
  549   1HB   PHE  70          1HB       PHE  70   8.374  -6.522   2.119
  550   2HB   PHE  70          2HB       PHE  70   9.208  -7.375   3.414
  551    HD1  PHE  70           1HD      PHE  70   6.001  -7.121   1.594
  552    HD2  PHE  70           2HD      PHE  70   8.434  -9.450   4.197
  553    HE1  PHE  70           1HE      PHE  70   4.470  -9.027   1.315
  554    HE2  PHE  70           2HE      PHE  70   6.907 -11.359   3.922
  555    HZ   PHE  70           HZ       PHE  70   4.922 -11.150   2.479
  556    H    ASN  71           H        ASN  71   8.769  -7.477   5.840
  557    HA   ASN  71           HA       ASN  71   6.470  -8.763   6.812
  558   1HB   ASN  71          1HB       ASN  71   9.161  -9.105   7.146
  559   2HB   ASN  71          2HB       ASN  71   8.689  -8.488   8.726
  560   1HD2  ASN  71          1HD2      ASN  71   8.902 -11.189   6.764
  561   2HD2  ASN  71          2HD2      ASN  71   7.960 -12.278   7.718
  562    H    LYS  72           H        LYS  72   8.185  -5.879   7.898
  563    HA   LYS  72           HA       LYS  72   6.753  -5.502  10.301
  564   1HB   LYS  72          1HB       LYS  72   8.819  -4.343  10.016
  565   2HB   LYS  72          2HB       LYS  72   8.270  -3.595   8.523
  566   1HG   LYS  72          1HG       LYS  72   8.302  -2.026  10.407
  567   2HG   LYS  72          2HG       LYS  72   6.683  -2.240   9.738
  568   1HD   LYS  72          1HD       LYS  72   6.179  -3.842  11.547
  569   2HD   LYS  72          2HD       LYS  72   7.780  -3.544  12.230
  570   1HE   LYS  72          1HE       LYS  72   5.935  -1.251  11.715
  571   2HE   LYS  72          2HE       LYS  72   5.697  -2.259  13.142
  572   1HZ   LYS  72          1HZ       LYS  72   7.980  -0.525  12.463
  573   2HZ   LYS  72          2HZ       LYS  72   8.190  -1.827  13.522
  574   3HZ   LYS  72          3HZ       LYS  72   7.088  -0.600  13.899
  575    H    VAL  73           H        VAL  73   6.328  -4.074   7.069
  576    HA   VAL  73           HA       VAL  73   4.157  -2.438   7.603
  577    HB   VAL  73           HB       VAL  73   4.886  -3.939   5.093
  578   1HG1  VAL  73          1HG1      VAL  73   2.630  -2.022   5.598
  579   2HG1  VAL  73          2HG1      VAL  73   3.324  -2.248   3.991
  580   3HG1  VAL  73          3HG1      VAL  73   2.578  -3.609   4.830
  581   1HG2  VAL  73          1HG2      VAL  73   6.239  -1.957   6.173
  582   2HG2  VAL  73          2HG2      VAL  73   5.994  -2.046   4.428
  583   3HG2  VAL  73          3HG2      VAL  73   4.986  -0.979   5.407
  584    H    LYS  74           H        LYS  74   4.304  -5.887   7.323
  585    HA   LYS  74           HA       LYS  74   1.599  -6.422   6.748
  586   1HB   LYS  74          1HB       LYS  74   3.574  -8.102   8.305
  587   2HB   LYS  74          2HB       LYS  74   2.060  -8.675   7.617
  588   1HG   LYS  74          1HG       LYS  74   3.269  -7.588   5.437
  589   2HG   LYS  74          2HG       LYS  74   4.651  -8.205   6.344
  590   1HD   LYS  74          1HD       LYS  74   4.193 -10.217   5.506
  591   2HD   LYS  74          2HD       LYS  74   2.727 -10.221   6.490
  592   1HE   LYS  74          1HE       LYS  74   3.035  -9.343   3.627
  593   2HE   LYS  74          2HE       LYS  74   2.076 -10.684   4.249
  594   1HZ   LYS  74          1HZ       LYS  74   1.513  -7.805   4.329
  595   2HZ   LYS  74          2HZ       LYS  74   0.897  -8.787   5.561
  596   3HZ   LYS  74          3HZ       LYS  74   0.482  -9.091   3.949
  597    H    TRP  75           H        TRP  75   3.035  -5.092   9.490
  598    HA   TRP  75           HA       TRP  75   1.342  -6.155  11.509
  599   1HB   TRP  75          1HB       TRP  75   2.315  -4.578  12.957
  600   2HB   TRP  75          2HB       TRP  75   3.585  -4.932  11.789
  601    HD1  TRP  75           HD       TRP  75   2.657  -3.001   9.444
  602    HE1  TRP  75           1HE      TRP  75   2.886  -0.454   9.732
  603    HE3  TRP  75           3HE      TRP  75   2.847  -2.776  14.547
  604    HZ2  TRP  75           2HZ      TRP  75   3.118   1.405  11.844
  605    HZ3  TRP  75           3HZ      TRP  75   3.074  -0.575  15.623
  606    HH2  TRP  75           HH       TRP  75   3.207   1.471  14.298
  607    H    TYR  76           H        TYR  76   0.896  -3.795   9.066
  608    HA   TYR  76           HA       TYR  76  -1.559  -2.840  10.387
  609   1HB   TYR  76          1HB       TYR  76   0.518  -1.474   8.844
  610   2HB   TYR  76          2HB       TYR  76  -1.111  -1.112   8.283
  611    HD1  TYR  76           2HD      TYR  76  -2.587  -1.224  10.870
  612    HD2  TYR  76           1HD      TYR  76   1.168   0.520   9.887
  613    HE1  TYR  76           2HE      TYR  76  -2.863   0.391  12.705
  614    HE2  TYR  76           1HE      TYR  76   0.903   2.138  11.720
  615    HH   TYR  76           HH       TYR  76  -1.965   2.083  13.819
  616    H    LEU  77           H        LEU  77  -0.200  -3.642   7.196
  617    HA   LEU  77           HA       LEU  77  -2.745  -3.763   5.916
  618   1HB   LEU  77          1HB       LEU  77  -0.068  -4.865   5.077
  619   2HB   LEU  77          2HB       LEU  77  -1.495  -4.784   4.047
  620    HG   LEU  77           HG       LEU  77   0.045  -2.442   5.165
  621   1HD1  LEU  77          1HD1      LEU  77   1.221  -3.545   3.364
  622   2HD1  LEU  77          2HD1      LEU  77   0.560  -2.012   2.796
  623   3HD1  LEU  77          3HD1      LEU  77  -0.233  -3.527   2.366
  624   1HD2  LEU  77          1HD2      LEU  77  -1.540  -1.316   3.373
  625   2HD2  LEU  77          2HD2      LEU  77  -2.045  -1.536   5.049
  626   3HD2  LEU  77          3HD2      LEU  77  -2.589  -2.666   3.808
  627    H    GLY  78           H        GLY  78  -1.154  -5.846   8.026
  628   1HA   GLY  78          1HA       GLY  78  -1.725  -7.931   8.809
  629   2HA   GLY  78          2HA       GLY  78  -3.182  -7.827   7.832
  630    H    ALA  79           H        ALA  79  -1.509 -10.142   8.275
  631    HA   ALA  79           HA       ALA  79   0.062 -10.600   5.925
  632   1HB   ALA  79          1HB       ALA  79  -0.591 -13.078   7.055
  633   2HB   ALA  79          2HB       ALA  79   0.891 -12.149   7.281
  634   3HB   ALA  79          3HB       ALA  79  -0.453 -11.952   8.405
  635    H    ARG  80           H        ARG  80  -3.261 -11.080   6.828
  636    HA   ARG  80           HA       ARG  80  -4.068 -13.053   5.066
  637   1HB   ARG  80          1HB       ARG  80  -5.617 -10.575   5.842
  638   2HB   ARG  80          2HB       ARG  80  -6.302 -12.059   5.194
  639   1HG   ARG  80          1HG       ARG  80  -4.837 -11.821   7.814
  640   2HG   ARG  80          2HG       ARG  80  -6.590 -11.872   7.619
  641   1HD   ARG  80          1HD       ARG  80  -4.626 -14.039   6.884
  642   2HD   ARG  80          2HD       ARG  80  -5.766 -14.062   8.230
  643    HE   ARG  80           HE       ARG  80  -7.237 -13.692   5.899
  644   1HH1  ARG  80          1HH1      ARG  80  -5.200 -16.121   7.338
  645   2HH1  ARG  80          2HH1      ARG  80  -6.012 -17.444   6.568
  646   1HH2  ARG  80          1HH2      ARG  80  -8.314 -15.425   4.880
  647   2HH2  ARG  80          2HH2      ARG  80  -7.782 -17.047   5.169
  648    H    CYS  81           H        CYS  81  -3.675  -9.583   4.488
  649    HA   CYS  81           HA       CYS  81  -4.385  -9.920   1.682
  650   1HB   CYS  81          1HB       CYS  81  -3.510  -7.372   3.040
  651   2HB   CYS  81          2HB       CYS  81  -4.412  -7.539   1.539
  652    HG   CYS  81           HG       CYS  81  -6.562  -6.910   2.820
  653    H    HIS  82           H        HIS  82  -2.957 -10.040   0.065
  654    HA   HIS  82           HA       HIS  82  -0.173 -10.307   0.648
  655   1HB   HIS  82          1HB       HIS  82  -1.548 -11.504  -1.179
  656   2HB   HIS  82          2HB       HIS  82  -1.321 -10.033  -2.121
  657    HD1  HIS  82           1HD      HIS  82   0.311 -13.171  -1.224
  658    HD2  HIS  82           2HD      HIS  82   1.482  -9.456  -2.668
  659    HE1  HIS  82           1HE      HIS  82   2.628 -13.507  -2.142
  660    H    ILE  83           H        ILE  83   1.360  -8.800   0.641
  661    HA   ILE  83           HA       ILE  83   0.726  -6.180  -0.549
  662    HB   ILE  83           HB       ILE  83   2.278  -5.179   1.036
  663   1HG1  ILE  83          1HG1      ILE  83   2.563  -7.952   2.212
  664   2HG1  ILE  83          2HG1      ILE  83   3.787  -7.151   1.233
  665   1HG2  ILE  83          1HG2      ILE  83   0.989  -5.514   3.080
  666   2HG2  ILE  83          2HG2      ILE  83  -0.069  -5.407   1.674
  667   3HG2  ILE  83          3HG2      ILE  83   0.277  -6.977   2.400
  668   1HD1  ILE  83          1HD1      ILE  83   2.740  -6.092   3.846
  669   2HD1  ILE  83          2HD1      ILE  83   4.217  -7.039   3.661
  670   3HD1  ILE  83          3HD1      ILE  83   4.083  -5.455   2.898
  671    H    GLU  84           H        GLU  84   2.333  -5.075  -1.705
  672    HA   GLU  84           HA       GLU  84   4.846  -6.429  -2.254
  673   1HB   GLU  84          1HB       GLU  84   2.759  -6.972  -3.918
  674   2HB   GLU  84          2HB       GLU  84   3.465  -5.572  -4.713
  675   1HG   GLU  84          1HG       GLU  84   5.584  -6.672  -4.907
  676   2HG   GLU  84          2HG       GLU  84   5.014  -8.031  -3.940
  677    H    LYS  85           H        LYS  85   6.278  -5.081  -3.651
  678    HA   LYS  85           HA       LYS  85   6.202  -2.358  -2.737
  679   1HB   LYS  85          1HB       LYS  85   8.350  -2.137  -3.916
  680   2HB   LYS  85          2HB       LYS  85   8.326  -3.544  -2.861
  681   1HG   LYS  85          1HG       LYS  85   7.811  -4.947  -4.850
  682   2HG   LYS  85          2HG       LYS  85   8.036  -3.514  -5.856
  683   1HD   LYS  85          1HD       LYS  85  10.249  -3.758  -5.813
  684   2HD   LYS  85          2HD       LYS  85  10.256  -3.845  -4.050
  685   1HE   LYS  85          1HE       LYS  85  11.207  -5.865  -5.002
  686   2HE   LYS  85          2HE       LYS  85   9.693  -6.230  -4.177
  687   1HZ   LYS  85          1HZ       LYS  85   8.614  -6.638  -6.140
  688   2HZ   LYS  85          2HZ       LYS  85  10.165  -7.192  -6.527
  689   3HZ   LYS  85          3HZ       LYS  85   9.653  -5.670  -7.061
  690    H    ALA  86           H        ALA  86   5.585  -0.581  -3.817
  691    HA   ALA  86           HA       ALA  86   4.359  -0.937  -6.433
  692   1HB   ALA  86          1HB       ALA  86   2.907   0.556  -5.675
  693   2HB   ALA  86          2HB       ALA  86   3.834   0.696  -4.181
  694   3HB   ALA  86          3HB       ALA  86   4.190   1.759  -5.543
  695    H    LYS  87           H        LYS  87   4.757   0.590  -8.172
  696    HA   LYS  87           HA       LYS  87   7.279   2.042  -8.090
  697   1HB   LYS  87          1HB       LYS  87   8.267   0.941  -9.946
  698   2HB   LYS  87          2HB       LYS  87   7.752  -0.327  -8.842
  699   1HG   LYS  87          1HG       LYS  87   5.568  -0.005 -10.484
  700   2HG   LYS  87          2HG       LYS  87   6.937   0.212 -11.577
  701   1HD   LYS  87          1HD       LYS  87   7.093  -2.047  -9.669
  702   2HD   LYS  87          2HD       LYS  87   5.914  -2.189 -10.975
  703   1HE   LYS  87          1HE       LYS  87   7.568  -2.044 -12.630
  704   2HE   LYS  87          2HE       LYS  87   8.761  -1.399 -11.505
  705   1HZ   LYS  87          1HZ       LYS  87   9.425  -3.439 -11.011
  706   2HZ   LYS  87          2HZ       LYS  87   8.426  -4.033 -12.240
  707   3HZ   LYS  87          3HZ       LYS  87   7.851  -3.945 -10.651
  708    H    GLY  88           H        GLY  88   7.381   3.749  -9.518
  709   1HA   GLY  88          1HA       GLY  88   6.560   4.675 -11.678
  710   2HA   GLY  88          2HA       GLY  88   4.958   4.175 -11.157
  711    H    THR  89           H        THR  89   4.979   6.661 -11.848
  712    HA   THR  89           HA       THR  89   5.754   8.432  -9.701
  713    HB   THR  89           HB       THR  89   4.998  10.229 -11.066
  714    HG1  THR  89           1HG      THR  89   3.672   9.905 -12.858
  715   1HG2  THR  89          1HG2      THR  89   6.349   9.989 -12.957
  716   2HG2  THR  89          2HG2      THR  89   5.981   8.271 -13.118
  717   3HG2  THR  89          3HG2      THR  89   7.032   8.830 -11.817
  718    H    ASP  90           H        ASP  90   4.006  10.138  -9.074
  719    HA   ASP  90           HA       ASP  90   2.120   8.913  -7.451
  720   1HB   ASP  90          1HB       ASP  90   1.201  11.107  -7.069
  721   2HB   ASP  90          2HB       ASP  90   2.949  11.262  -7.222
  722    H    GLN  91           H        GLN  91   1.772  10.202 -10.720
  723    HA   GLN  91           HA       GLN  91  -1.039   9.823 -10.879
  724   1HB   GLN  91          1HB       GLN  91   0.230  11.373 -12.341
  725   2HB   GLN  91          2HB       GLN  91   0.976   9.988 -13.127
  726   1HG   GLN  91          1HG       GLN  91  -0.830  10.853 -14.474
  727   2HG   GLN  91          2HG       GLN  91  -1.223   9.238 -13.886
  728   1HE2  GLN  91          1HE2      GLN  91  -3.421   9.514 -14.099
  729   2HE2  GLN  91          2HE2      GLN  91  -4.338  10.557 -13.071
  730    H    GLN  92           H        GLN  92   1.746   7.825 -11.652
  731    HA   GLN  92           HA       GLN  92   0.392   5.814 -13.085
  732   1HB   GLN  92          1HB       GLN  92   3.030   6.171 -11.868
  733   2HB   GLN  92          2HB       GLN  92   2.478   4.502 -11.858
  734   1HG   GLN  92          1HG       GLN  92   1.889   5.313 -14.408
  735   2HG   GLN  92          2HG       GLN  92   3.397   6.160 -14.066
  736   1HE2  GLN  92          1HE2      GLN  92   5.270   4.985 -13.722
  737   2HE2  GLN  92          2HE2      GLN  92   5.400   3.309 -14.122
  738    H    ASN  93           H        ASN  93   1.079   6.215  -9.641
  739    HA   ASN  93           HA       ASN  93  -0.068   3.688  -8.913
  740   1HB   ASN  93          1HB       ASN  93   0.909   6.078  -7.370
  741   2HB   ASN  93          2HB       ASN  93   0.053   4.769  -6.561
  742   1HD2  ASN  93          1HD2      ASN  93   2.374   4.682  -9.226
  743   2HD2  ASN  93          2HD2      ASN  93   3.535   3.693  -8.414
  744    H    LYS  94           H        LYS  94  -1.104   7.076  -8.709
  745    HA   LYS  94           HA       LYS  94  -3.574   6.611  -7.455
  746   1HB   LYS  94          1HB       LYS  94  -2.549   8.834  -7.605
  747   2HB   LYS  94          2HB       LYS  94  -2.785   8.834  -9.348
  748   1HG   LYS  94          1HG       LYS  94  -5.085   9.090  -9.165
  749   2HG   LYS  94          2HG       LYS  94  -5.112   8.525  -7.493
  750   1HD   LYS  94          1HD       LYS  94  -4.577  10.558  -6.660
  751   2HD   LYS  94          2HD       LYS  94  -3.502  10.943  -8.007
  752   1HE   LYS  94          1HE       LYS  94  -5.666  11.144  -9.390
  753   2HE   LYS  94          2HE       LYS  94  -6.483  11.225  -7.830
  754   1HZ   LYS  94          1HZ       LYS  94  -4.639  13.039  -7.415
  755   2HZ   LYS  94          2HZ       LYS  94  -6.100  13.420  -8.176
  756   3HZ   LYS  94          3HZ       LYS  94  -4.706  13.166  -9.101
  757    H    GLU  95           H        GLU  95  -2.694   6.810 -10.884
  758    HA   GLU  95           HA       GLU  95  -5.353   6.451 -11.839
  759   1HB   GLU  95          1HB       GLU  95  -3.574   7.514 -13.181
  760   2HB   GLU  95          2HB       GLU  95  -2.726   5.976 -13.259
  761   1HG   GLU  95          1HG       GLU  95  -5.521   5.932 -14.171
  762   2HG   GLU  95          2HG       GLU  95  -4.406   6.876 -15.157
  763    H    TYR  96           H        TYR  96  -2.649   4.284 -11.200
  764    HA   TYR  96           HA       TYR  96  -3.620   1.967 -12.396
  765   1HB   TYR  96          1HB       TYR  96  -1.355   2.063 -11.576
  766   2HB   TYR  96          2HB       TYR  96  -1.913   2.311  -9.925
  767    HD1  TYR  96           1HD      TYR  96  -2.870   0.452  -8.644
  768    HD2  TYR  96           2HD      TYR  96  -1.341  -0.131 -12.571
  769    HE1  TYR  96           1HE      TYR  96  -2.834  -1.978  -8.263
  770    HE2  TYR  96           2HE      TYR  96  -1.302  -2.562 -12.201
  771    HH   TYR  96           HH       TYR  96  -1.469  -3.976  -9.257
  772    H    CYS  97           H        CYS  97  -4.127   3.182  -9.098
  773    HA   CYS  97           HA       CYS  97  -5.740   1.011  -8.254
  774   1HB   CYS  97          1HB       CYS  97  -5.593   3.840  -7.191
  775   2HB   CYS  97          2HB       CYS  97  -6.361   2.486  -6.371
  776    HG   CYS  97           HG       CYS  97  -3.180   1.891  -7.193
  777    H    SER  98           H        SER  98  -6.431   4.079  -9.811
  778    HA   SER  98           HA       SER  98  -9.280   3.847  -9.504
  779   1HB   SER  98          1HB       SER  98  -7.976   6.025  -9.739
  780   2HB   SER  98          2HB       SER  98  -7.828   5.640 -11.453
  781    HG   SER  98           HG       SER  98 -10.352   5.613 -10.214
  782    H    LYS  99           H        LYS  99  -6.997   2.456 -11.553
  783    HA   LYS  99           HA       LYS  99  -8.302   2.327 -14.013
  784   1HB   LYS  99          1HB       LYS  99  -5.980   1.604 -13.673
  785   2HB   LYS  99          2HB       LYS  99  -6.540   0.241 -12.711
  786   1HG   LYS  99          1HG       LYS  99  -7.876   0.184 -15.222
  787   2HG   LYS  99          2HG       LYS  99  -6.144   0.378 -15.503
  788   1HD   LYS  99          1HD       LYS  99  -7.417  -1.747 -13.777
  789   2HD   LYS  99          2HD       LYS  99  -6.800  -1.987 -15.414
  790   1HE   LYS  99          1HE       LYS  99  -5.234  -1.255 -12.946
  791   2HE   LYS  99          2HE       LYS  99  -5.138  -2.752 -13.873
  792   1HZ   LYS  99          1HZ       LYS  99  -4.012  -0.122 -14.465
  793   2HZ   LYS  99          2HZ       LYS  99  -4.540  -1.051 -15.777
  794   3HZ   LYS  99          3HZ       LYS  99  -3.361  -1.661 -14.729
  795    H    GLU 100           H        GLU 100  -9.023   0.775 -11.025
  796    HA   GLU 100           HA       GLU 100 -10.514  -1.413 -12.089
  797   1HB   GLU 100          1HB       GLU 100 -10.859  -0.194  -9.353
  798   2HB   GLU 100          2HB       GLU 100 -11.187  -1.849  -9.847
  799   1HG   GLU 100          1HG       GLU 100  -8.522  -0.522  -9.477
  800   2HG   GLU 100          2HG       GLU 100  -9.189  -1.896  -8.598
  801    H    GLY 101           H        GLY 101 -11.146   1.918 -11.690
  802   1HA   GLY 101          1HA       GLY 101 -12.988   3.103 -12.473
  803   2HA   GLY 101          2HA       GLY 101 -13.818   1.578 -12.746
  804    H    ASN 102           H        ASN 102 -12.705   1.306  -9.709
  805    HA   ASN 102           HA       ASN 102 -14.967   2.725  -8.485
  806   1HB   ASN 102          1HB       ASN 102 -14.800  -0.078  -8.830
  807   2HB   ASN 102          2HB       ASN 102 -14.518   0.236  -7.120
  808   1HD2  ASN 102          1HD2      ASN 102 -16.281   0.162  -5.952
  809   2HD2  ASN 102          2HD2      ASN 102 -17.868   0.614  -6.462
  810    H    LEU 103           H        LEU 103 -14.338   3.935  -6.830
  811    HA   LEU 103           HA       LEU 103 -11.699   3.465  -5.658
  812   1HB   LEU 103          1HB       LEU 103 -13.237   5.781  -6.320
  813   2HB   LEU 103          2HB       LEU 103 -12.881   5.799  -4.594
  814    HG   LEU 103           HG       LEU 103 -11.254   7.045  -6.030
  815   1HD1  LEU 103          1HD1      LEU 103 -10.017   6.732  -4.216
  816   2HD1  LEU 103          2HD1      LEU 103  -9.343   5.295  -4.985
  817   3HD1  LEU 103          3HD1      LEU 103 -10.746   5.152  -3.925
  818   1HD2  LEU 103          1HD2      LEU 103 -10.166   6.096  -7.732
  819   2HD2  LEU 103          2HD2      LEU 103 -11.371   4.812  -7.631
  820   3HD2  LEU 103          3HD2      LEU 103  -9.820   4.633  -6.810
  821    H    LEU 104           H        LEU 104 -11.423   2.750  -3.638
  822    HA   LEU 104           HA       LEU 104 -13.812   2.267  -2.016
  823   1HB   LEU 104          1HB       LEU 104 -12.409   0.344  -2.461
  824   2HB   LEU 104          2HB       LEU 104 -11.006   1.186  -1.806
  825    HG   LEU 104           HG       LEU 104 -11.920   1.087   0.418
  826   1HD1  LEU 104          1HD1      LEU 104 -14.071  -0.365   0.649
  827   2HD1  LEU 104          2HD1      LEU 104 -14.373   0.160  -1.006
  828   3HD1  LEU 104          3HD1      LEU 104 -14.201   1.355   0.280
  829   1HD2  LEU 104          1HD2      LEU 104 -10.863  -0.877   0.404
  830   2HD2  LEU 104          2HD2      LEU 104 -11.469  -1.288  -1.201
  831   3HD2  LEU 104          3HD2      LEU 104 -12.460  -1.606   0.224
  832    H    MET 105           H        MET 105 -10.902   4.139  -2.106
  833    HA   MET 105           HA       MET 105 -11.768   5.760   0.077
  834   1HB   MET 105          1HB       MET 105 -10.878   4.219   1.573
  835   2HB   MET 105          2HB       MET 105  -9.563   3.776   0.493
  836   1HG   MET 105          1HG       MET 105  -8.232   5.454   1.195
  837   2HG   MET 105          2HG       MET 105  -9.578   6.563   1.448
  838   1HE   MET 105          1HE       MET 105  -6.938   4.629   2.763
  839   2HE   MET 105          2HE       MET 105  -7.241   4.352   4.478
  840   3HE   MET 105          3HE       MET 105  -7.876   3.227   3.277
  841    H    GLU 106           H        GLU 106 -10.908   7.769  -0.059
  842    HA   GLU 106           HA       GLU 106  -8.551   8.146  -1.776
  843   1HB   GLU 106          1HB       GLU 106 -10.776   8.639  -2.935
  844   2HB   GLU 106          2HB       GLU 106 -10.922  10.005  -1.838
  845   1HG   GLU 106          1HG       GLU 106  -8.440  10.423  -2.801
  846   2HG   GLU 106          2HG       GLU 106  -9.194   9.636  -4.186
  847    H    CYS 107           H        CYS 107  -7.056   8.826  -0.371
  848    HA   CYS 107           HA       CYS 107  -7.519  11.313   1.043
  849   1HB   CYS 107          1HB       CYS 107  -7.134   8.688   2.422
  850   2HB   CYS 107          2HB       CYS 107  -6.416  10.130   3.131
  851    HG   CYS 107           HG       CYS 107  -9.077  11.427   2.954
  852    H    GLY 108           H        GLY 108  -5.383  11.825   2.361
  853   1HA   GLY 108          1HA       GLY 108  -3.100  12.154   2.338
  854   2HA   GLY 108          2HA       GLY 108  -2.956  10.739   1.305
  855    H    ALA 109           H        ALA 109  -1.238  12.447   0.561
  856    HA   ALA 109           HA       ALA 109  -2.439  14.143  -1.525
  857   1HB   ALA 109          1HB       ALA 109  -0.441  14.682   0.406
  858   2HB   ALA 109          2HB       ALA 109   0.326  14.717  -1.182
  859   3HB   ALA 109          3HB       ALA 109  -1.066  15.749  -0.852
  860    HA   PRO 110           HA       PRO 110  -0.657  11.774  -4.759
  861   1HB   PRO 110          1HB       PRO 110   0.129  13.689  -6.517
  862   2HB   PRO 110          2HB       PRO 110  -1.568  13.282  -6.235
  863   1HG   PRO 110          1HG       PRO 110   0.048  15.544  -5.124
  864   2HG   PRO 110          2HG       PRO 110  -1.610  15.556  -5.752
  865   1HD   PRO 110          1HD       PRO 110  -1.057  15.501  -3.102
  866   2HD   PRO 110          2HD       PRO 110  -2.493  14.719  -3.794
  867    H    ARG 111           H        ARG 111   1.133  11.064  -3.348
  868    HA   ARG 111           HA       ARG 111   3.616  12.455  -3.334
  869   1HB   ARG 111          1HB       ARG 111   2.692   9.738  -2.499
  870   2HB   ARG 111          2HB       ARG 111   4.419  10.037  -2.649
  871   1HG   ARG 111          1HG       ARG 111   2.527  11.627  -0.928
  872   2HG   ARG 111          2HG       ARG 111   3.601  10.347  -0.358
  873   1HD   ARG 111          1HD       ARG 111   4.998  12.070   0.049
  874   2HD   ARG 111          2HD       ARG 111   5.368  11.901  -1.667
  875    HE   ARG 111           HE       ARG 111   3.191  13.634  -1.407
  876   1HH1  ARG 111          1HH1      ARG 111   6.584  13.514  -0.638
  877   2HH1  ARG 111          2HH1      ARG 111   6.804  15.228  -0.752
  878   1HH2  ARG 111          1HH2      ARG 111   3.468  15.893  -1.559
  879   2HH2  ARG 111          2HH2      ARG 111   5.031  16.581  -1.275
  880    H    SER 112           H        SER 112   5.011  12.634  -4.947
  881    HA   SER 112           HA       SER 112   5.040  10.542  -7.023
  882   1HB   SER 112          1HB       SER 112   6.258  12.885  -8.038
  883   2HB   SER 112          2HB       SER 112   4.712  12.181  -8.514
  884    HG   SER 112           HG       SER 112   3.950  13.371  -6.506
  885    H    GLN 113           H        GLN 113   6.935   9.591  -7.535
  886    HA   GLN 113           HA       GLN 113   9.212  10.159  -5.826
  887   1HB   GLN 113          1HB       GLN 113   8.314   7.822  -6.391
  888   2HB   GLN 113          2HB       GLN 113   9.082   8.038  -7.958
  889   1HG   GLN 113          1HG       GLN 113  10.938   8.684  -5.878
  890   2HG   GLN 113          2HG       GLN 113  10.234   7.094  -5.583
  891   1HE2  GLN 113          1HE2      GLN 113  12.838   8.428  -6.795
  892   2HE2  GLN 113          2HE2      GLN 113  13.204   7.355  -8.099
  893    H    GLY 114           H        GLY 114  10.603  11.682  -6.428
  894   1HA   GLY 114          1HA       GLY 114  10.932  12.350  -9.240
  895   2HA   GLY 114          2HA       GLY 114  11.622  13.213  -7.874
  896    H    GLN 115           H        GLN 115  12.585  11.789 -10.505
  897    HA   GLN 115           HA       GLN 115  14.660  10.083  -9.371
  898   1HB   GLN 115          1HB       GLN 115  13.576  10.570 -12.105
  899   2HB   GLN 115          2HB       GLN 115  15.234  10.004 -11.964
  900   1HG   GLN 115          1HG       GLN 115  14.033   8.048 -12.197
  901   2HG   GLN 115          2HG       GLN 115  14.253   8.170 -10.453
  902   1HE2  GLN 115          1HE2      GLN 115  11.993   8.503 -13.088
  903   2HE2  GLN 115          2HE2      GLN 115  10.559   8.441 -12.127
  904    H    ARG 116           H        ARG 116  14.636  12.697 -11.803
  905    HA   ARG 116           HA       ARG 116  17.041  13.803 -10.535
  906   1HB   ARG 116          1HB       ARG 116  18.157  14.078 -12.641
  907   2HB   ARG 116          2HB       ARG 116  17.677  12.392 -12.498
  908   1HG   ARG 116          1HG       ARG 116  15.848  12.717 -14.006
  909   2HG   ARG 116          2HG       ARG 116  16.123  14.460 -14.034
  910   1HD   ARG 116          1HD       ARG 116  17.331  14.055 -15.874
  911   2HD   ARG 116          2HD       ARG 116  18.569  13.475 -14.760
  912    HE   ARG 116           HE       ARG 116  18.184  11.349 -15.507
  913   1HH1  ARG 116          1HH1      ARG 116  15.505  13.373 -16.426
  914   2HH1  ARG 116          2HH1      ARG 116  14.751  12.155 -17.401
  915   1HH2  ARG 116          1HH2      ARG 116  17.201   9.738 -16.788
  916   2HH2  ARG 116          2HH2      ARG 116  15.716  10.088 -17.605
  Start of MODEL    4
    1    HA   PRO   2           HA       PRO   2  21.260  10.081   7.887
    2   1HB   PRO   2          1HB       PRO   2  18.929   8.915   8.648
    3   2HB   PRO   2          2HB       PRO   2  19.387  10.552   9.131
    4   1HG   PRO   2          1HG       PRO   2  17.548   9.668   6.940
    5   2HG   PRO   2          2HG       PRO   2  17.345  10.987   8.107
    6   1HD   PRO   2          1HD       PRO   2  18.159  11.409   5.559
    7   2HD   PRO   2          2HD       PRO   2  18.700  12.420   6.914
    8    H    SER   3           H        SER   3  22.172   8.131   7.709
    9    HA   SER   3           HA       SER   3  20.968   6.194   5.841
   10   1HB   SER   3          1HB       SER   3  23.870   6.033   6.491
   11   2HB   SER   3          2HB       SER   3  23.031   5.658   4.986
   12    HG   SER   3           HG       SER   3  23.309   7.645   4.344
   13    H    LYS   4           H        LYS   4  21.960   3.899   6.325
   14    HA   LYS   4           HA       LYS   4  22.141   3.417   9.203
   15   1HB   LYS   4          1HB       LYS   4  19.722   3.199   8.200
   16   2HB   LYS   4          2HB       LYS   4  20.327   1.664   7.591
   17   1HG   LYS   4          1HG       LYS   4  19.340   1.088   9.602
   18   2HG   LYS   4          2HG       LYS   4  21.048   1.228  10.023
   19   1HD   LYS   4          1HD       LYS   4  19.760   3.780  10.289
   20   2HD   LYS   4          2HD       LYS   4  18.868   2.558  11.199
   21   1HE   LYS   4          1HE       LYS   4  21.849   2.742  11.409
   22   2HE   LYS   4          2HE       LYS   4  20.818   3.824  12.344
   23   1HZ   LYS   4          1HZ       LYS   4  21.482   1.758  13.522
   24   2HZ   LYS   4          2HZ       LYS   4  20.581   0.867  12.402
   25   3HZ   LYS   4          3HZ       LYS   4  19.808   1.976  13.419
   26    H    LYS   5           H        LYS   5  23.279   1.579   9.768
   27    HA   LYS   5           HA       LYS   5  24.984   0.501   7.694
   28   1HB   LYS   5          1HB       LYS   5  24.955   0.501  10.664
   29   2HB   LYS   5          2HB       LYS   5  25.758  -0.851   9.878
   30   1HG   LYS   5          1HG       LYS   5  27.422   0.763  10.300
   31   2HG   LYS   5          2HG       LYS   5  27.085   0.842   8.569
   32   1HD   LYS   5          1HD       LYS   5  25.455   2.627  10.246
   33   2HD   LYS   5          2HD       LYS   5  27.181   2.997  10.212
   34   1HE   LYS   5          1HE       LYS   5  25.656   2.494   7.681
   35   2HE   LYS   5          2HE       LYS   5  25.641   4.081   8.448
   36   1HZ   LYS   5          1HZ       LYS   5  28.282   3.347   8.382
   37   2HZ   LYS   5          2HZ       LYS   5  27.525   4.472   7.372
   38   3HZ   LYS   5          3HZ       LYS   5  27.678   2.861   6.878
   39    H    ASN   6           H        ASN   6  24.534  -1.273   6.582
   40    HA   ASN   6           HA       ASN   6  22.318  -2.948   7.242
   41   1HB   ASN   6          1HB       ASN   6  23.043  -4.269   5.261
   42   2HB   ASN   6          2HB       ASN   6  22.868  -2.551   4.916
   43   1HD2  ASN   6          1HD2      ASN   6  24.243  -3.608   3.090
   44   2HD2  ASN   6          2HD2      ASN   6  25.950  -3.427   3.281
   45    H    GLY   7           H        GLY   7  22.757  -5.457   7.003
   46   1HA   GLY   7          1HA       GLY   7  25.142  -6.261   8.495
   47   2HA   GLY   7          2HA       GLY   7  23.582  -6.584   9.238
   48    H    ARG   8           H        ARG   8  21.995  -7.716   7.664
   49    HA   ARG   8           HA       ARG   8  23.171  -9.444   5.700
   50   1HB   ARG   8          1HB       ARG   8  23.717 -10.439   8.029
   51   2HB   ARG   8          2HB       ARG   8  22.010 -10.856   8.085
   52   1HG   ARG   8          1HG       ARG   8  22.229 -12.218   6.111
   53   2HG   ARG   8          2HG       ARG   8  23.909 -11.716   5.914
   54   1HD   ARG   8          1HD       ARG   8  23.610 -13.972   6.947
   55   2HD   ARG   8          2HD       ARG   8  24.557 -12.842   7.913
   56    HE   ARG   8           HE       ARG   8  21.856 -12.704   8.690
   57   1HH1  ARG   8          1HH1      ARG   8  24.607 -14.832   8.855
   58   2HH1  ARG   8          2HH1      ARG   8  24.098 -15.589  10.328
   59   1HH2  ARG   8          1HH2      ARG   8  21.175 -13.694  10.629
   60   2HH2  ARG   8          2HH2      ARG   8  22.145 -14.942  11.335
   61    H    SER   9           H        SER   9  21.493  -8.338   4.528
   62    HA   SER   9           HA       SER   9  19.078  -9.848   4.394
   63   1HB   SER   9          1HB       SER   9  19.086  -7.484   6.054
   64   2HB   SER   9          2HB       SER   9  17.987  -7.271   4.691
   65    HG   SER   9           HG       SER   9  17.935  -9.671   6.144
   66    H    GLY  10           H        GLY  10  18.532  -9.921   2.318
   67   1HA   GLY  10          1HA       GLY  10  19.859  -8.406   0.346
   68   2HA   GLY  10          2HA       GLY  10  18.448  -9.418   0.080
   69    HA   PRO  11           HA       PRO  11  15.868  -5.928  -0.499
   70   1HB   PRO  11          1HB       PRO  11  13.625  -6.526   0.908
   71   2HB   PRO  11          2HB       PRO  11  14.065  -7.348  -0.594
   72   1HG   PRO  11          1HG       PRO  11  14.452  -8.241   2.237
   73   2HG   PRO  11          2HG       PRO  11  13.900  -9.175   0.834
   74   1HD   PRO  11          1HD       PRO  11  16.442  -9.300   1.759
   75   2HD   PRO  11          2HD       PRO  11  16.041  -9.485   0.039
   76    H    GLN  12           H        GLN  12  15.257  -3.957   0.364
   77    HA   GLN  12           HA       GLN  12  15.755  -3.591   3.244
   78   1HB   GLN  12          1HB       GLN  12  16.890  -2.216   0.924
   79   2HB   GLN  12          2HB       GLN  12  16.225  -1.118   2.125
   80   1HG   GLN  12          1HG       GLN  12  18.563  -1.474   2.552
   81   2HG   GLN  12          2HG       GLN  12  17.606  -2.192   3.847
   82   1HE2  GLN  12          1HE2      GLN  12  18.056  -4.203   4.400
   83   2HE2  GLN  12          2HE2      GLN  12  18.964  -5.333   3.460
   84    HA   PRO  13           HA       PRO  13  11.834  -1.667   3.641
   85   1HB   PRO  13          1HB       PRO  13  12.343   0.357   5.378
   86   2HB   PRO  13          2HB       PRO  13  12.321  -1.343   5.863
   87   1HG   PRO  13          1HG       PRO  13  14.659   0.416   5.229
   88   2HG   PRO  13          2HG       PRO  13  14.464  -0.754   6.548
   89   1HD   PRO  13          1HD       PRO  13  15.864  -1.314   4.299
   90   2HD   PRO  13          2HD       PRO  13  14.960  -2.552   5.195
   91    H    HIS  14           H        HIS  14  10.559   0.003   2.875
   92    HA   HIS  14           HA       HIS  14  11.899   2.341   1.722
   93   1HB   HIS  14          1HB       HIS  14  10.024   0.489   0.244
   94   2HB   HIS  14          2HB       HIS  14  10.454   2.098  -0.327
   95    HD1  HIS  14           1HD      HIS  14  11.846  -1.346   0.118
   96    HD2  HIS  14           2HD      HIS  14  13.018   2.334  -1.414
   97    HE1  HIS  14           1HE      HIS  14  13.967  -1.793  -1.157
   98    H    LYS  15           H        LYS  15  10.037   3.826   0.753
   99    HA   LYS  15           HA       LYS  15   8.094   4.139   2.932
  100   1HB   LYS  15          1HB       LYS  15   7.868   6.481   1.994
  101   2HB   LYS  15          2HB       LYS  15   9.427   6.088   2.706
  102   1HG   LYS  15          1HG       LYS  15   9.429   5.465  -0.097
  103   2HG   LYS  15          2HG       LYS  15   8.926   7.136   0.167
  104   1HD   LYS  15          1HD       LYS  15  10.924   7.671   1.285
  105   2HD   LYS  15          2HD       LYS  15  11.347   5.973   1.516
  106   1HE   LYS  15          1HE       LYS  15  11.009   6.728  -1.286
  107   2HE   LYS  15          2HE       LYS  15  12.301   7.609  -0.471
  108   1HZ   LYS  15          1HZ       LYS  15  13.374   5.596   0.094
  109   2HZ   LYS  15          2HZ       LYS  15  12.975   5.471  -1.544
  110   3HZ   LYS  15          3HZ       LYS  15  12.052   4.656  -0.384
  111    H    ARG  16           H        ARG  16   7.961   2.424   0.394
  112    HA   ARG  16           HA       ARG  16   5.234   3.222  -0.305
  113   1HB   ARG  16          1HB       ARG  16   7.298   2.465  -2.379
  114   2HB   ARG  16          2HB       ARG  16   5.621   2.900  -2.678
  115   1HG   ARG  16          1HG       ARG  16   5.995   5.153  -2.122
  116   2HG   ARG  16          2HG       ARG  16   7.557   4.792  -1.384
  117   1HD   ARG  16          1HD       ARG  16   8.624   4.613  -3.402
  118   2HD   ARG  16          2HD       ARG  16   7.161   4.120  -4.253
  119    HE   ARG  16           HE       ARG  16   8.097   6.808  -3.820
  120   1HH1  ARG  16          1HH1      ARG  16   5.341   4.797  -4.512
  121   2HH1  ARG  16          2HH1      ARG  16   4.435   6.071  -5.260
  122   1HH2  ARG  16          1HH2      ARG  16   6.915   8.493  -4.803
  123   2HH2  ARG  16          2HH2      ARG  16   5.332   8.172  -5.426
  124    H    TRP  17           H        TRP  17   3.886   1.553  -0.190
  125    HA   TRP  17           HA       TRP  17   4.766  -1.122  -0.894
  126   1HB   TRP  17          1HB       TRP  17   3.907  -0.359   1.894
  127   2HB   TRP  17          2HB       TRP  17   3.803  -2.014   1.299
  128    HD1  TRP  17           HD       TRP  17   6.286   0.565   2.548
  129    HE1  TRP  17           1HE      TRP  17   8.593  -0.545   2.814
  130    HE3  TRP  17           3HE      TRP  17   5.300  -3.910   0.281
  131    HZ2  TRP  17           2HZ      TRP  17   9.831  -2.993   2.151
  132    HZ3  TRP  17           3HZ      TRP  17   7.101  -5.581   0.138
  133    HH2  TRP  17           HH       TRP  17   9.319  -5.130   1.054
  134    H    VAL  18           H        VAL  18   3.152  -2.325  -1.740
  135    HA   VAL  18           HA       VAL  18   0.456  -1.144  -1.704
  136    HB   VAL  18           HB       VAL  18   0.023  -2.334  -3.782
  137   1HG1  VAL  18          1HG1      VAL  18   1.766  -1.194  -5.219
  138   2HG1  VAL  18          2HG1      VAL  18   0.887  -0.156  -4.095
  139   3HG1  VAL  18          3HG1      VAL  18   2.531  -0.674  -3.718
  140   1HG2  VAL  18          1HG2      VAL  18   2.711  -3.149  -4.421
  141   2HG2  VAL  18          2HG2      VAL  18   2.140  -3.967  -2.967
  142   3HG2  VAL  18          3HG2      VAL  18   1.216  -4.084  -4.465
  143    H    PHE  19           H        PHE  19  -1.365  -2.672  -1.793
  144    HA   PHE  19           HA       PHE  19  -0.804  -5.285  -0.590
  145   1HB   PHE  19          1HB       PHE  19  -2.684  -4.935   1.016
  146   2HB   PHE  19          2HB       PHE  19  -1.306  -3.878   1.305
  147    HD1  PHE  19           1HD      PHE  19  -1.423  -1.493   0.542
  148    HD2  PHE  19           2HD      PHE  19  -4.817  -4.062   0.576
  149    HE1  PHE  19           1HE      PHE  19  -2.905   0.469   0.444
  150    HE2  PHE  19           2HE      PHE  19  -6.304  -2.105   0.478
  151    HZ   PHE  19           HZ       PHE  19  -5.349   0.164   0.411
  152    H    THR  20           H        THR  20  -2.290  -6.889  -1.065
  153    HA   THR  20           HA       THR  20  -4.668  -6.222  -2.603
  154    HB   THR  20           HB       THR  20  -4.096  -7.821  -4.415
  155    HG1  THR  20           1HG      THR  20  -1.671  -7.913  -2.966
  156   1HG2  THR  20          1HG2      THR  20  -3.716  -5.340  -4.597
  157   2HG2  THR  20          2HG2      THR  20  -2.714  -6.326  -5.663
  158   3HG2  THR  20          3HG2      THR  20  -2.027  -5.639  -4.191
  159    H    LEU  21           H        LEU  21  -6.300  -7.521  -2.062
  160    HA   LEU  21           HA       LEU  21  -5.731 -10.233  -1.113
  161   1HB   LEU  21          1HB       LEU  21  -5.899  -8.780   0.861
  162   2HB   LEU  21          2HB       LEU  21  -7.500  -8.266   0.334
  163    HG   LEU  21           HG       LEU  21  -7.935 -10.898   0.462
  164   1HD1  LEU  21          1HD1      LEU  21  -5.498 -11.154   1.217
  165   2HD1  LEU  21          2HD1      LEU  21  -6.744 -12.000   2.134
  166   3HD1  LEU  21          3HD1      LEU  21  -6.052 -10.504   2.760
  167   1HD2  LEU  21          1HD2      LEU  21  -7.971  -9.521   3.086
  168   2HD2  LEU  21          2HD2      LEU  21  -9.245 -10.414   2.254
  169   3HD2  LEU  21          3HD2      LEU  21  -8.856  -8.765   1.760
  170    H    ASN  22           H        ASN  22  -6.987 -11.659  -2.107
  171    HA   ASN  22           HA       ASN  22  -9.117 -10.811  -3.818
  172   1HB   ASN  22          1HB       ASN  22  -7.448 -12.862  -3.998
  173   2HB   ASN  22          2HB       ASN  22  -8.730 -13.688  -3.117
  174   1HD2  ASN  22          1HD2      ASN  22 -10.638 -14.146  -4.129
  175   2HD2  ASN  22          2HD2      ASN  22 -10.890 -13.922  -5.823
  176    H    ASN  23           H        ASN  23 -11.253 -10.792  -3.458
  177    HA   ASN  23           HA       ASN  23 -13.209 -10.775  -2.287
  178   1HB   ASN  23          1HB       ASN  23 -13.120 -13.151  -2.866
  179   2HB   ASN  23          2HB       ASN  23 -12.175 -13.483  -1.417
  180   1HD2  ASN  23          1HD2      ASN  23 -15.015 -11.431  -1.901
  181   2HD2  ASN  23          2HD2      ASN  23 -16.021 -12.256  -0.763
  182    HA   PRO  24           HA       PRO  24 -11.017  -9.533   1.646
  183   1HB   PRO  24          1HB       PRO  24 -11.762  -6.925   1.539
  184   2HB   PRO  24          2HB       PRO  24 -10.300  -7.539   0.758
  185   1HG   PRO  24          1HG       PRO  24 -12.983  -6.956  -0.435
  186   2HG   PRO  24          2HG       PRO  24 -11.370  -6.589  -1.075
  187   1HD   PRO  24          1HD       PRO  24 -12.832  -8.700  -1.933
  188   2HD   PRO  24          2HD       PRO  24 -11.059  -8.732  -1.865
  189    H    SER  25           H        SER  25 -11.987  -9.129   3.634
  190    HA   SER  25           HA       SER  25 -14.876  -9.516   3.680
  191   1HB   SER  25          1HB       SER  25 -12.887 -10.616   5.188
  192   2HB   SER  25          2HB       SER  25 -13.436  -9.318   6.248
  193    HG   SER  25           HG       SER  25 -14.575 -11.665   5.836
  194    H    GLU  26           H        GLU  26 -16.232  -8.250   5.118
  195    HA   GLU  26           HA       GLU  26 -15.966  -5.491   4.720
  196   1HB   GLU  26          1HB       GLU  26 -17.834  -5.298   6.374
  197   2HB   GLU  26          2HB       GLU  26 -18.143  -6.427   5.064
  198   1HG   GLU  26          1HG       GLU  26 -18.594  -8.004   6.539
  199   2HG   GLU  26          2HG       GLU  26 -16.947  -7.892   7.158
  200    H    ASP  27           H        ASP  27 -14.898  -7.566   7.306
  201    HA   ASP  27           HA       ASP  27 -14.354  -5.437   9.154
  202   1HB   ASP  27          1HB       ASP  27 -14.618  -8.167   9.383
  203   2HB   ASP  27          2HB       ASP  27 -12.881  -7.938   9.562
  204    H    GLU  28           H        GLU  28 -12.361  -7.531   7.082
  205    HA   GLU  28           HA       GLU  28  -9.893  -6.341   7.757
  206   1HB   GLU  28          1HB       GLU  28 -10.785  -8.441   6.092
  207   2HB   GLU  28          2HB       GLU  28  -9.866  -7.350   5.065
  208   1HG   GLU  28          1HG       GLU  28  -7.909  -7.658   6.266
  209   2HG   GLU  28          2HG       GLU  28  -8.761  -8.250   7.691
  210    H    ARG  29           H        ARG  29 -12.079  -5.824   5.000
  211    HA   ARG  29           HA       ARG  29 -10.550  -3.876   3.695
  212   1HB   ARG  29          1HB       ARG  29 -12.421  -4.989   2.607
  213   2HB   ARG  29          2HB       ARG  29 -13.547  -4.259   3.743
  214   1HG   ARG  29          1HG       ARG  29 -12.206  -2.098   2.659
  215   2HG   ARG  29          2HG       ARG  29 -12.431  -3.196   1.296
  216   1HD   ARG  29          1HD       ARG  29 -14.763  -2.825   3.064
  217   2HD   ARG  29          2HD       ARG  29 -14.283  -1.419   2.115
  218    HE   ARG  29           HE       ARG  29 -14.495  -3.859   0.596
  219   1HH1  ARG  29          1HH1      ARG  29 -16.174  -1.057   1.801
  220   2HH1  ARG  29          2HH1      ARG  29 -17.412  -1.117   0.590
  221   1HH2  ARG  29          1HH2      ARG  29 -16.119  -3.948  -1.003
  222   2HH2  ARG  29          2HH2      ARG  29 -17.380  -2.762  -1.004
  223    H    LYS  30           H        LYS  30 -12.885  -3.628   6.313
  224    HA   LYS  30           HA       LYS  30 -13.055  -0.790   6.307
  225   1HB   LYS  30          1HB       LYS  30 -13.872  -2.978   8.158
  226   2HB   LYS  30          2HB       LYS  30 -13.785  -1.344   8.804
  227   1HG   LYS  30          1HG       LYS  30 -15.382  -0.562   7.190
  228   2HG   LYS  30          2HG       LYS  30 -15.385  -2.129   6.377
  229   1HD   LYS  30          1HD       LYS  30 -16.160  -3.102   8.598
  230   2HD   LYS  30          2HD       LYS  30 -16.455  -1.436   9.102
  231   1HE   LYS  30          1HE       LYS  30 -17.655  -1.582   6.622
  232   2HE   LYS  30          2HE       LYS  30 -17.998  -3.158   7.333
  233   1HZ   LYS  30          1HZ       LYS  30 -18.618  -0.513   8.532
  234   2HZ   LYS  30          2HZ       LYS  30 -18.867  -1.999   9.300
  235   3HZ   LYS  30          3HZ       LYS  30 -19.732  -1.616   7.897
  236    H    LYS  31           H        LYS  31 -10.975  -3.118   7.916
  237    HA   LYS  31           HA       LYS  31  -9.790  -1.395   9.789
  238   1HB   LYS  31          1HB       LYS  31  -9.484  -3.752  10.032
  239   2HB   LYS  31          2HB       LYS  31  -8.776  -3.890   8.428
  240   1HG   LYS  31          1HG       LYS  31  -7.269  -2.038  10.024
  241   2HG   LYS  31          2HG       LYS  31  -7.443  -3.581  10.862
  242   1HD   LYS  31          1HD       LYS  31  -6.801  -3.813   8.009
  243   2HD   LYS  31          2HD       LYS  31  -5.550  -3.030   8.978
  244   1HE   LYS  31          1HE       LYS  31  -5.303  -5.505   8.781
  245   2HE   LYS  31          2HE       LYS  31  -5.406  -4.916  10.439
  246   1HZ   LYS  31          1HZ       LYS  31  -6.808  -6.955   9.657
  247   2HZ   LYS  31          2HZ       LYS  31  -7.869  -5.765   9.092
  248   3HZ   LYS  31          3HZ       LYS  31  -7.465  -5.826  10.733
  249    H    ILE  32           H        ILE  32  -8.730  -2.319   6.520
  250    HA   ILE  32           HA       ILE  32  -6.433  -0.672   6.500
  251    HB   ILE  32           HB       ILE  32  -8.034  -1.999   4.338
  252   1HG1  ILE  32          1HG1      ILE  32  -5.137  -2.286   5.159
  253   2HG1  ILE  32          2HG1      ILE  32  -6.442  -3.288   5.784
  254   1HG2  ILE  32          1HG2      ILE  32  -7.414  -0.198   3.072
  255   2HG2  ILE  32          2HG2      ILE  32  -5.981   0.132   4.045
  256   3HG2  ILE  32          3HG2      ILE  32  -5.977  -1.205   2.895
  257   1HD1  ILE  32          1HD1      ILE  32  -6.493  -4.560   3.952
  258   2HD1  ILE  32          2HD1      ILE  32  -6.316  -3.179   2.868
  259   3HD1  ILE  32          3HD1      ILE  32  -4.894  -3.886   3.636
  260    H    ARG  33           H        ARG  33  -9.752  -0.170   5.385
  261    HA   ARG  33           HA       ARG  33  -9.259   2.389   4.239
  262   1HB   ARG  33          1HB       ARG  33 -11.156   1.157   3.465
  263   2HB   ARG  33          2HB       ARG  33 -11.791   0.991   5.097
  264   1HG   ARG  33          1HG       ARG  33 -12.373   3.287   5.198
  265   2HG   ARG  33          2HG       ARG  33 -11.482   3.643   3.717
  266   1HD   ARG  33          1HD       ARG  33 -13.363   3.320   2.581
  267   2HD   ARG  33          2HD       ARG  33 -13.293   1.620   3.043
  268    HE   ARG  33           HE       ARG  33 -14.466   3.219   5.086
  269   1HH1  ARG  33          1HH1      ARG  33 -15.104   1.698   2.020
  270   2HH1  ARG  33          2HH1      ARG  33 -16.807   1.548   2.301
  271   1HH2  ARG  33          1HH2      ARG  33 -16.707   3.027   5.467
  272   2HH2  ARG  33          2HH2      ARG  33 -17.718   2.305   4.262
  273    H    ASP  34           H        ASP  34  -9.768   1.268   7.443
  274    HA   ASP  34           HA       ASP  34 -10.438   3.950   8.410
  275   1HB   ASP  34          1HB       ASP  34 -11.723   1.927   9.204
  276   2HB   ASP  34          2HB       ASP  34 -10.253   1.401  10.021
  277    H    LEU  35           H        LEU  35  -7.726   2.573   7.527
  278    HA   LEU  35           HA       LEU  35  -6.033   2.685   9.783
  279   1HB   LEU  35          1HB       LEU  35  -5.619   2.703   6.828
  280   2HB   LEU  35          2HB       LEU  35  -4.261   3.066   7.892
  281    HG   LEU  35           HG       LEU  35  -5.878   0.522   8.002
  282   1HD1  LEU  35          1HD1      LEU  35  -3.205   1.065   6.719
  283   2HD1  LEU  35          2HD1      LEU  35  -4.704   0.653   5.887
  284   3HD1  LEU  35          3HD1      LEU  35  -3.929  -0.528   6.942
  285   1HD2  LEU  35          1HD2      LEU  35  -4.810   1.120  10.110
  286   2HD2  LEU  35          2HD2      LEU  35  -3.263   1.310   9.284
  287   3HD2  LEU  35          3HD2      LEU  35  -4.023  -0.279   9.380
  288    HA   PRO  36           HA       PRO  36  -5.189   6.951  10.365
  289   1HB   PRO  36          1HB       PRO  36  -2.523   6.956  10.881
  290   2HB   PRO  36          2HB       PRO  36  -3.721   6.338  12.024
  291   1HG   PRO  36          1HG       PRO  36  -1.980   4.835  10.109
  292   2HG   PRO  36          2HG       PRO  36  -2.371   4.458  11.797
  293   1HD   PRO  36          1HD       PRO  36  -3.589   3.234   9.711
  294   2HD   PRO  36          2HD       PRO  36  -4.416   3.546  11.250
  295    H    ILE  37           H        ILE  37  -5.265   8.388   8.760
  296    HA   ILE  37           HA       ILE  37  -3.886   8.087   6.298
  297    HB   ILE  37           HB       ILE  37  -4.652  10.442   5.862
  298   1HG1  ILE  37          1HG1      ILE  37  -6.004  10.111   8.549
  299   2HG1  ILE  37          2HG1      ILE  37  -4.632  11.168   8.239
  300   1HG2  ILE  37          1HG2      ILE  37  -6.487   9.490   5.049
  301   2HG2  ILE  37          2HG2      ILE  37  -6.093   8.052   5.989
  302   3HG2  ILE  37          3HG2      ILE  37  -7.158   9.284   6.667
  303   1HD1  ILE  37          1HD1      ILE  37  -7.475  11.523   7.610
  304   2HD1  ILE  37          2HD1      ILE  37  -6.228  12.717   7.974
  305   3HD1  ILE  37          3HD1      ILE  37  -6.349  12.034   6.353
  306    H    SER  38           H        SER  38  -3.236   9.872   9.247
  307    HA   SER  38           HA       SER  38  -1.170  11.515   8.230
  308   1HB   SER  38          1HB       SER  38  -2.272  10.835  10.866
  309   2HB   SER  38          2HB       SER  38  -0.548  11.209  10.889
  310    HG   SER  38           HG       SER  38  -0.956  13.224  10.297
  311    H    LEU  39           H        LEU  39  -1.295   8.196   9.116
  312    HA   LEU  39           HA       LEU  39   1.481   7.841   9.671
  313   1HB   LEU  39          1HB       LEU  39  -0.717   6.338  10.084
  314   2HB   LEU  39          2HB       LEU  39  -0.074   5.554   8.643
  315    HG   LEU  39           HG       LEU  39   1.839   6.012  10.851
  316   1HD1  LEU  39          1HD1      LEU  39  -0.304   3.900  11.032
  317   2HD1  LEU  39          2HD1      LEU  39  -0.187   5.328  12.060
  318   3HD1  LEU  39          3HD1      LEU  39   1.072   4.095  12.117
  319   1HD2  LEU  39          1HD2      LEU  39   2.647   3.845  10.148
  320   2HD2  LEU  39          2HD2      LEU  39   2.433   4.886   8.740
  321   3HD2  LEU  39          3HD2      LEU  39   1.246   3.631   9.098
  322    H    PHE  40           H        PHE  40  -0.474   7.857   6.793
  323    HA   PHE  40           HA       PHE  40   1.939   7.282   5.205
  324   1HB   PHE  40          1HB       PHE  40  -0.834   6.657   4.223
  325   2HB   PHE  40          2HB       PHE  40   0.707   6.036   3.639
  326    HD1  PHE  40           2HD      PHE  40  -1.837   5.782   6.268
  327    HD2  PHE  40           1HD      PHE  40   1.782   4.178   4.702
  328    HE1  PHE  40           2HE      PHE  40  -2.103   3.796   7.695
  329    HE2  PHE  40           1HE      PHE  40   1.521   2.189   6.126
  330    HZ   PHE  40           HZ       PHE  40  -0.423   1.997   7.627
  331    H    ASP  41           H        ASP  41   2.585   9.044   4.178
  332    HA   ASP  41           HA       ASP  41   1.222  11.432   3.952
  333   1HB   ASP  41          1HB       ASP  41   3.725  10.510   3.228
  334   2HB   ASP  41          2HB       ASP  41   3.000  10.948   1.683
  335    H    TYR  42           H        TYR  42   1.024   8.596   1.947
  336    HA   TYR  42           HA       TYR  42  -1.154   9.854   0.448
  337   1HB   TYR  42          1HB       TYR  42   0.810  10.071  -0.987
  338   2HB   TYR  42          2HB       TYR  42   1.143   8.350  -0.825
  339    HD1  TYR  42           1HD      TYR  42  -2.165   9.949  -1.360
  340    HD2  TYR  42           2HD      TYR  42   0.968   7.620  -3.053
  341    HE1  TYR  42           1HE      TYR  42  -3.571   9.496  -3.327
  342    HE2  TYR  42           2HE      TYR  42  -0.429   7.162  -5.024
  343    HH   TYR  42           HH       TYR  42  -3.695   8.530  -5.320
  344    H    PHE  43           H        PHE  43  -2.897   8.608   0.471
  345    HA   PHE  43           HA       PHE  43  -2.566   5.693   0.618
  346   1HB   PHE  43          1HB       PHE  43  -3.268   7.083   2.816
  347   2HB   PHE  43          2HB       PHE  43  -4.858   6.857   2.096
  348    HD1  PHE  43           1HD      PHE  43  -3.875   4.123   0.805
  349    HD2  PHE  43           2HD      PHE  43  -3.956   5.739   4.742
  350    HE1  PHE  43           1HE      PHE  43  -3.971   1.846   1.734
  351    HE2  PHE  43           2HE      PHE  43  -4.051   3.465   5.677
  352    HZ   PHE  43           HZ       PHE  43  -4.057   1.515   4.173
  353    H    ILE  44           H        ILE  44  -3.477   4.844  -1.123
  354    HA   ILE  44           HA       ILE  44  -6.090   5.857  -1.991
  355    HB   ILE  44           HB       ILE  44  -4.703   6.900  -3.575
  356   1HG1  ILE  44          1HG1      ILE  44  -5.115   4.461  -5.198
  357   2HG1  ILE  44          2HG1      ILE  44  -6.537   5.066  -4.356
  358   1HG2  ILE  44          1HG2      ILE  44  -2.583   6.004  -3.223
  359   2HG2  ILE  44          2HG2      ILE  44  -3.127   4.353  -3.514
  360   3HG2  ILE  44          3HG2      ILE  44  -2.982   5.483  -4.860
  361   1HD1  ILE  44          1HD1      ILE  44  -5.208   7.252  -5.601
  362   2HD1  ILE  44          2HD1      ILE  44  -5.434   5.961  -6.782
  363   3HD1  ILE  44          3HD1      ILE  44  -6.821   6.608  -5.906
  364    H    VAL  45           H        VAL  45  -7.484   4.235  -1.928
  365    HA   VAL  45           HA       VAL  45  -6.533   1.529  -2.615
  366    HB   VAL  45           HB       VAL  45  -8.878   1.998  -0.803
  367   1HG1  VAL  45          1HG1      VAL  45  -8.951  -0.219  -0.891
  368   2HG1  VAL  45          2HG1      VAL  45  -7.479  -0.265  -1.864
  369   3HG1  VAL  45          3HG1      VAL  45  -7.375  -0.272  -0.103
  370   1HG2  VAL  45          1HG2      VAL  45  -5.965   2.022  -0.070
  371   2HG2  VAL  45          2HG2      VAL  45  -7.219   3.184   0.366
  372   3HG2  VAL  45          3HG2      VAL  45  -7.219   1.574   1.087
  373    H    GLY  46           H        GLY  46  -7.692   0.373  -4.072
  374   1HA   GLY  46          1HA       GLY  46 -10.248   1.522  -4.995
  375   2HA   GLY  46          2HA       GLY  46  -9.004   1.052  -6.144
  376    H    GLU  47           H        GLU  47 -11.863   0.114  -5.252
  377    HA   GLU  47           HA       GLU  47 -11.318  -2.700  -4.743
  378   1HB   GLU  47          1HB       GLU  47 -13.127  -1.761  -3.481
  379   2HB   GLU  47          2HB       GLU  47 -13.878  -1.112  -4.932
  380   1HG   GLU  47          1HG       GLU  47 -14.811  -3.086  -5.503
  381   2HG   GLU  47          2HG       GLU  47 -13.470  -4.033  -4.861
  382    H    GLU  48           H        GLU  48 -11.475  -4.299  -6.207
  383    HA   GLU  48           HA       GLU  48 -12.094  -3.523  -8.970
  384   1HB   GLU  48          1HB       GLU  48  -9.853  -4.554  -8.382
  385   2HB   GLU  48          2HB       GLU  48 -10.719  -6.048  -8.053
  386   1HG   GLU  48          1HG       GLU  48 -11.466  -6.177 -10.335
  387   2HG   GLU  48          2HG       GLU  48 -10.754  -4.605 -10.693
  388    H    GLY  49           H        GLY  49 -14.067  -3.999  -9.661
  389   1HA   GLY  49          1HA       GLY  49 -15.149  -6.654  -9.257
  390   2HA   GLY  49          2HA       GLY  49 -16.055  -5.374  -8.464
  391    H    ASN  50           H        ASN  50 -14.637  -6.128 -11.647
  392    HA   ASN  50           HA       ASN  50 -17.086  -5.035 -12.868
  393   1HB   ASN  50          1HB       ASN  50 -14.498  -4.053 -13.179
  394   2HB   ASN  50          2HB       ASN  50 -14.775  -5.005 -14.634
  395   1HD2  ASN  50          1HD2      ASN  50 -16.872  -2.971 -12.622
  396   2HD2  ASN  50          2HD2      ASN  50 -17.407  -1.953 -13.912
  397    H    GLU  51           H        GLU  51 -16.528  -7.774 -12.076
  398    HA   GLU  51           HA       GLU  51 -16.993  -9.031 -14.666
  399   1HB   GLU  51          1HB       GLU  51 -14.524  -9.195 -14.056
  400   2HB   GLU  51          2HB       GLU  51 -15.021 -10.240 -12.733
  401   1HG   GLU  51          1HG       GLU  51 -14.685 -11.879 -14.214
  402   2HG   GLU  51          2HG       GLU  51 -16.284 -11.429 -14.802
  403    H    GLU  52           H        GLU  52 -18.908  -9.964 -14.422
  404    HA   GLU  52           HA       GLU  52 -19.945 -10.732 -11.873
  405   1HB   GLU  52          1HB       GLU  52 -21.899 -11.499 -13.116
  406   2HB   GLU  52          2HB       GLU  52 -21.400  -9.907 -13.671
  407   1HG   GLU  52          1HG       GLU  52 -20.044 -11.424 -15.411
  408   2HG   GLU  52          2HG       GLU  52 -21.406 -12.494 -15.083
  409    H    GLY  53           H        GLY  53 -20.499 -12.830 -11.158
  410   1HA   GLY  53          1HA       GLY  53 -20.448 -15.187 -11.233
  411   2HA   GLY  53          2HA       GLY  53 -19.372 -15.097 -12.620
  412    H    ARG  54           H        ARG  54 -17.743 -13.047 -11.073
  413    HA   ARG  54           HA       ARG  54 -16.315 -14.990  -9.380
  414   1HB   ARG  54          1HB       ARG  54 -15.158 -14.226 -11.494
  415   2HB   ARG  54          2HB       ARG  54 -15.096 -12.616 -10.790
  416   1HG   ARG  54          1HG       ARG  54 -13.635 -13.303  -9.082
  417   2HG   ARG  54          2HG       ARG  54 -13.935 -15.012  -9.407
  418   1HD   ARG  54          1HD       ARG  54 -12.972 -13.684 -11.772
  419   2HD   ARG  54          2HD       ARG  54 -11.870 -13.416 -10.422
  420    HE   ARG  54           HE       ARG  54 -12.373 -15.899 -11.788
  421   1HH1  ARG  54          1HH1      ARG  54 -11.244 -14.412  -8.849
  422   2HH1  ARG  54          2HH1      ARG  54 -10.289 -15.776  -8.372
  423   1HH2  ARG  54          1HH2      ARG  54 -11.118 -17.701 -11.170
  424   2HH2  ARG  54          2HH2      ARG  54 -10.217 -17.646  -9.693
  425    H    THR  55           H        THR  55 -15.092 -14.065  -7.573
  426    HA   THR  55           HA       THR  55 -16.703 -12.148  -6.143
  427    HB   THR  55           HB       THR  55 -14.490 -12.587  -4.562
  428    HG1  THR  55           1HG      THR  55 -13.521 -14.272  -5.402
  429   1HG2  THR  55          1HG2      THR  55 -16.245 -13.063  -3.272
  430   2HG2  THR  55          2HG2      THR  55 -16.262 -14.676  -3.985
  431   3HG2  THR  55          3HG2      THR  55 -17.254 -13.394  -4.679
  432    HA   PRO  56           HA       PRO  56 -14.353  -8.497  -6.779
  433   1HB   PRO  56          1HB       PRO  56 -14.420  -7.336  -4.326
  434   2HB   PRO  56          2HB       PRO  56 -15.831  -7.421  -5.388
  435   1HG   PRO  56          1HG       PRO  56 -15.105  -9.156  -3.059
  436   2HG   PRO  56          2HG       PRO  56 -16.682  -8.475  -3.497
  437   1HD   PRO  56          1HD       PRO  56 -16.007 -11.043  -4.026
  438   2HD   PRO  56          2HD       PRO  56 -17.089 -10.104  -5.075
  439    H    HIS  57           H        HIS  57 -12.419  -7.293  -6.122
  440    HA   HIS  57           HA       HIS  57 -10.553  -8.777  -4.422
  441   1HB   HIS  57          1HB       HIS  57 -10.020  -9.591  -6.619
  442   2HB   HIS  57          2HB       HIS  57 -10.029  -7.960  -7.284
  443    HD1  HIS  57           1HD      HIS  57  -7.918  -6.554  -6.992
  444    HD2  HIS  57           2HD      HIS  57  -7.711 -10.262  -5.128
  445    HE1  HIS  57           1HE      HIS  57  -5.508  -6.843  -6.336
  446    H    LEU  58           H        LEU  58  -9.157  -7.515  -3.285
  447    HA   LEU  58           HA       LEU  58  -9.572  -4.628  -3.487
  448   1HB   LEU  58          1HB       LEU  58  -9.378  -6.378  -1.339
  449   2HB   LEU  58          2HB       LEU  58  -7.844  -5.510  -1.334
  450    HG   LEU  58           HG       LEU  58 -10.611  -4.336  -1.100
  451   1HD1  LEU  58          1HD1      LEU  58  -8.300  -4.709   0.770
  452   2HD1  LEU  58          2HD1      LEU  58  -9.996  -5.136   0.997
  453   3HD1  LEU  58          3HD1      LEU  58  -9.500  -3.444   1.038
  454   1HD2  LEU  58          1HD2      LEU  58  -9.501  -2.164  -0.928
  455   2HD2  LEU  58          2HD2      LEU  58  -9.234  -2.901  -2.508
  456   3HD2  LEU  58          3HD2      LEU  58  -7.953  -2.924  -1.296
  457    H    GLN  59           H        GLN  59  -8.021  -3.221  -4.076
  458    HA   GLN  59           HA       GLN  59  -5.233  -4.006  -4.126
  459   1HB   GLN  59          1HB       GLN  59  -5.790  -4.858  -6.259
  460   2HB   GLN  59          2HB       GLN  59  -6.820  -3.482  -6.629
  461   1HG   GLN  59          1HG       GLN  59  -4.740  -3.407  -7.886
  462   2HG   GLN  59          2HG       GLN  59  -4.876  -2.039  -6.783
  463   1HE2  GLN  59          1HE2      GLN  59  -2.827  -4.316  -7.945
  464   2HE2  GLN  59          2HE2      GLN  59  -1.673  -4.357  -6.660
  465    H    GLY  60           H        GLY  60  -4.320  -2.342  -3.117
  466   1HA   GLY  60          1HA       GLY  60  -4.792   0.351  -4.153
  467   2HA   GLY  60          2HA       GLY  60  -5.129   0.078  -2.450
  468    H    PHE  61           H        PHE  61  -3.297   1.963  -3.151
  469    HA   PHE  61           HA       PHE  61  -0.761   0.699  -2.349
  470   1HB   PHE  61          1HB       PHE  61  -0.406   1.359  -4.599
  471   2HB   PHE  61          2HB       PHE  61  -1.234   2.894  -4.360
  472    HD1  PHE  61           2HD      PHE  61   1.567   1.119  -2.642
  473    HD2  PHE  61           1HD      PHE  61   0.186   4.678  -4.522
  474    HE1  PHE  61           2HE      PHE  61   3.725   2.202  -2.169
  475    HE2  PHE  61           1HE      PHE  61   2.342   5.767  -4.053
  476    HZ   PHE  61           HZ       PHE  61   4.115   4.529  -2.875
  477    H    ALA  62           H        ALA  62   0.401   1.693  -0.755
  478    HA   ALA  62           HA       ALA  62  -0.604   4.245   0.295
  479   1HB   ALA  62          1HB       ALA  62  -1.451   3.265   2.095
  480   2HB   ALA  62          2HB       ALA  62  -0.864   1.689   1.564
  481   3HB   ALA  62          3HB       ALA  62   0.174   2.736   2.531
  482    H    ASN  63           H        ASN  63   0.978   5.662   0.622
  483    HA   ASN  63           HA       ASN  63   3.742   4.748   0.482
  484   1HB   ASN  63          1HB       ASN  63   2.986   6.642  -0.936
  485   2HB   ASN  63          2HB       ASN  63   2.650   7.570   0.522
  486   1HD2  ASN  63          1HD2      ASN  63   4.744   7.373  -1.866
  487   2HD2  ASN  63          2HD2      ASN  63   6.210   7.822  -1.068
  488    H    PHE  64           H        PHE  64   4.744   4.248   2.308
  489    HA   PHE  64           HA       PHE  64   3.822   5.069   4.871
  490   1HB   PHE  64          1HB       PHE  64   5.805   3.253   3.804
  491   2HB   PHE  64          2HB       PHE  64   6.461   4.164   5.160
  492    HD1  PHE  64           2HD      PHE  64   5.006   4.241   7.300
  493    HD2  PHE  64           1HD      PHE  64   4.527   1.372   4.193
  494    HE1  PHE  64           2HE      PHE  64   3.847   2.741   8.868
  495    HE2  PHE  64           1HE      PHE  64   3.365  -0.132   5.756
  496    HZ   PHE  64           HZ       PHE  64   3.025   0.551   8.098
  497    H    VAL  65           H        VAL  65   4.288   6.836   6.004
  498    HA   VAL  65           HA       VAL  65   5.745   8.981   4.939
  499    HB   VAL  65           HB       VAL  65   4.936   8.453   7.801
  500   1HG1  VAL  65          1HG1      VAL  65   6.056  10.915   6.481
  501   2HG1  VAL  65          2HG1      VAL  65   5.176  10.957   8.010
  502   3HG1  VAL  65          3HG1      VAL  65   6.684  10.051   7.884
  503   1HG2  VAL  65          1HG2      VAL  65   3.643  10.326   5.840
  504   2HG2  VAL  65          2HG2      VAL  65   3.154   8.638   5.989
  505   3HG2  VAL  65          3HG2      VAL  65   3.005   9.725   7.370
  506    H    LYS  66           H        LYS  66   6.754   6.224   6.738
  507    HA   LYS  66           HA       LYS  66   9.475   7.342   6.889
  508   1HB   LYS  66          1HB       LYS  66   7.910   5.844   8.957
  509   2HB   LYS  66          2HB       LYS  66   9.660   5.672   8.907
  510   1HG   LYS  66          1HG       LYS  66   9.432   7.385  10.403
  511   2HG   LYS  66          2HG       LYS  66   9.619   8.286   8.897
  512   1HD   LYS  66          1HD       LYS  66   7.801   9.313   9.944
  513   2HD   LYS  66          2HD       LYS  66   7.054   8.222   8.774
  514   1HE   LYS  66          1HE       LYS  66   5.961   7.181  10.403
  515   2HE   LYS  66          2HE       LYS  66   7.479   6.813  11.220
  516   1HZ   LYS  66          1HZ       LYS  66   6.217   9.469  11.483
  517   2HZ   LYS  66          2HZ       LYS  66   7.340   8.725  12.505
  518   3HZ   LYS  66          3HZ       LYS  66   5.740   8.179  12.468
  519    H    LYS  67           H        LYS  67  10.963   5.252   7.529
  520    HA   LYS  67           HA       LYS  67  10.696   3.522   5.209
  521   1HB   LYS  67          1HB       LYS  67  12.895   3.778   7.268
  522   2HB   LYS  67          2HB       LYS  67  12.960   2.727   5.860
  523   1HG   LYS  67          1HG       LYS  67  12.311   5.414   5.074
  524   2HG   LYS  67          2HG       LYS  67  13.788   5.385   6.040
  525   1HD   LYS  67          1HD       LYS  67  14.391   3.360   4.482
  526   2HD   LYS  67          2HD       LYS  67  13.210   4.109   3.405
  527   1HE   LYS  67          1HE       LYS  67  15.096   6.016   4.547
  528   2HE   LYS  67          2HE       LYS  67  15.879   4.760   3.589
  529   1HZ   LYS  67          1HZ       LYS  67  13.642   6.478   2.658
  530   2HZ   LYS  67          2HZ       LYS  67  14.442   5.305   1.740
  531   3HZ   LYS  67          3HZ       LYS  67  15.270   6.689   2.250
  532    H    GLN  68           H        GLN  68   9.827   1.564   5.288
  533    HA   GLN  68           HA       GLN  68   9.927   0.058   7.805
  534   1HB   GLN  68          1HB       GLN  68   7.469   0.212   6.057
  535   2HB   GLN  68          2HB       GLN  68   7.623  -0.615   7.602
  536   1HG   GLN  68          1HG       GLN  68   7.742   2.358   7.152
  537   2HG   GLN  68          2HG       GLN  68   6.401   1.456   7.856
  538   1HE2  GLN  68          1HE2      GLN  68   7.720  -0.261   9.528
  539   2HE2  GLN  68          2HE2      GLN  68   8.504   0.633  10.781
  540    H    THR  69           H        THR  69   9.822  -2.222   7.576
  541    HA   THR  69           HA       THR  69  10.835  -3.136   4.995
  542    HB   THR  69           HB       THR  69  11.640  -5.078   6.099
  543    HG1  THR  69           1HG      THR  69  10.622  -4.497   8.611
  544   1HG2  THR  69          1HG2      THR  69  12.970  -3.100   6.564
  545   2HG2  THR  69          2HG2      THR  69  12.956  -4.157   7.976
  546   3HG2  THR  69          3HG2      THR  69  11.949  -2.710   7.948
  547    H    PHE  70           H        PHE  70  10.144  -5.442   4.386
  548    HA   PHE  70           HA       PHE  70   7.412  -5.420   3.752
  549   1HB   PHE  70          1HB       PHE  70   8.708  -6.676   2.282
  550   2HB   PHE  70          2HB       PHE  70   9.579  -7.484   3.582
  551    HD1  PHE  70           1HD      PHE  70   6.276  -7.283   1.912
  552    HD2  PHE  70           2HD      PHE  70   8.904  -9.581   4.347
  553    HE1  PHE  70           1HE      PHE  70   4.763  -9.214   1.717
  554    HE2  PHE  70           2HE      PHE  70   7.397 -11.516   4.155
  555    HZ   PHE  70           HZ       PHE  70   5.324 -11.334   2.838
  556    H    ASN  71           H        ASN  71   9.176  -7.521   6.031
  557    HA   ASN  71           HA       ASN  71   6.914  -8.820   7.061
  558   1HB   ASN  71          1HB       ASN  71   9.699  -8.876   7.505
  559   2HB   ASN  71          2HB       ASN  71   8.960  -8.562   9.072
  560   1HD2  ASN  71          1HD2      ASN  71   9.225 -10.796   6.421
  561   2HD2  ASN  71          2HD2      ASN  71   8.553 -12.160   7.241
  562    H    LYS  72           H        LYS  72   8.581  -5.876   8.074
  563    HA   LYS  72           HA       LYS  72   7.124  -5.454  10.453
  564   1HB   LYS  72          1HB       LYS  72   9.178  -4.277  10.151
  565   2HB   LYS  72          2HB       LYS  72   8.628  -3.573   8.636
  566   1HG   LYS  72          1HG       LYS  72   8.631  -1.964  10.492
  567   2HG   LYS  72          2HG       LYS  72   7.024  -2.203   9.803
  568   1HD   LYS  72          1HD       LYS  72   6.464  -3.726  11.633
  569   2HD   LYS  72          2HD       LYS  72   8.076  -3.501  12.318
  570   1HE   LYS  72          1HE       LYS  72   6.476  -1.064  11.788
  571   2HE   LYS  72          2HE       LYS  72   5.950  -2.096  13.117
  572   1HZ   LYS  72          1HZ       LYS  72   8.225  -0.357  12.946
  573   2HZ   LYS  72          2HZ       LYS  72   8.630  -1.907  13.488
  574   3HZ   LYS  72          3HZ       LYS  72   7.461  -1.002  14.310
  575    H    VAL  73           H        VAL  73   6.704  -4.125   7.178
  576    HA   VAL  73           HA       VAL  73   4.511  -2.500   7.649
  577    HB   VAL  73           HB       VAL  73   5.280  -4.066   5.192
  578   1HG1  VAL  73          1HG1      VAL  73   3.692  -2.547   3.984
  579   2HG1  VAL  73          2HG1      VAL  73   2.924  -3.764   5.005
  580   3HG1  VAL  73          3HG1      VAL  73   3.035  -2.092   5.556
  581   1HG2  VAL  73          1HG2      VAL  73   6.345  -2.166   4.469
  582   2HG2  VAL  73          2HG2      VAL  73   5.324  -1.095   5.428
  583   3HG2  VAL  73          3HG2      VAL  73   6.596  -2.033   6.209
  584    H    LYS  74           H        LYS  74   4.701  -5.952   7.486
  585    HA   LYS  74           HA       LYS  74   2.003  -6.535   6.910
  586   1HB   LYS  74          1HB       LYS  74   3.979  -8.151   8.531
  587   2HB   LYS  74          2HB       LYS  74   2.484  -8.757   7.832
  588   1HG   LYS  74          1HG       LYS  74   3.714  -7.712   5.645
  589   2HG   LYS  74          2HG       LYS  74   5.091  -8.284   6.590
  590   1HD   LYS  74          1HD       LYS  74   4.670 -10.292   5.704
  591   2HD   LYS  74          2HD       LYS  74   3.285 -10.354   6.796
  592   1HE   LYS  74          1HE       LYS  74   1.843  -9.456   5.083
  593   2HE   LYS  74          2HE       LYS  74   3.215  -9.223   4.001
  594   1HZ   LYS  74          1HZ       LYS  74   3.301 -11.409   3.488
  595   2HZ   LYS  74          2HZ       LYS  74   1.657 -11.343   3.881
  596   3HZ   LYS  74          3HZ       LYS  74   2.774 -11.922   5.012
  597    H    TRP  75           H        TRP  75   3.407  -5.102   9.613
  598    HA   TRP  75           HA       TRP  75   1.716  -6.127  11.656
  599   1HB   TRP  75          1HB       TRP  75   2.671  -4.504  13.064
  600   2HB   TRP  75          2HB       TRP  75   3.949  -4.878  11.912
  601    HD1  TRP  75           HD       TRP  75   3.018  -3.019   9.511
  602    HE1  TRP  75           1HE      TRP  75   3.223  -0.463   9.731
  603    HE3  TRP  75           3HE      TRP  75   3.177  -2.655  14.607
  604    HZ2  TRP  75           2HZ      TRP  75   3.426   1.454  11.793
  605    HZ3  TRP  75           3HZ      TRP  75   3.378  -0.423  15.624
  606    HH2  TRP  75           HH       TRP  75   3.501   1.587  14.245
  607    H    TYR  76           H        TYR  76   1.262  -3.844   9.144
  608    HA   TYR  76           HA       TYR  76  -1.205  -2.869  10.427
  609   1HB   TYR  76          1HB       TYR  76   0.868  -1.533   8.851
  610   2HB   TYR  76          2HB       TYR  76  -0.761  -1.202   8.272
  611    HD1  TYR  76           2HD      TYR  76  -2.251  -1.244  10.852
  612    HD2  TYR  76           1HD      TYR  76   1.499   0.494   9.840
  613    HE1  TYR  76           2HE      TYR  76  -2.548   0.424  12.636
  614    HE2  TYR  76           1HE      TYR  76   1.212   2.165  11.621
  615    HH   TYR  76           HH       TYR  76  -0.987   1.880  14.071
  616    H    LEU  77           H        LEU  77   0.171  -3.750   7.264
  617    HA   LEU  77           HA       LEU  77  -2.383  -3.949   5.999
  618   1HB   LEU  77          1HB       LEU  77   0.364  -4.878   5.192
  619   2HB   LEU  77          2HB       LEU  77  -1.062  -5.062   4.172
  620    HG   LEU  77           HG       LEU  77  -0.040  -2.397   5.139
  621   1HD1  LEU  77          1HD1      LEU  77   0.342  -3.398   2.354
  622   2HD1  LEU  77          2HD1      LEU  77   1.502  -3.833   3.609
  623   3HD1  LEU  77          3HD1      LEU  77   1.213  -2.136   3.226
  624   1HD2  LEU  77          1HD2      LEU  77  -1.408  -1.614   3.183
  625   2HD2  LEU  77          2HD2      LEU  77  -2.334  -2.278   4.530
  626   3HD2  LEU  77          3HD2      LEU  77  -2.066  -3.247   3.080
  627    H    GLY  78           H        GLY  78  -0.698  -5.954   8.117
  628   1HA   GLY  78          1HA       GLY  78  -1.178  -8.050   8.930
  629   2HA   GLY  78          2HA       GLY  78  -2.672  -7.988   8.007
  630    H    ALA  79           H        ALA  79  -0.995 -10.281   8.390
  631    HA   ALA  79           HA       ALA  79   0.538 -10.727   6.012
  632   1HB   ALA  79          1HB       ALA  79  -0.012 -13.217   7.090
  633   2HB   ALA  79          2HB       ALA  79   1.402 -12.217   7.424
  634   3HB   ALA  79          3HB       ALA  79  -0.004 -12.137   8.485
  635    H    ARG  80           H        ARG  80  -2.766 -11.222   6.976
  636    HA   ARG  80           HA       ARG  80  -3.598 -13.194   5.224
  637   1HB   ARG  80          1HB       ARG  80  -5.140 -10.723   6.036
  638   2HB   ARG  80          2HB       ARG  80  -5.832 -12.206   5.393
  639   1HG   ARG  80          1HG       ARG  80  -4.587 -13.278   7.452
  640   2HG   ARG  80          2HG       ARG  80  -4.726 -11.638   8.089
  641   1HD   ARG  80          1HD       ARG  80  -6.676 -12.612   8.848
  642   2HD   ARG  80          2HD       ARG  80  -7.209 -11.845   7.352
  643    HE   ARG  80           HE       ARG  80  -6.429 -14.444   6.732
  644   1HH1  ARG  80          1HH1      ARG  80  -8.869 -12.824   8.614
  645   2HH1  ARG  80          2HH1      ARG  80 -10.039 -14.088   8.426
  646   1HH2  ARG  80          1HH2      ARG  80  -7.960 -16.115   6.478
  647   2HH2  ARG  80          2HH2      ARG  80  -9.520 -15.961   7.211
  648    H    CYS  81           H        CYS  81  -3.178  -9.732   4.643
  649    HA   CYS  81           HA       CYS  81  -3.955 -10.062   1.849
  650   1HB   CYS  81          1HB       CYS  81  -3.063  -7.514   3.199
  651   2HB   CYS  81          2HB       CYS  81  -3.988  -7.681   1.711
  652    HG   CYS  81           HG       CYS  81  -6.225  -7.288   2.891
  653    H    HIS  82           H        HIS  82  -2.557 -10.138   0.198
  654    HA   HIS  82           HA       HIS  82   0.234 -10.432   0.728
  655   1HB   HIS  82          1HB       HIS  82  -1.154 -11.596  -1.094
  656   2HB   HIS  82          2HB       HIS  82  -0.985 -10.100  -2.007
  657    HD1  HIS  82           1HD      HIS  82   0.927 -13.085  -0.855
  658    HD2  HIS  82           2HD      HIS  82   1.594  -9.597  -3.011
  659    HE1  HIS  82           1HE      HIS  82   3.170 -13.390  -1.950
  660    H    ILE  83           H        ILE  83   1.769  -8.929   0.742
  661    HA   ILE  83           HA       ILE  83   1.149  -6.296  -0.427
  662    HB   ILE  83           HB       ILE  83   2.673  -5.304   1.201
  663   1HG1  ILE  83          1HG1      ILE  83   2.876  -8.073   2.402
  664   2HG1  ILE  83          2HG1      ILE  83   4.141  -7.308   1.446
  665   1HG2  ILE  83          1HG2      ILE  83   1.333  -5.791   3.266
  666   2HG2  ILE  83          2HG2      ILE  83   0.385  -5.356   1.845
  667   3HG2  ILE  83          3HG2      ILE  83   0.499  -7.042   2.346
  668   1HD1  ILE  83          1HD1      ILE  83   4.624  -7.114   3.802
  669   2HD1  ILE  83          2HD1      ILE  83   4.295  -5.522   3.119
  670   3HD1  ILE  83          3HD1      ILE  83   3.066  -6.339   4.084
  671    H    GLU  84           H        GLU  84   2.750  -5.210  -1.583
  672    HA   GLU  84           HA       GLU  84   5.303  -6.524  -2.038
  673   1HB   GLU  84          1HB       GLU  84   3.171  -6.230  -4.128
  674   2HB   GLU  84          2HB       GLU  84   4.868  -6.194  -4.586
  675   1HG   GLU  84          1HG       GLU  84   3.475  -8.437  -3.142
  676   2HG   GLU  84          2HG       GLU  84   3.927  -8.418  -4.846
  677    H    LYS  85           H        LYS  85   6.743  -5.179  -3.428
  678    HA   LYS  85           HA       LYS  85   6.598  -2.441  -2.577
  679   1HB   LYS  85          1HB       LYS  85   8.566  -3.839  -4.399
  680   2HB   LYS  85          2HB       LYS  85   8.754  -2.207  -3.772
  681   1HG   LYS  85          1HG       LYS  85   8.561  -3.313  -1.452
  682   2HG   LYS  85          2HG       LYS  85   8.907  -4.814  -2.314
  683   1HD   LYS  85          1HD       LYS  85  10.701  -2.629  -3.036
  684   2HD   LYS  85          2HD       LYS  85  10.777  -3.057  -1.325
  685   1HE   LYS  85          1HE       LYS  85  12.301  -4.540  -2.141
  686   2HE   LYS  85          2HE       LYS  85  10.840  -5.509  -2.323
  687   1HZ   LYS  85          1HZ       LYS  85  10.974  -4.083  -4.637
  688   2HZ   LYS  85          2HZ       LYS  85  11.438  -5.698  -4.443
  689   3HZ   LYS  85          3HZ       LYS  85  12.593  -4.467  -4.332
  690    H    ALA  86           H        ALA  86   5.961  -0.697  -3.698
  691    HA   ALA  86           HA       ALA  86   4.721  -1.112  -6.286
  692   1HB   ALA  86          1HB       ALA  86   4.637   1.620  -5.555
  693   2HB   ALA  86          2HB       ALA  86   3.328   0.437  -5.529
  694   3HB   ALA  86          3HB       ALA  86   4.336   0.669  -4.101
  695    H    LYS  87           H        LYS  87   5.132   0.314  -8.103
  696    HA   LYS  87           HA       LYS  87   7.783   1.561  -8.136
  697   1HB   LYS  87          1HB       LYS  87   8.440   0.465 -10.157
  698   2HB   LYS  87          2HB       LYS  87   7.945  -0.783  -9.021
  699   1HG   LYS  87          1HG       LYS  87   5.636  -0.122 -10.444
  700   2HG   LYS  87          2HG       LYS  87   6.931  -0.187 -11.642
  701   1HD   LYS  87          1HD       LYS  87   7.397  -2.417 -11.201
  702   2HD   LYS  87          2HD       LYS  87   6.655  -2.359  -9.601
  703   1HE   LYS  87          1HE       LYS  87   4.485  -2.429 -10.484
  704   2HE   LYS  87          2HE       LYS  87   5.034  -1.982 -12.099
  705   1HZ   LYS  87          1HZ       LYS  87   6.094  -4.127 -12.312
  706   2HZ   LYS  87          2HZ       LYS  87   4.458  -4.335 -11.939
  707   3HZ   LYS  87          3HZ       LYS  87   5.632  -4.556 -10.742
  708    H    GLY  88           H        GLY  88   7.999   3.289  -9.545
  709   1HA   GLY  88          1HA       GLY  88   7.201   4.522 -11.491
  710   2HA   GLY  88          2HA       GLY  88   5.571   4.036 -11.049
  711    H    THR  89           H        THR  89   4.855   6.188 -11.036
  712    HA   THR  89           HA       THR  89   5.890   7.815  -8.807
  713    HB   THR  89           HB       THR  89   5.261   9.804  -9.968
  714    HG1  THR  89           1HG      THR  89   4.279   9.578 -12.114
  715   1HG2  THR  89          1HG2      THR  89   6.691   9.744 -11.890
  716   2HG2  THR  89          2HG2      THR  89   6.502   7.997 -12.042
  717   3HG2  THR  89          3HG2      THR  89   7.384   8.673 -10.672
  718    H    ASP  90           H        ASP  90   4.135   9.468  -8.081
  719    HA   ASP  90           HA       ASP  90   2.095   8.090  -6.803
  720   1HB   ASP  90          1HB       ASP  90   2.907  10.311  -6.102
  721   2HB   ASP  90          2HB       ASP  90   2.151  11.029  -7.522
  722    H    GLN  91           H        GLN  91   2.052   9.836  -9.872
  723    HA   GLN  91           HA       GLN  91  -0.733   9.643 -10.318
  724   1HB   GLN  91          1HB       GLN  91   1.007  11.143 -11.491
  725   2HB   GLN  91          2HB       GLN  91   1.314   9.749 -12.518
  726   1HG   GLN  91          1HG       GLN  91  -0.222  11.080 -13.686
  727   2HG   GLN  91          2HG       GLN  91  -1.158   9.739 -13.027
  728   1HE2  GLN  91          1HE2      GLN  91  -2.901  10.193 -11.865
  729   2HE2  GLN  91          2HE2      GLN  91  -3.329  11.755 -11.264
  730    H    GLN  92           H        GLN  92   1.971   7.525 -11.054
  731    HA   GLN  92           HA       GLN  92   0.593   5.765 -12.781
  732   1HB   GLN  92          1HB       GLN  92   3.058   5.449 -11.078
  733   2HB   GLN  92          2HB       GLN  92   2.443   4.143 -12.082
  734   1HG   GLN  92          1HG       GLN  92   2.520   6.155 -13.880
  735   2HG   GLN  92          2HG       GLN  92   3.866   6.598 -12.831
  736   1HE2  GLN  92          1HE2      GLN  92   5.731   5.494 -12.966
  737   2HE2  GLN  92          2HE2      GLN  92   6.001   4.149 -14.015
  738    H    ASN  93           H        ASN  93   1.094   5.784  -9.282
  739    HA   ASN  93           HA       ASN  93  -0.266   3.281  -8.891
  740   1HB   ASN  93          1HB       ASN  93   0.806   5.397  -7.036
  741   2HB   ASN  93          2HB       ASN  93  -0.157   4.052  -6.431
  742   1HD2  ASN  93          1HD2      ASN  93   2.416   4.377  -8.855
  743   2HD2  ASN  93          2HD2      ASN  93   3.425   3.139  -8.195
  744    H    LYS  94           H        LYS  94  -1.061   6.702  -8.575
  745    HA   LYS  94           HA       LYS  94  -3.565   6.411  -7.336
  746   1HB   LYS  94          1HB       LYS  94  -2.296   8.551  -7.560
  747   2HB   LYS  94          2HB       LYS  94  -2.725   8.581  -9.265
  748   1HG   LYS  94          1HG       LYS  94  -4.929   9.072  -8.845
  749   2HG   LYS  94          2HG       LYS  94  -4.886   8.374  -7.224
  750   1HD   LYS  94          1HD       LYS  94  -4.126  10.283  -6.283
  751   2HD   LYS  94          2HD       LYS  94  -3.108  10.684  -7.669
  752   1HE   LYS  94          1HE       LYS  94  -4.620  12.205  -8.251
  753   2HE   LYS  94          2HE       LYS  94  -5.740  10.886  -8.590
  754   1HZ   LYS  94          1HZ       LYS  94  -6.115  12.841  -6.749
  755   2HZ   LYS  94          2HZ       LYS  94  -5.582  11.545  -5.801
  756   3HZ   LYS  94          3HZ       LYS  94  -6.941  11.365  -6.792
  757    H    GLU  95           H        GLU  95  -2.690   6.655 -10.772
  758    HA   GLU  95           HA       GLU  95  -5.369   6.404 -11.705
  759   1HB   GLU  95          1HB       GLU  95  -2.725   6.005 -13.113
  760   2HB   GLU  95          2HB       GLU  95  -4.287   5.999 -13.921
  761   1HG   GLU  95          1HG       GLU  95  -3.850   8.355 -12.263
  762   2HG   GLU  95          2HG       GLU  95  -2.675   8.178 -13.565
  763    H    TYR  96           H        TYR  96  -2.715   4.141 -11.189
  764    HA   TYR  96           HA       TYR  96  -3.807   1.897 -12.440
  765   1HB   TYR  96          1HB       TYR  96  -1.482   1.989 -11.682
  766   2HB   TYR  96          2HB       TYR  96  -2.016   2.019 -10.005
  767    HD1  TYR  96           2HD      TYR  96  -1.734  -0.066 -13.029
  768    HD2  TYR  96           1HD      TYR  96  -2.686   0.013  -8.882
  769    HE1  TYR  96           2HE      TYR  96  -1.682  -2.525 -12.976
  770    HE2  TYR  96           1HE      TYR  96  -2.635  -2.445  -8.818
  771    HH   TYR  96           HH       TYR  96  -2.448  -4.316 -10.010
  772    H    CYS  97           H        CYS  97  -4.096   2.991  -9.074
  773    HA   CYS  97           HA       CYS  97  -5.698   0.846  -8.190
  774   1HB   CYS  97          1HB       CYS  97  -5.427   3.668  -7.139
  775   2HB   CYS  97          2HB       CYS  97  -6.291   2.383  -6.303
  776    HG   CYS  97           HG       CYS  97  -3.691   0.835  -6.562
  777    H    SER  98           H        SER  98  -6.465   3.936  -9.676
  778    HA   SER  98           HA       SER  98  -9.303   3.644  -9.282
  779   1HB   SER  98          1HB       SER  98  -9.512   5.764 -10.203
  780   2HB   SER  98          2HB       SER  98  -7.874   5.834  -9.555
  781    HG   SER  98           HG       SER  98  -8.123   6.580 -11.770
  782    H    LYS  99           H        LYS  99  -7.048   2.406 -11.459
  783    HA   LYS  99           HA       LYS  99  -8.444   2.360 -13.878
  784   1HB   LYS  99          1HB       LYS  99  -6.062   1.713 -13.590
  785   2HB   LYS  99          2HB       LYS  99  -6.586   0.232 -12.800
  786   1HG   LYS  99          1HG       LYS  99  -7.750  -0.430 -14.864
  787   2HG   LYS  99          2HG       LYS  99  -7.145   1.030 -15.649
  788   1HD   LYS  99          1HD       LYS  99  -5.745  -0.860 -16.230
  789   2HD   LYS  99          2HD       LYS  99  -4.837   0.271 -15.223
  790   1HE   LYS  99          1HE       LYS  99  -4.451  -1.319 -13.721
  791   2HE   LYS  99          2HE       LYS  99  -6.178  -1.628 -13.554
  792   1HZ   LYS  99          1HZ       LYS  99  -5.561  -3.634 -14.339
  793   2HZ   LYS  99          2HZ       LYS  99  -4.183  -3.048 -15.124
  794   3HZ   LYS  99          3HZ       LYS  99  -5.705  -2.870 -15.842
  795    H    GLU 100           H        GLU 100  -8.986   0.644 -10.948
  796    HA   GLU 100           HA       GLU 100 -10.417  -1.561 -12.059
  797   1HB   GLU 100          1HB       GLU 100 -10.281  -0.399  -9.279
  798   2HB   GLU 100          2HB       GLU 100 -11.258  -1.807  -9.673
  799   1HG   GLU 100          1HG       GLU 100  -9.476  -3.172  -9.835
  800   2HG   GLU 100          2HG       GLU 100  -8.440  -1.920 -10.520
  801    H    GLY 101           H        GLY 101 -11.170   1.715 -11.558
  802   1HA   GLY 101          1HA       GLY 101 -13.094   2.832 -12.240
  803   2HA   GLY 101          2HA       GLY 101 -13.879   1.278 -12.477
  804    H    ASN 102           H        ASN 102 -12.594   1.034  -9.507
  805    HA   ASN 102           HA       ASN 102 -14.839   2.360  -8.153
  806   1HB   ASN 102          1HB       ASN 102 -14.494  -0.461  -8.478
  807   2HB   ASN 102          2HB       ASN 102 -14.293  -0.064  -6.775
  808   1HD2  ASN 102          1HD2      ASN 102 -16.185  -0.979  -6.103
  809   2HD2  ASN 102          2HD2      ASN 102 -17.741  -0.350  -6.512
  810    H    LEU 103           H        LEU 103 -14.199   3.550  -6.483
  811    HA   LEU 103           HA       LEU 103 -11.486   3.145  -5.439
  812   1HB   LEU 103          1HB       LEU 103 -13.039   5.447  -6.113
  813   2HB   LEU 103          2HB       LEU 103 -12.633   5.509  -4.399
  814    HG   LEU 103           HG       LEU 103 -11.048   6.712  -5.920
  815   1HD1  LEU 103          1HD1      LEU 103  -9.109   4.998  -4.871
  816   2HD1  LEU 103          2HD1      LEU 103 -10.483   4.887  -3.771
  817   3HD1  LEU 103          3HD1      LEU 103  -9.765   6.458  -4.129
  818   1HD2  LEU 103          1HD2      LEU 103 -11.204   4.419  -7.437
  819   2HD2  LEU 103          2HD2      LEU 103  -9.626   4.284  -6.661
  820   3HD2  LEU 103          3HD2      LEU 103 -10.016   5.709  -7.625
  821    H    LEU 104           H        LEU 104 -11.211   2.282  -3.496
  822    HA   LEU 104           HA       LEU 104 -13.517   1.877  -1.771
  823   1HB   LEU 104          1HB       LEU 104 -11.532   0.223  -2.408
  824   2HB   LEU 104          2HB       LEU 104 -10.801   0.970  -0.989
  825    HG   LEU 104           HG       LEU 104 -11.903  -1.142  -0.442
  826   1HD1  LEU 104          1HD1      LEU 104 -12.631  -0.397   1.555
  827   2HD1  LEU 104          2HD1      LEU 104 -13.719   0.792   0.840
  828   3HD1  LEU 104          3HD1      LEU 104 -11.996   1.143   0.974
  829   1HD2  LEU 104          1HD2      LEU 104 -13.901  -0.180  -2.184
  830   2HD2  LEU 104          2HD2      LEU 104 -14.634  -0.315  -0.585
  831   3HD2  LEU 104          3HD2      LEU 104 -13.857  -1.718  -1.321
  832    H    MET 105           H        MET 105 -10.535   3.699  -1.866
  833    HA   MET 105           HA       MET 105 -11.457   5.388   0.274
  834   1HB   MET 105          1HB       MET 105 -10.472   3.918   1.774
  835   2HB   MET 105          2HB       MET 105  -9.189   3.473   0.656
  836   1HG   MET 105          1HG       MET 105  -7.870   5.202   1.259
  837   2HG   MET 105          2HG       MET 105  -9.231   6.281   1.557
  838   1HE   MET 105          1HE       MET 105  -6.805   3.952   4.501
  839   2HE   MET 105          2HE       MET 105  -7.562   2.901   3.304
  840   3HE   MET 105          3HE       MET 105  -6.542   4.242   2.781
  841    H    GLU 106           H        GLU 106 -10.671   7.423   0.083
  842    HA   GLU 106           HA       GLU 106  -8.374   7.854  -1.699
  843   1HB   GLU 106          1HB       GLU 106 -10.793   8.270  -2.668
  844   2HB   GLU 106          2HB       GLU 106 -10.663   9.773  -1.765
  845   1HG   GLU 106          1HG       GLU 106  -8.399   9.039  -3.526
  846   2HG   GLU 106          2HG       GLU 106  -9.901   9.555  -4.293
  847    H    CYS 107           H        CYS 107  -6.878   8.603  -0.326
  848    HA   CYS 107           HA       CYS 107  -7.380  11.113   1.024
  849   1HB   CYS 107          1HB       CYS 107  -7.003   8.537   2.476
  850   2HB   CYS 107          2HB       CYS 107  -6.226   9.973   3.132
  851    HG   CYS 107           HG       CYS 107  -9.500   9.180   2.999
  852    H    GLY 108           H        GLY 108  -5.244  11.686   2.329
  853   1HA   GLY 108          1HA       GLY 108  -2.905  11.795   2.366
  854   2HA   GLY 108          2HA       GLY 108  -2.852  10.657   1.028
  855    H    ALA 109           H        ALA 109  -1.131  12.525   0.671
  856    HA   ALA 109           HA       ALA 109  -2.405  14.608  -0.978
  857   1HB   ALA 109          1HB       ALA 109  -0.999  16.105  -0.123
  858   2HB   ALA 109          2HB       ALA 109  -0.552  14.880   1.065
  859   3HB   ALA 109          3HB       ALA 109   0.396  15.065  -0.411
  860    HA   PRO 110           HA       PRO 110  -0.574  13.046  -4.647
  861   1HB   PRO 110          1HB       PRO 110   0.107  15.321  -5.962
  862   2HB   PRO 110          2HB       PRO 110  -1.568  14.790  -5.766
  863   1HG   PRO 110          1HG       PRO 110  -0.035  16.835  -4.208
  864   2HG   PRO 110          2HG       PRO 110  -1.700  16.907  -4.813
  865   1HD   PRO 110          1HD       PRO 110  -1.110  16.318  -2.237
  866   2HD   PRO 110          2HD       PRO 110  -2.520  15.636  -3.073
  867    H    ARG 111           H        ARG 111   1.292  11.973  -4.089
  868    HA   ARG 111           HA       ARG 111   3.686  13.286  -3.288
  869   1HB   ARG 111          1HB       ARG 111   3.000  10.484  -4.116
  870   2HB   ARG 111          2HB       ARG 111   4.678  10.959  -3.890
  871   1HG   ARG 111          1HG       ARG 111   2.516  11.172  -1.805
  872   2HG   ARG 111          2HG       ARG 111   3.727   9.893  -1.900
  873   1HD   ARG 111          1HD       ARG 111   4.839  11.235  -0.462
  874   2HD   ARG 111          2HD       ARG 111   5.335  12.040  -1.950
  875    HE   ARG 111           HE       ARG 111   2.903  13.121  -0.960
  876   1HH1  ARG 111          1HH1      ARG 111   6.346  13.120  -0.445
  877   2HH1  ARG 111          2HH1      ARG 111   6.371  14.698   0.269
  878   1HH2  ARG 111          1HH2      ARG 111   2.923  15.200  -0.022
  879   2HH2  ARG 111          2HH2      ARG 111   4.424  15.880   0.510
  880    H    SER 112           H        SER 112   5.684  13.386  -4.448
  881    HA   SER 112           HA       SER 112   5.723  12.931  -7.289
  882   1HB   SER 112          1HB       SER 112   4.969  15.522  -6.278
  883   2HB   SER 112          2HB       SER 112   6.502  15.639  -7.143
  884    HG   SER 112           HG       SER 112   4.884  15.868  -8.640
  885    H    GLN 113           H        GLN 113   7.821  13.201  -8.212
  886    HA   GLN 113           HA       GLN 113  10.013  13.844  -6.406
  887   1HB   GLN 113          1HB       GLN 113   9.234  11.200  -6.744
  888   2HB   GLN 113          2HB       GLN 113  10.586  11.384  -7.854
  889   1HG   GLN 113          1HG       GLN 113  12.053  11.343  -6.198
  890   2HG   GLN 113          2HG       GLN 113  11.178  12.587  -5.307
  891   1HE2  GLN 113          1HE2      GLN 113  11.064   9.134  -6.078
  892   2HE2  GLN 113          2HE2      GLN 113  10.441   8.634  -4.546
  893    H    GLY 114           H        GLY 114  12.177  13.559  -7.662
  894   1HA   GLY 114          1HA       GLY 114  12.638  13.454 -10.283
  895   2HA   GLY 114          2HA       GLY 114  11.831  15.011 -10.164
  896    H    GLN 115           H        GLN 115  14.622  13.157  -9.047
  897    HA   GLN 115           HA       GLN 115  16.386  15.344  -9.356
  898   1HB   GLN 115          1HB       GLN 115  16.938  15.844  -7.072
  899   2HB   GLN 115          2HB       GLN 115  15.205  16.061  -7.278
  900   1HG   GLN 115          1HG       GLN 115  14.832  13.846  -6.277
  901   2HG   GLN 115          2HG       GLN 115  16.569  13.693  -6.019
  902   1HE2  GLN 115          1HE2      GLN 115  16.143  13.471  -3.781
  903   2HE2  GLN 115          2HE2      GLN 115  15.799  14.853  -2.803
  904    H    ARG 116           H        ARG 116  18.503  14.694  -9.332
  905    HA   ARG 116           HA       ARG 116  18.960  11.852  -9.295
  906   1HB   ARG 116          1HB       ARG 116  20.002  13.656 -10.861
  907   2HB   ARG 116          2HB       ARG 116  21.138  13.900  -9.541
  908   1HG   ARG 116          1HG       ARG 116  21.388  11.290  -9.703
  909   2HG   ARG 116          2HG       ARG 116  20.795  11.562 -11.343
  910   1HD   ARG 116          1HD       ARG 116  22.812  13.496 -10.691
  911   2HD   ARG 116          2HD       ARG 116  23.418  11.869 -10.383
  912    HE   ARG 116           HE       ARG 116  22.207  11.797 -12.867
  913   1HH1  ARG 116          1HH1      ARG 116  24.863  13.467 -11.358
  914   2HH1  ARG 116          2HH1      ARG 116  25.771  13.621 -12.825
  915   1HH2  ARG 116          1HH2      ARG 116  23.393  11.995 -14.806
  916   2HH2  ARG 116          2HH2      ARG 116  24.933  12.784 -14.786
  Start of MODEL    5
    1    HA   PRO   2           HA       PRO   2  28.509   1.279  22.251
    2   1HB   PRO   2          1HB       PRO   2  29.770   3.094  20.674
    3   2HB   PRO   2          2HB       PRO   2  28.993   3.524  22.203
    4   1HG   PRO   2          1HG       PRO   2  31.887   3.021  21.624
    5   2HG   PRO   2          2HG       PRO   2  31.149   4.295  22.612
    6   1HD   PRO   2          1HD       PRO   2  32.262   2.075  23.692
    7   2HD   PRO   2          2HD       PRO   2  30.874   2.902  24.428
    8    H    SER   3           H        SER   3  28.089   0.172  20.429
    9    HA   SER   3           HA       SER   3  30.008  -0.297  18.380
   10   1HB   SER   3          1HB       SER   3  30.654  -1.944  20.249
   11   2HB   SER   3          2HB       SER   3  29.166  -2.796  19.841
   12    HG   SER   3           HG       SER   3  31.551  -2.751  18.535
   13    H    LYS   4           H        LYS   4  28.815  -0.197  16.610
   14    HA   LYS   4           HA       LYS   4  26.540  -1.886  16.213
   15   1HB   LYS   4          1HB       LYS   4  24.964   0.020  15.730
   16   2HB   LYS   4          2HB       LYS   4  25.343  -0.223  17.430
   17   1HG   LYS   4          1HG       LYS   4  27.066   1.590  17.200
   18   2HG   LYS   4          2HG       LYS   4  26.401   1.911  15.597
   19   1HD   LYS   4          1HD       LYS   4  25.397   3.433  17.159
   20   2HD   LYS   4          2HD       LYS   4  24.176   2.261  16.656
   21   1HE   LYS   4          1HE       LYS   4  24.343   1.077  18.701
   22   2HE   LYS   4          2HE       LYS   4  25.811   1.938  19.162
   23   1HZ   LYS   4          1HZ       LYS   4  23.890   2.767  20.362
   24   2HZ   LYS   4          2HZ       LYS   4  23.107   3.140  18.910
   25   3HZ   LYS   4          3HZ       LYS   4  24.514   3.970  19.348
   26    H    LYS   5           H        LYS   5  26.340  -2.353  14.107
   27    HA   LYS   5           HA       LYS   5  26.765  -0.557  11.985
   28   1HB   LYS   5          1HB       LYS   5  29.140  -1.885  13.019
   29   2HB   LYS   5          2HB       LYS   5  28.866  -2.255  11.322
   30   1HG   LYS   5          1HG       LYS   5  29.300  -0.141  10.647
   31   2HG   LYS   5          2HG       LYS   5  28.629   0.582  12.111
   32   1HD   LYS   5          1HD       LYS   5  31.056  -1.013  12.536
   33   2HD   LYS   5          2HD       LYS   5  31.286   0.418  11.529
   34   1HE   LYS   5          1HE       LYS   5  31.536   1.468  13.503
   35   2HE   LYS   5          2HE       LYS   5  29.774   1.442  13.527
   36   1HZ   LYS   5          1HZ       LYS   5  30.380   0.592  15.583
   37   2HZ   LYS   5          2HZ       LYS   5  31.661  -0.318  14.959
   38   3HZ   LYS   5          3HZ       LYS   5  30.065  -0.804  14.681
   39    H    ASN   6           H        ASN   6  26.387  -1.505   9.928
   40    HA   ASN   6           HA       ASN   6  25.761  -4.354   9.860
   41   1HB   ASN   6          1HB       ASN   6  23.747  -2.472  10.265
   42   2HB   ASN   6          2HB       ASN   6  23.662  -2.832   8.543
   43   1HD2  ASN   6          1HD2      ASN   6  22.035  -3.526  11.041
   44   2HD2  ASN   6          2HD2      ASN   6  21.762  -5.224  10.881
   45    H    GLY   7           H        GLY   7  24.907  -4.869   7.507
   46   1HA   GLY   7          1HA       GLY   7  25.364  -3.471   5.252
   47   2HA   GLY   7          2HA       GLY   7  26.993  -3.922   5.733
   48    H    ARG   8           H        ARG   8  23.864  -5.135   4.705
   49    HA   ARG   8           HA       ARG   8  25.203  -7.589   3.796
   50   1HB   ARG   8          1HB       ARG   8  22.461  -7.461   5.066
   51   2HB   ARG   8          2HB       ARG   8  23.223  -8.901   4.405
   52   1HG   ARG   8          1HG       ARG   8  24.812  -7.507   6.434
   53   2HG   ARG   8          2HG       ARG   8  23.284  -8.172   7.014
   54   1HD   ARG   8          1HD       ARG   8  25.092  -9.846   5.323
   55   2HD   ARG   8          2HD       ARG   8  25.445  -9.634   7.038
   56    HE   ARG   8           HE       ARG   8  23.358 -11.224   5.889
   57   1HH1  ARG   8          1HH1      ARG   8  24.311  -9.392   8.692
   58   2HH1  ARG   8          2HH1      ARG   8  23.286 -10.271   9.777
   59   1HH2  ARG   8          1HH2      ARG   8  22.005 -12.390   7.308
   60   2HH2  ARG   8          2HH2      ARG   8  21.975 -11.977   8.989
   61    H    SER   9           H        SER   9  23.252  -8.823   2.450
   62    HA   SER   9           HA       SER   9  22.364  -6.828   0.470
   63   1HB   SER   9          1HB       SER   9  22.762  -9.639  -0.398
   64   2HB   SER   9          2HB       SER   9  23.086  -8.136  -1.260
   65    HG   SER   9           HG       SER   9  24.999  -7.935  -0.206
   66    H    GLY  10           H        GLY  10  20.454  -7.467  -0.805
   67   1HA   GLY  10          1HA       GLY  10  18.622  -9.210  -0.871
   68   2HA   GLY  10          2HA       GLY  10  18.575  -9.007   0.874
   69    HA   PRO  11           HA       PRO  11  15.400  -6.198  -1.006
   70   1HB   PRO  11          1HB       PRO  11  13.423  -6.891   0.721
   71   2HB   PRO  11          2HB       PRO  11  13.750  -7.780  -0.771
   72   1HG   PRO  11          1HG       PRO  11  14.578  -8.417   2.034
   73   2HG   PRO  11          2HG       PRO  11  13.951  -9.502   0.779
   74   1HD   PRO  11          1HD       PRO  11  16.588  -9.323   1.365
   75   2HD   PRO  11          2HD       PRO  11  15.995  -9.674  -0.271
   76    H    GLN  12           H        GLN  12  14.910  -4.186  -0.264
   77    HA   GLN  12           HA       GLN  12  15.512  -3.597   2.558
   78   1HB   GLN  12          1HB       GLN  12  16.538  -2.353   0.088
   79   2HB   GLN  12          2HB       GLN  12  16.021  -1.225   1.334
   80   1HG   GLN  12          1HG       GLN  12  17.483  -2.525   2.932
   81   2HG   GLN  12          2HG       GLN  12  18.142  -3.340   1.515
   82   1HE2  GLN  12          1HE2      GLN  12  19.811  -2.432   0.537
   83   2HE2  GLN  12          2HE2      GLN  12  20.348  -0.805   0.756
   84    HA   PRO  13           HA       PRO  13  11.622  -1.600   2.888
   85   1HB   PRO  13          1HB       PRO  13  12.192   0.544   4.452
   86   2HB   PRO  13          2HB       PRO  13  12.162  -1.112   5.067
   87   1HG   PRO  13          1HG       PRO  13  14.505   0.562   4.250
   88   2HG   PRO  13          2HG       PRO  13  14.326  -0.499   5.659
   89   1HD   PRO  13          1HD       PRO  13  15.669  -1.249   3.431
   90   2HD   PRO  13          2HD       PRO  13  14.772  -2.403   4.438
   91    H    HIS  14           H        HIS  14  10.350  -0.002   1.994
   92    HA   HIS  14           HA       HIS  14  11.695   2.221   0.632
   93   1HB   HIS  14          1HB       HIS  14   9.735   0.295  -0.625
   94   2HB   HIS  14          2HB       HIS  14  10.169   1.845  -1.340
   95    HD1  HIS  14           1HD      HIS  14  11.499  -1.587  -0.699
   96    HD2  HIS  14           2HD      HIS  14  12.718   1.954  -2.498
   97    HE1  HIS  14           1HE      HIS  14  13.571  -2.172  -1.999
   98    H    LYS  15           H        LYS  15   9.835   3.669  -0.390
   99    HA   LYS  15           HA       LYS  15   7.972   4.199   1.817
  100   1HB   LYS  15          1HB       LYS  15   7.768   6.466   0.713
  101   2HB   LYS  15          2HB       LYS  15   9.345   6.089   1.395
  102   1HG   LYS  15          1HG       LYS  15   9.242   5.249  -1.344
  103   2HG   LYS  15          2HG       LYS  15   8.755   6.940  -1.206
  104   1HD   LYS  15          1HD       LYS  15  10.974   7.326  -1.266
  105   2HD   LYS  15          2HD       LYS  15  10.901   6.896   0.445
  106   1HE   LYS  15          1HE       LYS  15  11.635   4.693   0.020
  107   2HE   LYS  15          2HE       LYS  15  11.357   4.852  -1.713
  108   1HZ   LYS  15          1HZ       LYS  15  13.290   5.961  -2.016
  109   2HZ   LYS  15          2HZ       LYS  15  13.745   5.092  -0.638
  110   3HZ   LYS  15          3HZ       LYS  15  13.254   6.705  -0.497
  111    H    ARG  16           H        ARG  16   7.718   2.295  -0.573
  112    HA   ARG  16           HA       ARG  16   4.986   3.098  -1.244
  113   1HB   ARG  16          1HB       ARG  16   7.069   2.280  -3.277
  114   2HB   ARG  16          2HB       ARG  16   5.351   2.443  -3.615
  115   1HG   ARG  16          1HG       ARG  16   5.802   4.538  -4.192
  116   2HG   ARG  16          2HG       ARG  16   6.006   4.862  -2.469
  117   1HD   ARG  16          1HD       ARG  16   7.964   5.677  -3.471
  118   2HD   ARG  16          2HD       ARG  16   8.422   4.119  -2.785
  119    HE   ARG  16           HE       ARG  16   7.600   3.920  -5.517
  120   1HH1  ARG  16          1HH1      ARG  16  10.263   4.707  -3.418
  121   2HH1  ARG  16          2HH1      ARG  16  11.475   4.327  -4.596
  122   1HH2  ARG  16          1HH2      ARG  16   9.186   3.416  -7.077
  123   2HH2  ARG  16          2HH2      ARG  16  10.861   3.593  -6.678
  124    H    TRP  17           H        TRP  17   3.613   1.468  -0.966
  125    HA   TRP  17           HA       TRP  17   4.430  -1.268  -1.494
  126   1HB   TRP  17          1HB       TRP  17   3.643  -0.286   1.247
  127   2HB   TRP  17          2HB       TRP  17   3.511  -1.979   0.779
  128    HD1  TRP  17           HD       TRP  17   6.044   0.657   1.783
  129    HE1  TRP  17           1HE      TRP  17   8.345  -0.456   2.084
  130    HE3  TRP  17           3HE      TRP  17   4.968  -3.962  -0.126
  131    HZ2  TRP  17           2HZ      TRP  17   9.545  -2.960   1.580
  132    HZ3  TRP  17           3HZ      TRP  17   6.749  -5.660  -0.180
  133    HH2  TRP  17           HH       TRP  17   8.990  -5.167   0.655
  134    H    VAL  18           H        VAL  18   2.777  -2.501  -2.211
  135    HA   VAL  18           HA       VAL  18   0.100  -1.278  -2.189
  136    HB   VAL  18           HB       VAL  18  -0.402  -2.583  -4.180
  137   1HG1  VAL  18          1HG1      VAL  18   2.163  -1.010  -4.336
  138   2HG1  VAL  18          2HG1      VAL  18   1.231  -1.523  -5.743
  139   3HG1  VAL  18          3HG1      VAL  18   0.522  -0.411  -4.572
  140   1HG2  VAL  18          1HG2      VAL  18   0.745  -4.394  -4.768
  141   2HG2  VAL  18          2HG2      VAL  18   2.246  -3.473  -4.860
  142   3HG2  VAL  18          3HG2      VAL  18   1.737  -4.179  -3.326
  143    H    PHE  19           H        PHE  19  -1.741  -2.787  -2.144
  144    HA   PHE  19           HA       PHE  19  -1.169  -5.312  -0.763
  145   1HB   PHE  19          1HB       PHE  19  -3.122  -4.823   0.762
  146   2HB   PHE  19          2HB       PHE  19  -1.692  -3.835   1.038
  147    HD1  PHE  19           1HD      PHE  19  -1.651  -1.484   0.219
  148    HD2  PHE  19           2HD      PHE  19  -5.183  -3.857   0.154
  149    HE1  PHE  19           1HE      PHE  19  -3.011   0.553  -0.019
  150    HE2  PHE  19           2HE      PHE  19  -6.549  -1.825  -0.085
  151    HZ   PHE  19           HZ       PHE  19  -5.463   0.384  -0.172
  152    H    THR  20           H        THR  20  -2.625  -6.962  -1.138
  153    HA   THR  20           HA       THR  20  -5.011  -6.438  -2.717
  154    HB   THR  20           HB       THR  20  -4.459  -7.991  -4.489
  155    HG1  THR  20           1HG      THR  20  -1.835  -8.198  -3.418
  156   1HG2  THR  20          1HG2      THR  20  -3.740  -5.591  -4.669
  157   2HG2  THR  20          2HG2      THR  20  -2.820  -6.712  -5.672
  158   3HG2  THR  20          3HG2      THR  20  -2.129  -6.102  -4.169
  159    H    LEU  21           H        LEU  21  -6.623  -7.727  -2.093
  160    HA   LEU  21           HA       LEU  21  -6.014 -10.364  -0.977
  161   1HB   LEU  21          1HB       LEU  21  -6.183  -8.769   0.898
  162   2HB   LEU  21          2HB       LEU  21  -7.811  -8.350   0.367
  163    HG   LEU  21           HG       LEU  21  -7.897 -11.103   0.686
  164   1HD1  LEU  21          1HD1      LEU  21  -7.111 -11.267   3.108
  165   2HD1  LEU  21          2HD1      LEU  21  -6.140  -9.837   2.763
  166   3HD1  LEU  21          3HD1      LEU  21  -5.878 -11.321   1.848
  167   1HD2  LEU  21          1HD2      LEU  21  -9.545 -10.636   2.218
  168   2HD2  LEU  21          2HD2      LEU  21  -9.457  -9.108   1.342
  169   3HD2  LEU  21          3HD2      LEU  21  -8.667  -9.272   2.911
  170    H    ASN  22           H        ASN  22  -7.480 -11.911  -1.479
  171    HA   ASN  22           HA       ASN  22  -9.525 -11.222  -3.398
  172   1HB   ASN  22          1HB       ASN  22  -7.922 -13.449  -2.975
  173   2HB   ASN  22          2HB       ASN  22  -9.526 -13.991  -2.489
  174   1HD2  ASN  22          1HD2      ASN  22  -7.524 -14.074  -4.960
  175   2HD2  ASN  22          2HD2      ASN  22  -8.626 -14.015  -6.290
  176    H    ASN  23           H        ASN  23 -11.679 -11.167  -3.081
  177    HA   ASN  23           HA       ASN  23 -13.637 -10.931  -1.936
  178   1HB   ASN  23          1HB       ASN  23 -13.478 -13.404  -2.115
  179   2HB   ASN  23          2HB       ASN  23 -12.680 -13.443  -0.545
  180   1HD2  ASN  23          1HD2      ASN  23 -15.618 -12.210  -2.096
  181   2HD2  ASN  23          2HD2      ASN  23 -16.667 -12.544  -0.764
  182    HA   PRO  24           HA       PRO  24 -11.420  -9.116   1.764
  183   1HB   PRO  24          1HB       PRO  24 -12.046  -6.534   1.203
  184   2HB   PRO  24          2HB       PRO  24 -10.602  -7.333   0.568
  185   1HG   PRO  24          1HG       PRO  24 -13.239  -6.847  -0.763
  186   2HG   PRO  24          2HG       PRO  24 -11.603  -6.662  -1.421
  187   1HD   PRO  24          1HD       PRO  24 -13.146  -8.825  -1.942
  188   2HD   PRO  24          2HD       PRO  24 -11.376  -8.918  -1.832
  189    H    SER  25           H        SER  25 -12.443  -8.694   3.652
  190    HA   SER  25           HA       SER  25 -15.357  -8.669   3.615
  191   1HB   SER  25          1HB       SER  25 -13.299  -9.594   5.456
  192   2HB   SER  25          2HB       SER  25 -14.540  -8.646   6.276
  193    HG   SER  25           HG       SER  25 -14.914 -10.998   6.003
  194    H    GLU  26           H        GLU  26 -16.561  -7.195   4.987
  195    HA   GLU  26           HA       GLU  26 -15.937  -4.514   4.538
  196   1HB   GLU  26          1HB       GLU  26 -18.003  -6.010   5.947
  197   2HB   GLU  26          2HB       GLU  26 -17.635  -4.480   6.730
  198   1HG   GLU  26          1HG       GLU  26 -17.880  -3.468   4.375
  199   2HG   GLU  26          2HG       GLU  26 -18.696  -4.980   3.981
  200    H    ASP  27           H        ASP  27 -15.115  -6.633   7.178
  201    HA   ASP  27           HA       ASP  27 -14.349  -4.604   9.023
  202   1HB   ASP  27          1HB       ASP  27 -14.621  -7.394   9.076
  203   2HB   ASP  27          2HB       ASP  27 -12.917  -7.090   9.401
  204    H    GLU  28           H        GLU  28 -12.507  -6.704   6.819
  205    HA   GLU  28           HA       GLU  28  -9.972  -5.644   7.450
  206   1HB   GLU  28          1HB       GLU  28 -11.052  -7.577   5.639
  207   2HB   GLU  28          2HB       GLU  28  -9.968  -6.518   4.748
  208   1HG   GLU  28          1HG       GLU  28  -9.254  -7.992   7.273
  209   2HG   GLU  28          2HG       GLU  28  -8.847  -8.515   5.640
  210    H    ARG  29           H        ARG  29 -12.210  -4.928   4.779
  211    HA   ARG  29           HA       ARG  29 -10.628  -2.967   3.541
  212   1HB   ARG  29          1HB       ARG  29 -13.547  -3.632   3.510
  213   2HB   ARG  29          2HB       ARG  29 -12.992  -2.150   2.743
  214   1HG   ARG  29          1HG       ARG  29 -11.768  -3.289   1.134
  215   2HG   ARG  29          2HG       ARG  29 -11.720  -4.775   2.085
  216   1HD   ARG  29          1HD       ARG  29 -13.247  -5.058   0.243
  217   2HD   ARG  29          2HD       ARG  29 -14.156  -5.022   1.754
  218    HE   ARG  29           HE       ARG  29 -13.950  -2.467   0.442
  219   1HH1  ARG  29          1HH1      ARG  29 -15.760  -5.429   0.705
  220   2HH1  ARG  29          2HH1      ARG  29 -17.231  -4.737   0.106
  221   1HH2  ARG  29          1HH2      ARG  29 -15.880  -1.543  -0.348
  222   2HH2  ARG  29          2HH2      ARG  29 -17.298  -2.526  -0.493
  223    H    LYS  30           H        LYS  30 -12.836  -2.825   6.248
  224    HA   LYS  30           HA       LYS  30 -13.067   0.008   6.348
  225   1HB   LYS  30          1HB       LYS  30 -14.722  -1.395   7.427
  226   2HB   LYS  30          2HB       LYS  30 -13.495  -2.101   8.470
  227   1HG   LYS  30          1HG       LYS  30 -13.333  -0.214   9.784
  228   2HG   LYS  30          2HG       LYS  30 -13.964   0.846   8.521
  229   1HD   LYS  30          1HD       LYS  30 -15.630   0.591  10.245
  230   2HD   LYS  30          2HD       LYS  30 -16.180  -0.235   8.785
  231   1HE   LYS  30          1HE       LYS  30 -16.385  -2.131   9.921
  232   2HE   LYS  30          2HE       LYS  30 -14.675  -2.076  10.347
  233   1HZ   LYS  30          1HZ       LYS  30 -16.235  -2.163  12.269
  234   2HZ   LYS  30          2HZ       LYS  30 -16.778  -0.618  11.846
  235   3HZ   LYS  30          3HZ       LYS  30 -15.165  -0.853  12.301
  236    H    LYS  31           H        LYS  31 -10.908  -2.334   7.866
  237    HA   LYS  31           HA       LYS  31  -9.623  -0.580   9.644
  238   1HB   LYS  31          1HB       LYS  31  -9.343  -2.934   9.939
  239   2HB   LYS  31          2HB       LYS  31  -8.702  -3.126   8.313
  240   1HG   LYS  31          1HG       LYS  31  -7.104  -1.255   9.790
  241   2HG   LYS  31          2HG       LYS  31  -7.269  -2.768  10.685
  242   1HD   LYS  31          1HD       LYS  31  -6.774  -3.187   7.847
  243   2HD   LYS  31          2HD       LYS  31  -5.487  -2.271   8.635
  244   1HE   LYS  31          1HE       LYS  31  -6.576  -4.940   9.527
  245   2HE   LYS  31          2HE       LYS  31  -5.037  -4.669   8.710
  246   1HZ   LYS  31          1HZ       LYS  31  -4.952  -2.992  10.854
  247   2HZ   LYS  31          2HZ       LYS  31  -4.183  -4.494  10.740
  248   3HZ   LYS  31          3HZ       LYS  31  -5.701  -4.375  11.477
  249    H    ILE  32           H        ILE  32  -8.651  -1.656   6.389
  250    HA   ILE  32           HA       ILE  32  -6.367   0.002   6.235
  251    HB   ILE  32           HB       ILE  32  -8.002  -1.450   4.180
  252   1HG1  ILE  32          1HG1      ILE  32  -5.097  -1.667   4.999
  253   2HG1  ILE  32          2HG1      ILE  32  -6.393  -2.677   5.631
  254   1HG2  ILE  32          1HG2      ILE  32  -6.215  -0.751   2.530
  255   2HG2  ILE  32          2HG2      ILE  32  -7.391   0.484   2.975
  256   3HG2  ILE  32          3HG2      ILE  32  -5.776   0.509   3.683
  257   1HD1  ILE  32          1HD1      ILE  32  -6.226  -4.053   3.910
  258   2HD1  ILE  32          2HD1      ILE  32  -6.402  -2.724   2.763
  259   3HD1  ILE  32          3HD1      ILE  32  -4.808  -3.145   3.387
  260    H    ARG  33           H        ARG  33  -9.719   0.434   5.206
  261    HA   ARG  33           HA       ARG  33  -9.277   2.918   3.886
  262   1HB   ARG  33          1HB       ARG  33 -11.225   1.359   3.503
  263   2HB   ARG  33          2HB       ARG  33 -11.879   1.913   5.039
  264   1HG   ARG  33          1HG       ARG  33 -11.322   4.249   3.653
  265   2HG   ARG  33          2HG       ARG  33 -11.975   3.154   2.433
  266   1HD   ARG  33          1HD       ARG  33 -13.798   4.365   3.400
  267   2HD   ARG  33          2HD       ARG  33 -13.886   2.697   3.964
  268    HE   ARG  33           HE       ARG  33 -12.446   4.144   5.854
  269   1HH1  ARG  33          1HH1      ARG  33 -15.667   4.049   4.537
  270   2HH1  ARG  33          2HH1      ARG  33 -16.418   4.624   5.989
  271   1HH2  ARG  33          1HH2      ARG  33 -13.422   4.902   7.771
  272   2HH2  ARG  33          2HH2      ARG  33 -15.140   5.110   7.827
  273    H    ASP  34           H        ASP  34  -9.653   1.996   7.169
  274    HA   ASP  34           HA       ASP  34 -10.284   4.735   7.995
  275   1HB   ASP  34          1HB       ASP  34 -11.557   2.789   8.960
  276   2HB   ASP  34          2HB       ASP  34 -10.062   2.277   9.738
  277    H    LEU  35           H        LEU  35  -7.611   3.280   7.107
  278    HA   LEU  35           HA       LEU  35  -5.842   3.528   9.294
  279   1HB   LEU  35          1HB       LEU  35  -5.530   3.331   6.334
  280   2HB   LEU  35          2HB       LEU  35  -4.133   3.760   7.320
  281    HG   LEU  35           HG       LEU  35  -5.758   1.241   7.664
  282   1HD1  LEU  35          1HD1      LEU  35  -3.125   1.686   6.266
  283   2HD1  LEU  35          2HD1      LEU  35  -4.646   1.199   5.518
  284   3HD1  LEU  35          3HD1      LEU  35  -3.828   0.111   6.639
  285   1HD2  LEU  35          1HD2      LEU  35  -4.627   1.992   9.693
  286   2HD2  LEU  35          2HD2      LEU  35  -3.102   2.093   8.814
  287   3HD2  LEU  35          3HD2      LEU  35  -3.881   0.528   9.053
  288    HA   PRO  36           HA       PRO  36  -4.945   7.816   9.546
  289   1HB   PRO  36          1HB       PRO  36  -2.264   7.829   9.973
  290   2HB   PRO  36          2HB       PRO  36  -3.429   7.306  11.195
  291   1HG   PRO  36          1HG       PRO  36  -1.763   5.654   9.336
  292   2HG   PRO  36          2HG       PRO  36  -2.102   5.401  11.058
  293   1HD   PRO  36          1HD       PRO  36  -3.398   4.046   9.105
  294   2HD   PRO  36          2HD       PRO  36  -4.171   4.474  10.644
  295    H    ILE  37           H        ILE  37  -5.033   9.167   7.871
  296    HA   ILE  37           HA       ILE  37  -3.753   8.670   5.382
  297    HB   ILE  37           HB       ILE  37  -4.508  10.991   4.803
  298   1HG1  ILE  37          1HG1      ILE  37  -5.716  10.896   7.577
  299   2HG1  ILE  37          2HG1      ILE  37  -4.370  11.922   7.092
  300   1HG2  ILE  37          1HG2      ILE  37  -6.441  10.075   4.181
  301   2HG2  ILE  37          2HG2      ILE  37  -5.960   8.655   5.109
  302   3HG2  ILE  37          3HG2      ILE  37  -6.975   9.891   5.851
  303   1HD1  ILE  37          1HD1      ILE  37  -6.176  12.654   5.256
  304   2HD1  ILE  37          2HD1      ILE  37  -7.252  12.208   6.580
  305   3HD1  ILE  37          3HD1      ILE  37  -6.009  13.434   6.828
  306    H    SER  38           H        SER  38  -2.984  10.650   8.175
  307    HA   SER  38           HA       SER  38  -0.923  12.175   6.975
  308   1HB   SER  38          1HB       SER  38  -1.652  11.523   9.819
  309   2HB   SER  38          2HB       SER  38  -0.177  12.416   9.450
  310    HG   SER  38           HG       SER  38  -1.892  13.845   9.810
  311    H    LEU  39           H        LEU  39  -1.090   8.923   7.982
  312    HA   LEU  39           HA       LEU  39   1.705   8.567   8.532
  313   1HB   LEU  39          1HB       LEU  39  -0.494   7.145   9.148
  314   2HB   LEU  39          2HB       LEU  39   0.065   6.242   7.742
  315    HG   LEU  39           HG       LEU  39   2.101   6.811   9.803
  316   1HD1  LEU  39          1HD1      LEU  39   0.112   6.309  11.168
  317   2HD1  LEU  39          2HD1      LEU  39   1.350   5.060  11.286
  318   3HD1  LEU  39          3HD1      LEU  39  -0.081   4.790  10.293
  319   1HD2  LEU  39          1HD2      LEU  39   2.842   4.610   9.228
  320   2HD2  LEU  39          2HD2      LEU  39   2.470   5.470   7.734
  321   3HD2  LEU  39          3HD2      LEU  39   1.340   4.273   8.367
  322    H    PHE  40           H        PHE  40  -0.351   8.403   5.731
  323    HA   PHE  40           HA       PHE  40   1.993   7.655   4.111
  324   1HB   PHE  40          1HB       PHE  40  -0.823   7.015   3.271
  325   2HB   PHE  40          2HB       PHE  40   0.686   6.313   2.694
  326    HD1  PHE  40           2HD      PHE  40  -1.787   6.323   5.398
  327    HD2  PHE  40           1HD      PHE  40   1.763   4.531   3.882
  328    HE1  PHE  40           2HE      PHE  40  -2.050   4.465   6.989
  329    HE2  PHE  40           1HE      PHE  40   1.506   2.670   5.470
  330    HZ   PHE  40           HZ       PHE  40  -0.401   2.636   7.028
  331    H    ASP  41           H        ASP  41   2.633   9.329   2.941
  332    HA   ASP  41           HA       ASP  41   1.296  11.713   2.571
  333   1HB   ASP  41          1HB       ASP  41   3.499  10.370   1.031
  334   2HB   ASP  41          2HB       ASP  41   2.851  11.920   0.499
  335    H    TYR  42           H        TYR  42   1.031   8.743   0.768
  336    HA   TYR  42           HA       TYR  42  -1.168   9.924  -0.768
  337   1HB   TYR  42          1HB       TYR  42   0.748   9.962  -2.269
  338   2HB   TYR  42          2HB       TYR  42   1.070   8.263  -1.944
  339    HD1  TYR  42           1HD      TYR  42  -2.303   9.671  -2.454
  340    HD2  TYR  42           2HD      TYR  42   0.906   7.481  -4.190
  341    HE1  TYR  42           1HE      TYR  42  -3.758   9.040  -4.334
  342    HE2  TYR  42           2HE      TYR  42  -0.541   6.845  -6.075
  343    HH   TYR  42           HH       TYR  42  -3.965   7.726  -6.143
  344    H    PHE  43           H        PHE  43  -2.944   8.735  -0.614
  345    HA   PHE  43           HA       PHE  43  -2.690   5.837  -0.203
  346   1HB   PHE  43          1HB       PHE  43  -3.321   7.444   1.865
  347   2HB   PHE  43          2HB       PHE  43  -4.928   7.195   1.190
  348    HD1  PHE  43           1HD      PHE  43  -4.041   4.328   0.147
  349    HD2  PHE  43           2HD      PHE  43  -4.006   6.303   3.917
  350    HE1  PHE  43           1HE      PHE  43  -4.180   2.151   1.285
  351    HE2  PHE  43           2HE      PHE  43  -4.144   4.130   5.061
  352    HZ   PHE  43           HZ       PHE  43  -4.230   2.050   3.745
  353    H    ILE  44           H        ILE  44  -3.652   4.858  -1.846
  354    HA   ILE  44           HA       ILE  44  -6.251   5.859  -2.768
  355    HB   ILE  44           HB       ILE  44  -4.791   6.716  -4.433
  356   1HG1  ILE  44          1HG1      ILE  44  -5.437   4.283  -5.945
  357   2HG1  ILE  44          2HG1      ILE  44  -6.786   4.917  -5.009
  358   1HG2  ILE  44          1HG2      ILE  44  -3.543   3.979  -4.634
  359   2HG2  ILE  44          2HG2      ILE  44  -3.099   5.406  -5.568
  360   3HG2  ILE  44          3HG2      ILE  44  -2.821   5.371  -3.827
  361   1HD1  ILE  44          1HD1      ILE  44  -5.250   6.246  -7.209
  362   2HD1  ILE  44          2HD1      ILE  44  -6.980   5.915  -7.107
  363   3HD1  ILE  44          3HD1      ILE  44  -6.258   7.160  -6.088
  364    H    VAL  45           H        VAL  45  -7.685   4.287  -2.544
  365    HA   VAL  45           HA       VAL  45  -6.820   1.508  -3.018
  366    HB   VAL  45           HB       VAL  45  -9.077   2.193  -1.162
  367   1HG1  VAL  45          1HG1      VAL  45  -9.178  -0.006  -0.849
  368   2HG1  VAL  45          2HG1      VAL  45  -8.016  -0.186  -2.166
  369   3HG1  VAL  45          3HG1      VAL  45  -7.452  -0.091  -0.497
  370   1HG2  VAL  45          1HG2      VAL  45  -7.298   1.801   0.667
  371   2HG2  VAL  45          2HG2      VAL  45  -6.137   2.243  -0.585
  372   3HG2  VAL  45          3HG2      VAL  45  -7.388   3.387  -0.099
  373    H    GLY  46           H        GLY  46  -8.150   0.198  -4.215
  374   1HA   GLY  46          1HA       GLY  46 -10.668   1.377  -5.193
  375   2HA   GLY  46          2HA       GLY  46  -9.492   0.736  -6.331
  376    H    GLU  47           H        GLU  47 -12.326  -0.022  -5.568
  377    HA   GLU  47           HA       GLU  47 -11.921  -2.755  -4.616
  378   1HB   GLU  47          1HB       GLU  47 -13.731  -1.565  -3.561
  379   2HB   GLU  47          2HB       GLU  47 -14.421  -1.139  -5.121
  380   1HG   GLU  47          1HG       GLU  47 -15.641  -2.977  -5.104
  381   2HG   GLU  47          2HG       GLU  47 -14.184  -3.964  -5.000
  382    H    GLU  48           H        GLU  48 -12.093  -4.520  -5.873
  383    HA   GLU  48           HA       GLU  48 -12.564  -4.080  -8.735
  384   1HB   GLU  48          1HB       GLU  48 -10.513  -5.367  -7.491
  385   2HB   GLU  48          2HB       GLU  48 -11.588  -6.713  -7.840
  386   1HG   GLU  48          1HG       GLU  48 -11.196  -4.881 -10.085
  387   2HG   GLU  48          2HG       GLU  48  -9.731  -5.701  -9.547
  388    H    GLY  49           H        GLY  49 -14.291  -4.900  -9.747
  389   1HA   GLY  49          1HA       GLY  49 -15.692  -7.205  -8.678
  390   2HA   GLY  49          2HA       GLY  49 -16.594  -5.698  -8.624
  391    H    ASN  50           H        ASN  50 -14.960  -7.963 -10.786
  392    HA   ASN  50           HA       ASN  50 -15.761  -6.816 -13.215
  393   1HB   ASN  50          1HB       ASN  50 -14.311  -9.072 -12.418
  394   2HB   ASN  50          2HB       ASN  50 -15.662  -9.711 -13.349
  395   1HD2  ASN  50          1HD2      ASN  50 -12.846  -7.663 -13.416
  396   2HD2  ASN  50          2HD2      ASN  50 -12.698  -7.587 -15.136
  397    H    GLU  51           H        GLU  51 -17.097  -8.671 -14.684
  398    HA   GLU  51           HA       GLU  51 -19.769  -8.107 -14.203
  399   1HB   GLU  51          1HB       GLU  51 -18.390 -10.210 -15.841
  400   2HB   GLU  51          2HB       GLU  51 -20.143 -10.189 -15.719
  401   1HG   GLU  51          1HG       GLU  51 -19.815  -7.660 -16.382
  402   2HG   GLU  51          2HG       GLU  51 -18.309  -8.279 -17.058
  403    H    GLU  52           H        GLU  52 -21.501  -9.861 -13.929
  404    HA   GLU  52           HA       GLU  52 -21.463 -10.821 -11.339
  405   1HB   GLU  52          1HB       GLU  52 -23.255 -10.872 -13.524
  406   2HB   GLU  52          2HB       GLU  52 -23.116 -12.528 -12.951
  407   1HG   GLU  52          1HG       GLU  52 -23.793 -11.897 -10.750
  408   2HG   GLU  52          2HG       GLU  52 -23.734 -10.186 -11.169
  409    H    GLY  53           H        GLY  53 -21.368 -12.975 -10.479
  410   1HA   GLY  53          1HA       GLY  53 -20.745 -15.250 -10.543
  411   2HA   GLY  53          2HA       GLY  53 -20.043 -14.989 -12.133
  412    H    ARG  54           H        ARG  54 -18.654 -12.535 -11.086
  413    HA   ARG  54           HA       ARG  54 -16.360 -13.960  -9.966
  414   1HB   ARG  54          1HB       ARG  54 -16.051 -12.545 -11.985
  415   2HB   ARG  54          2HB       ARG  54 -16.528 -11.140 -11.041
  416   1HG   ARG  54          1HG       ARG  54 -14.396 -10.858 -10.520
  417   2HG   ARG  54          2HG       ARG  54 -14.484 -12.346  -9.575
  418   1HD   ARG  54          1HD       ARG  54 -13.787 -13.651 -11.474
  419   2HD   ARG  54          2HD       ARG  54 -13.853 -12.234 -12.521
  420    HE   ARG  54           HE       ARG  54 -12.082 -11.702 -10.421
  421   1HH1  ARG  54          1HH1      ARG  54 -12.346 -13.763 -13.215
  422   2HH1  ARG  54          2HH1      ARG  54 -10.634 -13.864 -13.463
  423   1HH2  ARG  54          1HH2      ARG  54  -9.827 -11.827 -10.738
  424   2HH2  ARG  54          2HH2      ARG  54  -9.202 -12.764 -12.053
  425    H    THR  55           H        THR  55 -15.507 -13.543  -7.991
  426    HA   THR  55           HA       THR  55 -17.160 -12.109  -6.113
  427    HB   THR  55           HB       THR  55 -14.867 -12.788  -4.736
  428    HG1  THR  55           1HG      THR  55 -14.095 -13.909  -6.605
  429   1HG2  THR  55          1HG2      THR  55 -16.288 -14.093  -3.555
  430   2HG2  THR  55          2HG2      THR  55 -16.881 -14.928  -4.991
  431   3HG2  THR  55          3HG2      THR  55 -17.511 -13.334  -4.573
  432    HA   PRO  56           HA       PRO  56 -15.014  -8.286  -5.917
  433   1HB   PRO  56          1HB       PRO  56 -15.069  -7.736  -3.259
  434   2HB   PRO  56          2HB       PRO  56 -16.504  -7.648  -4.288
  435   1HG   PRO  56          1HG       PRO  56 -15.625  -9.837  -2.444
  436   2HG   PRO  56          2HG       PRO  56 -17.246  -9.159  -2.684
  437   1HD   PRO  56          1HD       PRO  56 -16.461 -11.492  -3.813
  438   2HD   PRO  56          2HD       PRO  56 -17.617 -10.395  -4.594
  439    H    HIS  57           H        HIS  57 -13.002  -7.393  -5.586
  440    HA   HIS  57           HA       HIS  57 -11.092  -8.839  -3.903
  441   1HB   HIS  57          1HB       HIS  57 -10.645  -9.824  -6.017
  442   2HB   HIS  57          2HB       HIS  57 -10.769  -8.276  -6.848
  443    HD1  HIS  57           1HD      HIS  57  -8.633  -7.064  -7.244
  444    HD2  HIS  57           2HD      HIS  57  -8.257  -9.986  -4.314
  445    HE1  HIS  57           1HE      HIS  57  -6.183  -7.143  -6.683
  446    H    LEU  58           H        LEU  58  -9.596  -7.561  -2.922
  447    HA   LEU  58           HA       LEU  58  -9.944  -4.681  -3.253
  448   1HB   LEU  58          1HB       LEU  58  -9.677  -6.282  -1.037
  449   2HB   LEU  58          2HB       LEU  58  -8.066  -5.588  -1.209
  450    HG   LEU  58           HG       LEU  58 -10.662  -4.106  -0.819
  451   1HD1  LEU  58          1HD1      LEU  58  -9.851  -4.988   1.234
  452   2HD1  LEU  58          2HD1      LEU  58  -9.439  -3.274   1.202
  453   3HD1  LEU  58          3HD1      LEU  58  -8.200  -4.485   0.870
  454   1HD2  LEU  58          1HD2      LEU  58  -9.283  -2.067  -0.837
  455   2HD2  LEU  58          2HD2      LEU  58  -9.301  -2.880  -2.403
  456   3HD2  LEU  58          3HD2      LEU  58  -7.895  -3.029  -1.347
  457    H    GLN  59           H        GLN  59  -8.436  -3.358  -4.081
  458    HA   GLN  59           HA       GLN  59  -5.671  -4.193  -4.298
  459   1HB   GLN  59          1HB       GLN  59  -6.455  -5.181  -6.314
  460   2HB   GLN  59          2HB       GLN  59  -7.431  -3.772  -6.709
  461   1HG   GLN  59          1HG       GLN  59  -5.502  -3.820  -8.126
  462   2HG   GLN  59          2HG       GLN  59  -5.365  -2.463  -7.009
  463   1HE2  GLN  59          1HE2      GLN  59  -3.876  -2.595  -5.293
  464   2HE2  GLN  59          2HE2      GLN  59  -2.537  -3.685  -5.349
  465    H    GLY  60           H        GLY  60  -4.654  -2.481  -3.489
  466   1HA   GLY  60          1HA       GLY  60  -5.132   0.135  -4.685
  467   2HA   GLY  60          2HA       GLY  60  -5.417   0.006  -2.956
  468    H    PHE  61           H        PHE  61  -3.613   1.807  -3.643
  469    HA   PHE  61           HA       PHE  61  -1.066   0.544  -2.896
  470   1HB   PHE  61          1HB       PHE  61  -0.729   1.014  -5.188
  471   2HB   PHE  61          2HB       PHE  61  -1.553   2.566  -5.074
  472    HD1  PHE  61           2HD      PHE  61   1.295   0.923  -3.301
  473    HD2  PHE  61           1HD      PHE  61  -0.159   4.352  -5.362
  474    HE1  PHE  61           2HE      PHE  61   3.459   2.042  -2.959
  475    HE2  PHE  61           1HE      PHE  61   2.004   5.476  -5.024
  476    HZ   PHE  61           HZ       PHE  61   3.816   4.322  -3.820
  477    H    ALA  62           H        ALA  62   0.154   1.632  -1.412
  478    HA   ALA  62           HA       ALA  62  -0.783   4.275  -0.537
  479   1HB   ALA  62          1HB       ALA  62  -0.948   1.804   0.954
  480   2HB   ALA  62          2HB       ALA  62   0.018   3.011   1.804
  481   3HB   ALA  62          3HB       ALA  62  -1.635   3.388   1.316
  482    H    ASN  63           H        ASN  63   0.826   5.691  -0.381
  483    HA   ASN  63           HA       ASN  63   3.573   4.731  -0.531
  484   1HB   ASN  63          1HB       ASN  63   2.789   6.523  -2.065
  485   2HB   ASN  63          2HB       ASN  63   2.519   7.564  -0.670
  486   1HD2  ASN  63          1HD2      ASN  63   4.486   7.269  -3.106
  487   2HD2  ASN  63          2HD2      ASN  63   5.999   7.708  -2.398
  488    H    PHE  64           H        PHE  64   4.618   4.350   1.301
  489    HA   PHE  64           HA       PHE  64   3.792   5.380   3.818
  490   1HB   PHE  64          1HB       PHE  64   5.688   3.442   2.840
  491   2HB   PHE  64          2HB       PHE  64   6.440   4.458   4.065
  492    HD1  PHE  64           2HD      PHE  64   5.114   4.771   6.266
  493    HD2  PHE  64           1HD      PHE  64   4.395   1.639   3.475
  494    HE1  PHE  64           2HE      PHE  64   4.015   3.455   8.031
  495    HE2  PHE  64           1HE      PHE  64   3.294   0.318   5.235
  496    HZ   PHE  64           HZ       PHE  64   3.105   1.226   7.517
  497    H    VAL  65           H        VAL  65   4.364   7.186   4.849
  498    HA   VAL  65           HA       VAL  65   5.768   9.251   3.574
  499    HB   VAL  65           HB       VAL  65   5.096   8.882   6.494
  500   1HG1  VAL  65          1HG1      VAL  65   5.360  11.518   6.293
  501   2HG1  VAL  65          2HG1      VAL  65   6.712  10.468   6.720
  502   3HG1  VAL  65          3HG1      VAL  65   6.532  11.046   5.063
  503   1HG2  VAL  65          1HG2      VAL  65   3.207  10.233   6.089
  504   2HG2  VAL  65          2HG2      VAL  65   3.797  10.720   4.499
  505   3HG2  VAL  65          3HG2      VAL  65   3.242   9.067   4.766
  506    H    LYS  66           H        LYS  66   6.851   6.618   5.538
  507    HA   LYS  66           HA       LYS  66   9.593   7.684   5.404
  508   1HB   LYS  66          1HB       LYS  66   9.995   6.372   7.548
  509   2HB   LYS  66          2HB       LYS  66   9.043   7.843   7.694
  510   1HG   LYS  66          1HG       LYS  66   7.547   5.334   7.249
  511   2HG   LYS  66          2HG       LYS  66   8.337   5.528   8.815
  512   1HD   LYS  66          1HD       LYS  66   6.772   7.824   7.769
  513   2HD   LYS  66          2HD       LYS  66   5.874   6.418   8.345
  514   1HE   LYS  66          1HE       LYS  66   6.662   6.646  10.514
  515   2HE   LYS  66          2HE       LYS  66   8.063   7.592  10.012
  516   1HZ   LYS  66          1HZ       LYS  66   6.888   9.363  10.605
  517   2HZ   LYS  66          2HZ       LYS  66   5.455   8.478  10.758
  518   3HZ   LYS  66          3HZ       LYS  66   5.911   9.094   9.250
  519    H    LYS  67           H        LYS  67  11.064   5.602   6.173
  520    HA   LYS  67           HA       LYS  67  10.651   3.702   4.015
  521   1HB   LYS  67          1HB       LYS  67  12.938   3.903   5.982
  522   2HB   LYS  67          2HB       LYS  67  12.907   2.934   4.515
  523   1HG   LYS  67          1HG       LYS  67  12.321   5.536   3.691
  524   2HG   LYS  67          2HG       LYS  67  13.624   5.694   4.872
  525   1HD   LYS  67          1HD       LYS  67  13.646   3.860   2.475
  526   2HD   LYS  67          2HD       LYS  67  14.477   5.413   2.584
  527   1HE   LYS  67          1HE       LYS  67  15.373   4.151   4.825
  528   2HE   LYS  67          2HE       LYS  67  15.193   2.798   3.708
  529   1HZ   LYS  67          1HZ       LYS  67  17.408   3.808   3.618
  530   2HZ   LYS  67          2HZ       LYS  67  16.724   5.278   3.136
  531   3HZ   LYS  67          3HZ       LYS  67  16.605   3.921   2.133
  532    H    GLN  68           H        GLN  68   9.684   1.810   4.290
  533    HA   GLN  68           HA       GLN  68   9.826   0.512   6.923
  534   1HB   GLN  68          1HB       GLN  68   7.352   0.683   5.193
  535   2HB   GLN  68          2HB       GLN  68   7.486  -0.183   6.718
  536   1HG   GLN  68          1HG       GLN  68   7.531   2.780   6.253
  537   2HG   GLN  68          2HG       GLN  68   6.384   1.835   7.201
  538   1HE2  GLN  68          1HE2      GLN  68   8.100   0.249   8.653
  539   2HE2  GLN  68          2HE2      GLN  68   9.015   1.237   9.736
  540    H    THR  69           H        THR  69   9.681  -1.774   6.902
  541    HA   THR  69           HA       THR  69  10.629  -2.939   4.400
  542    HB   THR  69           HB       THR  69  11.400  -4.796   5.664
  543    HG1  THR  69           1HG      THR  69  10.744  -5.187   7.767
  544   1HG2  THR  69          1HG2      THR  69  11.797  -2.289   7.303
  545   2HG2  THR  69          2HG2      THR  69  12.776  -2.805   5.930
  546   3HG2  THR  69          3HG2      THR  69  12.778  -3.750   7.419
  547    H    PHE  70           H        PHE  70   9.871  -5.254   3.978
  548    HA   PHE  70           HA       PHE  70   7.128  -5.223   3.397
  549   1HB   PHE  70          1HB       PHE  70   8.364  -6.618   2.005
  550   2HB   PHE  70          2HB       PHE  70   9.251  -7.337   3.345
  551    HD1  PHE  70           1HD      PHE  70   5.951  -7.236   1.676
  552    HD2  PHE  70           2HD      PHE  70   8.521  -9.325   4.350
  553    HE1  PHE  70           1HE      PHE  70   4.402  -9.147   1.667
  554    HE2  PHE  70           2HE      PHE  70   6.977 -11.239   4.344
  555    HZ   PHE  70           HZ       PHE  70   4.914 -11.153   3.001
  556    H    ASN  71           H        ASN  71   8.889  -7.204   5.785
  557    HA   ASN  71           HA       ASN  71   6.608  -8.343   6.960
  558   1HB   ASN  71          1HB       ASN  71   8.807  -9.312   7.298
  559   2HB   ASN  71          2HB       ASN  71   9.359  -7.855   8.120
  560   1HD2  ASN  71          1HD2      ASN  71   9.637  -8.315  10.176
  561   2HD2  ASN  71          2HD2      ASN  71   8.537  -9.191  11.180
  562    H    LYS  72           H        LYS  72   8.401  -5.395   7.693
  563    HA   LYS  72           HA       LYS  72   7.063  -4.755  10.094
  564   1HB   LYS  72          1HB       LYS  72   9.140  -3.672   9.599
  565   2HB   LYS  72          2HB       LYS  72   8.520  -3.045   8.078
  566   1HG   LYS  72          1HG       LYS  72   8.670  -1.324   9.818
  567   2HG   LYS  72          2HG       LYS  72   7.016  -1.568   9.253
  568   1HD   LYS  72          1HD       LYS  72   6.589  -3.002  11.215
  569   2HD   LYS  72          2HD       LYS  72   8.226  -2.675  11.787
  570   1HE   LYS  72          1HE       LYS  72   6.262  -0.474  11.219
  571   2HE   LYS  72          2HE       LYS  72   6.331  -1.284  12.783
  572   1HZ   LYS  72          1HZ       LYS  72   7.660   0.800  12.617
  573   2HZ   LYS  72          2HZ       LYS  72   8.675   0.016  11.515
  574   3HZ   LYS  72          3HZ       LYS  72   8.549  -0.556  13.103
  575    H    VAL  73           H        VAL  73   6.534  -3.659   6.749
  576    HA   VAL  73           HA       VAL  73   4.407  -1.939   7.191
  577    HB   VAL  73           HB       VAL  73   5.020  -3.705   4.826
  578   1HG1  VAL  73          1HG1      VAL  73   3.426  -2.227   3.577
  579   2HG1  VAL  73          2HG1      VAL  73   2.667  -3.335   4.722
  580   3HG1  VAL  73          3HG1      VAL  73   2.857  -1.631   5.136
  581   1HG2  VAL  73          1HG2      VAL  73   6.436  -1.641   5.641
  582   2HG2  VAL  73          2HG2      VAL  73   6.122  -1.907   3.926
  583   3HG2  VAL  73          3HG2      VAL  73   5.165  -0.730   4.824
  584    H    LYS  74           H        LYS  74   4.496  -5.402   7.259
  585    HA   LYS  74           HA       LYS  74   1.760  -5.939   6.852
  586   1HB   LYS  74          1HB       LYS  74   3.764  -7.502   8.491
  587   2HB   LYS  74          2HB       LYS  74   2.222  -8.107   7.900
  588   1HG   LYS  74          1HG       LYS  74   3.368  -7.260   5.593
  589   2HG   LYS  74          2HG       LYS  74   4.782  -7.780   6.512
  590   1HD   LYS  74          1HD       LYS  74   4.307  -9.874   5.928
  591   2HD   LYS  74          2HD       LYS  74   2.848  -9.765   6.915
  592   1HE   LYS  74          1HE       LYS  74   1.567  -9.007   5.025
  593   2HE   LYS  74          2HE       LYS  74   3.018  -8.907   4.029
  594   1HZ   LYS  74          1HZ       LYS  74   2.220 -11.469   5.251
  595   2HZ   LYS  74          2HZ       LYS  74   3.176 -11.194   3.882
  596   3HZ   LYS  74          3HZ       LYS  74   1.503 -10.951   3.808
  597    H    TRP  75           H        TRP  75   3.331  -4.369   9.382
  598    HA   TRP  75           HA       TRP  75   1.712  -5.200  11.566
  599   1HB   TRP  75          1HB       TRP  75   2.779  -3.517  12.813
  600   2HB   TRP  75          2HB       TRP  75   3.988  -4.002  11.628
  601    HD1  TRP  75           HD       TRP  75   2.994  -2.282   9.155
  602    HE1  TRP  75           1HE      TRP  75   3.270   0.277   9.193
  603    HE3  TRP  75           3HE      TRP  75   3.395  -1.584  14.203
  604    HZ2  TRP  75           2HZ      TRP  75   3.614   2.320  11.110
  605    HZ3  TRP  75           3HZ      TRP  75   3.696   0.703  15.058
  606    HH2  TRP  75           HH       TRP  75   3.803   2.614  13.541
  607    H    TYR  76           H        TYR  76   1.200  -3.081   8.925
  608    HA   TYR  76           HA       TYR  76  -1.175  -1.946  10.249
  609   1HB   TYR  76          1HB       TYR  76   0.855  -0.785   8.492
  610   2HB   TYR  76          2HB       TYR  76  -0.790  -0.447   7.964
  611    HD1  TYR  76           2HD      TYR  76  -2.159  -0.265  10.603
  612    HD2  TYR  76           1HD      TYR  76   1.584   1.286   9.305
  613    HE1  TYR  76           2HE      TYR  76  -2.330   1.531  12.275
  614    HE2  TYR  76           1HE      TYR  76   1.425   3.085  10.974
  615    HH   TYR  76           HH       TYR  76  -1.277   3.232  13.264
  616    H    LEU  77           H        LEU  77   0.020  -3.079   7.093
  617    HA   LEU  77           HA       LEU  77  -2.568  -3.259   5.928
  618   1HB   LEU  77          1HB       LEU  77   0.088  -4.448   5.160
  619   2HB   LEU  77          2HB       LEU  77  -1.373  -4.637   4.193
  620    HG   LEU  77           HG       LEU  77  -0.042  -2.006   4.839
  621   1HD1  LEU  77          1HD1      LEU  77  -0.113  -3.475   2.213
  622   2HD1  LEU  77          2HD1      LEU  77   1.252  -3.521   3.327
  623   3HD1  LEU  77          3HD1      LEU  77   0.761  -1.992   2.598
  624   1HD2  LEU  77          1HD2      LEU  77  -2.456  -1.819   4.517
  625   2HD2  LEU  77          2HD2      LEU  77  -2.323  -2.677   2.982
  626   3HD2  LEU  77          3HD2      LEU  77  -1.574  -1.092   3.174
  627    H    GLY  78           H        GLY  78  -0.419  -5.578   7.510
  628   1HA   GLY  78          1HA       GLY  78  -1.217  -7.418   8.772
  629   2HA   GLY  78          2HA       GLY  78  -2.718  -7.360   7.860
  630    H    ALA  79           H        ALA  79  -1.020  -9.654   8.413
  631    HA   ALA  79           HA       ALA  79   0.390 -10.324   6.010
  632   1HB   ALA  79          1HB       ALA  79  -0.063 -12.706   7.306
  633   2HB   ALA  79          2HB       ALA  79   1.327 -11.646   7.545
  634   3HB   ALA  79          3HB       ALA  79  -0.066 -11.530   8.621
  635    H    ARG  80           H        ARG  80  -2.863 -10.682   7.167
  636    HA   ARG  80           HA       ARG  80  -3.802 -12.813   5.681
  637   1HB   ARG  80          1HB       ARG  80  -5.240 -10.228   6.311
  638   2HB   ARG  80          2HB       ARG  80  -6.013 -11.720   5.790
  639   1HG   ARG  80          1HG       ARG  80  -4.280 -11.798   8.202
  640   2HG   ARG  80          2HG       ARG  80  -5.875 -11.053   8.328
  641   1HD   ARG  80          1HD       ARG  80  -5.545 -13.752   7.075
  642   2HD   ARG  80          2HD       ARG  80  -5.613 -13.581   8.829
  643    HE   ARG  80           HE       ARG  80  -7.796 -13.400   7.007
  644   1HH1  ARG  80          1HH1      ARG  80  -6.572 -12.192  10.034
  645   2HH1  ARG  80          2HH1      ARG  80  -8.140 -11.829  10.673
  646   1HH2  ARG  80          1HH2      ARG  80  -9.867 -12.926   7.837
  647   2HH2  ARG  80          2HH2      ARG  80 -10.014 -12.247   9.423
  648    H    CYS  81           H        CYS  81  -3.244  -9.481   4.679
  649    HA   CYS  81           HA       CYS  81  -4.117 -10.144   1.959
  650   1HB   CYS  81          1HB       CYS  81  -4.123  -7.748   1.541
  651   2HB   CYS  81          2HB       CYS  81  -5.050  -8.101   2.994
  652    HG   CYS  81           HG       CYS  81  -2.294  -7.566   4.325
  653    H    HIS  82           H        HIS  82  -2.745 -10.206   0.259
  654    HA   HIS  82           HA       HIS  82   0.055 -10.427   0.791
  655   1HB   HIS  82          1HB       HIS  82  -1.339 -11.708  -0.960
  656   2HB   HIS  82          2HB       HIS  82  -1.162 -10.268  -1.958
  657    HD1  HIS  82           1HD      HIS  82   1.090 -12.715  -0.106
  658    HD2  HIS  82           2HD      HIS  82   1.070 -10.297  -3.485
  659    HE1  HIS  82           1HE      HIS  82   3.251 -13.204  -1.296
  660    H    ILE  83           H        ILE  83   1.566  -8.901   0.698
  661    HA   ILE  83           HA       ILE  83   0.892  -6.357  -0.630
  662    HB   ILE  83           HB       ILE  83   2.402  -5.238   0.945
  663   1HG1  ILE  83          1HG1      ILE  83   2.564  -7.907   2.359
  664   2HG1  ILE  83          2HG1      ILE  83   3.851  -7.232   1.366
  665   1HG2  ILE  83          1HG2      ILE  83   1.001  -5.465   2.961
  666   2HG2  ILE  83          2HG2      ILE  83   0.047  -5.331   1.484
  667   3HG2  ILE  83          3HG2      ILE  83   0.258  -6.901   2.258
  668   1HD1  ILE  83          1HD1      ILE  83   4.207  -6.895   3.773
  669   2HD1  ILE  83          2HD1      ILE  83   4.098  -5.377   2.882
  670   3HD1  ILE  83          3HD1      ILE  83   2.727  -5.939   3.839
  671    H    GLU  84           H        GLU  84   2.427  -5.365  -1.910
  672    HA   GLU  84           HA       GLU  84   5.044  -6.600  -2.217
  673   1HB   GLU  84          1HB       GLU  84   2.850  -6.925  -4.127
  674   2HB   GLU  84          2HB       GLU  84   4.314  -6.281  -4.857
  675   1HG   GLU  84          1HG       GLU  84   5.588  -8.165  -4.138
  676   2HG   GLU  84          2HG       GLU  84   4.244  -8.769  -3.170
  677    H    LYS  85           H        LYS  85   6.445  -5.331  -3.706
  678    HA   LYS  85           HA       LYS  85   6.189  -2.538  -3.115
  679   1HB   LYS  85          1HB       LYS  85   8.376  -3.642  -3.111
  680   2HB   LYS  85          2HB       LYS  85   8.205  -4.010  -4.822
  681   1HG   LYS  85          1HG       LYS  85   8.204  -1.621  -5.337
  682   2HG   LYS  85          2HG       LYS  85   8.378  -1.254  -3.619
  683   1HD   LYS  85          1HD       LYS  85  10.575  -1.731  -3.619
  684   2HD   LYS  85          2HD       LYS  85  10.367  -3.140  -4.661
  685   1HE   LYS  85          1HE       LYS  85  11.041  -1.986  -6.437
  686   2HE   LYS  85          2HE       LYS  85   9.829  -0.740  -6.139
  687   1HZ   LYS  85          1HZ       LYS  85  12.649  -0.810  -5.381
  688   2HZ   LYS  85          2HZ       LYS  85  11.579  -0.058  -4.308
  689   3HZ   LYS  85          3HZ       LYS  85  11.701   0.491  -5.903
  690    H    ALA  86           H        ALA  86   5.488  -0.923  -4.385
  691    HA   ALA  86           HA       ALA  86   4.247  -1.612  -6.911
  692   1HB   ALA  86          1HB       ALA  86   4.099   1.177  -6.429
  693   2HB   ALA  86          2HB       ALA  86   2.819  -0.030  -6.300
  694   3HB   ALA  86          3HB       ALA  86   3.821   0.347  -4.898
  695    H    LYS  87           H        LYS  87   4.602  -0.353  -8.859
  696    HA   LYS  87           HA       LYS  87   7.207   0.971  -9.040
  697   1HB   LYS  87          1HB       LYS  87   7.910  -0.306 -10.930
  698   2HB   LYS  87          2HB       LYS  87   7.447  -1.450  -9.677
  699   1HG   LYS  87          1HG       LYS  87   5.346  -1.875 -10.776
  700   2HG   LYS  87          2HG       LYS  87   5.690  -0.631 -11.981
  701   1HD   LYS  87          1HD       LYS  87   7.229  -1.925 -13.078
  702   2HD   LYS  87          2HD       LYS  87   7.659  -2.834 -11.627
  703   1HE   LYS  87          1HE       LYS  87   5.629  -4.103 -11.748
  704   2HE   LYS  87          2HE       LYS  87   5.019  -3.093 -13.059
  705   1HZ   LYS  87          1HZ       LYS  87   6.186  -4.226 -14.570
  706   2HZ   LYS  87          2HZ       LYS  87   6.319  -5.428 -13.388
  707   3HZ   LYS  87          3HZ       LYS  87   7.573  -4.313 -13.604
  708    H    GLY  88           H        GLY  88   7.350   2.557 -10.610
  709   1HA   GLY  88          1HA       GLY  88   6.471   3.498 -12.704
  710   2HA   GLY  88          2HA       GLY  88   4.866   3.079 -12.123
  711    H    THR  89           H        THR  89   4.898   5.524 -12.862
  712    HA   THR  89           HA       THR  89   5.828   7.327 -10.795
  713    HB   THR  89           HB       THR  89   5.107   9.117 -12.190
  714    HG1  THR  89           1HG      THR  89   3.816   8.676 -14.072
  715   1HG2  THR  89          1HG2      THR  89   6.356   8.750 -14.156
  716   2HG2  THR  89          2HG2      THR  89   5.996   7.023 -14.160
  717   3HG2  THR  89          3HG2      THR  89   7.085   7.695 -12.946
  718    H    ASP  90           H        ASP  90   4.169   9.115 -10.165
  719    HA   ASP  90           HA       ASP  90   2.274   8.005  -8.470
  720   1HB   ASP  90          1HB       ASP  90   1.335  10.313  -8.315
  721   2HB   ASP  90          2HB       ASP  90   3.083  10.248  -8.108
  722    H    GLN  91           H        GLN  91   1.903   9.239 -11.758
  723    HA   GLN  91           HA       GLN  91  -0.924   8.988 -11.845
  724   1HB   GLN  91          1HB       GLN  91   1.103   9.070 -14.086
  725   2HB   GLN  91          2HB       GLN  91  -0.637   9.209 -14.299
  726   1HG   GLN  91          1HG       GLN  91   0.127  11.120 -12.367
  727   2HG   GLN  91          2HG       GLN  91   1.264  11.238 -13.709
  728   1HE2  GLN  91          1HE2      GLN  91  -1.792  12.055 -12.568
  729   2HE2  GLN  91          2HE2      GLN  91  -2.446  12.697 -14.032
  730    H    GLN  92           H        GLN  92   1.743   6.838 -12.628
  731    HA   GLN  92           HA       GLN  92   0.213   4.854 -13.944
  732   1HB   GLN  92          1HB       GLN  92   2.947   5.105 -12.880
  733   2HB   GLN  92          2HB       GLN  92   2.317   3.464 -12.907
  734   1HG   GLN  92          1HG       GLN  92   1.637   4.433 -15.388
  735   2HG   GLN  92          2HG       GLN  92   3.216   5.156 -15.088
  736   1HE2  GLN  92          1HE2      GLN  92   5.015   3.877 -15.030
  737   2HE2  GLN  92          2HE2      GLN  92   5.006   2.204 -15.460
  738    H    ASN  93           H        ASN  93   1.067   5.405 -10.575
  739    HA   ASN  93           HA       ASN  93  -0.013   2.907  -9.663
  740   1HB   ASN  93          1HB       ASN  93   0.995   5.387  -8.288
  741   2HB   ASN  93          2HB       ASN  93   0.202   4.103  -7.380
  742   1HD2  ASN  93          1HD2      ASN  93   2.404   3.933 -10.141
  743   2HD2  ASN  93          2HD2      ASN  93   3.619   3.004  -9.338
  744    H    LYS  94           H        LYS  94  -1.076   6.292  -9.588
  745    HA   LYS  94           HA       LYS  94  -3.484   5.871  -8.207
  746   1HB   LYS  94          1HB       LYS  94  -2.399   8.089  -8.607
  747   2HB   LYS  94          2HB       LYS  94  -2.925   7.997 -10.282
  748   1HG   LYS  94          1HG       LYS  94  -5.266   7.579  -8.978
  749   2HG   LYS  94          2HG       LYS  94  -4.435   8.666  -7.862
  750   1HD   LYS  94          1HD       LYS  94  -4.577   9.255 -10.802
  751   2HD   LYS  94          2HD       LYS  94  -5.893   9.700  -9.713
  752   1HE   LYS  94          1HE       LYS  94  -4.062  10.820  -8.297
  753   2HE   LYS  94          2HE       LYS  94  -3.055  10.674  -9.737
  754   1HZ   LYS  94          1HZ       LYS  94  -5.205  12.495  -9.186
  755   2HZ   LYS  94          2HZ       LYS  94  -5.352  11.742 -10.693
  756   3HZ   LYS  94          3HZ       LYS  94  -3.952  12.614 -10.317
  757    H    GLU  95           H        GLU  95  -2.797   5.995 -11.692
  758    HA   GLU  95           HA       GLU  95  -5.467   5.554 -12.517
  759   1HB   GLU  95          1HB       GLU  95  -2.830   5.126 -13.923
  760   2HB   GLU  95          2HB       GLU  95  -4.388   4.901 -14.706
  761   1HG   GLU  95          1HG       GLU  95  -4.039   7.478 -13.345
  762   2HG   GLU  95          2HG       GLU  95  -2.979   7.203 -14.727
  763    H    TYR  96           H        TYR  96  -2.795   3.404 -11.755
  764    HA   TYR  96           HA       TYR  96  -3.796   1.023 -12.803
  765   1HB   TYR  96          1HB       TYR  96  -1.522   1.164 -11.998
  766   2HB   TYR  96          2HB       TYR  96  -2.076   1.497 -10.362
  767    HD1  TYR  96           1HD      TYR  96  -3.006  -0.287  -8.975
  768    HD2  TYR  96           2HD      TYR  96  -1.554  -1.081 -12.894
  769    HE1  TYR  96           1HE      TYR  96  -2.982  -2.694  -8.471
  770    HE2  TYR  96           2HE      TYR  96  -1.526  -3.491 -12.402
  771    HH   TYR  96           HH       TYR  96  -2.989  -5.008 -10.550
  772    H    CYS  97           H        CYS  97  -4.288   2.481  -9.606
  773    HA   CYS  97           HA       CYS  97  -5.904   0.384  -8.594
  774   1HB   CYS  97          1HB       CYS  97  -5.819   3.284  -7.734
  775   2HB   CYS  97          2HB       CYS  97  -6.470   1.944  -6.799
  776    HG   CYS  97           HG       CYS  97  -3.649   0.786  -7.180
  777    H    SER  98           H        SER  98  -6.588   3.327 -10.378
  778    HA   SER  98           HA       SER  98  -9.438   3.119 -10.051
  779   1HB   SER  98          1HB       SER  98  -8.213   5.291 -10.394
  780   2HB   SER  98          2HB       SER  98  -7.922   4.795 -12.061
  781    HG   SER  98           HG       SER  98 -10.329   5.497 -10.802
  782    H    LYS  99           H        LYS  99  -7.150   1.604 -12.005
  783    HA   LYS  99           HA       LYS  99  -8.458   1.313 -14.450
  784   1HB   LYS  99          1HB       LYS  99  -6.132   0.629 -14.078
  785   2HB   LYS  99          2HB       LYS  99  -6.674  -0.668 -13.022
  786   1HG   LYS  99          1HG       LYS  99  -7.888  -1.656 -14.947
  787   2HG   LYS  99          2HG       LYS  99  -7.178  -0.412 -15.978
  788   1HD   LYS  99          1HD       LYS  99  -5.880  -2.445 -16.147
  789   2HD   LYS  99          2HD       LYS  99  -4.929  -1.204 -15.328
  790   1HE   LYS  99          1HE       LYS  99  -4.789  -2.409 -13.452
  791   2HE   LYS  99          2HE       LYS  99  -6.504  -2.812 -13.486
  792   1HZ   LYS  99          1HZ       LYS  99  -4.465  -4.154 -15.171
  793   2HZ   LYS  99          2HZ       LYS  99  -6.080  -4.610 -14.964
  794   3HZ   LYS  99          3HZ       LYS  99  -4.990  -4.751 -13.678
  795    H    GLU 100           H        GLU 100  -9.171  -0.039 -11.368
  796    HA   GLU 100           HA       GLU 100 -10.642  -2.308 -12.282
  797   1HB   GLU 100          1HB       GLU 100 -10.480  -0.851  -9.654
  798   2HB   GLU 100          2HB       GLU 100 -11.610  -2.175  -9.900
  799   1HG   GLU 100          1HG       GLU 100  -9.816  -3.254  -8.965
  800   2HG   GLU 100          2HG       GLU 100  -9.511  -3.480 -10.687
  801    H    GLY 101           H        GLY 101 -11.316   1.047 -12.033
  802   1HA   GLY 101          1HA       GLY 101 -13.162   2.148 -12.943
  803   2HA   GLY 101          2HA       GLY 101 -13.988   0.602 -13.077
  804    H    ASN 102           H        ASN 102 -12.844   0.586 -10.042
  805    HA   ASN 102           HA       ASN 102 -15.096   2.098  -8.915
  806   1HB   ASN 102          1HB       ASN 102 -14.686  -0.790  -8.851
  807   2HB   ASN 102          2HB       ASN 102 -14.858  -0.100  -7.240
  808   1HD2  ASN 102          1HD2      ASN 102 -16.853  -0.757  -6.717
  809   2HD2  ASN 102          2HD2      ASN 102 -18.284  -0.350  -7.596
  810    H    LEU 103           H        LEU 103 -14.453   3.441  -7.371
  811    HA   LEU 103           HA       LEU 103 -11.789   3.106  -6.220
  812   1HB   LEU 103          1HB       LEU 103 -13.392   5.325  -6.996
  813   2HB   LEU 103          2HB       LEU 103 -13.064   5.456  -5.270
  814    HG   LEU 103           HG       LEU 103 -11.458   6.679  -6.739
  815   1HD1  LEU 103          1HD1      LEU 103 -10.414   6.445  -4.767
  816   2HD1  LEU 103          2HD1      LEU 103  -9.431   5.263  -5.631
  817   3HD1  LEU 103          3HD1      LEU 103 -10.796   4.727  -4.650
  818   1HD2  LEU 103          1HD2      LEU 103  -9.958   4.261  -7.394
  819   2HD2  LEU 103          2HD2      LEU 103 -10.293   5.690  -8.372
  820   3HD2  LEU 103          3HD2      LEU 103 -11.491   4.400  -8.255
  821    H    LEU 104           H        LEU 104 -11.395   2.798  -4.079
  822    HA   LEU 104           HA       LEU 104 -13.739   2.237  -2.395
  823   1HB   LEU 104          1HB       LEU 104 -11.878   0.496  -2.957
  824   2HB   LEU 104          2HB       LEU 104 -10.964   1.358  -1.721
  825    HG   LEU 104           HG       LEU 104 -12.050  -0.653  -0.838
  826   1HD1  LEU 104          1HD1      LEU 104 -11.835   1.705   0.374
  827   2HD1  LEU 104          2HD1      LEU 104 -12.562   0.301   1.155
  828   3HD1  LEU 104          3HD1      LEU 104 -13.590   1.536   0.428
  829   1HD2  LEU 104          1HD2      LEU 104 -14.750   0.358  -0.777
  830   2HD2  LEU 104          2HD2      LEU 104 -14.149  -1.213  -1.308
  831   3HD2  LEU 104          3HD2      LEU 104 -14.190   0.144  -2.436
  832    H    MET 105           H        MET 105 -10.632   3.901  -2.482
  833    HA   MET 105           HA       MET 105 -11.567   5.767  -0.481
  834   1HB   MET 105          1HB       MET 105 -10.663   4.335   1.109
  835   2HB   MET 105          2HB       MET 105  -9.370   3.801   0.043
  836   1HG   MET 105          1HG       MET 105  -8.014   5.520   0.593
  837   2HG   MET 105          2HG       MET 105  -9.350   6.649   0.813
  838   1HE   MET 105          1HE       MET 105  -7.652   3.397   2.823
  839   2HE   MET 105          2HE       MET 105  -6.707   4.729   2.156
  840   3HE   MET 105          3HE       MET 105  -6.943   4.600   3.900
  841    H    GLU 106           H        GLU 106 -10.701   7.761  -0.750
  842    HA   GLU 106           HA       GLU 106  -8.387   8.016  -2.550
  843   1HB   GLU 106          1HB       GLU 106 -10.506   8.505  -3.753
  844   2HB   GLU 106          2HB       GLU 106 -10.839   9.782  -2.593
  845   1HG   GLU 106          1HG       GLU 106  -8.293  10.359  -3.500
  846   2HG   GLU 106          2HG       GLU 106  -9.145   9.800  -4.938
  847    H    CYS 107           H        CYS 107  -6.823   8.716  -1.231
  848    HA   CYS 107           HA       CYS 107  -7.244  11.233   0.176
  849   1HB   CYS 107          1HB       CYS 107  -6.194   8.743   1.535
  850   2HB   CYS 107          2HB       CYS 107  -6.166  10.357   2.234
  851    HG   CYS 107           HG       CYS 107  -9.045   8.726   1.362
  852    H    GLY 108           H        GLY 108  -5.019  11.875   1.245
  853   1HA   GLY 108          1HA       GLY 108  -2.827  12.469   0.910
  854   2HA   GLY 108          2HA       GLY 108  -2.620  10.915   0.115
  855    H    ALA 109           H        ALA 109  -1.103  12.498  -1.077
  856    HA   ALA 109           HA       ALA 109  -2.570  13.797  -3.276
  857   1HB   ALA 109          1HB       ALA 109   0.100  14.594  -3.419
  858   2HB   ALA 109          2HB       ALA 109  -1.269  15.545  -2.845
  859   3HB   ALA 109          3HB       ALA 109  -0.301  14.615  -1.702
  860    HA   PRO 110           HA       PRO 110  -1.018  10.905  -6.193
  861   1HB   PRO 110          1HB       PRO 110  -0.729  12.476  -8.389
  862   2HB   PRO 110          2HB       PRO 110  -2.306  11.980  -7.763
  863   1HG   PRO 110          1HG       PRO 110  -0.846  14.565  -7.383
  864   2HG   PRO 110          2HG       PRO 110  -2.564  14.291  -7.725
  865   1HD   PRO 110          1HD       PRO 110  -1.644  14.842  -5.239
  866   2HD   PRO 110          2HD       PRO 110  -3.053  13.801  -5.527
  867    H    ARG 111           H        ARG 111   1.028  10.869  -4.824
  868    HA   ARG 111           HA       ARG 111   3.278  11.931  -6.403
  869   1HB   ARG 111          1HB       ARG 111   4.534  12.303  -4.439
  870   2HB   ARG 111          2HB       ARG 111   2.933  12.943  -4.093
  871   1HG   ARG 111          1HG       ARG 111   2.380  10.938  -2.836
  872   2HG   ARG 111          2HG       ARG 111   3.961  10.252  -3.217
  873   1HD   ARG 111          1HD       ARG 111   3.344  12.659  -1.520
  874   2HD   ARG 111          2HD       ARG 111   4.101  11.147  -1.021
  875    HE   ARG 111           HE       ARG 111   5.802  12.101  -2.896
  876   1HH1  ARG 111          1HH1      ARG 111   4.380  13.476  -0.030
  877   2HH1  ARG 111          2HH1      ARG 111   5.721  14.525   0.290
  878   1HH2  ARG 111          1HH2      ARG 111   7.573  13.478  -2.485
  879   2HH2  ARG 111          2HH2      ARG 111   7.537  14.526  -1.108
  880    H    SER 112           H        SER 112   5.180  10.623  -6.493
  881    HA   SER 112           HA       SER 112   4.680   7.774  -5.926
  882   1HB   SER 112          1HB       SER 112   4.757   7.547  -8.176
  883   2HB   SER 112          2HB       SER 112   5.507   9.127  -8.402
  884    HG   SER 112           HG       SER 112   6.798   6.717  -7.640
  885    H    GLN 113           H        GLN 113   7.420   9.876  -6.830
  886    HA   GLN 113           HA       GLN 113   8.936   8.683  -4.604
  887   1HB   GLN 113          1HB       GLN 113   9.596   8.906  -7.451
  888   2HB   GLN 113          2HB       GLN 113  10.864   9.497  -6.385
  889   1HG   GLN 113          1HG       GLN 113  11.082   7.407  -5.320
  890   2HG   GLN 113          2HG       GLN 113   9.587   6.805  -6.035
  891   1HE2  GLN 113          1HE2      GLN 113   9.561   6.457  -8.343
  892   2HE2  GLN 113          2HE2      GLN 113  11.023   6.020  -9.154
  893    H    GLY 114           H        GLY 114  10.955  10.105  -4.122
  894   1HA   GLY 114          1HA       GLY 114   9.972  12.870  -3.867
  895   2HA   GLY 114          2HA       GLY 114  11.117  12.098  -2.781
  896    H    GLN 115           H        GLN 115  12.012  14.390  -3.430
  897    HA   GLN 115           HA       GLN 115  14.210  13.861  -5.233
  898   1HB   GLN 115          1HB       GLN 115  11.936  15.520  -6.005
  899   2HB   GLN 115          2HB       GLN 115  13.468  16.376  -6.112
  900   1HG   GLN 115          1HG       GLN 115  14.281  15.005  -7.759
  901   2HG   GLN 115          2HG       GLN 115  13.252  13.652  -7.290
  902   1HE2  GLN 115          1HE2      GLN 115  12.241  13.229  -9.161
  903   2HE2  GLN 115          2HE2      GLN 115  11.242  14.351 -10.015
  904    H    ARG 116           H        ARG 116  12.607  16.646  -3.676
  905    HA   ARG 116           HA       ARG 116  15.112  17.806  -2.908
  906   1HB   ARG 116          1HB       ARG 116  13.698  19.456  -1.706
  907   2HB   ARG 116          2HB       ARG 116  13.247  19.259  -3.395
  908   1HG   ARG 116          1HG       ARG 116  11.184  18.637  -2.863
  909   2HG   ARG 116          2HG       ARG 116  11.766  17.463  -1.680
  910   1HD   ARG 116          1HD       ARG 116  12.007  20.287  -0.887
  911   2HD   ARG 116          2HD       ARG 116  10.357  19.689  -1.058
  912    HE   ARG 116           HE       ARG 116  11.811  17.834   0.444
  913   1HH1  ARG 116          1HH1      ARG 116  10.627  21.098   0.698
  914   2HH1  ARG 116          2HH1      ARG 116  10.474  21.047   2.423
  915   1HH2  ARG 116          1HH2      ARG 116  11.614  17.755   2.715
  916   2HH2  ARG 116          2HH2      ARG 116  11.037  19.145   3.570
  Start of MODEL    6
    1    HA   PRO   2           HA       PRO   2  32.788  -9.228  19.818
    2   1HB   PRO   2          1HB       PRO   2  30.186  -9.726  19.225
    3   2HB   PRO   2          2HB       PRO   2  31.100 -10.672  20.405
    4   1HG   PRO   2          1HG       PRO   2  29.165  -8.433  20.861
    5   2HG   PRO   2          2HG       PRO   2  29.327  -9.968  21.735
    6   1HD   PRO   2          1HD       PRO   2  30.328  -7.637  22.684
    7   2HD   PRO   2          2HD       PRO   2  31.098  -9.206  22.998
    8    H    SER   3           H        SER   3  31.345  -9.098  17.617
    9    HA   SER   3           HA       SER   3  30.564  -6.361  17.036
   10   1HB   SER   3          1HB       SER   3  33.013  -7.671  15.883
   11   2HB   SER   3          2HB       SER   3  32.134  -6.446  14.970
   12    HG   SER   3           HG       SER   3  33.601  -6.198  17.339
   13    H    LYS   4           H        LYS   4  29.254  -6.164  15.230
   14    HA   LYS   4           HA       LYS   4  28.549  -8.682  13.872
   15   1HB   LYS   4          1HB       LYS   4  26.703  -6.482  14.811
   16   2HB   LYS   4          2HB       LYS   4  26.208  -7.799  13.756
   17   1HG   LYS   4          1HG       LYS   4  25.760  -9.021  15.542
   18   2HG   LYS   4          2HG       LYS   4  27.470  -8.980  15.977
   19   1HD   LYS   4          1HD       LYS   4  27.186  -7.193  17.432
   20   2HD   LYS   4          2HD       LYS   4  25.679  -6.682  16.668
   21   1HE   LYS   4          1HE       LYS   4  24.426  -8.155  17.851
   22   2HE   LYS   4          2HE       LYS   4  25.694  -9.379  17.876
   23   1HZ   LYS   4          1HZ       LYS   4  25.286  -8.503  20.082
   24   2HZ   LYS   4          2HZ       LYS   4  25.615  -6.930  19.555
   25   3HZ   LYS   4          3HZ       LYS   4  26.846  -8.091  19.572
   26    H    LYS   5           H        LYS   5  29.090  -8.570  11.803
   27    HA   LYS   5           HA       LYS   5  28.395  -6.189  10.268
   28   1HB   LYS   5          1HB       LYS   5  31.147  -7.396  10.024
   29   2HB   LYS   5          2HB       LYS   5  30.552  -5.909   9.297
   30   1HG   LYS   5          1HG       LYS   5  30.238  -5.118  11.735
   31   2HG   LYS   5          2HG       LYS   5  31.336  -6.441  12.131
   32   1HD   LYS   5          1HD       LYS   5  32.648  -5.266  10.062
   33   2HD   LYS   5          2HD       LYS   5  31.866  -3.870  10.808
   34   1HE   LYS   5          1HE       LYS   5  32.822  -4.547  12.984
   35   2HE   LYS   5          2HE       LYS   5  33.658  -5.874  12.179
   36   1HZ   LYS   5          1HZ       LYS   5  35.131  -4.004  12.465
   37   2HZ   LYS   5          2HZ       LYS   5  34.059  -2.978  11.653
   38   3HZ   LYS   5          3HZ       LYS   5  34.827  -4.232  10.816
   39    H    ASN   6           H        ASN   6  28.338  -6.560   7.967
   40    HA   ASN   6           HA       ASN   6  28.668  -9.250   6.976
   41   1HB   ASN   6          1HB       ASN   6  26.068  -8.280   7.839
   42   2HB   ASN   6          2HB       ASN   6  26.063  -8.715   6.132
   43   1HD2  ASN   6          1HD2      ASN   6  25.328  -9.873   9.020
   44   2HD2  ASN   6          2HD2      ASN   6  25.665 -11.553   8.798
   45    H    GLY   7           H        GLY   7  27.667  -9.288   4.607
   46   1HA   GLY   7          1HA       GLY   7  29.004  -7.143   3.215
   47   2HA   GLY   7          2HA       GLY   7  28.230  -8.542   2.484
   48    H    ARG   8           H        ARG   8  25.718  -8.489   2.867
   49    HA   ARG   8           HA       ARG   8  24.827  -5.810   2.034
   50   1HB   ARG   8          1HB       ARG   8  22.884  -7.062   1.012
   51   2HB   ARG   8          2HB       ARG   8  24.451  -7.354   0.269
   52   1HG   ARG   8          1HG       ARG   8  24.640  -9.451   1.540
   53   2HG   ARG   8          2HG       ARG   8  23.034  -9.164   2.213
   54   1HD   ARG   8          1HD       ARG   8  21.974  -9.592   0.224
   55   2HD   ARG   8          2HD       ARG   8  23.370  -9.121  -0.744
   56    HE   ARG   8           HE       ARG   8  24.156 -11.276  -0.613
   57   1HH1  ARG   8          1HH1      ARG   8  21.566 -10.836   1.672
   58   2HH1  ARG   8          2HH1      ARG   8  21.441 -12.521   2.053
   59   1HH2  ARG   8          1HH2      ARG   8  24.001 -13.497  -0.120
   60   2HH2  ARG   8          2HH2      ARG   8  22.827 -14.034   1.033
   61    H    SER   9           H        SER   9  23.029  -4.879   2.959
   62    HA   SER   9           HA       SER   9  22.295  -5.930   5.570
   63   1HB   SER   9          1HB       SER   9  22.330  -3.304   4.284
   64   2HB   SER   9          2HB       SER   9  20.859  -3.592   5.212
   65    HG   SER   9           HG       SER   9  23.537  -3.574   6.092
   66    H    GLY  10           H        GLY  10  20.638  -4.854   2.605
   67   1HA   GLY  10          1HA       GLY  10  18.898  -6.543   1.868
   68   2HA   GLY  10          2HA       GLY  10  18.268  -6.370   3.500
   69    HA   PRO  11           HA       PRO  11  16.014  -3.415   0.713
   70   1HB   PRO  11          1HB       PRO  11  13.537  -4.105   1.585
   71   2HB   PRO  11          2HB       PRO  11  14.363  -4.952   0.272
   72   1HG   PRO  11          1HG       PRO  11  14.118  -5.711   3.157
   73   2HG   PRO  11          2HG       PRO  11  13.965  -6.731   1.715
   74   1HD   PRO  11          1HD       PRO  11  16.219  -6.656   3.214
   75   2HD   PRO  11          2HD       PRO  11  16.247  -6.931   1.460
   76    H    GLN  12           H        GLN  12  15.935  -1.392   1.440
   77    HA   GLN  12           HA       GLN  12  15.623  -0.875   4.282
   78   1HB   GLN  12          1HB       GLN  12  16.737   0.549   1.974
   79   2HB   GLN  12          2HB       GLN  12  15.842   1.584   3.079
   80   1HG   GLN  12          1HG       GLN  12  17.530   1.606   4.502
   81   2HG   GLN  12          2HG       GLN  12  17.550  -0.155   4.572
   82   1HE2  GLN  12          1HE2      GLN  12  18.282   2.179   2.004
   83   2HE2  GLN  12          2HE2      GLN  12  19.873   1.587   1.683
   84    HA   PRO  13           HA       PRO  13  11.449   0.469   4.237
   85   1HB   PRO  13          1HB       PRO  13  11.507   2.626   5.884
   86   2HB   PRO  13          2HB       PRO  13  11.683   0.967   6.468
   87   1HG   PRO  13          1HG       PRO  13  13.795   3.017   5.924
   88   2HG   PRO  13          2HG       PRO  13  13.650   1.896   7.290
   89   1HD   PRO  13          1HD       PRO  13  15.312   1.440   5.202
   90   2HD   PRO  13          2HD       PRO  13  14.516   0.127   6.094
   91    H    HIS  14           H        HIS  14  10.069   1.793   3.138
   92    HA   HIS  14           HA       HIS  14  11.190   4.234   1.935
   93   1HB   HIS  14          1HB       HIS  14   9.307   2.361   0.498
   94   2HB   HIS  14          2HB       HIS  14  10.169   3.742  -0.174
   95    HD1  HIS  14           1HD      HIS  14  10.336   0.189  -0.043
   96    HD2  HIS  14           2HD      HIS  14  13.146   3.249   0.014
   97    HE1  HIS  14           1HE      HIS  14  12.513  -0.884  -0.701
   98    H    LYS  15           H        LYS  15   9.224   5.454   0.808
   99    HA   LYS  15           HA       LYS  15   7.197   5.750   2.913
  100   1HB   LYS  15          1HB       LYS  15   6.798   7.992   1.796
  101   2HB   LYS  15          2HB       LYS  15   8.353   7.793   2.593
  102   1HG   LYS  15          1HG       LYS  15   8.517   6.982  -0.163
  103   2HG   LYS  15          2HG       LYS  15   7.884   8.624  -0.025
  104   1HD   LYS  15          1HD       LYS  15  10.210   7.955   1.675
  105   2HD   LYS  15          2HD       LYS  15  10.506   8.055  -0.062
  106   1HE   LYS  15          1HE       LYS  15   9.280  10.294   0.040
  107   2HE   LYS  15          2HE       LYS  15   9.469  10.182   1.790
  108   1HZ   LYS  15          1HZ       LYS  15  11.239  11.411   0.392
  109   2HZ   LYS  15          2HZ       LYS  15  11.815   9.860   0.043
  110   3HZ   LYS  15          3HZ       LYS  15  11.741  10.393   1.647
  111    H    ARG  16           H        ARG  16   7.299   3.861   0.500
  112    HA   ARG  16           HA       ARG  16   4.542   4.375  -0.340
  113   1HB   ARG  16          1HB       ARG  16   6.768   3.666  -2.260
  114   2HB   ARG  16          2HB       ARG  16   5.068   3.851  -2.670
  115   1HG   ARG  16          1HG       ARG  16   5.151   6.202  -2.137
  116   2HG   ARG  16          2HG       ARG  16   6.821   6.046  -1.589
  117   1HD   ARG  16          1HD       ARG  16   6.296   5.071  -4.314
  118   2HD   ARG  16          2HD       ARG  16   6.087   6.807  -4.086
  119    HE   ARG  16           HE       ARG  16   8.497   6.190  -2.914
  120   1HH1  ARG  16          1HH1      ARG  16   7.088   5.905  -6.085
  121   2HH1  ARG  16          2HH1      ARG  16   8.601   6.068  -6.914
  122   1HH2  ARG  16          1HH2      ARG  16  10.494   6.407  -3.994
  123   2HH2  ARG  16          2HH2      ARG  16  10.538   6.353  -5.724
  124    H    TRP  17           H        TRP  17   3.320   2.616  -0.154
  125    HA   TRP  17           HA       TRP  17   4.438  -0.026  -0.593
  126   1HB   TRP  17          1HB       TRP  17   3.395   0.891   2.083
  127   2HB   TRP  17          2HB       TRP  17   3.431  -0.810   1.626
  128    HD1  TRP  17           HD       TRP  17   5.665   2.023   2.777
  129    HE1  TRP  17           1HE      TRP  17   8.031   1.109   3.219
  130    HE3  TRP  17           3HE      TRP  17   5.110  -2.658   0.798
  131    HZ2  TRP  17           2HZ      TRP  17   9.471  -1.279   2.785
  132    HZ3  TRP  17           3HZ      TRP  17   7.031  -4.196   0.850
  133    HH2  TRP  17           HH       TRP  17   9.165  -3.519   1.823
  134    H    VAL  18           H        VAL  18   2.967  -1.421  -1.402
  135    HA   VAL  18           HA       VAL  18   0.186  -0.469  -1.568
  136    HB   VAL  18           HB       VAL  18  -0.050  -1.841  -3.570
  137   1HG1  VAL  18          1HG1      VAL  18   0.609   0.374  -4.025
  138   2HG1  VAL  18          2HG1      VAL  18   2.272   0.068  -3.517
  139   3HG1  VAL  18          3HG1      VAL  18   1.660  -0.641  -5.012
  140   1HG2  VAL  18          1HG2      VAL  18   1.335  -3.501  -4.095
  141   2HG2  VAL  18          2HG2      VAL  18   2.736  -2.431  -4.035
  142   3HG2  VAL  18          3HG2      VAL  18   2.159  -3.212  -2.563
  143    H    PHE  19           H        PHE  19  -1.497  -2.150  -1.622
  144    HA   PHE  19           HA       PHE  19  -0.773  -4.601  -0.181
  145   1HB   PHE  19          1HB       PHE  19  -2.811  -4.311   1.247
  146   2HB   PHE  19          2HB       PHE  19  -1.549  -3.123   1.551
  147    HD1  PHE  19           1HD      PHE  19  -1.794  -0.818   0.601
  148    HD2  PHE  19           2HD      PHE  19  -4.963  -3.659   0.574
  149    HE1  PHE  19           1HE      PHE  19  -3.415   0.998   0.238
  150    HE2  PHE  19           2HE      PHE  19  -6.588  -1.849   0.210
  151    HZ   PHE  19           HZ       PHE  19  -5.815   0.483   0.040
  152    H    THR  20           H        THR  20  -2.051  -6.384  -0.616
  153    HA   THR  20           HA       THR  20  -4.366  -6.096  -2.353
  154    HB   THR  20           HB       THR  20  -3.505  -7.758  -3.986
  155    HG1  THR  20           1HG      THR  20  -0.944  -7.242  -2.862
  156   1HG2  THR  20          1HG2      THR  20  -2.204  -6.219  -5.267
  157   2HG2  THR  20          2HG2      THR  20  -1.699  -5.348  -3.819
  158   3HG2  THR  20          3HG2      THR  20  -3.378  -5.274  -4.353
  159    H    LEU  21           H        LEU  21  -5.891  -7.517  -1.806
  160    HA   LEU  21           HA       LEU  21  -5.119 -10.081  -0.623
  161   1HB   LEU  21          1HB       LEU  21  -5.529  -8.537   1.236
  162   2HB   LEU  21          2HB       LEU  21  -7.132  -8.191   0.591
  163    HG   LEU  21           HG       LEU  21  -7.312 -10.864   0.874
  164   1HD1  LEU  21          1HD1      LEU  21  -5.702 -10.045   3.270
  165   2HD1  LEU  21          2HD1      LEU  21  -4.964 -10.811   1.864
  166   3HD1  LEU  21          3HD1      LEU  21  -6.209 -11.661   2.779
  167   1HD2  LEU  21          1HD2      LEU  21  -7.773  -9.316   3.352
  168   2HD2  LEU  21          2HD2      LEU  21  -8.860 -10.378   2.455
  169   3HD2  LEU  21          3HD2      LEU  21  -8.567  -8.733   1.889
  170    H    ASN  22           H        ASN  22  -6.299 -11.736  -1.363
  171    HA   ASN  22           HA       ASN  22  -8.341 -11.228  -3.326
  172   1HB   ASN  22          1HB       ASN  22  -8.424 -13.767  -3.416
  173   2HB   ASN  22          2HB       ASN  22  -6.876 -13.032  -3.820
  174   1HD2  ASN  22          1HD2      ASN  22  -8.431 -15.326  -1.964
  175   2HD2  ASN  22          2HD2      ASN  22  -7.151 -15.685  -0.860
  176    H    ASN  23           H        ASN  23 -10.492 -11.342  -3.085
  177    HA   ASN  23           HA       ASN  23 -12.513 -11.362  -2.033
  178   1HB   ASN  23          1HB       ASN  23 -12.222 -13.769  -2.329
  179   2HB   ASN  23          2HB       ASN  23 -11.325 -13.865  -0.816
  180   1HD2  ASN  23          1HD2      ASN  23 -14.309 -12.167  -1.686
  181   2HD2  ASN  23          2HD2      ASN  23 -15.293 -12.925  -0.485
  182    HA   PRO  24           HA       PRO  24 -10.670  -9.520   1.845
  183   1HB   PRO  24          1HB       PRO  24 -11.595  -7.007   1.397
  184   2HB   PRO  24          2HB       PRO  24 -10.045  -7.586   0.773
  185   1HG   PRO  24          1HG       PRO  24 -12.682  -7.353  -0.625
  186   2HG   PRO  24          2HG       PRO  24 -11.063  -6.932  -1.213
  187   1HD   PRO  24          1HD       PRO  24 -12.310  -9.236  -1.901
  188   2HD   PRO  24          2HD       PRO  24 -10.547  -9.118  -1.732
  189    H    SER  25           H        SER  25 -11.787  -9.164   3.722
  190    HA   SER  25           HA       SER  25 -14.645  -9.685   3.636
  191   1HB   SER  25          1HB       SER  25 -12.512 -10.141   5.519
  192   2HB   SER  25          2HB       SER  25 -13.829  -9.272   6.306
  193    HG   SER  25           HG       SER  25 -13.725 -11.855   5.398
  194    H    GLU  26           H        GLU  26 -16.138  -8.411   4.967
  195    HA   GLU  26           HA       GLU  26 -16.026  -5.673   4.327
  196   1HB   GLU  26          1HB       GLU  26 -17.890  -7.484   5.563
  197   2HB   GLU  26          2HB       GLU  26 -17.822  -5.984   6.478
  198   1HG   GLU  26          1HG       GLU  26 -17.983  -4.988   3.994
  199   2HG   GLU  26          2HG       GLU  26 -18.845  -6.509   3.766
  200    H    ASP  27           H        ASP  27 -14.998  -7.472   7.127
  201    HA   ASP  27           HA       ASP  27 -14.700  -5.172   8.824
  202   1HB   ASP  27          1HB       ASP  27 -15.052  -7.645   9.519
  203   2HB   ASP  27          2HB       ASP  27 -13.315  -7.804   9.268
  204    H    GLU  28           H        GLU  28 -12.528  -7.215   6.909
  205    HA   GLU  28           HA       GLU  28 -10.151  -5.855   7.674
  206   1HB   GLU  28          1HB       GLU  28 -10.744  -8.174   6.286
  207   2HB   GLU  28          2HB       GLU  28 -10.061  -7.128   5.049
  208   1HG   GLU  28          1HG       GLU  28  -8.155  -8.091   5.794
  209   2HG   GLU  28          2HG       GLU  28  -8.228  -6.729   6.911
  210    H    ARG  29           H        ARG  29 -12.220  -5.686   4.790
  211    HA   ARG  29           HA       ARG  29 -10.726  -3.738   3.423
  212   1HB   ARG  29          1HB       ARG  29 -12.390  -5.046   2.263
  213   2HB   ARG  29          2HB       ARG  29 -13.667  -4.415   3.295
  214   1HG   ARG  29          1HG       ARG  29 -12.385  -2.194   2.123
  215   2HG   ARG  29          2HG       ARG  29 -12.662  -3.376   0.842
  216   1HD   ARG  29          1HD       ARG  29 -14.909  -2.964   2.699
  217   2HD   ARG  29          2HD       ARG  29 -14.502  -1.581   1.685
  218    HE   ARG  29           HE       ARG  29 -14.679  -3.995   0.178
  219   1HH1  ARG  29          1HH1      ARG  29 -16.565  -1.471   1.659
  220   2HH1  ARG  29          2HH1      ARG  29 -17.906  -1.660   0.579
  221   1HH2  ARG  29          1HH2      ARG  29 -16.438  -4.253  -1.251
  222   2HH2  ARG  29          2HH2      ARG  29 -17.833  -3.243  -1.075
  223    H    LYS  30           H        LYS  30 -13.268  -3.486   5.840
  224    HA   LYS  30           HA       LYS  30 -13.650  -0.678   5.593
  225   1HB   LYS  30          1HB       LYS  30 -15.355  -2.112   6.591
  226   2HB   LYS  30          2HB       LYS  30 -14.254  -2.549   7.891
  227   1HG   LYS  30          1HG       LYS  30 -14.253  -0.256   8.690
  228   2HG   LYS  30          2HG       LYS  30 -15.307   0.223   7.357
  229   1HD   LYS  30          1HD       LYS  30 -16.154  -1.974   9.197
  230   2HD   LYS  30          2HD       LYS  30 -16.317  -0.294   9.711
  231   1HE   LYS  30          1HE       LYS  30 -17.290  -0.558   7.038
  232   2HE   LYS  30          2HE       LYS  30 -18.040  -1.794   8.048
  233   1HZ   LYS  30          1HZ       LYS  30 -17.982   0.719   9.374
  234   2HZ   LYS  30          2HZ       LYS  30 -19.306  -0.271   9.015
  235   3HZ   LYS  30          3HZ       LYS  30 -18.758   0.854   7.877
  236    H    LYS  31           H        LYS  31 -11.534  -2.705   7.529
  237    HA   LYS  31           HA       LYS  31 -10.631  -0.754   9.337
  238   1HB   LYS  31          1HB       LYS  31 -10.169  -3.040   9.817
  239   2HB   LYS  31          2HB       LYS  31  -9.357  -3.272   8.274
  240   1HG   LYS  31          1HG       LYS  31  -7.558  -1.777   9.007
  241   2HG   LYS  31          2HG       LYS  31  -8.367  -1.584  10.564
  242   1HD   LYS  31          1HD       LYS  31  -7.575  -3.532  11.321
  243   2HD   LYS  31          2HD       LYS  31  -8.017  -4.376   9.835
  244   1HE   LYS  31          1HE       LYS  31  -5.640  -4.512  10.108
  245   2HE   LYS  31          2HE       LYS  31  -5.985  -3.427   8.762
  246   1HZ   LYS  31          1HZ       LYS  31  -5.417  -1.570  10.016
  247   2HZ   LYS  31          2HZ       LYS  31  -4.244  -2.707  10.455
  248   3HZ   LYS  31          3HZ       LYS  31  -5.542  -2.388  11.492
  249    H    ILE  32           H        ILE  32  -9.190  -1.883   6.280
  250    HA   ILE  32           HA       ILE  32  -7.025  -0.101   6.268
  251    HB   ILE  32           HB       ILE  32  -8.438  -1.613   4.097
  252   1HG1  ILE  32          1HG1      ILE  32  -5.583  -1.712   5.087
  253   2HG1  ILE  32          2HG1      ILE  32  -6.872  -2.745   5.693
  254   1HG2  ILE  32          1HG2      ILE  32  -6.312  -0.783   2.748
  255   2HG2  ILE  32          2HG2      ILE  32  -7.829   0.114   2.743
  256   3HG2  ILE  32          3HG2      ILE  32  -6.509   0.621   3.796
  257   1HD1  ILE  32          1HD1      ILE  32  -6.779  -4.100   3.918
  258   2HD1  ILE  32          2HD1      ILE  32  -6.559  -2.767   2.783
  259   3HD1  ILE  32          3HD1      ILE  32  -5.180  -3.394   3.685
  260    H    ARG  33           H        ARG  33 -10.286   0.185   4.920
  261    HA   ARG  33           HA       ARG  33  -9.823   2.722   3.701
  262   1HB   ARG  33          1HB       ARG  33 -11.577   1.340   2.827
  263   2HB   ARG  33          2HB       ARG  33 -12.353   1.233   4.401
  264   1HG   ARG  33          1HG       ARG  33 -12.809   3.660   4.299
  265   2HG   ARG  33          2HG       ARG  33 -12.125   3.686   2.672
  266   1HD   ARG  33          1HD       ARG  33 -14.446   3.523   2.356
  267   2HD   ARG  33          2HD       ARG  33 -13.833   1.890   2.098
  268    HE   ARG  33           HE       ARG  33 -14.541   2.090   4.776
  269   1HH1  ARG  33          1HH1      ARG  33 -16.087   2.237   1.661
  270   2HH1  ARG  33          2HH1      ARG  33 -17.604   1.632   2.240
  271   1HH2  ARG  33          1HH2      ARG  33 -16.533   1.293   5.551
  272   2HH2  ARG  33          2HH2      ARG  33 -17.857   1.097   4.453
  273    H    ASP  34           H        ASP  34 -10.558   1.686   6.891
  274    HA   ASP  34           HA       ASP  34 -11.501   4.332   7.697
  275   1HB   ASP  34          1HB       ASP  34 -12.646   2.261   8.524
  276   2HB   ASP  34          2HB       ASP  34 -11.171   1.853   9.397
  277    H    LEU  35           H        LEU  35  -8.617   3.209   7.028
  278    HA   LEU  35           HA       LEU  35  -7.100   3.632   9.387
  279   1HB   LEU  35          1HB       LEU  35  -6.479   3.421   6.476
  280   2HB   LEU  35          2HB       LEU  35  -5.236   3.996   7.585
  281    HG   LEU  35           HG       LEU  35  -6.641   1.337   7.820
  282   1HD1  LEU  35          1HD1      LEU  35  -3.891   1.965   6.755
  283   2HD1  LEU  35          2HD1      LEU  35  -5.277   1.459   5.789
  284   3HD1  LEU  35          3HD1      LEU  35  -4.584   0.358   6.980
  285   1HD2  LEU  35          1HD2      LEU  35  -4.218   2.462   9.222
  286   2HD2  LEU  35          2HD2      LEU  35  -4.854   0.828   9.409
  287   3HD2  LEU  35          3HD2      LEU  35  -5.810   2.213   9.940
  288    HA   PRO  36           HA       PRO  36  -6.653   7.991   9.609
  289   1HB   PRO  36          1HB       PRO  36  -4.041   8.278  10.290
  290   2HB   PRO  36          2HB       PRO  36  -5.263   7.663  11.409
  291   1HG   PRO  36          1HG       PRO  36  -3.271   6.153   9.762
  292   2HG   PRO  36          2HG       PRO  36  -3.751   5.897  11.450
  293   1HD   PRO  36          1HD       PRO  36  -4.711   4.387   9.418
  294   2HD   PRO  36          2HD       PRO  36  -5.670   4.762  10.865
  295    H    ILE  37           H        ILE  37  -6.722   9.279   7.882
  296    HA   ILE  37           HA       ILE  37  -5.163   8.875   5.546
  297    HB   ILE  37           HB       ILE  37  -6.070  11.117   4.852
  298   1HG1  ILE  37          1HG1      ILE  37  -7.573  10.909   7.469
  299   2HG1  ILE  37          2HG1      ILE  37  -6.265  12.043   7.150
  300   1HG2  ILE  37          1HG2      ILE  37  -7.769   9.956   4.018
  301   2HG2  ILE  37          2HG2      ILE  37  -7.334   8.639   5.106
  302   3HG2  ILE  37          3HG2      ILE  37  -8.531   9.834   5.604
  303   1HD1  ILE  37          1HD1      ILE  37  -7.955  13.429   6.654
  304   2HD1  ILE  37          2HD1      ILE  37  -7.908  12.608   5.094
  305   3HD1  ILE  37          3HD1      ILE  37  -9.078  12.112   6.316
  306    H    SER  38           H        SER  38  -4.848  10.961   8.349
  307    HA   SER  38           HA       SER  38  -2.866  12.688   7.330
  308   1HB   SER  38          1HB       SER  38  -2.335  13.037   9.808
  309   2HB   SER  38          2HB       SER  38  -3.985  13.392   9.298
  310    HG   SER  38           HG       SER  38  -3.024  11.380  10.941
  311    H    LEU  39           H        LEU  39  -2.754   9.432   8.434
  312    HA   LEU  39           HA       LEU  39   0.023   9.366   9.106
  313   1HB   LEU  39          1HB       LEU  39  -2.095   7.697   9.509
  314   2HB   LEU  39          2HB       LEU  39  -1.216   6.856   8.234
  315    HG   LEU  39           HG       LEU  39   0.376   7.759  10.558
  316   1HD1  LEU  39          1HD1      LEU  39  -1.627   6.963  11.675
  317   2HD1  LEU  39          2HD1      LEU  39  -0.301   5.823  11.898
  318   3HD1  LEU  39          3HD1      LEU  39  -1.580   5.471  10.735
  319   1HD2  LEU  39          1HD2      LEU  39   0.287   5.090   9.175
  320   2HD2  LEU  39          2HD2      LEU  39   1.598   5.787  10.128
  321   3HD2  LEU  39          3HD2      LEU  39   1.202   6.461   8.546
  322    H    PHE  40           H        PHE  40  -1.824   9.005   6.183
  323    HA   PHE  40           HA       PHE  40   0.680   8.508   4.714
  324   1HB   PHE  40          1HB       PHE  40  -1.995   7.575   3.706
  325   2HB   PHE  40          2HB       PHE  40  -0.389   7.040   3.223
  326    HD1  PHE  40           2HD      PHE  40  -2.989   6.801   5.802
  327    HD2  PHE  40           1HD      PHE  40   0.779   5.354   4.449
  328    HE1  PHE  40           2HE      PHE  40  -3.148   4.920   7.380
  329    HE2  PHE  40           1HE      PHE  40   0.625   3.471   6.024
  330    HZ   PHE  40           HZ       PHE  40  -1.340   3.252   7.494
  331    H    ASP  41           H        ASP  41   1.211  10.263   3.610
  332    HA   ASP  41           HA       ASP  41  -0.368  12.478   3.133
  333   1HB   ASP  41          1HB       ASP  41   2.184  12.173   2.866
  334   2HB   ASP  41          2HB       ASP  41   1.808  11.663   1.222
  335    H    TYR  42           H        TYR  42  -0.170   9.498   1.356
  336    HA   TYR  42           HA       TYR  42  -2.323  10.446  -0.394
  337   1HB   TYR  42          1HB       TYR  42  -0.266  10.635  -1.700
  338   2HB   TYR  42          2HB       TYR  42   0.138   8.961  -1.338
  339    HD1  TYR  42           1HD      TYR  42  -3.231  10.221  -2.210
  340    HD2  TYR  42           2HD      TYR  42   0.204   8.092  -3.540
  341    HE1  TYR  42           1HE      TYR  42  -4.462   9.497  -4.212
  342    HE2  TYR  42           2HE      TYR  42  -1.017   7.363  -5.546
  343    HH   TYR  42           HH       TYR  42  -4.341   8.439  -6.166
  344    H    PHE  43           H        PHE  43  -3.991   9.101  -0.356
  345    HA   PHE  43           HA       PHE  43  -3.510   6.243   0.124
  346   1HB   PHE  43          1HB       PHE  43  -4.448   7.805   2.108
  347   2HB   PHE  43          2HB       PHE  43  -5.966   7.404   1.313
  348    HD1  PHE  43           1HD      PHE  43  -4.694   4.623   0.396
  349    HD2  PHE  43           2HD      PHE  43  -5.238   6.623   4.113
  350    HE1  PHE  43           1HE      PHE  43  -4.727   2.452   1.554
  351    HE2  PHE  43           2HE      PHE  43  -5.271   4.456   5.278
  352    HZ   PHE  43           HZ       PHE  43  -5.015   2.367   3.999
  353    H    ILE  44           H        ILE  44  -4.241   5.169  -1.578
  354    HA   ILE  44           HA       ILE  44  -6.843   5.908  -2.711
  355    HB   ILE  44           HB       ILE  44  -5.406   6.903  -4.290
  356   1HG1  ILE  44          1HG1      ILE  44  -5.570   4.323  -5.721
  357   2HG1  ILE  44          2HG1      ILE  44  -7.077   4.885  -5.006
  358   1HG2  ILE  44          1HG2      ILE  44  -3.268   6.170  -3.733
  359   2HG2  ILE  44          2HG2      ILE  44  -3.702   4.470  -3.905
  360   3HG2  ILE  44          3HG2      ILE  44  -3.532   5.486  -5.337
  361   1HD1  ILE  44          1HD1      ILE  44  -7.369   6.165  -6.780
  362   2HD1  ILE  44          2HD1      ILE  44  -5.955   7.102  -6.297
  363   3HD1  ILE  44          3HD1      ILE  44  -5.775   5.739  -7.401
  364    H    VAL  45           H        VAL  45  -8.125   4.200  -2.583
  365    HA   VAL  45           HA       VAL  45  -6.949   1.521  -2.955
  366    HB   VAL  45           HB       VAL  45  -9.421   1.985  -1.316
  367   1HG1  VAL  45          1HG1      VAL  45  -7.952  -0.275  -2.160
  368   2HG1  VAL  45          2HG1      VAL  45  -7.724  -0.123  -0.416
  369   3HG1  VAL  45          3HG1      VAL  45  -9.352  -0.221  -1.089
  370   1HG2  VAL  45          1HG2      VAL  45  -6.561   2.292  -0.465
  371   2HG2  VAL  45          2HG2      VAL  45  -7.932   3.355  -0.146
  372   3HG2  VAL  45          3HG2      VAL  45  -7.812   1.800   0.677
  373    H    GLY  46           H        GLY  46  -8.070   0.050  -4.201
  374   1HA   GLY  46          1HA       GLY  46 -10.591   0.961  -5.416
  375   2HA   GLY  46          2HA       GLY  46  -9.259   0.473  -6.453
  376    H    GLU  47           H        GLU  47 -12.002  -0.637  -6.060
  377    HA   GLU  47           HA       GLU  47 -11.306  -3.342  -5.141
  378   1HB   GLU  47          1HB       GLU  47 -13.210  -2.374  -3.983
  379   2HB   GLU  47          2HB       GLU  47 -14.001  -2.026  -5.513
  380   1HG   GLU  47          1HG       GLU  47 -14.853  -4.070  -5.649
  381   2HG   GLU  47          2HG       GLU  47 -13.308  -4.826  -5.265
  382    H    GLU  48           H        GLU  48 -11.324  -5.032  -6.509
  383    HA   GLU  48           HA       GLU  48 -12.372  -4.598  -9.226
  384   1HB   GLU  48          1HB       GLU  48  -9.761  -4.593  -8.826
  385   2HB   GLU  48          2HB       GLU  48  -9.980  -6.337  -8.802
  386   1HG   GLU  48          1HG       GLU  48 -11.389  -5.523 -11.036
  387   2HG   GLU  48          2HG       GLU  48  -9.953  -4.501 -11.036
  388    H    GLY  49           H        GLY  49 -14.121  -5.864  -9.327
  389   1HA   GLY  49          1HA       GLY  49 -13.770  -8.724  -8.870
  390   2HA   GLY  49          2HA       GLY  49 -15.002  -7.923  -7.906
  391    H    ASN  50           H        ASN  50 -14.225  -7.072 -11.223
  392    HA   ASN  50           HA       ASN  50 -16.981  -7.612 -11.974
  393   1HB   ASN  50          1HB       ASN  50 -14.899  -5.813 -12.854
  394   2HB   ASN  50          2HB       ASN  50 -15.562  -6.700 -14.224
  395   1HD2  ASN  50          1HD2      ASN  50 -18.131  -6.959 -13.779
  396   2HD2  ASN  50          2HD2      ASN  50 -18.914  -5.433 -13.573
  397    H    GLU  51           H        GLU  51 -17.019  -9.877 -12.011
  398    HA   GLU  51           HA       GLU  51 -16.474 -11.086 -14.469
  399   1HB   GLU  51          1HB       GLU  51 -14.227 -11.036 -12.668
  400   2HB   GLU  51          2HB       GLU  51 -14.742 -12.695 -12.939
  401   1HG   GLU  51          1HG       GLU  51 -14.317 -12.592 -15.217
  402   2HG   GLU  51          2HG       GLU  51 -14.343 -10.830 -15.240
  403    H    GLU  52           H        GLU  52 -18.412 -12.080 -14.361
  404    HA   GLU  52           HA       GLU  52 -19.662 -13.167 -12.154
  405   1HB   GLU  52          1HB       GLU  52 -20.396 -12.860 -14.697
  406   2HB   GLU  52          2HB       GLU  52 -19.999 -14.571 -14.757
  407   1HG   GLU  52          1HG       GLU  52 -21.843 -15.152 -13.656
  408   2HG   GLU  52          2HG       GLU  52 -21.642 -13.870 -12.462
  409    H    GLY  53           H        GLY  53 -19.487 -14.994 -10.994
  410   1HA   GLY  53          1HA       GLY  53 -18.928 -17.215 -10.527
  411   2HA   GLY  53          2HA       GLY  53 -18.082 -17.302 -12.065
  412    H    ARG  54           H        ARG  54 -17.017 -14.533 -10.725
  413    HA   ARG  54           HA       ARG  54 -14.763 -15.890  -9.397
  414   1HB   ARG  54          1HB       ARG  54 -14.218 -14.775 -11.568
  415   2HB   ARG  54          2HB       ARG  54 -14.694 -13.242 -10.851
  416   1HG   ARG  54          1HG       ARG  54 -12.921 -13.433  -9.206
  417   2HG   ARG  54          2HG       ARG  54 -12.466 -15.008  -9.859
  418   1HD   ARG  54          1HD       ARG  54 -12.576 -12.741 -11.760
  419   2HD   ARG  54          2HD       ARG  54 -11.267 -12.729 -10.579
  420    HE   ARG  54           HE       ARG  54 -11.511 -14.438 -12.852
  421   1HH1  ARG  54          1HH1      ARG  54 -10.269 -14.242  -9.606
  422   2HH1  ARG  54          2HH1      ARG  54  -9.030 -15.424  -9.869
  423   1HH2  ARG  54          1HH2      ARG  54  -9.883 -15.995 -13.211
  424   2HH2  ARG  54          2HH2      ARG  54  -8.811 -16.420 -11.921
  425    H    THR  55           H        THR  55 -13.736 -14.750  -7.648
  426    HA   THR  55           HA       THR  55 -15.673 -13.264  -6.054
  427    HB   THR  55           HB       THR  55 -13.420 -13.513  -4.485
  428    HG1  THR  55           1HG      THR  55 -13.687 -16.044  -5.687
  429   1HG2  THR  55          1HG2      THR  55 -15.101 -14.281  -3.237
  430   2HG2  THR  55          2HG2      THR  55 -14.916 -15.838  -4.044
  431   3HG2  THR  55          3HG2      THR  55 -16.061 -14.652  -4.668
  432    HA   PRO  56           HA       PRO  56 -13.807  -9.312  -6.452
  433   1HB   PRO  56          1HB       PRO  56 -14.026  -8.318  -3.935
  434   2HB   PRO  56          2HB       PRO  56 -15.413  -8.519  -5.013
  435   1HG   PRO  56          1HG       PRO  56 -14.474 -10.283  -2.784
  436   2HG   PRO  56          2HG       PRO  56 -16.125  -9.783  -3.195
  437   1HD   PRO  56          1HD       PRO  56 -15.127 -12.208  -3.870
  438   2HD   PRO  56          2HD       PRO  56 -16.318 -11.354  -4.871
  439    H    HIS  57           H        HIS  57 -11.977  -8.014  -5.913
  440    HA   HIS  57           HA       HIS  57  -9.988  -9.226  -4.140
  441   1HB   HIS  57          1HB       HIS  57  -9.350 -10.113  -6.267
  442   2HB   HIS  57          2HB       HIS  57  -9.558  -8.551  -7.052
  443    HD1  HIS  57           1HD      HIS  57  -7.523  -7.129  -7.243
  444    HD2  HIS  57           2HD      HIS  57  -7.072 -10.145  -4.422
  445    HE1  HIS  57           1HE      HIS  57  -5.118  -7.017  -6.519
  446    H    LEU  58           H        LEU  58  -8.712  -7.781  -3.080
  447    HA   LEU  58           HA       LEU  58  -9.367  -4.954  -3.472
  448   1HB   LEU  58          1HB       LEU  58  -9.104  -6.547  -1.204
  449   2HB   LEU  58          2HB       LEU  58  -7.662  -5.533  -1.209
  450    HG   LEU  58           HG       LEU  58 -10.536  -4.625  -1.144
  451   1HD1  LEU  58          1HD1      LEU  58  -9.575  -3.481   0.956
  452   2HD1  LEU  58          2HD1      LEU  58  -8.275  -4.664   0.818
  453   3HD1  LEU  58          3HD1      LEU  58  -9.942  -5.205   1.022
  454   1HD2  LEU  58          1HD2      LEU  58  -9.060  -2.384  -0.771
  455   2HD2  LEU  58          2HD2      LEU  58  -9.774  -2.861  -2.311
  456   3HD2  LEU  58          3HD2      LEU  58  -8.084  -3.232  -1.970
  457    H    GLN  59           H        GLN  59  -7.907  -3.474  -4.111
  458    HA   GLN  59           HA       GLN  59  -5.068  -4.020  -3.998
  459   1HB   GLN  59          1HB       GLN  59  -5.442  -5.097  -6.064
  460   2HB   GLN  59          2HB       GLN  59  -6.579  -3.866  -6.595
  461   1HG   GLN  59          1HG       GLN  59  -4.469  -3.692  -7.783
  462   2HG   GLN  59          2HG       GLN  59  -4.770  -2.258  -6.802
  463   1HE2  GLN  59          1HE2      GLN  59  -2.478  -4.413  -7.708
  464   2HE2  GLN  59          2HE2      GLN  59  -1.377  -4.246  -6.387
  465    H    GLY  60           H        GLY  60  -4.342  -2.202  -3.112
  466   1HA   GLY  60          1HA       GLY  60  -4.990   0.340  -4.403
  467   2HA   GLY  60          2HA       GLY  60  -5.381   0.188  -2.696
  468    H    PHE  61           H        PHE  61  -3.722   2.171  -3.356
  469    HA   PHE  61           HA       PHE  61  -1.111   1.200  -2.407
  470   1HB   PHE  61          1HB       PHE  61  -0.704   1.730  -4.679
  471   2HB   PHE  61          2HB       PHE  61  -1.685   3.190  -4.596
  472    HD1  PHE  61           2HD      PHE  61   1.185   1.827  -2.632
  473    HD2  PHE  61           1HD      PHE  61  -0.437   5.090  -4.831
  474    HE1  PHE  61           2HE      PHE  61   3.204   3.149  -2.153
  475    HE2  PHE  61           1HE      PHE  61   1.579   6.418  -4.356
  476    HZ   PHE  61           HZ       PHE  61   3.403   5.448  -3.014
  477    H    ALA  62           H        ALA  62  -0.117   2.404  -0.846
  478    HA   ALA  62           HA       ALA  62  -1.395   4.918  -0.026
  479   1HB   ALA  62          1HB       ALA  62  -0.711   3.858   2.383
  480   2HB   ALA  62          2HB       ALA  62  -2.328   3.801   1.681
  481   3HB   ALA  62          3HB       ALA  62  -1.241   2.423   1.505
  482    H    ASN  63           H        ASN  63   0.037   6.497   0.237
  483    HA   ASN  63           HA       ASN  63   2.875   5.846   0.261
  484   1HB   ASN  63          1HB       ASN  63   1.995   7.574  -1.294
  485   2HB   ASN  63          2HB       ASN  63   1.526   8.550   0.094
  486   1HD2  ASN  63          1HD2      ASN  63   3.633   8.585  -2.211
  487   2HD2  ASN  63          2HD2      ASN  63   5.053   9.148  -1.402
  488    H    PHE  64           H        PHE  64   3.848   5.550   2.146
  489    HA   PHE  64           HA       PHE  64   2.756   6.452   4.619
  490   1HB   PHE  64          1HB       PHE  64   4.886   4.708   3.750
  491   2HB   PHE  64          2HB       PHE  64   5.447   5.761   5.044
  492    HD1  PHE  64           2HD      PHE  64   3.888   5.922   7.125
  493    HD2  PHE  64           1HD      PHE  64   3.771   2.763   4.274
  494    HE1  PHE  64           2HE      PHE  64   2.788   4.473   8.781
  495    HE2  PHE  64           1HE      PHE  64   2.670   1.309   5.925
  496    HZ   PHE  64           HZ       PHE  64   2.178   2.163   8.182
  497    H    VAL  65           H        VAL  65   3.027   8.333   5.618
  498    HA   VAL  65           HA       VAL  65   4.395  10.492   4.468
  499    HB   VAL  65           HB       VAL  65   3.491  10.133   7.329
  500   1HG1  VAL  65          1HG1      VAL  65   5.164  11.883   7.176
  501   2HG1  VAL  65          2HG1      VAL  65   4.289  12.632   5.839
  502   3HG1  VAL  65          3HG1      VAL  65   3.571  12.587   7.450
  503   1HG2  VAL  65          1HG2      VAL  65   1.473  11.166   6.720
  504   2HG2  VAL  65          2HG2      VAL  65   2.116  11.705   5.169
  505   3HG2  VAL  65          3HG2      VAL  65   1.781   9.995   5.438
  506    H    LYS  66           H        LYS  66   5.472   7.967   6.560
  507    HA   LYS  66           HA       LYS  66   8.094   9.295   6.780
  508   1HB   LYS  66          1HB       LYS  66   6.460   7.894   8.827
  509   2HB   LYS  66          2HB       LYS  66   8.196   7.612   8.867
  510   1HG   LYS  66          1HG       LYS  66   7.868   9.396  10.323
  511   2HG   LYS  66          2HG       LYS  66   8.428  10.157   8.832
  512   1HD   LYS  66          1HD       LYS  66   5.805  10.232   8.364
  513   2HD   LYS  66          2HD       LYS  66   5.760  10.237  10.129
  514   1HE   LYS  66          1HE       LYS  66   7.409  12.141  10.048
  515   2HE   LYS  66          2HE       LYS  66   7.132  12.205   8.308
  516   1HZ   LYS  66          1HZ       LYS  66   4.627  12.224   9.328
  517   2HZ   LYS  66          2HZ       LYS  66   5.485  13.593   8.829
  518   3HZ   LYS  66          3HZ       LYS  66   5.478  13.148  10.461
  519    H    LYS  67           H        LYS  67   9.734   7.408   7.550
  520    HA   LYS  67           HA       LYS  67   9.693   5.516   5.340
  521   1HB   LYS  67          1HB       LYS  67  11.829   6.128   7.391
  522   2HB   LYS  67          2HB       LYS  67  12.019   5.022   6.037
  523   1HG   LYS  67          1HG       LYS  67  11.155   7.780   5.408
  524   2HG   LYS  67          2HG       LYS  67  12.819   7.556   5.954
  525   1HD   LYS  67          1HD       LYS  67  12.036   5.573   3.984
  526   2HD   LYS  67          2HD       LYS  67  11.867   7.220   3.372
  527   1HE   LYS  67          1HE       LYS  67  14.354   6.472   4.834
  528   2HE   LYS  67          2HE       LYS  67  14.146   5.918   3.174
  529   1HZ   LYS  67          1HZ       LYS  67  14.915   7.897   2.574
  530   2HZ   LYS  67          2HZ       LYS  67  14.797   8.520   4.142
  531   3HZ   LYS  67          3HZ       LYS  67  13.456   8.564   3.113
  532    H    GLN  68           H        GLN  68   8.867   3.556   5.586
  533    HA   GLN  68           HA       GLN  68   9.152   2.220   8.190
  534   1HB   GLN  68          1HB       GLN  68   6.711   2.016   6.424
  535   2HB   GLN  68          2HB       GLN  68   6.927   1.308   8.020
  536   1HG   GLN  68          1HG       GLN  68   6.586   4.200   7.301
  537   2HG   GLN  68          2HG       GLN  68   5.554   3.192   8.315
  538   1HE2  GLN  68          1HE2      GLN  68   7.005   5.758   8.794
  539   2HE2  GLN  68          2HE2      GLN  68   7.922   5.484  10.232
  540    H    THR  69           H        THR  69   9.207  -0.090   8.114
  541    HA   THR  69           HA       THR  69  10.371  -1.074   5.621
  542    HB   THR  69           HB       THR  69  11.354  -2.823   6.855
  543    HG1  THR  69           1HG      THR  69  10.691  -3.230   9.060
  544   1HG2  THR  69          1HG2      THR  69  12.406  -0.681   7.320
  545   2HG2  THR  69          2HG2      THR  69  12.453  -1.701   8.759
  546   3HG2  THR  69          3HG2      THR  69  11.278  -0.391   8.644
  547    H    PHE  70           H        PHE  70   9.902  -3.493   5.197
  548    HA   PHE  70           HA       PHE  70   7.199  -3.746   4.484
  549   1HB   PHE  70          1HB       PHE  70   8.644  -4.998   3.156
  550   2HB   PHE  70          2HB       PHE  70   9.530  -5.629   4.541
  551    HD1  PHE  70           1HD      PHE  70   6.267  -5.820   2.788
  552    HD2  PHE  70           2HD      PHE  70   9.013  -7.719   5.428
  553    HE1  PHE  70           1HE      PHE  70   4.921  -7.878   2.703
  554    HE2  PHE  70           2HE      PHE  70   7.672  -9.780   5.346
  555    HZ   PHE  70           HZ       PHE  70   5.624  -9.862   3.982
  556    H    ASN  71           H        ASN  71   9.054  -5.477   6.989
  557    HA   ASN  71           HA       ASN  71   6.886  -6.899   8.055
  558   1HB   ASN  71          1HB       ASN  71   9.661  -6.364   8.793
  559   2HB   ASN  71          2HB       ASN  71   8.605  -6.528  10.193
  560   1HD2  ASN  71          1HD2      ASN  71   9.848  -8.437  10.650
  561   2HD2  ASN  71          2HD2      ASN  71   9.464  -9.921   9.853
  562    H    LYS  72           H        LYS  72   8.242  -3.742   8.888
  563    HA   LYS  72           HA       LYS  72   6.629  -3.268  11.154
  564   1HB   LYS  72          1HB       LYS  72   8.753  -2.013  10.149
  565   2HB   LYS  72          2HB       LYS  72   7.507  -0.984   9.455
  566   1HG   LYS  72          1HG       LYS  72   7.948  -1.558  12.376
  567   2HG   LYS  72          2HG       LYS  72   8.264  -0.042  11.530
  568   1HD   LYS  72          1HD       LYS  72   5.834   0.081  10.986
  569   2HD   LYS  72          2HD       LYS  72   5.582  -1.340  12.002
  570   1HE   LYS  72          1HE       LYS  72   6.595   1.369  12.846
  571   2HE   LYS  72          2HE       LYS  72   5.077   0.599  13.305
  572   1HZ   LYS  72          1HZ       LYS  72   6.659   0.417  15.087
  573   2HZ   LYS  72          2HZ       LYS  72   7.804  -0.297  14.066
  574   3HZ   LYS  72          3HZ       LYS  72   6.377  -1.123  14.445
  575    H    VAL  73           H        VAL  73   6.278  -2.233   7.767
  576    HA   VAL  73           HA       VAL  73   3.937  -0.771   8.000
  577    HB   VAL  73           HB       VAL  73   4.969  -2.450   5.721
  578   1HG1  VAL  73          1HG1      VAL  73   2.612  -2.394   5.394
  579   2HG1  VAL  73          2HG1      VAL  73   2.533  -0.682   5.814
  580   3HG1  VAL  73          3HG1      VAL  73   3.316  -1.188   4.317
  581   1HG2  VAL  73          1HG2      VAL  73   4.727   0.521   5.715
  582   2HG2  VAL  73          2HG2      VAL  73   6.041  -0.230   6.620
  583   3HG2  VAL  73          3HG2      VAL  73   5.889  -0.516   4.887
  584    H    LYS  74           H        LYS  74   4.415  -4.197   8.134
  585    HA   LYS  74           HA       LYS  74   1.806  -5.049   7.486
  586   1HB   LYS  74          1HB       LYS  74   3.821  -6.364   9.318
  587   2HB   LYS  74          2HB       LYS  74   2.418  -7.146   8.602
  588   1HG   LYS  74          1HG       LYS  74   3.714  -6.125   6.413
  589   2HG   LYS  74          2HG       LYS  74   5.045  -6.606   7.468
  590   1HD   LYS  74          1HD       LYS  74   4.740  -8.649   6.592
  591   2HD   LYS  74          2HD       LYS  74   3.354  -8.741   7.682
  592   1HE   LYS  74          1HE       LYS  74   1.868  -8.013   5.943
  593   2HE   LYS  74          2HE       LYS  74   3.220  -7.689   4.860
  594   1HZ   LYS  74          1HZ       LYS  74   2.428 -10.361   5.886
  595   2HZ   LYS  74          2HZ       LYS  74   3.729 -10.053   4.851
  596   3HZ   LYS  74          3HZ       LYS  74   2.145  -9.780   4.323
  597    H    TRP  75           H        TRP  75   2.950  -3.296  10.121
  598    HA   TRP  75           HA       TRP  75   1.240  -4.302  12.161
  599   1HB   TRP  75          1HB       TRP  75   2.003  -2.518  13.485
  600   2HB   TRP  75          2HB       TRP  75   3.360  -2.866  12.418
  601    HD1  TRP  75           HD       TRP  75   2.412  -1.259   9.851
  602    HE1  TRP  75           1HE      TRP  75   2.407   1.315   9.895
  603    HE3  TRP  75           3HE      TRP  75   2.280  -0.532  14.910
  604    HZ2  TRP  75           2HZ      TRP  75   2.354   3.380  11.819
  605    HZ3  TRP  75           3HZ      TRP  75   2.255   1.773  15.770
  606    HH2  TRP  75           HH       TRP  75   2.292   3.687  14.255
  607    H    TYR  76           H        TYR  76   0.753  -2.245   9.465
  608    HA   TYR  76           HA       TYR  76  -1.845  -1.379  10.551
  609   1HB   TYR  76          1HB       TYR  76   0.207   0.007   8.995
  610   2HB   TYR  76          2HB       TYR  76  -1.405   0.168   8.307
  611    HD1  TYR  76           2HD      TYR  76  -3.031   0.177  10.808
  612    HD2  TYR  76           1HD      TYR  76   0.619   2.146   9.857
  613    HE1  TYR  76           2HE      TYR  76  -3.558   1.933  12.448
  614    HE2  TYR  76           1HE      TYR  76   0.103   3.907  11.495
  615    HH   TYR  76           HH       TYR  76  -2.799   3.734  13.525
  616    H    LEU  77           H        LEU  77  -0.235  -2.359   7.531
  617    HA   LEU  77           HA       LEU  77  -2.686  -2.832   6.148
  618   1HB   LEU  77          1HB       LEU  77   0.168  -3.595   5.581
  619   2HB   LEU  77          2HB       LEU  77  -1.166  -4.012   4.507
  620    HG   LEU  77           HG       LEU  77  -0.405  -1.190   5.251
  621   1HD1  LEU  77          1HD1      LEU  77   0.802  -1.005   3.273
  622   2HD1  LEU  77          2HD1      LEU  77   0.114  -2.483   2.599
  623   3HD1  LEU  77          3HD1      LEU  77   1.294  -2.576   3.906
  624   1HD2  LEU  77          1HD2      LEU  77  -1.800  -0.668   3.246
  625   2HD2  LEU  77          2HD2      LEU  77  -2.701  -1.328   4.611
  626   3HD2  LEU  77          3HD2      LEU  77  -2.313  -2.356   3.231
  627    H    GLY  78           H        GLY  78  -1.027  -4.554   8.516
  628   1HA   GLY  78          1HA       GLY  78  -1.432  -6.610   9.462
  629   2HA   GLY  78          2HA       GLY  78  -2.852  -6.725   8.434
  630    H    ALA  79           H        ALA  79  -1.008  -8.833   9.135
  631    HA   ALA  79           HA       ALA  79   0.690  -9.349   6.886
  632   1HB   ALA  79          1HB       ALA  79   0.224 -10.499   9.467
  633   2HB   ALA  79          2HB       ALA  79   0.195 -11.763   8.236
  634   3HB   ALA  79          3HB       ALA  79   1.601 -10.709   8.384
  635    H    ARG  80           H        ARG  80  -2.609 -10.048   7.728
  636    HA   ARG  80           HA       ARG  80  -3.174 -12.236   6.136
  637   1HB   ARG  80          1HB       ARG  80  -4.963  -9.845   6.611
  638   2HB   ARG  80          2HB       ARG  80  -5.486 -11.445   6.102
  639   1HG   ARG  80          1HG       ARG  80  -3.932 -11.273   8.614
  640   2HG   ARG  80          2HG       ARG  80  -5.578 -10.635   8.631
  641   1HD   ARG  80          1HD       ARG  80  -4.869 -13.383   7.623
  642   2HD   ARG  80          2HD       ARG  80  -5.344 -13.053   9.289
  643    HE   ARG  80           HE       ARG  80  -7.287 -11.990   7.572
  644   1HH1  ARG  80          1HH1      ARG  80  -6.040 -15.071   8.606
  645   2HH1  ARG  80          2HH1      ARG  80  -7.537 -15.907   8.360
  646   1HH2  ARG  80          1HH2      ARG  80  -9.264 -13.079   7.244
  647   2HH2  ARG  80          2HH2      ARG  80  -9.370 -14.773   7.584
  648    H    CYS  81           H        CYS  81  -3.042  -8.815   5.242
  649    HA   CYS  81           HA       CYS  81  -3.598  -9.480   2.456
  650   1HB   CYS  81          1HB       CYS  81  -3.046  -6.741   3.598
  651   2HB   CYS  81          2HB       CYS  81  -3.847  -7.136   2.082
  652    HG   CYS  81           HG       CYS  81  -6.230  -7.119   3.020
  653    H    HIS  82           H        HIS  82  -2.094  -9.569   0.902
  654    HA   HIS  82           HA       HIS  82   0.671  -9.525   1.611
  655   1HB   HIS  82          1HB       HIS  82  -0.449 -11.004  -0.147
  656   2HB   HIS  82          2HB       HIS  82  -0.422  -9.591  -1.198
  657    HD1  HIS  82           1HD      HIS  82   1.877 -12.035   0.504
  658    HD2  HIS  82           2HD      HIS  82   2.029  -9.013  -2.343
  659    HE1  HIS  82           1HE      HIS  82   4.168 -12.192  -0.522
  660    H    ILE  83           H        ILE  83   2.052  -7.880   1.558
  661    HA   ILE  83           HA       ILE  83   1.249  -5.437   0.119
  662    HB   ILE  83           HB       ILE  83   2.573  -4.155   1.704
  663   1HG1  ILE  83          1HG1      ILE  83   3.091  -6.805   3.072
  664   2HG1  ILE  83          2HG1      ILE  83   4.282  -5.869   2.176
  665   1HG2  ILE  83          1HG2      ILE  83   0.623  -6.049   3.006
  666   2HG2  ILE  83          2HG2      ILE  83   1.219  -4.562   3.743
  667   3HG2  ILE  83          3HG2      ILE  83   0.259  -4.490   2.265
  668   1HD1  ILE  83          1HD1      ILE  83   4.575  -5.543   4.543
  669   2HD1  ILE  83          2HD1      ILE  83   4.024  -4.042   3.799
  670   3HD1  ILE  83          3HD1      ILE  83   2.894  -5.040   4.712
  671    H    GLU  84           H        GLU  84   2.806  -4.288  -1.049
  672    HA   GLU  84           HA       GLU  84   5.479  -5.402  -1.306
  673   1HB   GLU  84          1HB       GLU  84   3.588  -6.331  -3.028
  674   2HB   GLU  84          2HB       GLU  84   4.189  -4.939  -3.916
  675   1HG   GLU  84          1HG       GLU  84   5.809  -6.252  -4.659
  676   2HG   GLU  84          2HG       GLU  84   6.484  -6.197  -3.031
  677    H    LYS  85           H        LYS  85   6.859  -4.042  -2.741
  678    HA   LYS  85           HA       LYS  85   6.448  -1.273  -2.107
  679   1HB   LYS  85          1HB       LYS  85   8.626  -0.930  -3.202
  680   2HB   LYS  85          2HB       LYS  85   8.686  -2.231  -2.019
  681   1HG   LYS  85          1HG       LYS  85   8.417  -3.850  -3.898
  682   2HG   LYS  85          2HG       LYS  85   8.578  -2.492  -5.014
  683   1HD   LYS  85          1HD       LYS  85  10.794  -2.561  -4.844
  684   2HD   LYS  85          2HD       LYS  85  10.700  -2.418  -3.087
  685   1HE   LYS  85          1HE       LYS  85  11.868  -4.440  -3.610
  686   2HE   LYS  85          2HE       LYS  85  10.280  -4.871  -2.978
  687   1HZ   LYS  85          1HZ       LYS  85  11.177  -6.023  -5.097
  688   2HZ   LYS  85          2HZ       LYS  85  10.665  -4.616  -5.882
  689   3HZ   LYS  85          3HZ       LYS  85   9.551  -5.561  -5.029
  690    H    ALA  86           H        ALA  86   5.715   0.325  -3.378
  691    HA   ALA  86           HA       ALA  86   4.678  -0.391  -6.001
  692   1HB   ALA  86          1HB       ALA  86   3.860   1.360  -3.942
  693   2HB   ALA  86          2HB       ALA  86   4.203   2.346  -5.364
  694   3HB   ALA  86          3HB       ALA  86   3.049   1.016  -5.470
  695    H    LYS  87           H        LYS  87   5.017   1.001  -7.859
  696    HA   LYS  87           HA       LYS  87   7.389   2.696  -7.800
  697   1HB   LYS  87          1HB       LYS  87   8.548   1.546  -9.524
  698   2HB   LYS  87          2HB       LYS  87   8.101   0.328  -8.337
  699   1HG   LYS  87          1HG       LYS  87   5.969   0.310 -10.070
  700   2HG   LYS  87          2HG       LYS  87   7.352   0.576 -11.134
  701   1HD   LYS  87          1HD       LYS  87   8.357  -1.432 -10.537
  702   2HD   LYS  87          2HD       LYS  87   7.444  -1.554  -9.031
  703   1HE   LYS  87          1HE       LYS  87   5.447  -2.121 -10.203
  704   2HE   LYS  87          2HE       LYS  87   6.181  -1.740 -11.759
  705   1HZ   LYS  87          1HZ       LYS  87   6.692  -3.883 -11.880
  706   2HZ   LYS  87          2HZ       LYS  87   6.272  -4.166 -10.266
  707   3HZ   LYS  87          3HZ       LYS  87   7.828  -3.626 -10.653
  708    H    GLY  88           H        GLY  88   7.403   4.287  -9.359
  709   1HA   GLY  88          1HA       GLY  88   6.602   4.969 -11.612
  710   2HA   GLY  88          2HA       GLY  88   5.030   4.357 -11.121
  711    H    THR  89           H        THR  89   4.947   6.809 -12.028
  712    HA   THR  89           HA       THR  89   5.419   8.787  -9.988
  713    HB   THR  89           HB       THR  89   4.581  10.400 -11.524
  714    HG1  THR  89           1HG      THR  89   3.395   9.805 -13.361
  715   1HG2  THR  89          1HG2      THR  89   6.038  10.139 -13.330
  716   2HG2  THR  89          2HG2      THR  89   5.820   8.390 -13.376
  717   3HG2  THR  89          3HG2      THR  89   6.759   9.127 -12.079
  718    H    ASP  90           H        ASP  90   3.500  10.369  -9.573
  719    HA   ASP  90           HA       ASP  90   1.649   9.103  -7.941
  720   1HB   ASP  90          1HB       ASP  90   0.530  11.226  -7.766
  721   2HB   ASP  90          2HB       ASP  90   2.262  11.529  -7.866
  722    H    GLN  91           H        GLN  91   1.352  10.113 -11.312
  723    HA   GLN  91           HA       GLN  91  -1.404   9.463 -11.558
  724   1HB   GLN  91          1HB       GLN  91   0.657  10.551 -13.219
  725   2HB   GLN  91          2HB       GLN  91  -0.142   9.249 -14.090
  726   1HG   GLN  91          1HG       GLN  91  -1.130  11.474 -14.500
  727   2HG   GLN  91          2HG       GLN  91  -2.273  10.302 -13.844
  728   1HE2  GLN  91          1HE2      GLN  91  -3.256  10.708 -11.944
  729   2HE2  GLN  91          2HE2      GLN  91  -3.003  12.133 -10.999
  730    H    GLN  92           H        GLN  92   1.586   7.688 -12.067
  731    HA   GLN  92           HA       GLN  92   0.500   5.467 -13.410
  732   1HB   GLN  92          1HB       GLN  92   3.023   6.163 -12.115
  733   2HB   GLN  92          2HB       GLN  92   2.625   4.457 -11.958
  734   1HG   GLN  92          1HG       GLN  92   2.096   4.961 -14.601
  735   2HG   GLN  92          2HG       GLN  92   3.507   5.968 -14.281
  736   1HE2  GLN  92          1HE2      GLN  92   5.454   5.008 -13.768
  737   2HE2  GLN  92          2HE2      GLN  92   5.745   3.319 -13.981
  738    H    ASN  93           H        ASN  93   0.947   6.162  -9.973
  739    HA   ASN  93           HA       ASN  93  -0.012   3.595  -9.124
  740   1HB   ASN  93          1HB       ASN  93   0.665   6.163  -7.711
  741   2HB   ASN  93          2HB       ASN  93  -0.124   4.842  -6.853
  742   1HD2  ASN  93          1HD2      ASN  93   2.347   4.773  -9.380
  743   2HD2  ASN  93          2HD2      ASN  93   3.538   3.951  -8.437
  744    H    LYS  94           H        LYS  94  -1.352   6.880  -9.218
  745    HA   LYS  94           HA       LYS  94  -3.839   6.278  -8.061
  746   1HB   LYS  94          1HB       LYS  94  -2.966   8.571  -8.356
  747   2HB   LYS  94          2HB       LYS  94  -3.189   8.421 -10.094
  748   1HG   LYS  94          1HG       LYS  94  -5.497   8.508  -9.937
  749   2HG   LYS  94          2HG       LYS  94  -5.499   8.030  -8.238
  750   1HD   LYS  94          1HD       LYS  94  -4.461  10.204  -7.669
  751   2HD   LYS  94          2HD       LYS  94  -4.584  10.676  -9.365
  752   1HE   LYS  94          1HE       LYS  94  -7.024  10.407  -9.243
  753   2HE   LYS  94          2HE       LYS  94  -6.882   9.975  -7.540
  754   1HZ   LYS  94          1HZ       LYS  94  -7.486  12.324  -7.927
  755   2HZ   LYS  94          2HZ       LYS  94  -5.992  12.567  -8.682
  756   3HZ   LYS  94          3HZ       LYS  94  -6.054  12.146  -7.044
  757    H    GLU  95           H        GLU  95  -2.765   6.272 -11.435
  758    HA   GLU  95           HA       GLU  95  -5.318   5.652 -12.524
  759   1HB   GLU  95          1HB       GLU  95  -2.517   5.430 -13.618
  760   2HB   GLU  95          2HB       GLU  95  -3.936   4.983 -14.555
  761   1HG   GLU  95          1HG       GLU  95  -3.599   7.700 -13.326
  762   2HG   GLU  95          2HG       GLU  95  -3.008   7.298 -14.937
  763    H    TYR  96           H        TYR  96  -2.568   3.726 -11.464
  764    HA   TYR  96           HA       TYR  96  -3.300   1.251 -12.504
  765   1HB   TYR  96          1HB       TYR  96  -1.123   1.735 -11.422
  766   2HB   TYR  96          2HB       TYR  96  -1.930   1.785  -9.859
  767    HD1  TYR  96           1HD      TYR  96  -3.056  -0.325  -9.018
  768    HD2  TYR  96           2HD      TYR  96  -0.404  -0.306 -12.345
  769    HE1  TYR  96           1HE      TYR  96  -2.740  -2.752  -8.773
  770    HE2  TYR  96           2HE      TYR  96  -0.082  -2.733 -12.110
  771    HH   TYR  96           HH       TYR  96  -1.769  -4.707 -10.926
  772    H    CYS  97           H        CYS  97  -4.011   2.572  -9.269
  773    HA   CYS  97           HA       CYS  97  -5.624   0.442  -8.415
  774   1HB   CYS  97          1HB       CYS  97  -5.721   3.348  -7.576
  775   2HB   CYS  97          2HB       CYS  97  -6.455   2.010  -6.701
  776    HG   CYS  97           HG       CYS  97  -3.609   0.869  -6.754
  777    H    SER  98           H        SER  98  -6.354   3.333 -10.265
  778    HA   SER  98           HA       SER  98  -9.202   2.964 -10.143
  779   1HB   SER  98          1HB       SER  98  -8.019   5.189 -10.459
  780   2HB   SER  98          2HB       SER  98  -7.683   4.679 -12.113
  781    HG   SER  98           HG       SER  98  -9.823   5.872 -11.298
  782    H    LYS  99           H        LYS  99  -6.700   1.554 -11.907
  783    HA   LYS  99           HA       LYS  99  -7.866   1.143 -14.421
  784   1HB   LYS  99          1HB       LYS  99  -5.466   0.662 -13.661
  785   2HB   LYS  99          2HB       LYS  99  -6.090  -0.862 -13.043
  786   1HG   LYS  99          1HG       LYS  99  -6.769  -1.539 -15.247
  787   2HG   LYS  99          2HG       LYS  99  -6.322   0.036 -15.907
  788   1HD   LYS  99          1HD       LYS  99  -4.564  -1.490 -16.432
  789   2HD   LYS  99          2HD       LYS  99  -3.973  -0.416 -15.162
  790   1HE   LYS  99          1HE       LYS  99  -3.445  -2.220 -13.976
  791   2HE   LYS  99          2HE       LYS  99  -5.168  -2.564 -13.829
  792   1HZ   LYS  99          1HZ       LYS  99  -4.673  -4.448 -14.883
  793   2HZ   LYS  99          2HZ       LYS  99  -3.167  -3.888 -15.410
  794   3HZ   LYS  99          3HZ       LYS  99  -4.563  -3.513 -16.289
  795    H    GLU 100           H        GLU 100  -8.600  -0.207 -11.353
  796    HA   GLU 100           HA       GLU 100  -9.790  -2.633 -12.269
  797   1HB   GLU 100          1HB       GLU 100 -10.293  -1.148  -9.685
  798   2HB   GLU 100          2HB       GLU 100 -10.674  -2.832 -10.013
  799   1HG   GLU 100          1HG       GLU 100  -8.446  -3.480  -9.966
  800   2HG   GLU 100          2HG       GLU 100  -7.863  -1.835 -10.216
  801    H    GLY 101           H        GLY 101 -10.790   0.638 -12.210
  802   1HA   GLY 101          1HA       GLY 101 -12.685   1.531 -13.228
  803   2HA   GLY 101          2HA       GLY 101 -13.342  -0.093 -13.372
  804    H    ASN 102           H        ASN 102 -12.420   0.004 -10.284
  805    HA   ASN 102           HA       ASN 102 -14.846   1.349  -9.317
  806   1HB   ASN 102          1HB       ASN 102 -14.312  -1.490  -9.290
  807   2HB   ASN 102          2HB       ASN 102 -14.469  -0.879  -7.645
  808   1HD2  ASN 102          1HD2      ASN 102 -16.387  -2.155  -7.513
  809   2HD2  ASN 102          2HD2      ASN 102 -17.869  -1.568  -8.180
  810    H    LEU 103           H        LEU 103 -14.404   2.736  -7.742
  811    HA   LEU 103           HA       LEU 103 -11.812   2.576  -6.400
  812   1HB   LEU 103          1HB       LEU 103 -13.486   4.692  -7.321
  813   2HB   LEU 103          2HB       LEU 103 -13.266   4.864  -5.581
  814    HG   LEU 103           HG       LEU 103 -11.646   6.152  -6.980
  815   1HD1  LEU 103          1HD1      LEU 103  -9.658   4.694  -5.706
  816   2HD1  LEU 103          2HD1      LEU 103 -11.106   4.403  -4.744
  817   3HD1  LEU 103          3HD1      LEU 103 -10.564   6.054  -5.043
  818   1HD2  LEU 103          1HD2      LEU 103 -11.450   3.795  -8.410
  819   2HD2  LEU 103          2HD2      LEU 103  -9.938   3.863  -7.504
  820   3HD2  LEU 103          3HD2      LEU 103 -10.395   5.201  -8.560
  821    H    LEU 104           H        LEU 104 -11.569   2.190  -4.270
  822    HA   LEU 104           HA       LEU 104 -13.999   1.563  -2.746
  823   1HB   LEU 104          1HB       LEU 104 -12.311  -0.220  -3.038
  824   2HB   LEU 104          2HB       LEU 104 -11.139   0.786  -2.189
  825    HG   LEU 104           HG       LEU 104 -12.385   0.598  -0.139
  826   1HD1  LEU 104          1HD1      LEU 104 -14.333  -1.320  -0.586
  827   2HD1  LEU 104          2HD1      LEU 104 -14.518  -0.191  -1.927
  828   3HD1  LEU 104          3HD1      LEU 104 -14.594   0.395  -0.265
  829   1HD2  LEU 104          1HD2      LEU 104 -11.073  -1.488  -1.398
  830   2HD2  LEU 104          2HD2      LEU 104 -12.561  -2.221  -0.796
  831   3HD2  LEU 104          3HD2      LEU 104 -11.476  -1.384   0.316
  832    H    MET 105           H        MET 105 -11.168   3.590  -2.792
  833    HA   MET 105           HA       MET 105 -12.303   5.311  -0.793
  834   1HB   MET 105          1HB       MET 105 -11.328   3.957   0.831
  835   2HB   MET 105          2HB       MET 105  -9.934   3.584  -0.174
  836   1HG   MET 105          1HG       MET 105  -8.802   5.418   0.473
  837   2HG   MET 105          2HG       MET 105 -10.254   6.411   0.577
  838   1HE   MET 105          1HE       MET 105  -7.854   4.809   3.883
  839   2HE   MET 105          2HE       MET 105  -8.232   3.499   2.764
  840   3HE   MET 105          3HE       MET 105  -7.499   4.987   2.164
  841    H    GLU 106           H        GLU 106 -11.628   7.378  -1.049
  842    HA   GLU 106           HA       GLU 106  -9.258   7.855  -2.722
  843   1HB   GLU 106          1HB       GLU 106 -11.597   8.076  -3.872
  844   2HB   GLU 106          2HB       GLU 106 -11.682   9.595  -2.991
  845   1HG   GLU 106          1HG       GLU 106  -9.154   9.294  -4.360
  846   2HG   GLU 106          2HG       GLU 106 -10.521   9.171  -5.465
  847    H    CYS 107           H        CYS 107  -7.879   8.761  -1.325
  848    HA   CYS 107           HA       CYS 107  -8.614  11.284  -0.100
  849   1HB   CYS 107          1HB       CYS 107  -8.021   8.805   1.466
  850   2HB   CYS 107          2HB       CYS 107  -7.477  10.357   2.092
  851    HG   CYS 107           HG       CYS 107  -9.826  11.345   2.746
  852    H    GLY 108           H        GLY 108  -6.579  12.089   1.225
  853   1HA   GLY 108          1HA       GLY 108  -4.346  12.655   1.223
  854   2HA   GLY 108          2HA       GLY 108  -4.025  11.169   0.342
  855    H    ALA 109           H        ALA 109  -2.458  13.000  -0.493
  856    HA   ALA 109           HA       ALA 109  -3.730  14.323  -2.796
  857   1HB   ALA 109          1HB       ALA 109  -1.608  15.128  -0.942
  858   2HB   ALA 109          2HB       ALA 109  -1.260  15.451  -2.641
  859   3HB   ALA 109          3HB       ALA 109  -2.717  16.111  -1.898
  860    HA   PRO 110           HA       PRO 110  -1.506  11.879  -5.682
  861   1HB   PRO 110          1HB       PRO 110  -0.845  13.692  -7.593
  862   2HB   PRO 110          2HB       PRO 110  -2.498  13.114  -7.347
  863   1HG   PRO 110          1HG       PRO 110  -1.218  15.652  -6.407
  864   2HG   PRO 110          2HG       PRO 110  -2.828  15.404  -7.107
  865   1HD   PRO 110          1HD       PRO 110  -2.424  15.677  -4.443
  866   2HD   PRO 110          2HD       PRO 110  -3.719  14.663  -5.114
  867    H    ARG 111           H        ARG 111   0.263  11.563  -4.091
  868    HA   ARG 111           HA       ARG 111   2.571  13.228  -4.143
  869   1HB   ARG 111          1HB       ARG 111   1.855  10.591  -2.967
  870   2HB   ARG 111          2HB       ARG 111   3.565  10.950  -3.163
  871   1HG   ARG 111          1HG       ARG 111   1.592  12.669  -1.674
  872   2HG   ARG 111          2HG       ARG 111   2.728  11.537  -0.936
  873   1HD   ARG 111          1HD       ARG 111   3.333  14.060  -2.457
  874   2HD   ARG 111          2HD       ARG 111   3.721  13.680  -0.779
  875    HE   ARG 111           HE       ARG 111   5.059  11.784  -2.169
  876   1HH1  ARG 111          1HH1      ARG 111   4.921  15.257  -2.378
  877   2HH1  ARG 111          2HH1      ARG 111   6.544  15.417  -2.962
  878   1HH2  ARG 111          1HH2      ARG 111   7.198  11.982  -2.937
  879   2HH2  ARG 111          2HH2      ARG 111   7.838  13.553  -3.281
  880    H    SER 112           H        SER 112   4.029  13.376  -5.702
  881    HA   SER 112           HA       SER 112   4.230  11.221  -7.677
  882   1HB   SER 112          1HB       SER 112   5.654  13.831  -7.996
  883   2HB   SER 112          2HB       SER 112   4.928  12.793  -9.223
  884    HG   SER 112           HG       SER 112   3.670  14.647  -8.918
  885    H    GLN 113           H        GLN 113   6.674  11.420  -8.689
  886    HA   GLN 113           HA       GLN 113   8.340  10.397  -6.546
  887   1HB   GLN 113          1HB       GLN 113   8.061   9.853  -9.297
  888   2HB   GLN 113          2HB       GLN 113   9.677  10.516  -9.093
  889   1HG   GLN 113          1HG       GLN 113   9.993   8.836  -7.235
  890   2HG   GLN 113          2HG       GLN 113   8.494   8.088  -7.784
  891   1HE2  GLN 113          1HE2      GLN 113  10.775   6.631  -7.762
  892   2HE2  GLN 113          2HE2      GLN 113  11.314   6.335  -9.376
  893    H    GLY 114           H        GLY 114  10.858  10.962  -7.152
  894   1HA   GLY 114          1HA       GLY 114  10.978  13.903  -6.921
  895   2HA   GLY 114          2HA       GLY 114  12.097  12.800  -6.135
  896    H    GLN 115           H        GLN 115  13.514  14.499  -7.292
  897    HA   GLN 115           HA       GLN 115  13.862  14.169 -10.118
  898   1HB   GLN 115          1HB       GLN 115  15.151  15.748  -7.962
  899   2HB   GLN 115          2HB       GLN 115  16.131  15.403  -9.381
  900   1HG   GLN 115          1HG       GLN 115  13.492  16.315 -10.116
  901   2HG   GLN 115          2HG       GLN 115  14.312  17.469  -9.066
  902   1HE2  GLN 115          1HE2      GLN 115  15.981  18.643  -9.847
  903   2HE2  GLN 115          2HE2      GLN 115  16.546  18.560 -11.478
  904    H    ARG 116           H        ARG 116  15.998  13.554 -11.054
  905    HA   ARG 116           HA       ARG 116  16.881  11.054  -9.831
  906   1HB   ARG 116          1HB       ARG 116  17.332  12.217 -12.584
  907   2HB   ARG 116          2HB       ARG 116  17.996  10.682 -12.041
  908   1HG   ARG 116          1HG       ARG 116  16.132   9.655 -12.634
  909   2HG   ARG 116          2HG       ARG 116  15.208  10.664 -11.520
  910   1HD   ARG 116          1HD       ARG 116  14.172  11.374 -13.382
  911   2HD   ARG 116          2HD       ARG 116  15.603  12.387 -13.575
  912    HE   ARG 116           HE       ARG 116  16.222  11.110 -15.372
  913   1HH1  ARG 116          1HH1      ARG 116  13.766   9.429 -13.566
  914   2HH1  ARG 116          2HH1      ARG 116  13.565   8.181 -14.750
  915   1HH2  ARG 116          1HH2      ARG 116  15.966   9.473 -16.940
  916   2HH2  ARG 116          2HH2      ARG 116  14.817   8.207 -16.669
  Start of MODEL    7
    1    HA   PRO   2           HA       PRO   2  34.367   3.656  19.558
    2   1HB   PRO   2          1HB       PRO   2  33.527   1.149  20.173
    3   2HB   PRO   2          2HB       PRO   2  34.963   1.885  20.895
    4   1HG   PRO   2          1HG       PRO   2  32.199   1.631  22.016
    5   2HG   PRO   2          2HG       PRO   2  33.760   1.376  22.818
    6   1HD   PRO   2          1HD       PRO   2  32.326   3.654  23.112
    7   2HD   PRO   2          2HD       PRO   2  34.101   3.631  23.149
    8    H    SER   3           H        SER   3  33.265   1.754  18.150
    9    HA   SER   3           HA       SER   3  30.415   2.299  17.792
   10   1HB   SER   3          1HB       SER   3  32.137   2.311  15.343
   11   2HB   SER   3          2HB       SER   3  30.560   3.056  15.607
   12    HG   SER   3           HG       SER   3  32.136   4.654  15.573
   13    H    LYS   4           H        LYS   4  29.432   0.794  16.172
   14    HA   LYS   4           HA       LYS   4  30.899  -1.737  15.931
   15   1HB   LYS   4          1HB       LYS   4  28.083  -1.437  16.988
   16   2HB   LYS   4          2HB       LYS   4  28.842  -2.970  16.582
   17   1HG   LYS   4          1HG       LYS   4  30.104  -1.123  18.567
   18   2HG   LYS   4          2HG       LYS   4  28.795  -2.209  19.040
   19   1HD   LYS   4          1HD       LYS   4  30.229  -4.041  17.904
   20   2HD   LYS   4          2HD       LYS   4  31.546  -2.876  18.056
   21   1HE   LYS   4          1HE       LYS   4  30.475  -2.794  20.550
   22   2HE   LYS   4          2HE       LYS   4  30.184  -4.476  20.110
   23   1HZ   LYS   4          1HZ       LYS   4  32.617  -3.215  20.850
   24   2HZ   LYS   4          2HZ       LYS   4  32.769  -3.942  19.331
   25   3HZ   LYS   4          3HZ       LYS   4  32.281  -4.863  20.664
   26    H    LYS   5           H        LYS   5  30.100  -3.152  14.275
   27    HA   LYS   5           HA       LYS   5  28.282  -1.898  12.338
   28   1HB   LYS   5          1HB       LYS   5  30.951  -3.163  11.692
   29   2HB   LYS   5          2HB       LYS   5  29.763  -2.660  10.496
   30   1HG   LYS   5          1HG       LYS   5  31.016  -0.794  10.457
   31   2HG   LYS   5          2HG       LYS   5  30.029  -0.364  11.856
   32   1HD   LYS   5          1HD       LYS   5  31.820  -1.471  13.276
   33   2HD   LYS   5          2HD       LYS   5  32.819  -1.493  11.820
   34   1HE   LYS   5          1HE       LYS   5  31.838   1.103  11.957
   35   2HE   LYS   5          2HE       LYS   5  32.220   0.690  13.628
   36   1HZ   LYS   5          1HZ       LYS   5  34.115   0.307  11.379
   37   2HZ   LYS   5          2HZ       LYS   5  34.447   0.195  13.033
   38   3HZ   LYS   5          3HZ       LYS   5  34.083   1.697  12.344
   39    H    ASN   6           H        ASN   6  27.831  -3.599  10.506
   40    HA   ASN   6           HA       ASN   6  27.929  -6.350  11.173
   41   1HB   ASN   6          1HB       ASN   6  26.291  -5.928  12.838
   42   2HB   ASN   6          2HB       ASN   6  25.377  -4.861  11.776
   43   1HD2  ASN   6          1HD2      ASN   6  23.545  -5.732  11.174
   44   2HD2  ASN   6          2HD2      ASN   6  23.275  -7.398  10.805
   45    H    GLY   7           H        GLY   7  25.294  -4.438   9.731
   46   1HA   GLY   7          1HA       GLY   7  25.606  -4.122   7.207
   47   2HA   GLY   7          2HA       GLY   7  25.785  -5.870   7.203
   48    H    ARG   8           H        ARG   8  23.975  -5.849   5.711
   49    HA   ARG   8           HA       ARG   8  21.523  -6.417   7.017
   50   1HB   ARG   8          1HB       ARG   8  21.938  -3.693   6.103
   51   2HB   ARG   8          2HB       ARG   8  20.564  -4.441   5.299
   52   1HG   ARG   8          1HG       ARG   8  20.217  -5.141   7.943
   53   2HG   ARG   8          2HG       ARG   8  20.836  -3.490   8.024
   54   1HD   ARG   8          1HD       ARG   8  19.091  -2.738   6.512
   55   2HD   ARG   8          2HD       ARG   8  18.500  -4.390   6.342
   56    HE   ARG   8           HE       ARG   8  18.496  -3.670   9.062
   57   1HH1  ARG   8          1HH1      ARG   8  16.827  -2.980   6.086
   58   2HH1  ARG   8          2HH1      ARG   8  15.333  -2.576   6.865
   59   1HH2  ARG   8          1HH2      ARG   8  16.535  -3.140  10.100
   60   2HH2  ARG   8          2HH2      ARG   8  15.169  -2.666   9.148
   61    H    SER   9           H        SER   9  22.483  -5.078   3.850
   62    HA   SER   9           HA       SER   9  22.288  -5.888   1.733
   63   1HB   SER   9          1HB       SER   9  22.020  -8.679   2.810
   64   2HB   SER   9          2HB       SER   9  22.846  -8.124   1.354
   65    HG   SER   9           HG       SER   9  23.794  -8.390   3.887
   66    H    GLY  10           H        GLY  10  20.853  -7.737   0.469
   67   1HA   GLY  10          1HA       GLY  10  18.739  -8.318  -0.219
   68   2HA   GLY  10          2HA       GLY  10  18.256  -8.229   1.468
   69    HA   PRO  11           HA       PRO  11  16.050  -4.883  -0.871
   70   1HB   PRO  11          1HB       PRO  11  13.610  -5.423   0.188
   71   2HB   PRO  11          2HB       PRO  11  14.232  -6.235  -1.253
   72   1HG   PRO  11          1HG       PRO  11  14.180  -7.187   1.585
   73   2HG   PRO  11          2HG       PRO  11  13.804  -8.078   0.099
   74   1HD   PRO  11          1HD       PRO  11  16.181  -8.310   1.374
   75   2HD   PRO  11          2HD       PRO  11  16.025  -8.452  -0.389
   76    H    GLN  12           H        GLN  12  15.538  -2.888  -0.070
   77    HA   GLN  12           HA       GLN  12  15.747  -2.566   2.847
   78   1HB   GLN  12          1HB       GLN  12  16.684  -0.954   0.539
   79   2HB   GLN  12          2HB       GLN  12  16.121  -0.063   1.947
   80   1HG   GLN  12          1HG       GLN  12  18.178  -0.295   2.743
   81   2HG   GLN  12          2HG       GLN  12  17.756  -1.981   3.041
   82   1HE2  GLN  12          1HE2      GLN  12  19.264  -3.311   2.371
   83   2HE2  GLN  12          2HE2      GLN  12  20.246  -3.123   0.963
   84    HA   PRO  13           HA       PRO  13  11.685  -0.948   3.186
   85   1HB   PRO  13          1HB       PRO  13  12.005   1.077   4.965
   86   2HB   PRO  13          2HB       PRO  13  12.100  -0.627   5.423
   87   1HG   PRO  13          1HG       PRO  13  14.313   1.311   4.869
   88   2HG   PRO  13          2HG       PRO  13  14.178   0.108   6.164
   89   1HD   PRO  13          1HD       PRO  13  15.663  -0.308   3.939
   90   2HD   PRO  13          2HD       PRO  13  14.836  -1.625   4.794
   91    H    HIS  14           H        HIS  14  10.371   0.457   2.151
   92    HA   HIS  14           HA       HIS  14  11.563   2.934   1.092
   93   1HB   HIS  14          1HB       HIS  14   9.513   1.251  -0.355
   94   2HB   HIS  14          2HB       HIS  14  10.384   2.647  -0.981
   95    HD1  HIS  14           1HD      HIS  14  10.418  -0.899  -1.142
   96    HD2  HIS  14           2HD      HIS  14  13.355   2.034  -0.979
   97    HE1  HIS  14           1HE      HIS  14  12.512  -1.997  -1.998
   98    H    LYS  15           H        LYS  15   9.630   4.347   0.164
   99    HA   LYS  15           HA       LYS  15   7.730   4.612   2.388
  100   1HB   LYS  15          1HB       LYS  15   7.411   6.943   1.445
  101   2HB   LYS  15          2HB       LYS  15   8.995   6.601   2.131
  102   1HG   LYS  15          1HG       LYS  15   8.959   5.968  -0.673
  103   2HG   LYS  15          2HG       LYS  15   8.420   7.627  -0.400
  104   1HD   LYS  15          1HD       LYS  15  10.543   7.523   1.266
  105   2HD   LYS  15          2HD       LYS  15  11.069   6.398   0.011
  106   1HE   LYS  15          1HE       LYS  15  10.305   8.277  -1.616
  107   2HE   LYS  15          2HE       LYS  15  10.436   9.315  -0.197
  108   1HZ   LYS  15          1HZ       LYS  15  12.745   8.553   0.052
  109   2HZ   LYS  15          2HZ       LYS  15  12.487   9.352  -1.416
  110   3HZ   LYS  15          3HZ       LYS  15  12.602   7.665  -1.381
  111    H    ARG  16           H        ARG  16   7.594   2.885  -0.142
  112    HA   ARG  16           HA       ARG  16   4.832   3.606  -0.790
  113   1HB   ARG  16          1HB       ARG  16   6.969   3.002  -2.841
  114   2HB   ARG  16          2HB       ARG  16   5.250   3.121  -3.192
  115   1HG   ARG  16          1HG       ARG  16   5.567   5.277  -3.584
  116   2HG   ARG  16          2HG       ARG  16   5.868   5.482  -1.857
  117   1HD   ARG  16          1HD       ARG  16   8.260   4.981  -2.262
  118   2HD   ARG  16          2HD       ARG  16   7.920   4.907  -3.991
  119    HE   ARG  16           HE       ARG  16   7.067   7.371  -2.834
  120   1HH1  ARG  16          1HH1      ARG  16   9.845   5.646  -4.029
  121   2HH1  ARG  16          2HH1      ARG  16  10.725   7.083  -4.434
  122   1HH2  ARG  16          1HH2      ARG  16   8.215   9.269  -3.363
  123   2HH2  ARG  16          2HH2      ARG  16   9.797   9.143  -4.054
  124    H    TRP  17           H        TRP  17   3.524   1.905  -0.648
  125    HA   TRP  17           HA       TRP  17   4.463  -0.755  -1.333
  126   1HB   TRP  17          1HB       TRP  17   3.602   0.009   1.457
  127   2HB   TRP  17          2HB       TRP  17   3.565  -1.654   0.877
  128    HD1  TRP  17           HD       TRP  17   5.943   1.036   2.091
  129    HE1  TRP  17           1HE      TRP  17   8.296   0.028   2.352
  130    HE3  TRP  17           3HE      TRP  17   5.136  -3.493  -0.138
  131    HZ2  TRP  17           2HZ      TRP  17   9.634  -2.370   1.698
  132    HZ3  TRP  17           3HZ      TRP  17   7.005  -5.087  -0.280
  133    HH2  TRP  17           HH       TRP  17   9.207  -4.535   0.619
  134    H    VAL  18           H        VAL  18   2.870  -2.006  -2.147
  135    HA   VAL  18           HA       VAL  18   0.140  -0.904  -2.066
  136    HB   VAL  18           HB       VAL  18  -0.290  -2.077  -4.153
  137   1HG1  VAL  18          1HG1      VAL  18   2.199  -0.379  -4.153
  138   2HG1  VAL  18          2HG1      VAL  18   1.326  -0.843  -5.615
  139   3HG1  VAL  18          3HG1      VAL  18   0.534   0.149  -4.392
  140   1HG2  VAL  18          1HG2      VAL  18   2.411  -2.800  -4.849
  141   2HG2  VAL  18          2HG2      VAL  18   1.889  -3.655  -3.397
  142   3HG2  VAL  18          3HG2      VAL  18   0.945  -3.779  -4.881
  143    H    PHE  19           H        PHE  19  -1.630  -2.493  -2.148
  144    HA   PHE  19           HA       PHE  19  -0.955  -5.090  -0.965
  145   1HB   PHE  19          1HB       PHE  19  -2.848  -4.831   0.637
  146   2HB   PHE  19          2HB       PHE  19  -1.530  -3.700   0.926
  147    HD1  PHE  19           1HD      PHE  19  -1.774  -1.330   0.106
  148    HD2  PHE  19           2HD      PHE  19  -5.024  -4.074   0.240
  149    HE1  PHE  19           1HE      PHE  19  -3.360   0.549   0.000
  150    HE2  PHE  19           2HE      PHE  19  -6.615  -2.201   0.133
  151    HZ   PHE  19           HZ       PHE  19  -5.784   0.114   0.012
  152    H    THR  20           H        THR  20  -2.382  -6.757  -1.430
  153    HA   THR  20           HA       THR  20  -4.756  -6.181  -3.018
  154    HB   THR  20           HB       THR  20  -4.048  -7.945  -4.709
  155    HG1  THR  20           1HG      THR  20  -1.501  -7.360  -3.566
  156   1HG2  THR  20          1HG2      THR  20  -2.134  -5.739  -5.072
  157   2HG2  THR  20          2HG2      THR  20  -3.793  -5.242  -4.740
  158   3HG2  THR  20          3HG2      THR  20  -3.444  -6.287  -6.117
  159    H    LEU  21           H        LEU  21  -6.371  -7.506  -2.482
  160    HA   LEU  21           HA       LEU  21  -5.757 -10.173  -1.435
  161   1HB   LEU  21          1HB       LEU  21  -6.041  -8.627   0.472
  162   2HB   LEU  21          2HB       LEU  21  -7.657  -8.239  -0.115
  163    HG   LEU  21           HG       LEU  21  -7.726 -10.983   0.124
  164   1HD1  LEU  21          1HD1      LEU  21  -6.924 -11.355   2.464
  165   2HD1  LEU  21          2HD1      LEU  21  -6.068  -9.818   2.350
  166   3HD1  LEU  21          3HD1      LEU  21  -5.645 -11.145   1.268
  167   1HD2  LEU  21          1HD2      LEU  21  -9.265  -8.986   0.880
  168   2HD2  LEU  21          2HD2      LEU  21  -8.506  -9.288   2.443
  169   3HD2  LEU  21          3HD2      LEU  21  -9.398 -10.576   1.632
  170    H    ASN  22           H        ASN  22  -7.165 -11.732  -2.047
  171    HA   ASN  22           HA       ASN  22  -9.169 -11.007  -4.007
  172   1HB   ASN  22          1HB       ASN  22  -9.359 -13.406  -4.411
  173   2HB   ASN  22          2HB       ASN  22  -7.664 -12.928  -4.397
  174   1HD2  ASN  22          1HD2      ASN  22 -10.096 -14.834  -2.933
  175   2HD2  ASN  22          2HD2      ASN  22  -9.098 -15.606  -1.753
  176    H    ASN  23           H        ASN  23 -11.328 -11.044  -3.743
  177    HA   ASN  23           HA       ASN  23 -13.326 -10.965  -2.648
  178   1HB   ASN  23          1HB       ASN  23 -13.176 -13.378  -2.958
  179   2HB   ASN  23          2HB       ASN  23 -12.236 -13.534  -1.478
  180   1HD2  ASN  23          1HD2      ASN  23 -15.137 -11.641  -2.200
  181   2HD2  ASN  23          2HD2      ASN  23 -16.126 -12.371  -0.985
  182    HA   PRO  24           HA       PRO  24 -11.300  -9.249   1.201
  183   1HB   PRO  24          1HB       PRO  24 -12.069  -6.681   0.773
  184   2HB   PRO  24          2HB       PRO  24 -10.569  -7.355   0.125
  185   1HG   PRO  24          1HG       PRO  24 -13.206  -6.950  -1.233
  186   2HG   PRO  24          2HG       PRO  24 -11.572  -6.631  -1.844
  187   1HD   PRO  24          1HD       PRO  24 -12.974  -8.847  -2.519
  188   2HD   PRO  24          2HD       PRO  24 -11.204  -8.843  -2.377
  189    H    SER  25           H        SER  25 -12.379  -8.997   3.088
  190    HA   SER  25           HA       SER  25 -15.289  -9.142   2.991
  191   1HB   SER  25          1HB       SER  25 -13.199  -9.982   4.868
  192   2HB   SER  25          2HB       SER  25 -14.596  -9.249   5.656
  193    HG   SER  25           HG       SER  25 -15.100 -11.370   5.443
  194    H    GLU  26           H        GLU  26 -16.602  -7.822   4.421
  195    HA   GLU  26           HA       GLU  26 -16.132  -5.087   4.133
  196   1HB   GLU  26          1HB       GLU  26 -18.069  -4.741   5.504
  197   2HB   GLU  26          2HB       GLU  26 -18.358  -6.161   4.509
  198   1HG   GLU  26          1HG       GLU  26 -17.732  -7.583   6.431
  199   2HG   GLU  26          2HG       GLU  26 -17.579  -6.129   7.415
  200    H    ASP  27           H        ASP  27 -15.240  -7.301   6.672
  201    HA   ASP  27           HA       ASP  27 -14.617  -5.324   8.630
  202   1HB   ASP  27          1HB       ASP  27 -14.426  -8.231   8.378
  203   2HB   ASP  27          2HB       ASP  27 -13.081  -7.528   9.272
  204    H    GLU  28           H        GLU  28 -12.638  -7.249   6.387
  205    HA   GLU  28           HA       GLU  28 -10.166  -6.109   7.128
  206   1HB   GLU  28          1HB       GLU  28 -11.119  -8.011   5.208
  207   2HB   GLU  28          2HB       GLU  28 -10.040  -6.880   4.403
  208   1HG   GLU  28          1HG       GLU  28  -8.532  -8.430   5.092
  209   2HG   GLU  28          2HG       GLU  28  -8.519  -7.363   6.495
  210    H    ARG  29           H        ARG  29 -12.378  -5.384   4.439
  211    HA   ARG  29           HA       ARG  29 -10.865  -3.339   3.274
  212   1HB   ARG  29          1HB       ARG  29 -13.714  -4.178   3.198
  213   2HB   ARG  29          2HB       ARG  29 -13.347  -2.552   2.639
  214   1HG   ARG  29          1HG       ARG  29 -12.071  -3.308   0.863
  215   2HG   ARG  29          2HG       ARG  29 -11.795  -4.886   1.604
  216   1HD   ARG  29          1HD       ARG  29 -13.335  -5.267  -0.136
  217   2HD   ARG  29          2HD       ARG  29 -14.287  -5.280   1.348
  218    HE   ARG  29           HE       ARG  29 -14.200  -2.699   0.123
  219   1HH1  ARG  29          1HH1      ARG  29 -15.762  -5.809   0.047
  220   2HH1  ARG  29          2HH1      ARG  29 -17.223  -5.203  -0.659
  221   1HH2  ARG  29          1HH2      ARG  29 -16.119  -1.889  -0.808
  222   2HH2  ARG  29          2HH2      ARG  29 -17.425  -2.974  -1.146
  223    H    LYS  30           H        LYS  30 -13.131  -3.309   5.955
  224    HA   LYS  30           HA       LYS  30 -13.336  -0.480   6.166
  225   1HB   LYS  30          1HB       LYS  30 -14.100  -2.819   7.834
  226   2HB   LYS  30          2HB       LYS  30 -13.955  -1.268   8.651
  227   1HG   LYS  30          1HG       LYS  30 -15.537  -0.307   7.005
  228   2HG   LYS  30          2HG       LYS  30 -15.747  -1.921   6.322
  229   1HD   LYS  30          1HD       LYS  30 -16.341  -2.615   8.739
  230   2HD   LYS  30          2HD       LYS  30 -16.567  -0.886   9.015
  231   1HE   LYS  30          1HE       LYS  30 -17.960  -2.524   6.898
  232   2HE   LYS  30          2HE       LYS  30 -18.669  -2.019   8.431
  233   1HZ   LYS  30          1HZ       LYS  30 -19.396  -0.311   7.187
  234   2HZ   LYS  30          2HZ       LYS  30 -18.186  -0.481   6.018
  235   3HZ   LYS  30          3HZ       LYS  30 -17.852   0.321   7.469
  236    H    LYS  31           H        LYS  31 -11.183  -2.893   7.540
  237    HA   LYS  31           HA       LYS  31  -9.958  -1.279   9.490
  238   1HB   LYS  31          1HB       LYS  31  -9.649  -3.650   9.579
  239   2HB   LYS  31          2HB       LYS  31  -8.965  -3.683   7.959
  240   1HG   LYS  31          1HG       LYS  31  -7.433  -1.924   9.621
  241   2HG   LYS  31          2HG       LYS  31  -7.603  -3.499  10.399
  242   1HD   LYS  31          1HD       LYS  31  -7.012  -3.654   7.539
  243   2HD   LYS  31          2HD       LYS  31  -5.749  -2.860   8.483
  244   1HE   LYS  31          1HE       LYS  31  -5.459  -5.326   8.246
  245   2HE   LYS  31          2HE       LYS  31  -5.528  -4.761   9.914
  246   1HZ   LYS  31          1HZ       LYS  31  -6.950  -6.805   9.023
  247   2HZ   LYS  31          2HZ       LYS  31  -8.055  -5.562   8.714
  248   3HZ   LYS  31          3HZ       LYS  31  -7.475  -5.807  10.285
  249    H    ILE  32           H        ILE  32  -8.953  -2.034   6.158
  250    HA   ILE  32           HA       ILE  32  -6.699  -0.304   6.203
  251    HB   ILE  32           HB       ILE  32  -8.146  -1.162   3.708
  252   1HG1  ILE  32          1HG1      ILE  32  -6.239  -2.765   5.421
  253   2HG1  ILE  32          2HG1      ILE  32  -7.911  -3.163   5.041
  254   1HG2  ILE  32          1HG2      ILE  32  -5.975   0.422   4.019
  255   2HG2  ILE  32          2HG2      ILE  32  -5.212  -1.160   3.870
  256   3HG2  ILE  32          3HG2      ILE  32  -6.281  -0.573   2.596
  257   1HD1  ILE  32          1HD1      ILE  32  -6.769  -2.935   2.563
  258   2HD1  ILE  32          2HD1      ILE  32  -5.481  -3.656   3.528
  259   3HD1  ILE  32          3HD1      ILE  32  -7.058  -4.439   3.436
  260    H    ARG  33           H        ARG  33 -10.054   0.072   5.211
  261    HA   ARG  33           HA       ARG  33  -9.687   2.631   3.995
  262   1HB   ARG  33          1HB       ARG  33 -11.557   1.224   3.346
  263   2HB   ARG  33          2HB       ARG  33 -12.177   1.238   4.991
  264   1HG   ARG  33          1HG       ARG  33 -12.864   3.460   4.842
  265   2HG   ARG  33          2HG       ARG  33 -11.842   3.777   3.439
  266   1HD   ARG  33          1HD       ARG  33 -13.879   3.589   2.417
  267   2HD   ARG  33          2HD       ARG  33 -13.342   1.911   2.346
  268    HE   ARG  33           HE       ARG  33 -14.732   2.171   4.714
  269   1HH1  ARG  33          1HH1      ARG  33 -15.395   2.556   1.318
  270   2HH1  ARG  33          2HH1      ARG  33 -17.066   2.123   1.462
  271   1HH2  ARG  33          1HH2      ARG  33 -16.931   1.600   4.917
  272   2HH2  ARG  33          2HH2      ARG  33 -17.939   1.581   3.510
  273    H    ASP  34           H        ASP  34 -10.047   1.524   7.221
  274    HA   ASP  34           HA       ASP  34 -10.773   4.198   8.180
  275   1HB   ASP  34          1HB       ASP  34 -10.710   1.501   9.537
  276   2HB   ASP  34          2HB       ASP  34 -10.973   3.008  10.411
  277    H    LEU  35           H        LEU  35  -8.052   2.844   7.267
  278    HA   LEU  35           HA       LEU  35  -6.325   3.024   9.494
  279   1HB   LEU  35          1HB       LEU  35  -5.963   2.976   6.534
  280   2HB   LEU  35          2HB       LEU  35  -4.593   3.398   7.559
  281    HG   LEU  35           HG       LEU  35  -6.150   0.820   7.749
  282   1HD1  LEU  35          1HD1      LEU  35  -4.223  -0.219   6.691
  283   2HD1  LEU  35          2HD1      LEU  35  -3.457   1.358   6.503
  284   3HD1  LEU  35          3HD1      LEU  35  -4.943   0.989   5.627
  285   1HD2  LEU  35          1HD2      LEU  35  -4.305   0.094   9.165
  286   2HD2  LEU  35          2HD2      LEU  35  -5.096   1.517   9.844
  287   3HD2  LEU  35          3HD2      LEU  35  -3.548   1.680   9.012
  288    HA   PRO  36           HA       PRO  36  -5.531   7.313   9.974
  289   1HB   PRO  36          1HB       PRO  36  -2.858   7.365  10.446
  290   2HB   PRO  36          2HB       PRO  36  -4.030   6.755  11.621
  291   1HG   PRO  36          1HG       PRO  36  -2.297   5.236   9.709
  292   2HG   PRO  36          2HG       PRO  36  -2.657   4.890  11.411
  293   1HD   PRO  36          1HD       PRO  36  -3.890   3.606   9.371
  294   2HD   PRO  36          2HD       PRO  36  -4.697   3.938  10.917
  295    H    ILE  37           H        ILE  37  -5.661   8.707   8.333
  296    HA   ILE  37           HA       ILE  37  -4.310   8.374   5.860
  297    HB   ILE  37           HB       ILE  37  -5.116  10.725   5.403
  298   1HG1  ILE  37          1HG1      ILE  37  -6.522  10.371   8.056
  299   2HG1  ILE  37          2HG1      ILE  37  -5.124  11.413   7.812
  300   1HG2  ILE  37          1HG2      ILE  37  -6.942   9.747   4.596
  301   2HG2  ILE  37          2HG2      ILE  37  -6.478   8.302   5.492
  302   3HG2  ILE  37          3HG2      ILE  37  -7.584   9.470   6.215
  303   1HD1  ILE  37          1HD1      ILE  37  -6.796  12.294   5.865
  304   2HD1  ILE  37          2HD1      ILE  37  -7.933  11.840   7.136
  305   3HD1  ILE  37          3HD1      ILE  37  -6.651  13.003   7.473
  306    H    SER  38           H        SER  38  -3.644  10.222   8.763
  307    HA   SER  38           HA       SER  38  -1.625  11.883   7.679
  308   1HB   SER  38          1HB       SER  38  -2.260  11.010  10.497
  309   2HB   SER  38          2HB       SER  38  -0.930  12.106  10.126
  310    HG   SER  38           HG       SER  38  -3.062  13.062  10.659
  311    H    LEU  39           H        LEU  39  -1.677   8.587   8.668
  312    HA   LEU  39           HA       LEU  39   1.108   8.289   9.188
  313   1HB   LEU  39          1HB       LEU  39  -1.056   6.757   9.653
  314   2HB   LEU  39          2HB       LEU  39  -0.421   5.959   8.215
  315    HG   LEU  39           HG       LEU  39   1.513   6.482  10.390
  316   1HD1  LEU  39          1HD1      LEU  39  -0.503   5.777  11.620
  317   2HD1  LEU  39          2HD1      LEU  39   0.797   4.589  11.705
  318   3HD1  LEU  39          3HD1      LEU  39  -0.574   4.320  10.628
  319   1HD2  LEU  39          1HD2      LEU  39   1.265   4.854   8.068
  320   2HD2  LEU  39          2HD2      LEU  39   1.464   3.806   9.473
  321   3HD2  LEU  39          3HD2      LEU  39   2.657   5.060   9.131
  322    H    PHE  40           H        PHE  40  -0.872   8.216   6.327
  323    HA   PHE  40           HA       PHE  40   1.538   7.650   4.729
  324   1HB   PHE  40          1HB       PHE  40  -1.235   6.970   3.783
  325   2HB   PHE  40          2HB       PHE  40   0.308   6.361   3.194
  326    HD1  PHE  40           2HD      PHE  40  -2.200   6.121   5.859
  327    HD2  PHE  40           1HD      PHE  40   1.413   4.531   4.268
  328    HE1  PHE  40           2HE      PHE  40  -2.425   4.155   7.322
  329    HE2  PHE  40           1HE      PHE  40   1.194   2.563   5.728
  330    HZ   PHE  40           HZ       PHE  40  -0.726   2.373   7.258
  331    H    ASP  41           H        ASP  41   2.151   9.399   3.662
  332    HA   ASP  41           HA       ASP  41   0.751  11.764   3.407
  333   1HB   ASP  41          1HB       ASP  41   3.238  10.727   2.503
  334   2HB   ASP  41          2HB       ASP  41   2.449  11.485   1.122
  335    H    TYR  42           H        TYR  42   0.565   8.886   1.469
  336    HA   TYR  42           HA       TYR  42  -1.627  10.092  -0.049
  337   1HB   TYR  42          1HB       TYR  42   0.310  10.298  -1.509
  338   2HB   TYR  42          2HB       TYR  42   0.688   8.593  -1.293
  339    HD1  TYR  42           1HD      TYR  42  -2.734   9.887  -1.752
  340    HD2  TYR  42           2HD      TYR  42   0.593   7.988  -3.604
  341    HE1  TYR  42           1HE      TYR  42  -4.138   9.335  -3.694
  342    HE2  TYR  42           2HE      TYR  42  -0.802   7.432  -5.552
  343    HH   TYR  42           HH       TYR  42  -3.877   8.798  -6.062
  344    H    PHE  43           H        PHE  43  -3.360   8.832   0.007
  345    HA   PHE  43           HA       PHE  43  -3.002   5.924   0.225
  346   1HB   PHE  43          1HB       PHE  43  -3.712   7.359   2.388
  347   2HB   PHE  43          2HB       PHE  43  -5.302   7.107   1.677
  348    HD1  PHE  43           1HD      PHE  43  -4.280   4.349   0.451
  349    HD2  PHE  43           2HD      PHE  43  -4.414   6.058   4.347
  350    HE1  PHE  43           1HE      PHE  43  -4.361   2.094   1.434
  351    HE2  PHE  43           2HE      PHE  43  -4.494   3.807   5.335
  352    HZ   PHE  43           HZ       PHE  43  -4.467   1.821   3.879
  353    H    ILE  44           H        ILE  44  -3.904   5.027  -1.497
  354    HA   ILE  44           HA       ILE  44  -6.532   5.986  -2.381
  355    HB   ILE  44           HB       ILE  44  -5.076   7.019  -3.955
  356   1HG1  ILE  44          1HG1      ILE  44  -5.637   4.713  -5.673
  357   2HG1  ILE  44          2HG1      ILE  44  -7.010   5.192  -4.682
  358   1HG2  ILE  44          1HG2      ILE  44  -3.080   5.663  -3.429
  359   2HG2  ILE  44          2HG2      ILE  44  -3.758   4.341  -4.378
  360   3HG2  ILE  44          3HG2      ILE  44  -3.334   5.861  -5.163
  361   1HD1  ILE  44          1HD1      ILE  44  -7.329   7.101  -5.821
  362   2HD1  ILE  44          2HD1      ILE  44  -5.603   7.378  -6.056
  363   3HD1  ILE  44          3HD1      ILE  44  -6.462   6.236  -7.089
  364    H    VAL  45           H        VAL  45  -7.899   4.343  -2.279
  365    HA   VAL  45           HA       VAL  45  -6.912   1.642  -2.931
  366    HB   VAL  45           HB       VAL  45  -9.210   2.155  -1.060
  367   1HG1  VAL  45          1HG1      VAL  45  -7.428  -0.200  -1.641
  368   2HG1  VAL  45          2HG1      VAL  45  -8.515  -0.129  -0.253
  369   3HG1  VAL  45          3HG1      VAL  45  -9.168  -0.067  -1.890
  370   1HG2  VAL  45          1HG2      VAL  45  -6.334   2.454  -0.557
  371   2HG2  VAL  45          2HG2      VAL  45  -7.715   3.082   0.342
  372   3HG2  VAL  45          3HG2      VAL  45  -7.183   1.419   0.591
  373    H    GLY  46           H        GLY  46  -8.178   0.352  -4.225
  374   1HA   GLY  46          1HA       GLY  46 -10.723   1.490  -5.178
  375   2HA   GLY  46          2HA       GLY  46  -9.498   0.992  -6.336
  376    H    GLU  47           H        GLU  47 -12.249   0.018  -5.931
  377    HA   GLU  47           HA       GLU  47 -11.725  -2.761  -5.133
  378   1HB   GLU  47          1HB       GLU  47 -13.630  -1.419  -4.087
  379   2HB   GLU  47          2HB       GLU  47 -14.430  -1.535  -5.649
  380   1HG   GLU  47          1HG       GLU  47 -15.202  -3.232  -4.056
  381   2HG   GLU  47          2HG       GLU  47 -14.478  -3.936  -5.501
  382    H    GLU  48           H        GLU  48 -11.829  -4.392  -6.566
  383    HA   GLU  48           HA       GLU  48 -12.744  -3.759  -9.294
  384   1HB   GLU  48          1HB       GLU  48 -10.190  -4.085  -8.833
  385   2HB   GLU  48          2HB       GLU  48 -10.605  -5.792  -8.775
  386   1HG   GLU  48          1HG       GLU  48 -11.318  -4.026 -11.095
  387   2HG   GLU  48          2HG       GLU  48  -9.794  -4.905 -10.990
  388    H    GLY  49           H        GLY  49 -14.642  -4.770  -9.518
  389   1HA   GLY  49          1HA       GLY  49 -14.867  -7.529  -9.746
  390   2HA   GLY  49          2HA       GLY  49 -15.371  -7.125  -8.112
  391    H    ASN  50           H        ASN  50 -15.910  -5.974 -11.445
  392    HA   ASN  50           HA       ASN  50 -18.748  -5.610 -10.744
  393   1HB   ASN  50          1HB       ASN  50 -16.997  -3.737 -11.753
  394   2HB   ASN  50          2HB       ASN  50 -17.830  -4.300 -13.199
  395   1HD2  ASN  50          1HD2      ASN  50 -18.818  -3.717  -9.840
  396   2HD2  ASN  50          2HD2      ASN  50 -20.143  -2.680 -10.232
  397    H    GLU  51           H        GLU  51 -17.635  -8.126 -11.524
  398    HA   GLU  51           HA       GLU  51 -19.123  -8.538 -14.026
  399   1HB   GLU  51          1HB       GLU  51 -16.521  -8.584 -14.188
  400   2HB   GLU  51          2HB       GLU  51 -16.673 -10.155 -13.414
  401   1HG   GLU  51          1HG       GLU  51 -18.073 -10.944 -15.229
  402   2HG   GLU  51          2HG       GLU  51 -18.000  -9.358 -15.995
  403    H    GLU  52           H        GLU  52 -20.814  -9.773 -13.573
  404    HA   GLU  52           HA       GLU  52 -21.234 -11.226 -11.256
  405   1HB   GLU  52          1HB       GLU  52 -23.066 -10.633 -12.719
  406   2HB   GLU  52          2HB       GLU  52 -22.412 -11.633 -14.008
  407   1HG   GLU  52          1HG       GLU  52 -23.189 -13.553 -13.108
  408   2HG   GLU  52          2HG       GLU  52 -22.982 -12.990 -11.450
  409    H    GLY  53           H        GLY  53 -21.088 -13.404 -10.702
  410   1HA   GLY  53          1HA       GLY  53 -20.498 -15.660 -11.025
  411   2HA   GLY  53          2HA       GLY  53 -19.754 -15.224 -12.556
  412    H    ARG  54           H        ARG  54 -18.413 -12.925 -11.032
  413    HA   ARG  54           HA       ARG  54 -16.270 -14.559  -9.840
  414   1HB   ARG  54          1HB       ARG  54 -15.607 -13.512 -11.967
  415   2HB   ARG  54          2HB       ARG  54 -16.017 -11.932 -11.314
  416   1HG   ARG  54          1HG       ARG  54 -13.669 -12.146 -11.174
  417   2HG   ARG  54          2HG       ARG  54 -14.293 -12.334  -9.533
  418   1HD   ARG  54          1HD       ARG  54 -13.403 -14.364  -9.366
  419   2HD   ARG  54          2HD       ARG  54 -14.188 -14.881 -10.858
  420    HE   ARG  54           HE       ARG  54 -12.095 -13.446 -11.760
  421   1HH1  ARG  54          1HH1      ARG  54 -12.364 -16.025  -9.437
  422   2HH1  ARG  54          2HH1      ARG  54 -10.777 -16.647  -9.749
  423   1HH2  ARG  54          1HH2      ARG  54 -10.004 -14.256 -12.180
  424   2HH2  ARG  54          2HH2      ARG  54  -9.435 -15.639 -11.309
  425    H    THR  55           H        THR  55 -15.270 -13.822  -7.971
  426    HA   THR  55           HA       THR  55 -16.905 -12.117  -6.312
  427    HB   THR  55           HB       THR  55 -14.635 -12.639  -4.840
  428    HG1  THR  55           1HG      THR  55 -15.184 -15.080  -6.133
  429   1HG2  THR  55          1HG2      THR  55 -17.378 -13.515  -4.964
  430   2HG2  THR  55          2HG2      THR  55 -16.336 -13.299  -3.558
  431   3HG2  THR  55          3HG2      THR  55 -16.331 -14.830  -4.432
  432    HA   PRO  56           HA       PRO  56 -14.684  -8.346  -6.637
  433   1HB   PRO  56          1HB       PRO  56 -14.721  -7.436  -4.079
  434   2HB   PRO  56          2HB       PRO  56 -16.156  -7.462  -5.111
  435   1HG   PRO  56          1HG       PRO  56 -15.316  -9.395  -2.985
  436   2HG   PRO  56          2HG       PRO  56 -16.924  -8.725  -3.315
  437   1HD   PRO  56          1HD       PRO  56 -16.187 -11.205  -4.114
  438   2HD   PRO  56          2HD       PRO  56 -17.323 -10.203  -5.038
  439    H    HIS  57           H        HIS  57 -12.732  -7.221  -6.068
  440    HA   HIS  57           HA       HIS  57 -10.802  -8.717  -4.453
  441   1HB   HIS  57          1HB       HIS  57 -10.368  -9.489  -6.700
  442   2HB   HIS  57          2HB       HIS  57 -10.352  -7.836  -7.310
  443    HD1  HIS  57           1HD      HIS  57  -8.235  -6.415  -6.827
  444    HD2  HIS  57           2HD      HIS  57  -8.010 -10.339  -5.480
  445    HE1  HIS  57           1HE      HIS  57  -5.810  -6.802  -6.285
  446    H    LEU  58           H        LEU  58  -9.387  -7.460  -3.338
  447    HA   LEU  58           HA       LEU  58  -9.818  -4.573  -3.497
  448   1HB   LEU  58          1HB       LEU  58  -9.619  -6.305  -1.371
  449   2HB   LEU  58          2HB       LEU  58  -8.027  -5.550  -1.411
  450    HG   LEU  58           HG       LEU  58 -10.696  -4.202  -1.044
  451   1HD1  LEU  58          1HD1      LEU  58  -9.536  -3.399   1.039
  452   2HD1  LEU  58          2HD1      LEU  58  -8.261  -4.565   0.684
  453   3HD1  LEU  58          3HD1      LEU  58  -9.906  -5.122   0.990
  454   1HD2  LEU  58          1HD2      LEU  58  -7.982  -2.936  -1.403
  455   2HD2  LEU  58          2HD2      LEU  58  -9.467  -2.092  -0.963
  456   3HD2  LEU  58          3HD2      LEU  58  -9.323  -2.856  -2.547
  457    H    GLN  59           H        GLN  59  -8.324  -3.182  -4.213
  458    HA   GLN  59           HA       GLN  59  -5.521  -3.910  -4.296
  459   1HB   GLN  59          1HB       GLN  59  -6.083  -4.830  -6.391
  460   2HB   GLN  59          2HB       GLN  59  -7.182  -3.510  -6.771
  461   1HG   GLN  59          1HG       GLN  59  -5.153  -3.371  -8.093
  462   2HG   GLN  59          2HG       GLN  59  -5.299  -1.990  -7.007
  463   1HE2  GLN  59          1HE2      GLN  59  -3.198  -4.176  -8.218
  464   2HE2  GLN  59          2HE2      GLN  59  -2.004  -4.167  -6.969
  465    H    GLY  60           H        GLY  60  -4.615  -2.202  -3.358
  466   1HA   GLY  60          1HA       GLY  60  -5.150   0.450  -4.461
  467   2HA   GLY  60          2HA       GLY  60  -5.470   0.224  -2.748
  468    H    PHE  61           H        PHE  61  -3.683   2.120  -3.488
  469    HA   PHE  61           HA       PHE  61  -1.113   0.919  -2.696
  470   1HB   PHE  61          1HB       PHE  61  -0.774   1.553  -4.948
  471   2HB   PHE  61          2HB       PHE  61  -1.663   3.059  -4.743
  472    HD1  PHE  61           2HD      PHE  61   1.223   1.429  -3.019
  473    HD2  PHE  61           1HD      PHE  61  -0.330   4.906  -4.921
  474    HE1  PHE  61           2HE      PHE  61   3.335   2.611  -2.577
  475    HE2  PHE  61           1HE      PHE  61   1.781   6.093  -4.483
  476    HZ   PHE  61           HZ       PHE  61   3.616   4.945  -3.308
  477    H    ALA  62           H        ALA  62   0.043   1.955  -1.127
  478    HA   ALA  62           HA       ALA  62  -1.005   4.497  -0.097
  479   1HB   ALA  62          1HB       ALA  62  -1.866   3.450   1.668
  480   2HB   ALA  62          2HB       ALA  62  -1.088   1.927   1.235
  481   3HB   ALA  62          3HB       ALA  62  -0.208   3.131   2.177
  482    H    ASN  63           H        ASN  63   0.549   5.955   0.184
  483    HA   ASN  63           HA       ASN  63   3.331   5.100   0.027
  484   1HB   ASN  63          1HB       ASN  63   2.523   6.950  -1.416
  485   2HB   ASN  63          2HB       ASN  63   2.172   7.896   0.028
  486   1HD2  ASN  63          1HD2      ASN  63   4.220   7.810  -2.363
  487   2HD2  ASN  63          2HD2      ASN  63   5.692   8.272  -1.585
  488    H    PHE  64           H        PHE  64   4.360   4.650   1.852
  489    HA   PHE  64           HA       PHE  64   3.450   5.498   4.410
  490   1HB   PHE  64          1HB       PHE  64   5.467   3.710   3.351
  491   2HB   PHE  64          2HB       PHE  64   6.104   4.652   4.695
  492    HD1  PHE  64           2HD      PHE  64   4.666   4.713   6.842
  493    HD2  PHE  64           1HD      PHE  64   4.219   1.810   3.760
  494    HE1  PHE  64           2HE      PHE  64   3.545   3.204   8.429
  495    HE2  PHE  64           1HE      PHE  64   3.097   0.298   5.343
  496    HZ   PHE  64           HZ       PHE  64   2.759   0.993   7.682
  497    H    VAL  65           H        VAL  65   3.887   7.296   5.502
  498    HA   VAL  65           HA       VAL  65   5.289   9.451   4.386
  499    HB   VAL  65           HB       VAL  65   4.533   8.960   7.269
  500   1HG1  VAL  65          1HG1      VAL  65   4.638  11.571   7.221
  501   2HG1  VAL  65          2HG1      VAL  65   6.107  10.628   7.479
  502   3HG1  VAL  65          3HG1      VAL  65   5.759  11.303   5.887
  503   1HG2  VAL  65          1HG2      VAL  65   3.157  10.753   5.289
  504   2HG2  VAL  65          2HG2      VAL  65   2.717   9.057   5.483
  505   3HG2  VAL  65          3HG2      VAL  65   2.561  10.169   6.843
  506    H    LYS  66           H        LYS  66   6.380   6.741   6.202
  507    HA   LYS  66           HA       LYS  66   9.074   7.925   6.319
  508   1HB   LYS  66          1HB       LYS  66   7.567   6.400   8.408
  509   2HB   LYS  66          2HB       LYS  66   9.319   6.270   8.343
  510   1HG   LYS  66          1HG       LYS  66   9.080   7.988   9.825
  511   2HG   LYS  66          2HG       LYS  66   9.200   8.889   8.313
  512   1HD   LYS  66          1HD       LYS  66   7.374   9.861   9.390
  513   2HD   LYS  66          2HD       LYS  66   6.633   8.730   8.256
  514   1HE   LYS  66          1HE       LYS  66   5.502   7.949  10.017
  515   2HE   LYS  66          2HE       LYS  66   7.018   7.190  10.501
  516   1HZ   LYS  66          1HZ       LYS  66   5.671   9.518  11.607
  517   2HZ   LYS  66          2HZ       LYS  66   7.358   9.612  11.517
  518   3HZ   LYS  66          3HZ       LYS  66   6.626   8.352  12.376
  519    H    LYS  67           H        LYS  67  10.625   5.884   6.945
  520    HA   LYS  67           HA       LYS  67  10.383   4.138   4.637
  521   1HB   LYS  67          1HB       LYS  67  12.590   4.356   6.693
  522   2HB   LYS  67          2HB       LYS  67  12.664   3.431   5.199
  523   1HG   LYS  67          1HG       LYS  67  11.969   6.232   4.789
  524   2HG   LYS  67          2HG       LYS  67  13.549   5.997   5.539
  525   1HD   LYS  67          1HD       LYS  67  14.357   4.763   3.730
  526   2HD   LYS  67          2HD       LYS  67  12.735   4.420   3.121
  527   1HE   LYS  67          1HE       LYS  67  12.496   6.868   2.648
  528   2HE   LYS  67          2HE       LYS  67  14.199   7.054   3.061
  529   1HZ   LYS  67          1HZ       LYS  67  14.570   5.258   1.300
  530   2HZ   LYS  67          2HZ       LYS  67  14.201   6.820   0.768
  531   3HZ   LYS  67          3HZ       LYS  67  13.005   5.624   0.772
  532    H    GLN  68           H        GLN  68   9.405   2.237   4.761
  533    HA   GLN  68           HA       GLN  68   9.572   0.727   7.281
  534   1HB   GLN  68          1HB       GLN  68   7.155   0.847   5.472
  535   2HB   GLN  68          2HB       GLN  68   7.287  -0.041   6.984
  536   1HG   GLN  68          1HG       GLN  68   7.104   2.914   6.551
  537   2HG   GLN  68          2HG       GLN  68   6.077   1.869   7.531
  538   1HE2  GLN  68          1HE2      GLN  68   7.901   0.473   8.987
  539   2HE2  GLN  68          2HE2      GLN  68   8.773   1.543  10.026
  540    H    THR  69           H        THR  69   9.493  -1.568   7.076
  541    HA   THR  69           HA       THR  69  10.601  -2.488   4.533
  542    HB   THR  69           HB       THR  69  11.451  -4.378   5.679
  543    HG1  THR  69           1HG      THR  69  10.760  -4.953   7.749
  544   1HG2  THR  69          1HG2      THR  69  12.706  -2.369   6.173
  545   2HG2  THR  69          2HG2      THR  69  12.662  -3.396   7.607
  546   3HG2  THR  69          3HG2      THR  69  11.618  -1.979   7.504
  547    H    PHE  70           H        PHE  70   9.987  -4.832   3.963
  548    HA   PHE  70           HA       PHE  70   7.265  -4.891   3.275
  549   1HB   PHE  70          1HB       PHE  70   8.625  -6.127   1.844
  550   2HB   PHE  70          2HB       PHE  70   9.492  -6.895   3.170
  551    HD1  PHE  70           1HD      PHE  70   6.264  -6.830   1.367
  552    HD2  PHE  70           2HD      PHE  70   8.812  -8.973   4.018
  553    HE1  PHE  70           1HE      PHE  70   4.807  -8.803   1.166
  554    HE2  PHE  70           2HE      PHE  70   7.360 -10.950   3.821
  555    HZ   PHE  70           HZ       PHE  70   5.355 -10.867   2.394
  556    H    ASN  71           H        ASN  71   9.050  -6.916   5.606
  557    HA   ASN  71           HA       ASN  71   6.774  -8.228   6.624
  558   1HB   ASN  71          1HB       ASN  71   9.559  -8.327   7.041
  559   2HB   ASN  71          2HB       ASN  71   8.846  -7.998   8.617
  560   1HD2  ASN  71          1HD2      ASN  71  10.153 -10.400   7.382
  561   2HD2  ASN  71          2HD2      ASN  71   9.039 -11.690   7.665
  562    H    LYS  72           H        LYS  72   8.424  -5.263   7.560
  563    HA   LYS  72           HA       LYS  72   7.036  -4.843   9.988
  564   1HB   LYS  72          1HB       LYS  72   9.075  -3.652   9.617
  565   2HB   LYS  72          2HB       LYS  72   8.471  -2.958   8.118
  566   1HG   LYS  72          1HG       LYS  72   8.515  -1.340   9.961
  567   2HG   LYS  72          2HG       LYS  72   6.886  -1.605   9.336
  568   1HD   LYS  72          1HD       LYS  72   6.448  -3.158  11.195
  569   2HD   LYS  72          2HD       LYS  72   8.063  -2.833  11.830
  570   1HE   LYS  72          1HE       LYS  72   6.152  -0.587  11.323
  571   2HE   LYS  72          2HE       LYS  72   6.024  -1.548  12.795
  572   1HZ   LYS  72          1HZ       LYS  72   8.211   0.224  11.927
  573   2HZ   LYS  72          2HZ       LYS  72   8.524  -1.036  13.011
  574   3HZ   LYS  72          3HZ       LYS  72   7.409   0.171  13.415
  575    H    VAL  73           H        VAL  73   6.518  -3.551   6.713
  576    HA   VAL  73           HA       VAL  73   4.320  -1.942   7.234
  577    HB   VAL  73           HB       VAL  73   5.064  -3.500   4.765
  578   1HG1  VAL  73          1HG1      VAL  73   3.416  -1.918   3.626
  579   2HG1  VAL  73          2HG1      VAL  73   2.740  -3.280   4.523
  580   3HG1  VAL  73          3HG1      VAL  73   2.733  -1.665   5.232
  581   1HG2  VAL  73          1HG2      VAL  73   5.021  -0.567   4.750
  582   2HG2  VAL  73          2HG2      VAL  73   6.193  -1.279   5.859
  583   3HG2  VAL  73          3HG2      VAL  73   6.240  -1.688   4.144
  584    H    LYS  74           H        LYS  74   4.545  -5.396   7.048
  585    HA   LYS  74           HA       LYS  74   1.836  -6.001   6.551
  586   1HB   LYS  74          1HB       LYS  74   4.045  -7.534   7.916
  587   2HB   LYS  74          2HB       LYS  74   2.435  -8.205   7.686
  588   1HG   LYS  74          1HG       LYS  74   3.654  -7.094   5.262
  589   2HG   LYS  74          2HG       LYS  74   4.493  -8.488   5.947
  590   1HD   LYS  74          1HD       LYS  74   2.151  -9.561   6.065
  591   2HD   LYS  74          2HD       LYS  74   1.675  -8.290   4.936
  592   1HE   LYS  74          1HE       LYS  74   3.906  -9.167   3.724
  593   2HE   LYS  74          2HE       LYS  74   3.403 -10.653   4.528
  594   1HZ   LYS  74          1HZ       LYS  74   2.524 -10.040   2.159
  595   2HZ   LYS  74          2HZ       LYS  74   1.397  -9.129   3.031
  596   3HZ   LYS  74          3HZ       LYS  74   1.513 -10.797   3.285
  597    H    TRP  75           H        TRP  75   3.308  -4.573   9.220
  598    HA   TRP  75           HA       TRP  75   1.708  -5.632  11.313
  599   1HB   TRP  75          1HB       TRP  75   2.673  -3.991  12.691
  600   2HB   TRP  75          2HB       TRP  75   3.918  -4.329  11.492
  601    HD1  TRP  75           HD       TRP  75   2.861  -2.488   9.133
  602    HE1  TRP  75           1HE      TRP  75   3.007   0.072   9.356
  603    HE3  TRP  75           3HE      TRP  75   3.177  -2.134  14.223
  604    HZ2  TRP  75           2HZ      TRP  75   3.227   1.988  11.418
  605    HZ3  TRP  75           3HZ      TRP  75   3.352   0.099  15.242
  606    HH2  TRP  75           HH       TRP  75   3.377   2.116  13.866
  607    H    TYR  76           H        TYR  76   1.108  -3.365   8.820
  608    HA   TYR  76           HA       TYR  76  -1.331  -2.444  10.193
  609   1HB   TYR  76          1HB       TYR  76   0.648  -1.066   8.536
  610   2HB   TYR  76          2HB       TYR  76  -1.009  -0.775   8.018
  611    HD1  TYR  76           2HD      TYR  76  -2.398  -0.842  10.653
  612    HD2  TYR  76           1HD      TYR  76   1.268   0.978   9.494
  613    HE1  TYR  76           2HE      TYR  76  -2.667   0.824  12.442
  614    HE2  TYR  76           1HE      TYR  76   1.010   2.649  11.280
  615    HH   TYR  76           HH       TYR  76  -1.435   2.368  13.720
  616    H    LEU  77           H        LEU  77  -0.059  -3.296   6.978
  617    HA   LEU  77           HA       LEU  77  -2.614  -3.515   5.763
  618   1HB   LEU  77          1HB       LEU  77   0.102  -4.552   4.986
  619   2HB   LEU  77          2HB       LEU  77  -1.332  -4.766   3.984
  620    HG   LEU  77           HG       LEU  77  -0.240  -2.076   4.799
  621   1HD1  LEU  77          1HD1      LEU  77   0.043  -3.201   2.053
  622   2HD1  LEU  77          2HD1      LEU  77   1.214  -3.642   3.295
  623   3HD1  LEU  77          3HD1      LEU  77   0.985  -1.948   2.861
  624   1HD2  LEU  77          1HD2      LEU  77  -1.678  -1.238   3.036
  625   2HD2  LEU  77          2HD2      LEU  77  -2.627  -2.144   4.215
  626   3HD2  LEU  77          3HD2      LEU  77  -2.215  -2.876   2.664
  627    H    GLY  78           H        GLY  78  -0.475  -5.796   7.376
  628   1HA   GLY  78          1HA       GLY  78  -1.192  -7.752   8.467
  629   2HA   GLY  78          2HA       GLY  78  -2.696  -7.680   7.559
  630    H    ALA  79           H        ALA  79  -0.961  -9.965   7.978
  631    HA   ALA  79           HA       ALA  79   0.477 -10.464   5.551
  632   1HB   ALA  79          1HB       ALA  79  -0.352 -12.270   7.814
  633   2HB   ALA  79          2HB       ALA  79   0.623 -12.797   6.442
  634   3HB   ALA  79          3HB       ALA  79   1.235 -11.553   7.533
  635    H    ARG  80           H        ARG  80  -2.780 -10.930   6.647
  636    HA   ARG  80           HA       ARG  80  -3.680 -12.990   5.047
  637   1HB   ARG  80          1HB       ARG  80  -5.144 -10.448   5.781
  638   2HB   ARG  80          2HB       ARG  80  -5.902 -11.913   5.169
  639   1HG   ARG  80          1HG       ARG  80  -4.288 -11.825   7.704
  640   2HG   ARG  80          2HG       ARG  80  -6.034 -11.578   7.648
  641   1HD   ARG  80          1HD       ARG  80  -4.982 -13.981   6.281
  642   2HD   ARG  80          2HD       ARG  80  -4.898 -13.973   8.042
  643    HE   ARG  80           HE       ARG  80  -7.258 -14.200   6.421
  644   1HH1  ARG  80          1HH1      ARG  80  -6.003 -13.239   9.523
  645   2HH1  ARG  80          2HH1      ARG  80  -7.511 -13.463  10.348
  646   1HH2  ARG  80          1HH2      ARG  80  -9.247 -14.498   7.495
  647   2HH2  ARG  80          2HH2      ARG  80  -9.355 -14.180   9.193
  648    H    CYS  81           H        CYS  81  -3.065  -9.635   4.200
  649    HA   CYS  81           HA       CYS  81  -3.901 -10.179   1.438
  650   1HB   CYS  81          1HB       CYS  81  -4.034  -7.802   1.121
  651   2HB   CYS  81          2HB       CYS  81  -4.867  -8.191   2.622
  652    HG   CYS  81           HG       CYS  81  -1.620  -7.320   2.898
  653    H    HIS  82           H        HIS  82  -2.507  -9.991  -0.265
  654    HA   HIS  82           HA       HIS  82   0.296 -10.216   0.338
  655   1HB   HIS  82          1HB       HIS  82  -0.950 -11.502  -1.473
  656   2HB   HIS  82          2HB       HIS  82  -0.939 -10.009  -2.408
  657    HD1  HIS  82           1HD      HIS  82   1.509 -12.439  -0.829
  658    HD2  HIS  82           2HD      HIS  82   1.324  -9.610  -3.866
  659    HE1  HIS  82           1HE      HIS  82   3.697 -12.624  -2.054
  660    H    ILE  83           H        ILE  83   1.764  -8.645   0.336
  661    HA   ILE  83           HA       ILE  83   1.019  -6.051  -0.848
  662    HB   ILE  83           HB       ILE  83   2.523  -4.989   0.756
  663   1HG1  ILE  83          1HG1      ILE  83   2.846  -7.726   2.000
  664   2HG1  ILE  83          2HG1      ILE  83   4.058  -6.965   0.975
  665   1HG2  ILE  83          1HG2      ILE  83   1.237  -5.580   2.856
  666   2HG2  ILE  83          2HG2      ILE  83   0.274  -5.093   1.461
  667   3HG2  ILE  83          3HG2      ILE  83   0.407  -6.799   1.888
  668   1HD1  ILE  83          1HD1      ILE  83   4.599  -6.697   3.322
  669   2HD1  ILE  83          2HD1      ILE  83   4.256  -5.135   2.578
  670   3HD1  ILE  83          3HD1      ILE  83   3.048  -5.907   3.604
  671    H    GLU  84           H        GLU  84   2.562  -4.891  -2.017
  672    HA   GLU  84           HA       GLU  84   5.157  -6.103  -2.515
  673   1HB   GLU  84          1HB       GLU  84   2.999  -6.581  -4.257
  674   2HB   GLU  84          2HB       GLU  84   4.008  -5.386  -5.060
  675   1HG   GLU  84          1HG       GLU  84   5.887  -6.810  -5.036
  676   2HG   GLU  84          2HG       GLU  84   5.118  -7.926  -3.909
  677    H    LYS  85           H        LYS  85   6.526  -4.696  -3.914
  678    HA   LYS  85           HA       LYS  85   6.285  -1.970  -3.045
  679   1HB   LYS  85          1HB       LYS  85   8.422  -1.640  -4.214
  680   2HB   LYS  85          2HB       LYS  85   8.474  -3.041  -3.151
  681   1HG   LYS  85          1HG       LYS  85   8.019  -4.468  -5.156
  682   2HG   LYS  85          2HG       LYS  85   8.226  -3.023  -6.149
  683   1HD   LYS  85          1HD       LYS  85  10.428  -3.178  -4.366
  684   2HD   LYS  85          2HD       LYS  85  10.218  -4.768  -5.103
  685   1HE   LYS  85          1HE       LYS  85  10.451  -3.902  -7.279
  686   2HE   LYS  85          2HE       LYS  85  10.228  -2.242  -6.730
  687   1HZ   LYS  85          1HZ       LYS  85  12.376  -2.898  -5.339
  688   2HZ   LYS  85          2HZ       LYS  85  12.464  -2.239  -6.894
  689   3HZ   LYS  85          3HZ       LYS  85  12.612  -3.910  -6.674
  690    H    ALA  86           H        ALA  86   5.572  -0.245  -4.150
  691    HA   ALA  86           HA       ALA  86   4.344  -0.700  -6.743
  692   1HB   ALA  86          1HB       ALA  86   2.862   0.769  -5.997
  693   2HB   ALA  86          2HB       ALA  86   3.817   0.989  -4.530
  694   3HB   ALA  86          3HB       ALA  86   4.110   2.014  -5.935
  695    H    LYS  87           H        LYS  87   4.671   0.782  -8.534
  696    HA   LYS  87           HA       LYS  87   7.153   2.306  -8.537
  697   1HB   LYS  87          1HB       LYS  87   8.140   1.178 -10.377
  698   2HB   LYS  87          2HB       LYS  87   7.678  -0.072  -9.229
  699   1HG   LYS  87          1HG       LYS  87   5.459   0.141 -10.839
  700   2HG   LYS  87          2HG       LYS  87   6.801   0.368 -11.963
  701   1HD   LYS  87          1HD       LYS  87   7.829  -1.705 -11.102
  702   2HD   LYS  87          2HD       LYS  87   6.429  -1.940 -10.054
  703   1HE   LYS  87          1HE       LYS  87   5.139  -2.679 -11.741
  704   2HE   LYS  87          2HE       LYS  87   5.777  -1.491 -12.878
  705   1HZ   LYS  87          1HZ       LYS  87   7.116  -4.015 -12.065
  706   2HZ   LYS  87          2HZ       LYS  87   7.756  -2.869 -13.131
  707   3HZ   LYS  87          3HZ       LYS  87   6.359  -3.726 -13.550
  708    H    GLY  88           H        GLY  88   7.185   3.971 -10.016
  709   1HA   GLY  88          1HA       GLY  88   6.307   4.820 -12.181
  710   2HA   GLY  88          2HA       GLY  88   4.728   4.279 -11.632
  711    H    THR  89           H        THR  89   4.628   6.736 -12.373
  712    HA   THR  89           HA       THR  89   5.378   8.594 -10.290
  713    HB   THR  89           HB       THR  89   4.523  10.323 -11.685
  714    HG1  THR  89           1HG      THR  89   2.973  10.005 -13.134
  715   1HG2  THR  89          1HG2      THR  89   5.539   8.368 -13.720
  716   2HG2  THR  89          2HG2      THR  89   6.595   8.967 -12.441
  717   3HG2  THR  89          3HG2      THR  89   5.861  10.096 -13.579
  718    H    ASP  90           H        ASP  90   3.584  10.243  -9.661
  719    HA   ASP  90           HA       ASP  90   1.773   8.980  -7.979
  720   1HB   ASP  90          1HB       ASP  90   0.798  11.145  -7.601
  721   2HB   ASP  90          2HB       ASP  90   2.534  11.362  -7.811
  722    H    GLN  91           H        GLN  91   1.321  10.207 -11.259
  723    HA   GLN  91           HA       GLN  91  -1.478   9.736 -11.358
  724   1HB   GLN  91          1HB       GLN  91   0.538   9.998 -13.595
  725   2HB   GLN  91          2HB       GLN  91  -1.208  10.013 -13.805
  726   1HG   GLN  91          1HG       GLN  91   0.160  11.984 -12.015
  727   2HG   GLN  91          2HG       GLN  91   0.034  12.249 -13.753
  728   1HE2  GLN  91          1HE2      GLN  91  -1.731  11.935 -10.763
  729   2HE2  GLN  91          2HE2      GLN  91  -3.203  12.642 -11.327
  730    H    GLN  92           H        GLN  92   1.354   7.814 -12.155
  731    HA   GLN  92           HA       GLN  92   0.044   5.740 -13.534
  732   1HB   GLN  92          1HB       GLN  92   2.684   6.200 -12.362
  733   2HB   GLN  92          2HB       GLN  92   2.184   4.515 -12.302
  734   1HG   GLN  92          1HG       GLN  92   1.535   5.242 -14.863
  735   2HG   GLN  92          2HG       GLN  92   3.020   6.143 -14.564
  736   1HE2  GLN  92          1HE2      GLN  92   4.935   5.061 -14.341
  737   2HE2  GLN  92          2HE2      GLN  92   5.111   3.371 -14.653
  738    H    ASN  93           H        ASN  93   0.752   6.219 -10.105
  739    HA   ASN  93           HA       ASN  93  -0.308   3.671  -9.323
  740   1HB   ASN  93          1HB       ASN  93   0.613   6.113  -7.829
  741   2HB   ASN  93          2HB       ASN  93  -0.194   4.791  -6.990
  742   1HD2  ASN  93          1HD2      ASN  93   2.100   4.735  -9.680
  743   2HD2  ASN  93          2HD2      ASN  93   3.299   3.795  -8.866
  744    H    LYS  94           H        LYS  94  -1.444   7.029  -9.160
  745    HA   LYS  94           HA       LYS  94  -3.884   6.512  -7.871
  746   1HB   LYS  94          1HB       LYS  94  -2.945   8.762  -8.060
  747   2HB   LYS  94          2HB       LYS  94  -3.165   8.724  -9.804
  748   1HG   LYS  94          1HG       LYS  94  -5.612   8.516  -9.433
  749   2HG   LYS  94          2HG       LYS  94  -5.322   8.729  -7.705
  750   1HD   LYS  94          1HD       LYS  94  -4.345  10.720  -9.732
  751   2HD   LYS  94          2HD       LYS  94  -5.978  10.798  -9.066
  752   1HE   LYS  94          1HE       LYS  94  -3.771  10.513  -7.121
  753   2HE   LYS  94          2HE       LYS  94  -3.869  12.053  -7.974
  754   1HZ   LYS  94          1HZ       LYS  94  -5.243  12.489  -6.241
  755   2HZ   LYS  94          2HZ       LYS  94  -5.718  10.878  -6.042
  756   3HZ   LYS  94          3HZ       LYS  94  -6.386  11.808  -7.287
  757    H    GLU  95           H        GLU  95  -3.055   6.686 -11.315
  758    HA   GLU  95           HA       GLU  95  -5.693   6.270 -12.261
  759   1HB   GLU  95          1HB       GLU  95  -2.988   5.909 -13.543
  760   2HB   GLU  95          2HB       GLU  95  -4.491   5.616 -14.406
  761   1HG   GLU  95          1HG       GLU  95  -4.373   8.204 -13.052
  762   2HG   GLU  95          2HG       GLU  95  -3.166   7.987 -14.318
  763    H    TYR  96           H        TYR  96  -3.054   4.111 -11.417
  764    HA   TYR  96           HA       TYR  96  -3.987   1.745 -12.546
  765   1HB   TYR  96          1HB       TYR  96  -1.749   2.048 -11.503
  766   2HB   TYR  96          2HB       TYR  96  -2.515   2.034  -9.918
  767    HD1  TYR  96           1HD      TYR  96  -3.783  -0.066  -9.224
  768    HD2  TYR  96           2HD      TYR  96  -1.134   0.043 -12.552
  769    HE1  TYR  96           1HE      TYR  96  -3.604  -2.518  -9.155
  770    HE2  TYR  96           2HE      TYR  96  -0.949  -2.409 -12.492
  771    HH   TYR  96           HH       TYR  96  -2.410  -4.345 -11.638
  772    H    CYS  97           H        CYS  97  -4.461   2.890  -9.200
  773    HA   CYS  97           HA       CYS  97  -6.211   0.854  -8.415
  774   1HB   CYS  97          1HB       CYS  97  -6.116   3.701  -7.397
  775   2HB   CYS  97          2HB       CYS  97  -6.827   2.325  -6.562
  776    HG   CYS  97           HG       CYS  97  -3.522   2.964  -7.105
  777    H    SER  98           H        SER  98  -6.786   3.897 -10.063
  778    HA   SER  98           HA       SER  98  -9.647   3.737  -9.846
  779   1HB   SER  98          1HB       SER  98  -8.254   5.870 -10.114
  780   2HB   SER  98          2HB       SER  98  -8.120   5.435 -11.818
  781    HG   SER  98           HG       SER  98 -10.294   5.660 -12.051
  782    H    LYS  99           H        LYS  99  -7.331   2.242 -11.786
  783    HA   LYS  99           HA       LYS  99  -8.664   2.058 -14.256
  784   1HB   LYS  99          1HB       LYS  99  -6.250   1.452 -13.746
  785   2HB   LYS  99          2HB       LYS  99  -6.861  -0.058 -13.083
  786   1HG   LYS  99          1HG       LYS  99  -7.786  -0.670 -15.229
  787   2HG   LYS  99          2HG       LYS  99  -7.293   0.881 -15.912
  788   1HD   LYS  99          1HD       LYS  99  -5.700  -0.801 -16.565
  789   2HD   LYS  99          2HD       LYS  99  -4.933   0.292 -15.410
  790   1HE   LYS  99          1HE       LYS  99  -4.617  -1.344 -13.917
  791   2HE   LYS  99          2HE       LYS  99  -6.246  -1.978 -14.140
  792   1HZ   LYS  99          1HZ       LYS  99  -3.947  -2.498 -15.946
  793   2HZ   LYS  99          2HZ       LYS  99  -5.503  -3.138 -16.110
  794   3HZ   LYS  99          3HZ       LYS  99  -4.543  -3.579 -14.789
  795    H    GLU 100           H        GLU 100  -9.243   0.546 -11.227
  796    HA   GLU 100           HA       GLU 100 -10.604  -1.765 -12.204
  797   1HB   GLU 100          1HB       GLU 100 -10.815  -0.430  -9.500
  798   2HB   GLU 100          2HB       GLU 100 -11.352  -2.056  -9.896
  799   1HG   GLU 100          1HG       GLU 100  -9.189  -2.870 -10.065
  800   2HG   GLU 100          2HG       GLU 100  -8.497  -1.264 -10.286
  801    H    GLY 101           H        GLY 101 -11.440   1.530 -11.897
  802   1HA   GLY 101          1HA       GLY 101 -13.364   2.560 -12.711
  803   2HA   GLY 101          2HA       GLY 101 -14.109   0.977 -12.879
  804    H    ASN 102           H        ASN 102 -12.938   0.878  -9.874
  805    HA   ASN 102           HA       ASN 102 -15.215   2.273  -8.651
  806   1HB   ASN 102          1HB       ASN 102 -15.126  -0.477  -8.964
  807   2HB   ASN 102          2HB       ASN 102 -14.555  -0.239  -7.315
  808   1HD2  ASN 102          1HD2      ASN 102 -16.388  -1.151  -6.422
  809   2HD2  ASN 102          2HD2      ASN 102 -17.918  -0.347  -6.424
  810    H    LEU 103           H        LEU 103 -14.655   3.481  -6.959
  811    HA   LEU 103           HA       LEU 103 -11.957   3.153  -5.856
  812   1HB   LEU 103          1HB       LEU 103 -13.562   5.405  -6.572
  813   2HB   LEU 103          2HB       LEU 103 -13.186   5.490  -4.852
  814    HG   LEU 103           HG       LEU 103 -11.608   6.733  -6.334
  815   1HD1  LEU 103          1HD1      LEU 103  -9.790   4.791  -5.206
  816   2HD1  LEU 103          2HD1      LEU 103 -11.106   5.170  -4.095
  817   3HD1  LEU 103          3HD1      LEU 103 -10.091   6.463  -4.734
  818   1HD2  LEU 103          1HD2      LEU 103 -10.442   5.765  -7.992
  819   2HD2  LEU 103          2HD2      LEU 103 -11.721   4.552  -7.944
  820   3HD2  LEU 103          3HD2      LEU 103 -10.203   4.268  -7.091
  821    H    LEU 104           H        LEU 104 -11.627   2.532  -3.812
  822    HA   LEU 104           HA       LEU 104 -13.980   2.045  -2.136
  823   1HB   LEU 104          1HB       LEU 104 -12.467   0.162  -2.607
  824   2HB   LEU 104          2HB       LEU 104 -11.150   1.048  -1.841
  825    HG   LEU 104           HG       LEU 104 -12.443   0.978   0.295
  826   1HD1  LEU 104          1HD1      LEU 104 -14.237  -0.746   0.430
  827   2HD1  LEU 104          2HD1      LEU 104 -14.229  -0.821  -1.332
  828   3HD1  LEU 104          3HD1      LEU 104 -14.671   0.679  -0.516
  829   1HD2  LEU 104          1HD2      LEU 104 -11.871  -1.309   0.806
  830   2HD2  LEU 104          2HD2      LEU 104 -10.633  -0.618  -0.243
  831   3HD2  LEU 104          3HD2      LEU 104 -11.839  -1.721  -0.909
  832    H    MET 105           H        MET 105 -11.015   3.871  -2.279
  833    HA   MET 105           HA       MET 105 -11.898   5.565  -0.132
  834   1HB   MET 105          1HB       MET 105 -10.912   4.083   1.363
  835   2HB   MET 105          2HB       MET 105  -9.628   3.647   0.243
  836   1HG   MET 105          1HG       MET 105  -8.312   5.367   0.862
  837   2HG   MET 105          2HG       MET 105  -9.672   6.455   1.130
  838   1HE   MET 105          1HE       MET 105  -7.044   4.406   2.320
  839   2HE   MET 105          2HE       MET 105  -7.165   4.363   4.079
  840   3HE   MET 105          3HE       MET 105  -7.966   3.126   3.109
  841    H    GLU 106           H        GLU 106 -11.104   7.593  -0.343
  842    HA   GLU 106           HA       GLU 106  -8.805   8.002  -2.126
  843   1HB   GLU 106          1HB       GLU 106 -11.277   8.421  -3.056
  844   2HB   GLU 106          2HB       GLU 106 -11.030   9.969  -2.260
  845   1HG   GLU 106          1HG       GLU 106  -8.704   9.698  -3.634
  846   2HG   GLU 106          2HG       GLU 106  -9.846   8.897  -4.712
  847    H    CYS 107           H        CYS 107  -7.320   8.785  -0.763
  848    HA   CYS 107           HA       CYS 107  -7.849  11.309   0.555
  849   1HB   CYS 107          1HB       CYS 107  -7.418   8.754   2.038
  850   2HB   CYS 107          2HB       CYS 107  -6.689  10.222   2.678
  851    HG   CYS 107           HG       CYS 107  -9.911   9.284   2.615
  852    H    GLY 108           H        GLY 108  -5.721  11.931   1.842
  853   1HA   GLY 108          1HA       GLY 108  -3.437  12.279   1.814
  854   2HA   GLY 108          2HA       GLY 108  -3.277  10.872   0.773
  855    H    ALA 109           H        ALA 109  -1.603  12.542  -0.044
  856    HA   ALA 109           HA       ALA 109  -2.862  14.281  -2.060
  857   1HB   ALA 109          1HB       ALA 109  -0.669  14.687  -0.247
  858   2HB   ALA 109          2HB       ALA 109  -0.139  14.906  -1.915
  859   3HB   ALA 109          3HB       ALA 109  -1.492  15.848  -1.289
  860    HA   PRO 110           HA       PRO 110  -1.240  11.928  -5.390
  861   1HB   PRO 110          1HB       PRO 110  -0.488  13.852  -7.151
  862   2HB   PRO 110          2HB       PRO 110  -2.180  13.470  -6.811
  863   1HG   PRO 110          1HG       PRO 110  -0.485  15.690  -5.733
  864   2HG   PRO 110          2HG       PRO 110  -2.165  15.739  -6.299
  865   1HD   PRO 110          1HD       PRO 110  -1.515  15.639  -3.672
  866   2HD   PRO 110          2HD       PRO 110  -2.988  14.890  -4.320
  867    H    ARG 111           H        ARG 111   0.592  11.284  -3.909
  868    HA   ARG 111           HA       ARG 111   3.116  12.621  -4.273
  869   1HB   ARG 111          1HB       ARG 111   2.039  10.783  -2.425
  870   2HB   ARG 111          2HB       ARG 111   3.384   9.962  -3.206
  871   1HG   ARG 111          1HG       ARG 111   4.080  11.116  -1.173
  872   2HG   ARG 111          2HG       ARG 111   4.875  11.779  -2.602
  873   1HD   ARG 111          1HD       ARG 111   2.366  13.116  -1.994
  874   2HD   ARG 111          2HD       ARG 111   3.522  13.211  -0.665
  875    HE   ARG 111           HE       ARG 111   3.684  14.550  -3.188
  876   1HH1  ARG 111          1HH1      ARG 111   5.551  13.216  -0.570
  877   2HH1  ARG 111          2HH1      ARG 111   6.917  14.245  -0.847
  878   1HH2  ARG 111          1HH2      ARG 111   5.477  15.910  -3.563
  879   2HH2  ARG 111          2HH2      ARG 111   6.874  15.777  -2.549
  880    H    SER 112           H        SER 112   4.738  12.102  -5.634
  881    HA   SER 112           HA       SER 112   4.250   9.875  -7.498
  882   1HB   SER 112          1HB       SER 112   4.357  12.290  -8.369
  883   2HB   SER 112          2HB       SER 112   6.086  12.208  -8.028
  884    HG   SER 112           HG       SER 112   5.879  11.551 -10.106
  885    H    GLN 113           H        GLN 113   6.696   9.594  -8.640
  886    HA   GLN 113           HA       GLN 113   8.127   8.166  -6.601
  887   1HB   GLN 113          1HB       GLN 113   7.955   8.111  -9.445
  888   2HB   GLN 113          2HB       GLN 113   9.645   8.318  -9.007
  889   1HG   GLN 113          1HG       GLN 113   9.650   6.322  -7.730
  890   2HG   GLN 113          2HG       GLN 113   7.896   6.177  -7.833
  891   1HE2  GLN 113          1HE2      GLN 113   9.581   4.109  -8.533
  892   2HE2  GLN 113          2HE2      GLN 113   9.478   3.842 -10.237
  893    H    GLY 114           H        GLY 114  10.207   8.547  -5.841
  894   1HA   GLY 114          1HA       GLY 114  10.959  11.325  -5.724
  895   2HA   GLY 114          2HA       GLY 114  11.759   9.991  -4.907
  896    H    GLN 115           H        GLN 115  13.123  12.109  -6.156
  897    HA   GLN 115           HA       GLN 115  14.453  10.662  -8.349
  898   1HB   GLN 115          1HB       GLN 115  13.295  12.488  -9.367
  899   2HB   GLN 115          2HB       GLN 115  13.850  13.609  -8.131
  900   1HG   GLN 115          1HG       GLN 115  15.983  13.729  -9.008
  901   2HG   GLN 115          2HG       GLN 115  15.826  12.197  -9.866
  902   1HE2  GLN 115          1HE2      GLN 115  16.361  15.185 -10.533
  903   2HE2  GLN 115          2HE2      GLN 115  15.396  15.435 -11.944
  904    H    ARG 116           H        ARG 116  16.697  10.804  -8.455
  905    HA   ARG 116           HA       ARG 116  18.283  12.466  -6.826
  906   1HB   ARG 116          1HB       ARG 116  19.176  10.581  -5.345
  907   2HB   ARG 116          2HB       ARG 116  17.615  11.268  -4.919
  908   1HG   ARG 116          1HG       ARG 116  16.519   9.349  -5.306
  909   2HG   ARG 116          2HG       ARG 116  17.498   8.955  -6.721
  910   1HD   ARG 116          1HD       ARG 116  19.249   8.089  -5.374
  911   2HD   ARG 116          2HD       ARG 116  18.532   8.745  -3.903
  912    HE   ARG 116           HE       ARG 116  16.746   6.937  -5.138
  913   1HH1  ARG 116          1HH1      ARG 116  19.709   7.033  -3.313
  914   2HH1  ARG 116          2HH1      ARG 116  19.486   5.460  -2.621
  915   1HH2  ARG 116          1HH2      ARG 116  16.441   4.865  -4.233
  916   2HH2  ARG 116          2HH2      ARG 116  17.628   4.228  -3.146
  Start of MODEL    8
    1    HA   PRO   2           HA       PRO   2  37.131  -3.196  19.754
    2   1HB   PRO   2          1HB       PRO   2  36.356  -4.807  21.797
    3   2HB   PRO   2          2HB       PRO   2  37.998  -4.170  21.646
    4   1HG   PRO   2          1HG       PRO   2  35.735  -3.192  23.345
    5   2HG   PRO   2          2HG       PRO   2  37.448  -3.377  23.762
    6   1HD   PRO   2          1HD       PRO   2  36.357  -0.985  23.117
    7   2HD   PRO   2          2HD       PRO   2  38.042  -1.399  22.739
    8    H    SER   3           H        SER   3  35.231  -2.267  18.558
    9    HA   SER   3           HA       SER   3  33.073  -4.067  18.591
   10   1HB   SER   3          1HB       SER   3  32.166  -3.038  20.501
   11   2HB   SER   3          2HB       SER   3  32.621  -1.423  19.958
   12    HG   SER   3           HG       SER   3  30.592  -3.091  18.885
   13    H    LYS   4           H        LYS   4  32.746  -4.208  16.481
   14    HA   LYS   4           HA       LYS   4  32.605  -1.719  14.909
   15   1HB   LYS   4          1HB       LYS   4  34.531  -3.585  14.594
   16   2HB   LYS   4          2HB       LYS   4  33.308  -4.232  13.509
   17   1HG   LYS   4          1HG       LYS   4  33.226  -1.855  12.528
   18   2HG   LYS   4          2HG       LYS   4  34.765  -1.623  13.361
   19   1HD   LYS   4          1HD       LYS   4  35.731  -3.494  12.159
   20   2HD   LYS   4          2HD       LYS   4  34.181  -3.828  11.383
   21   1HE   LYS   4          1HE       LYS   4  35.165  -2.614   9.726
   22   2HE   LYS   4          2HE       LYS   4  34.431  -1.298  10.639
   23   1HZ   LYS   4          1HZ       LYS   4  36.946  -1.244   9.944
   24   2HZ   LYS   4          2HZ       LYS   4  37.138  -2.133  11.370
   25   3HZ   LYS   4          3HZ       LYS   4  36.432  -0.596  11.420
   26    H    LYS   5           H        LYS   5  30.658  -1.345  14.105
   27    HA   LYS   5           HA       LYS   5  28.782  -3.582  13.818
   28   1HB   LYS   5          1HB       LYS   5  28.484  -0.653  14.293
   29   2HB   LYS   5          2HB       LYS   5  27.191  -1.489  13.443
   30   1HG   LYS   5          1HG       LYS   5  26.537  -2.641  15.280
   31   2HG   LYS   5          2HG       LYS   5  28.169  -2.725  15.946
   32   1HD   LYS   5          1HD       LYS   5  27.926  -0.194  16.322
   33   2HD   LYS   5          2HD       LYS   5  26.200  -0.462  16.066
   34   1HE   LYS   5          1HE       LYS   5  26.399  -0.641  18.366
   35   2HE   LYS   5          2HE       LYS   5  26.478  -2.323  17.847
   36   1HZ   LYS   5          1HZ       LYS   5  28.769  -2.396  18.192
   37   2HZ   LYS   5          2HZ       LYS   5  28.187  -1.540  19.530
   38   3HZ   LYS   5          3HZ       LYS   5  28.923  -0.712  18.252
   39    H    ASN   6           H        ASN   6  28.621  -4.434  11.858
   40    HA   ASN   6           HA       ASN   6  28.317  -2.696   9.552
   41   1HB   ASN   6          1HB       ASN   6  30.789  -4.044  10.115
   42   2HB   ASN   6          2HB       ASN   6  30.071  -4.733   8.662
   43   1HD2  ASN   6          1HD2      ASN   6  29.947  -3.526   6.821
   44   2HD2  ASN   6          2HD2      ASN   6  30.690  -1.975   6.650
   45    H    GLY   7           H        GLY   7  26.431  -3.390   8.779
   46   1HA   GLY   7          1HA       GLY   7  26.131  -6.274   8.273
   47   2HA   GLY   7          2HA       GLY   7  24.848  -5.402   9.099
   48    H    ARG   8           H        ARG   8  24.770  -6.838   6.554
   49    HA   ARG   8           HA       ARG   8  23.911  -4.599   4.846
   50   1HB   ARG   8          1HB       ARG   8  25.408  -7.096   4.071
   51   2HB   ARG   8          2HB       ARG   8  24.501  -6.150   2.898
   52   1HG   ARG   8          1HG       ARG   8  26.150  -4.683   2.702
   53   2HG   ARG   8          2HG       ARG   8  26.235  -4.456   4.450
   54   1HD   ARG   8          1HD       ARG   8  27.556  -6.583   4.568
   55   2HD   ARG   8          2HD       ARG   8  27.604  -6.576   2.806
   56    HE   ARG   8           HE       ARG   8  28.535  -4.110   3.841
   57   1HH1  ARG   8          1HH1      ARG   8  29.461  -7.439   3.415
   58   2HH1  ARG   8          2HH1      ARG   8  31.158  -7.095   3.359
   59   1HH2  ARG   8          1HH2      ARG   8  30.767  -3.645   3.769
   60   2HH2  ARG   8          2HH2      ARG   8  31.900  -4.937   3.562
   61    H    SER   9           H        SER   9  22.382  -5.427   3.070
   62    HA   SER   9           HA       SER   9  20.856  -7.772   3.531
   63   1HB   SER   9          1HB       SER   9  20.035  -6.533   5.470
   64   2HB   SER   9          2HB       SER   9  19.622  -5.160   4.443
   65    HG   SER   9           HG       SER   9  17.902  -6.190   3.729
   66    H    GLY  10           H        GLY  10  19.215  -8.084   1.963
   67   1HA   GLY  10          1HA       GLY  10  19.706  -6.645  -0.484
   68   2HA   GLY  10          2HA       GLY  10  18.609  -8.001  -0.271
   69    HA   PRO  11           HA       PRO  11  15.113  -5.364  -0.291
   70   1HB   PRO  11          1HB       PRO  11  13.568  -6.306   1.733
   71   2HB   PRO  11          2HB       PRO  11  13.809  -7.185   0.219
   72   1HG   PRO  11          1HG       PRO  11  15.151  -7.571   2.867
   73   2HG   PRO  11          2HG       PRO  11  14.531  -8.791   1.738
   74   1HD   PRO  11          1HD       PRO  11  17.159  -8.159   1.901
   75   2HD   PRO  11          2HD       PRO  11  16.390  -8.664   0.382
   76    H    GLN  12           H        GLN  12  14.538  -3.391   0.437
   77    HA   GLN  12           HA       GLN  12  15.232  -2.657   3.197
   78   1HB   GLN  12          1HB       GLN  12  15.803  -0.349   2.191
   79   2HB   GLN  12          2HB       GLN  12  16.986  -1.642   2.044
   80   1HG   GLN  12          1HG       GLN  12  16.596  -1.921  -0.219
   81   2HG   GLN  12          2HG       GLN  12  15.013  -1.150  -0.143
   82   1HE2  GLN  12          1HE2      GLN  12  17.344  -0.624  -1.862
   83   2HE2  GLN  12          2HE2      GLN  12  17.715   1.049  -1.641
   84    HA   PRO  13           HA       PRO  13  11.235  -0.874   3.485
   85   1HB   PRO  13          1HB       PRO  13  11.693   1.271   5.085
   86   2HB   PRO  13          2HB       PRO  13  11.723  -0.394   5.678
   87   1HG   PRO  13          1HG       PRO  13  14.005   1.387   4.917
   88   2HG   PRO  13          2HG       PRO  13  13.851   0.300   6.309
   89   1HD   PRO  13          1HD       PRO  13  15.256  -0.364   4.091
   90   2HD   PRO  13          2HD       PRO  13  14.393  -1.567   5.071
   91    H    HIS  14           H        HIS  14   9.911   0.677   2.587
   92    HA   HIS  14           HA       HIS  14  11.176   2.981   1.286
   93   1HB   HIS  14          1HB       HIS  14   9.292   1.033  -0.058
   94   2HB   HIS  14          2HB       HIS  14   9.789   2.576  -0.746
   95    HD1  HIS  14           1HD      HIS  14  10.972  -0.897  -0.135
   96    HD2  HIS  14           2HD      HIS  14  12.447   2.662  -1.688
   97    HE1  HIS  14           1HE      HIS  14  13.109  -1.511  -1.309
   98    H    LYS  15           H        LYS  15   9.270   4.350   0.240
   99    HA   LYS  15           HA       LYS  15   7.324   4.743   2.405
  100   1HB   LYS  15          1HB       LYS  15   7.049   7.026   1.355
  101   2HB   LYS  15          2HB       LYS  15   8.623   6.704   2.071
  102   1HG   LYS  15          1HG       LYS  15   8.634   5.933  -0.689
  103   2HG   LYS  15          2HG       LYS  15   8.063   7.595  -0.524
  104   1HD   LYS  15          1HD       LYS  15  10.097   7.867   1.065
  105   2HD   LYS  15          2HD       LYS  15  10.694   6.407   0.272
  106   1HE   LYS  15          1HE       LYS  15   9.728   8.263  -1.690
  107   2HE   LYS  15          2HE       LYS  15  10.883   9.066  -0.627
  108   1HZ   LYS  15          1HZ       LYS  15  12.227   8.161  -2.242
  109   2HZ   LYS  15          2HZ       LYS  15  11.299   6.757  -2.404
  110   3HZ   LYS  15          3HZ       LYS  15  12.291   6.963  -1.050
  111    H    ARG  16           H        ARG  16   7.259   2.918  -0.081
  112    HA   ARG  16           HA       ARG  16   4.510   3.615  -0.816
  113   1HB   ARG  16          1HB       ARG  16   6.508   2.687  -2.875
  114   2HB   ARG  16          2HB       ARG  16   4.879   3.291  -3.146
  115   1HG   ARG  16          1HG       ARG  16   5.564   5.512  -2.437
  116   2HG   ARG  16          2HG       ARG  16   7.191   4.916  -2.105
  117   1HD   ARG  16          1HD       ARG  16   5.891   4.729  -4.813
  118   2HD   ARG  16          2HD       ARG  16   6.870   6.106  -4.311
  119    HE   ARG  16           HE       ARG  16   8.262   3.661  -3.924
  120   1HH1  ARG  16          1HH1      ARG  16   7.285   5.936  -6.371
  121   2HH1  ARG  16          2HH1      ARG  16   8.598   5.554  -7.436
  122   1HH2  ARG  16          1HH2      ARG  16   9.994   3.149  -5.317
  123   2HH2  ARG  16          2HH2      ARG  16  10.137   3.967  -6.835
  124    H    TRP  17           H        TRP  17   3.202   1.937  -0.545
  125    HA   TRP  17           HA       TRP  17   4.145  -0.764  -1.088
  126   1HB   TRP  17          1HB       TRP  17   3.191   0.175   1.613
  127   2HB   TRP  17          2HB       TRP  17   3.118  -1.518   1.133
  128    HD1  TRP  17           HD       TRP  17   5.525   1.145   2.319
  129    HE1  TRP  17           1HE      TRP  17   7.839   0.087   2.708
  130    HE3  TRP  17           3HE      TRP  17   4.683  -3.440   0.221
  131    HZ2  TRP  17           2HZ      TRP  17   9.136  -2.366   2.192
  132    HZ3  TRP  17           3HZ      TRP  17   6.513  -5.085   0.209
  133    HH2  TRP  17           HH       TRP  17   8.692  -4.557   1.174
  134    H    VAL  18           H        VAL  18   2.584  -2.054  -1.902
  135    HA   VAL  18           HA       VAL  18  -0.148  -0.953  -1.980
  136    HB   VAL  18           HB       VAL  18  -0.495  -2.156  -4.051
  137   1HG1  VAL  18          1HG1      VAL  18   1.995  -0.476  -3.939
  138   2HG1  VAL  18          2HG1      VAL  18   1.296  -1.038  -5.459
  139   3HG1  VAL  18          3HG1      VAL  18   0.363   0.013  -4.393
  140   1HG2  VAL  18          1HG2      VAL  18   2.120  -2.993  -4.743
  141   2HG2  VAL  18          2HG2      VAL  18   1.742  -3.678  -3.162
  142   3HG2  VAL  18          3HG2      VAL  18   0.675  -3.982  -4.532
  143    H    PHE  19           H        PHE  19  -1.913  -2.321  -1.661
  144    HA   PHE  19           HA       PHE  19  -1.270  -4.950  -0.495
  145   1HB   PHE  19          1HB       PHE  19  -3.276  -4.598   0.981
  146   2HB   PHE  19          2HB       PHE  19  -1.927  -3.516   1.309
  147    HD1  PHE  19           1HD      PHE  19  -2.026  -1.158   0.500
  148    HD2  PHE  19           2HD      PHE  19  -5.384  -3.769   0.340
  149    HE1  PHE  19           1HE      PHE  19  -3.517   0.782   0.245
  150    HE2  PHE  19           2HE      PHE  19  -6.881  -1.833   0.084
  151    HZ   PHE  19           HZ       PHE  19  -5.948   0.446   0.035
  152    H    THR  20           H        THR  20  -2.642  -6.655  -0.948
  153    HA   THR  20           HA       THR  20  -4.979  -6.201  -2.621
  154    HB   THR  20           HB       THR  20  -4.291  -7.714  -4.380
  155    HG1  THR  20           1HG      THR  20  -2.045  -8.444  -4.359
  156   1HG2  THR  20          1HG2      THR  20  -1.999  -5.801  -4.003
  157   2HG2  THR  20          2HG2      THR  20  -3.623  -5.252  -4.419
  158   3HG2  THR  20          3HG2      THR  20  -2.750  -6.330  -5.508
  159    H    LEU  21           H        LEU  21  -6.568  -7.543  -2.057
  160    HA   LEU  21           HA       LEU  21  -5.916 -10.179  -0.968
  161   1HB   LEU  21          1HB       LEU  21  -6.168  -8.688   0.951
  162   2HB   LEU  21          2HB       LEU  21  -7.756  -8.197   0.365
  163    HG   LEU  21           HG       LEU  21  -7.993 -10.933   0.573
  164   1HD1  LEU  21          1HD1      LEU  21  -5.929 -11.237   1.717
  165   2HD1  LEU  21          2HD1      LEU  21  -7.219 -11.380   2.911
  166   3HD1  LEU  21          3HD1      LEU  21  -6.268  -9.898   2.813
  167   1HD2  LEU  21          1HD2      LEU  21  -9.598 -10.457   2.168
  168   2HD2  LEU  21          2HD2      LEU  21  -9.459  -8.921   1.312
  169   3HD2  LEU  21          3HD2      LEU  21  -8.661  -9.138   2.870
  170    H    ASN  22           H        ASN  22  -7.322 -11.756  -1.541
  171    HA   ASN  22           HA       ASN  22  -9.362 -11.065  -3.478
  172   1HB   ASN  22          1HB       ASN  22  -9.483 -13.412  -3.954
  173   2HB   ASN  22          2HB       ASN  22  -7.780 -12.999  -3.775
  174   1HD2  ASN  22          1HD2      ASN  22 -10.238 -15.055  -2.820
  175   2HD2  ASN  22          2HD2      ASN  22  -9.445 -15.806  -1.482
  176    H    ASN  23           H        ASN  23 -11.534 -11.240  -3.224
  177    HA   ASN  23           HA       ASN  23 -13.522 -11.176  -2.108
  178   1HB   ASN  23          1HB       ASN  23 -12.793 -13.704  -2.193
  179   2HB   ASN  23          2HB       ASN  23 -12.634 -13.506  -0.450
  180   1HD2  ASN  23          1HD2      ASN  23 -14.913 -12.777  -3.068
  181   2HD2  ASN  23          2HD2      ASN  23 -16.334 -13.190  -2.176
  182    HA   PRO  24           HA       PRO  24 -11.526  -9.199   1.632
  183   1HB   PRO  24          1HB       PRO  24 -12.382  -6.682   1.084
  184   2HB   PRO  24          2HB       PRO  24 -10.865  -7.339   0.458
  185   1HG   PRO  24          1HG       PRO  24 -13.522  -7.089  -0.898
  186   2HG   PRO  24          2HG       PRO  24 -11.904  -6.747  -1.537
  187   1HD   PRO  24          1HD       PRO  24 -13.235  -9.039  -2.090
  188   2HD   PRO  24          2HD       PRO  24 -11.465  -8.970  -1.961
  189    H    SER  25           H        SER  25 -12.593  -8.742   3.513
  190    HA   SER  25           HA       SER  25 -15.486  -9.102   3.475
  191   1HB   SER  25          1HB       SER  25 -13.348  -9.700   5.333
  192   2HB   SER  25          2HB       SER  25 -14.639  -8.803   6.133
  193    HG   SER  25           HG       SER  25 -16.084 -10.376   5.547
  194    H    GLU  26           H        GLU  26 -16.881  -7.727   4.768
  195    HA   GLU  26           HA       GLU  26 -16.570  -5.004   4.183
  196   1HB   GLU  26          1HB       GLU  26 -18.525  -6.686   5.493
  197   2HB   GLU  26          2HB       GLU  26 -18.350  -5.156   6.342
  198   1HG   GLU  26          1HG       GLU  26 -19.068  -3.915   4.531
  199   2HG   GLU  26          2HG       GLU  26 -18.690  -5.193   3.376
  200    H    ASP  27           H        ASP  27 -15.627  -6.898   6.951
  201    HA   ASP  27           HA       ASP  27 -15.147  -4.662   8.678
  202   1HB   ASP  27          1HB       ASP  27 -15.592  -6.688   9.796
  203   2HB   ASP  27          2HB       ASP  27 -14.450  -7.587   8.801
  204    H    GLU  28           H        GLU  28 -13.144  -6.736   6.625
  205    HA   GLU  28           HA       GLU  28 -10.661  -5.610   7.365
  206   1HB   GLU  28          1HB       GLU  28 -11.533  -7.681   5.700
  207   2HB   GLU  28          2HB       GLU  28 -10.701  -6.561   4.629
  208   1HG   GLU  28          1HG       GLU  28  -8.676  -6.813   5.727
  209   2HG   GLU  28          2HG       GLU  28  -9.435  -7.438   7.190
  210    H    ARG  29           H        ARG  29 -12.799  -4.995   4.589
  211    HA   ARG  29           HA       ARG  29 -11.228  -3.016   3.378
  212   1HB   ARG  29          1HB       ARG  29 -14.164  -3.650   3.298
  213   2HB   ARG  29          2HB       ARG  29 -13.518  -2.261   2.436
  214   1HG   ARG  29          1HG       ARG  29 -12.381  -3.552   0.921
  215   2HG   ARG  29          2HG       ARG  29 -12.258  -4.925   2.022
  216   1HD   ARG  29          1HD       ARG  29 -13.817  -5.338   0.158
  217   2HD   ARG  29          2HD       ARG  29 -14.605  -5.417   1.734
  218    HE   ARG  29           HE       ARG  29 -14.907  -2.820   0.812
  219   1HH1  ARG  29          1HH1      ARG  29 -15.860  -6.028  -0.147
  220   2HH1  ARG  29          2HH1      ARG  29 -17.317  -5.504  -0.926
  221   1HH2  ARG  29          1HH2      ARG  29 -16.822  -2.117  -0.210
  222   2HH2  ARG  29          2HH2      ARG  29 -17.862  -3.279  -0.962
  223    H    LYS  30           H        LYS  30 -13.576  -2.859   5.978
  224    HA   LYS  30           HA       LYS  30 -13.803  -0.025   6.037
  225   1HB   LYS  30          1HB       LYS  30 -15.468  -1.584   7.031
  226   2HB   LYS  30          2HB       LYS  30 -14.295  -1.999   8.274
  227   1HG   LYS  30          1HG       LYS  30 -14.257   0.503   8.808
  228   2HG   LYS  30          2HG       LYS  30 -15.733   0.593   7.843
  229   1HD   LYS  30          1HD       LYS  30 -15.367  -1.288  10.170
  230   2HD   LYS  30          2HD       LYS  30 -16.093   0.314  10.312
  231   1HE   LYS  30          1HE       LYS  30 -17.976  -0.949  10.022
  232   2HE   LYS  30          2HE       LYS  30 -17.603  -0.570   8.341
  233   1HZ   LYS  30          1HZ       LYS  30 -17.745  -3.094   9.595
  234   2HZ   LYS  30          2HZ       LYS  30 -16.188  -2.867   8.976
  235   3HZ   LYS  30          3HZ       LYS  30 -17.531  -2.735   7.956
  236    H    LYS  31           H        LYS  31 -11.681  -2.350   7.600
  237    HA   LYS  31           HA       LYS  31 -10.519  -0.620   9.491
  238   1HB   LYS  31          1HB       LYS  31 -10.217  -2.985   9.726
  239   2HB   LYS  31          2HB       LYS  31  -9.474  -3.107   8.136
  240   1HG   LYS  31          1HG       LYS  31  -8.002  -1.251   9.743
  241   2HG   LYS  31          2HG       LYS  31  -8.206  -2.772  10.616
  242   1HD   LYS  31          1HD       LYS  31  -7.504  -3.107   7.794
  243   2HD   LYS  31          2HD       LYS  31  -6.275  -2.266   8.742
  244   1HE   LYS  31          1HE       LYS  31  -5.998  -4.744   8.663
  245   2HE   LYS  31          2HE       LYS  31  -6.130  -4.080  10.291
  246   1HZ   LYS  31          1HZ       LYS  31  -7.532  -6.164   9.466
  247   2HZ   LYS  31          2HZ       LYS  31  -8.611  -4.936   9.034
  248   3HZ   LYS  31          3HZ       LYS  31  -8.102  -5.087  10.640
  249    H    ILE  32           H        ILE  32  -9.407  -1.576   6.245
  250    HA   ILE  32           HA       ILE  32  -7.155   0.152   6.253
  251    HB   ILE  32           HB       ILE  32  -8.540  -0.840   3.772
  252   1HG1  ILE  32          1HG1      ILE  32  -6.672  -2.344   5.615
  253   2HG1  ILE  32          2HG1      ILE  32  -8.337  -2.763   5.227
  254   1HG2  ILE  32          1HG2      ILE  32  -5.606  -0.811   4.027
  255   2HG2  ILE  32          2HG2      ILE  32  -6.635  -0.342   2.675
  256   3HG2  ILE  32          3HG2      ILE  32  -6.393   0.767   4.025
  257   1HD1  ILE  32          1HD1      ILE  32  -5.901  -3.423   3.842
  258   2HD1  ILE  32          2HD1      ILE  32  -7.525  -4.087   3.652
  259   3HD1  ILE  32          3HD1      ILE  32  -7.056  -2.634   2.769
  260    H    ARG  33           H        ARG  33 -10.481   0.488   5.165
  261    HA   ARG  33           HA       ARG  33 -10.066   2.977   3.820
  262   1HB   ARG  33          1HB       ARG  33 -11.920   1.587   3.156
  263   2HB   ARG  33          2HB       ARG  33 -12.571   1.596   4.789
  264   1HG   ARG  33          1HG       ARG  33 -13.372   3.746   4.605
  265   2HG   ARG  33          2HG       ARG  33 -12.230   4.174   3.329
  266   1HD   ARG  33          1HD       ARG  33 -14.111   3.956   2.067
  267   2HD   ARG  33          2HD       ARG  33 -13.557   2.283   2.029
  268    HE   ARG  33           HE       ARG  33 -15.409   1.690   3.226
  269   1HH1  ARG  33          1HH1      ARG  33 -14.923   5.124   3.531
  270   2HH1  ARG  33          2HH1      ARG  33 -16.413   5.391   4.374
  271   1HH2  ARG  33          1HH2      ARG  33 -17.373   2.029   4.334
  272   2HH2  ARG  33          2HH2      ARG  33 -17.806   3.630   4.831
  273    H    ASP  34           H        ASP  34 -10.525   2.041   7.086
  274    HA   ASP  34           HA       ASP  34 -11.269   4.763   7.882
  275   1HB   ASP  34          1HB       ASP  34 -11.266   2.140   9.378
  276   2HB   ASP  34          2HB       ASP  34 -11.548   3.691  10.164
  277    H    LEU  35           H        LEU  35  -8.528   3.362   7.124
  278    HA   LEU  35           HA       LEU  35  -6.870   3.638   9.391
  279   1HB   LEU  35          1HB       LEU  35  -6.417   3.462   6.449
  280   2HB   LEU  35          2HB       LEU  35  -5.077   3.923   7.498
  281    HG   LEU  35           HG       LEU  35  -6.652   1.361   7.749
  282   1HD1  LEU  35          1HD1      LEU  35  -5.429   1.329   5.678
  283   2HD1  LEU  35          2HD1      LEU  35  -4.603   0.302   6.849
  284   3HD1  LEU  35          3HD1      LEU  35  -3.971   1.907   6.484
  285   1HD2  LEU  35          1HD2      LEU  35  -5.657   2.138   9.842
  286   2HD2  LEU  35          2HD2      LEU  35  -4.086   2.270   9.051
  287   3HD2  LEU  35          3HD2      LEU  35  -4.847   0.690   9.245
  288    HA   PRO  36           HA       PRO  36  -6.080   7.942   9.709
  289   1HB   PRO  36          1HB       PRO  36  -3.423   8.010  10.265
  290   2HB   PRO  36          2HB       PRO  36  -4.634   7.454  11.427
  291   1HG   PRO  36          1HG       PRO  36  -2.846   5.850   9.641
  292   2HG   PRO  36          2HG       PRO  36  -3.262   5.579  11.344
  293   1HD   PRO  36          1HD       PRO  36  -4.432   4.209   9.323
  294   2HD   PRO  36          2HD       PRO  36  -5.288   4.611  10.826
  295    H    ILE  37           H        ILE  37  -6.095   9.325   8.059
  296    HA   ILE  37           HA       ILE  37  -4.696   8.865   5.624
  297    HB   ILE  37           HB       ILE  37  -5.455  11.202   5.052
  298   1HG1  ILE  37          1HG1      ILE  37  -6.915  10.988   7.692
  299   2HG1  ILE  37          2HG1      ILE  37  -5.503  12.003   7.422
  300   1HG2  ILE  37          1HG2      ILE  37  -7.546  10.462   4.472
  301   2HG2  ILE  37          2HG2      ILE  37  -6.750   8.930   4.830
  302   3HG2  ILE  37          3HG2      ILE  37  -7.817   9.670   6.024
  303   1HD1  ILE  37          1HD1      ILE  37  -6.997  13.594   6.971
  304   2HD1  ILE  37          2HD1      ILE  37  -7.153  12.793   5.407
  305   3HD1  ILE  37          3HD1      ILE  37  -8.296  12.432   6.701
  306    H    SER  38           H        SER  38  -4.086  10.807   8.476
  307    HA   SER  38           HA       SER  38  -2.002  12.390   7.385
  308   1HB   SER  38          1HB       SER  38  -1.395  12.735   9.833
  309   2HB   SER  38          2HB       SER  38  -3.040  13.180   9.378
  310    HG   SER  38           HG       SER  38  -3.459  11.945  11.058
  311    H    LEU  39           H        LEU  39  -2.160   9.122   8.306
  312    HA   LEU  39           HA       LEU  39   0.617   8.813   8.992
  313   1HB   LEU  39          1HB       LEU  39  -1.589   7.350   9.505
  314   2HB   LEU  39          2HB       LEU  39  -0.935   6.457   8.134
  315    HG   LEU  39           HG       LEU  39   0.966   7.081  10.308
  316   1HD1  LEU  39          1HD1      LEU  39  -1.199   5.013  10.655
  317   2HD1  LEU  39          2HD1      LEU  39  -1.060   6.514  11.569
  318   3HD1  LEU  39          3HD1      LEU  39   0.183   5.272  11.721
  319   1HD2  LEU  39          1HD2      LEU  39   2.087   5.381   9.396
  320   2HD2  LEU  39          2HD2      LEU  39   0.932   5.484   8.067
  321   3HD2  LEU  39          3HD2      LEU  39   0.664   4.339   9.382
  322    H    PHE  40           H        PHE  40  -1.324   8.631   6.113
  323    HA   PHE  40           HA       PHE  40   1.094   7.938   4.582
  324   1HB   PHE  40          1HB       PHE  40  -1.670   7.217   3.643
  325   2HB   PHE  40          2HB       PHE  40  -0.123   6.563   3.116
  326    HD1  PHE  40           2HD      PHE  40  -2.692   6.483   5.724
  327    HD2  PHE  40           1HD      PHE  40   0.974   4.818   4.347
  328    HE1  PHE  40           2HE      PHE  40  -2.952   4.614   7.303
  329    HE2  PHE  40           1HE      PHE  40   0.720   2.946   5.923
  330    HZ   PHE  40           HZ       PHE  40  -1.244   2.843   7.404
  331    H    ASP  41           H        ASP  41   1.731   9.645   3.459
  332    HA   ASP  41           HA       ASP  41   0.337  11.984   3.031
  333   1HB   ASP  41          1HB       ASP  41   2.629  10.717   1.550
  334   2HB   ASP  41          2HB       ASP  41   1.969  12.271   1.046
  335    H    TYR  42           H        TYR  42   0.260   9.016   1.197
  336    HA   TYR  42           HA       TYR  42  -1.915  10.132  -0.424
  337   1HB   TYR  42          1HB       TYR  42   0.090  10.218  -1.823
  338   2HB   TYR  42          2HB       TYR  42   0.399   8.513  -1.512
  339    HD1  TYR  42           1HD      TYR  42  -2.890  10.069  -2.236
  340    HD2  TYR  42           2HD      TYR  42   0.278   7.630  -3.693
  341    HE1  TYR  42           1HE      TYR  42  -4.257   9.471  -4.191
  342    HE2  TYR  42           2HE      TYR  42  -1.081   7.026  -5.652
  343    HH   TYR  42           HH       TYR  42  -3.109   7.134  -6.590
  344    H    PHE  43           H        PHE  43  -3.662   8.899  -0.316
  345    HA   PHE  43           HA       PHE  43  -3.347   6.004   0.069
  346   1HB   PHE  43          1HB       PHE  43  -4.058   7.566   2.146
  347   2HB   PHE  43          2HB       PHE  43  -5.644   7.288   1.435
  348    HD1  PHE  43           1HD      PHE  43  -4.682   4.459   0.370
  349    HD2  PHE  43           2HD      PHE  43  -4.741   6.379   4.168
  350    HE1  PHE  43           1HE      PHE  43  -4.791   2.263   1.475
  351    HE2  PHE  43           2HE      PHE  43  -4.849   4.187   5.279
  352    HZ   PHE  43           HZ       PHE  43  -4.873   2.125   3.932
  353    H    ILE  44           H        ILE  44  -4.250   5.027  -1.607
  354    HA   ILE  44           HA       ILE  44  -6.858   5.970  -2.563
  355    HB   ILE  44           HB       ILE  44  -5.459   6.910  -4.204
  356   1HG1  ILE  44          1HG1      ILE  44  -5.879   4.369  -5.663
  357   2HG1  ILE  44          2HG1      ILE  44  -7.300   5.038  -4.867
  358   1HG2  ILE  44          1HG2      ILE  44  -3.895   4.362  -3.985
  359   2HG2  ILE  44          2HG2      ILE  44  -3.740   5.415  -5.390
  360   3HG2  ILE  44          3HG2      ILE  44  -3.343   6.025  -3.784
  361   1HD1  ILE  44          1HD1      ILE  44  -5.669   6.885  -6.502
  362   2HD1  ILE  44          2HD1      ILE  44  -6.622   5.666  -7.349
  363   3HD1  ILE  44          3HD1      ILE  44  -7.415   6.811  -6.268
  364    H    VAL  45           H        VAL  45  -8.246   4.350  -2.403
  365    HA   VAL  45           HA       VAL  45  -7.285   1.611  -2.924
  366    HB   VAL  45           HB       VAL  45  -9.585   2.188  -1.081
  367   1HG1  VAL  45          1HG1      VAL  45  -9.332  -0.010  -0.370
  368   2HG1  VAL  45          2HG1      VAL  45  -9.003  -0.113  -2.101
  369   3HG1  VAL  45          3HG1      VAL  45  -7.669  -0.110  -0.947
  370   1HG2  VAL  45          1HG2      VAL  45  -8.126   3.255   0.260
  371   2HG2  VAL  45          2HG2      VAL  45  -7.565   1.626   0.635
  372   3HG2  VAL  45          3HG2      VAL  45  -6.718   2.594  -0.571
  373    H    GLY  46           H        GLY  46  -8.602   0.256  -4.113
  374   1HA   GLY  46          1HA       GLY  46 -11.149   1.358  -5.086
  375   2HA   GLY  46          2HA       GLY  46  -9.933   0.858  -6.253
  376    H    GLU  47           H        GLU  47 -12.569  -0.197  -6.052
  377    HA   GLU  47           HA       GLU  47 -12.176  -2.867  -4.917
  378   1HB   GLU  47          1HB       GLU  47 -14.290  -1.406  -4.567
  379   2HB   GLU  47          2HB       GLU  47 -14.713  -1.899  -6.200
  380   1HG   GLU  47          1HG       GLU  47 -14.921  -4.144  -5.597
  381   2HG   GLU  47          2HG       GLU  47 -14.038  -3.912  -4.090
  382    H    GLU  48           H        GLU  48 -11.961  -4.663  -6.126
  383    HA   GLU  48           HA       GLU  48 -11.831  -4.303  -9.034
  384   1HB   GLU  48          1HB       GLU  48 -10.103  -5.540  -7.236
  385   2HB   GLU  48          2HB       GLU  48 -10.914  -6.876  -8.040
  386   1HG   GLU  48          1HG       GLU  48 -10.327  -5.622 -10.216
  387   2HG   GLU  48          2HG       GLU  48  -9.170  -4.752  -9.210
  388    H    GLY  49           H        GLY  49 -13.264  -5.226 -10.358
  389   1HA   GLY  49          1HA       GLY  49 -14.703  -7.619  -9.564
  390   2HA   GLY  49          2HA       GLY  49 -15.693  -6.176  -9.727
  391    H    ASN  50           H        ASN  50 -13.514  -8.350 -11.455
  392    HA   ASN  50           HA       ASN  50 -13.834  -7.273 -14.019
  393   1HB   ASN  50          1HB       ASN  50 -12.413  -9.365 -12.929
  394   2HB   ASN  50          2HB       ASN  50 -13.584 -10.193 -13.952
  395   1HD2  ASN  50          1HD2      ASN  50 -10.562  -9.196 -13.946
  396   2HD2  ASN  50          2HD2      ASN  50 -10.344  -8.768 -15.606
  397    H    GLU  51           H        GLU  51 -14.744  -9.208 -15.700
  398    HA   GLU  51           HA       GLU  51 -17.459  -8.753 -15.865
  399   1HB   GLU  51          1HB       GLU  51 -15.583 -10.694 -17.081
  400   2HB   GLU  51          2HB       GLU  51 -17.288 -11.115 -17.162
  401   1HG   GLU  51          1HG       GLU  51 -17.759  -8.965 -18.235
  402   2HG   GLU  51          2HG       GLU  51 -16.042  -8.570 -18.178
  403    H    GLU  52           H        GLU  52 -19.185 -10.515 -15.850
  404    HA   GLU  52           HA       GLU  52 -19.715 -11.318 -13.265
  405   1HB   GLU  52          1HB       GLU  52 -21.155 -11.302 -15.519
  406   2HB   GLU  52          2HB       GLU  52 -20.789 -13.020 -15.453
  407   1HG   GLU  52          1HG       GLU  52 -22.033 -13.359 -13.569
  408   2HG   GLU  52          2HG       GLU  52 -21.831 -11.702 -13.003
  409    H    GLY  53           H        GLY  53 -19.724 -13.369 -12.221
  410   1HA   GLY  53          1HA       GLY  53 -19.068 -15.617 -11.953
  411   2HA   GLY  53          2HA       GLY  53 -18.089 -15.481 -13.406
  412    H    ARG  54           H        ARG  54 -17.012 -12.866 -12.269
  413    HA   ARG  54           HA       ARG  54 -14.841 -14.115 -10.783
  414   1HB   ARG  54          1HB       ARG  54 -14.508 -12.495 -12.729
  415   2HB   ARG  54          2HB       ARG  54 -15.021 -11.227 -11.624
  416   1HG   ARG  54          1HG       ARG  54 -12.662 -11.222 -11.615
  417   2HG   ARG  54          2HG       ARG  54 -13.167 -11.957 -10.092
  418   1HD   ARG  54          1HD       ARG  54 -12.550 -14.093 -10.775
  419   2HD   ARG  54          2HD       ARG  54 -12.581 -13.659 -12.484
  420    HE   ARG  54           HE       ARG  54 -10.409 -12.968 -12.305
  421   1HH1  ARG  54          1HH1      ARG  54 -11.782 -13.225  -9.116
  422   2HH1  ARG  54          2HH1      ARG  54 -10.276 -12.947  -8.304
  423   1HH2  ARG  54          1HH2      ARG  54  -8.422 -12.601 -11.248
  424   2HH2  ARG  54          2HH2      ARG  54  -8.366 -12.591  -9.518
  425    H    THR  55           H        THR  55 -14.352 -13.721  -8.685
  426    HA   THR  55           HA       THR  55 -16.403 -12.526  -7.048
  427    HB   THR  55           HB       THR  55 -14.298 -13.067  -5.347
  428    HG1  THR  55           1HG      THR  55 -13.004 -14.140  -6.729
  429   1HG2  THR  55          1HG2      THR  55 -16.041 -15.358  -5.984
  430   2HG2  THR  55          2HG2      THR  55 -16.874 -13.846  -5.624
  431   3HG2  THR  55          3HG2      THR  55 -15.758 -14.540  -4.448
  432    HA   PRO  56           HA       PRO  56 -14.680  -8.544  -6.387
  433   1HB   PRO  56          1HB       PRO  56 -15.198  -8.127  -3.755
  434   2HB   PRO  56          2HB       PRO  56 -16.457  -8.116  -4.995
  435   1HG   PRO  56          1HG       PRO  56 -15.675 -10.305  -3.108
  436   2HG   PRO  56          2HG       PRO  56 -17.296  -9.761  -3.580
  437   1HD   PRO  56          1HD       PRO  56 -16.130 -11.960  -4.647
  438   2HD   PRO  56          2HD       PRO  56 -17.248 -10.931  -5.565
  439    H    HIS  57           H        HIS  57 -12.714  -7.699  -6.009
  440    HA   HIS  57           HA       HIS  57 -11.013  -8.934  -3.955
  441   1HB   HIS  57          1HB       HIS  57 -10.224  -9.919  -5.975
  442   2HB   HIS  57          2HB       HIS  57 -10.293  -8.382  -6.833
  443    HD1  HIS  57           1HD      HIS  57  -8.073 -10.493  -4.821
  444    HD2  HIS  57           2HD      HIS  57  -8.221  -6.525  -6.040
  445    HE1  HIS  57           1HE      HIS  57  -5.761  -9.584  -4.431
  446    H    LEU  58           H        LEU  58  -9.649  -7.558  -2.871
  447    HA   LEU  58           HA       LEU  58 -10.193  -4.714  -3.240
  448   1HB   LEU  58          1HB       LEU  58 -10.039  -6.258  -1.005
  449   2HB   LEU  58          2HB       LEU  58  -8.426  -5.549  -1.048
  450    HG   LEU  58           HG       LEU  58 -11.066  -4.116  -0.834
  451   1HD1  LEU  58          1HD1      LEU  58  -9.831  -3.175   1.194
  452   2HD1  LEU  58          2HD1      LEU  58  -8.699  -4.507   0.966
  453   3HD1  LEU  58          3HD1      LEU  58 -10.401  -4.842   1.286
  454   1HD2  LEU  58          1HD2      LEU  58  -9.787  -2.034  -0.869
  455   2HD2  LEU  58          2HD2      LEU  58  -9.641  -2.902  -2.397
  456   3HD2  LEU  58          3HD2      LEU  58  -8.317  -2.939  -1.231
  457    H    GLN  59           H        GLN  59  -8.827  -3.441  -4.288
  458    HA   GLN  59           HA       GLN  59  -5.961  -4.063  -4.233
  459   1HB   GLN  59          1HB       GLN  59  -6.603  -4.938  -6.341
  460   2HB   GLN  59          2HB       GLN  59  -7.649  -3.564  -6.678
  461   1HG   GLN  59          1HG       GLN  59  -5.650  -3.438  -8.017
  462   2HG   GLN  59          2HG       GLN  59  -5.680  -2.118  -6.848
  463   1HE2  GLN  59          1HE2      GLN  59  -4.131  -2.004  -5.288
  464   2HE2  GLN  59          2HE2      GLN  59  -2.762  -3.056  -5.221
  465    H    GLY  60           H        GLY  60  -5.021  -2.373  -3.299
  466   1HA   GLY  60          1HA       GLY  60  -5.592   0.302  -4.317
  467   2HA   GLY  60          2HA       GLY  60  -5.885   0.035  -2.604
  468    H    PHE  61           H        PHE  61  -4.109   1.951  -3.351
  469    HA   PHE  61           HA       PHE  61  -1.549   0.760  -2.530
  470   1HB   PHE  61          1HB       PHE  61  -1.153   1.242  -4.799
  471   2HB   PHE  61          2HB       PHE  61  -2.065   2.746  -4.729
  472    HD1  PHE  61           2HD      PHE  61   0.831   1.271  -2.886
  473    HD2  PHE  61           1HD      PHE  61  -0.776   4.617  -4.970
  474    HE1  PHE  61           2HE      PHE  61   2.920   2.512  -2.499
  475    HE2  PHE  61           1HE      PHE  61   1.310   5.863  -4.587
  476    HZ   PHE  61           HZ       PHE  61   3.162   4.811  -3.349
  477    H    ALA  62           H        ALA  62  -0.388   1.877  -1.020
  478    HA   ALA  62           HA       ALA  62  -1.401   4.498  -0.166
  479   1HB   ALA  62          1HB       ALA  62  -0.629   3.203   2.187
  480   2HB   ALA  62          2HB       ALA  62  -2.266   3.631   1.687
  481   3HB   ALA  62          3HB       ALA  62  -1.616   2.036   1.307
  482    H    ASN  63           H        ASN  63   0.173   5.943   0.088
  483    HA   ASN  63           HA       ASN  63   2.942   5.028   0.000
  484   1HB   ASN  63          1HB       ASN  63   2.206   6.803  -1.557
  485   2HB   ASN  63          2HB       ASN  63   1.821   7.834  -0.182
  486   1HD2  ASN  63          1HD2      ASN  63   3.986   7.456  -2.500
  487   2HD2  ASN  63          2HD2      ASN  63   5.419   8.007  -1.708
  488    H    PHE  64           H        PHE  64   3.995   4.712   1.836
  489    HA   PHE  64           HA       PHE  64   3.058   5.664   4.347
  490   1HB   PHE  64          1HB       PHE  64   5.175   3.909   3.375
  491   2HB   PHE  64          2HB       PHE  64   5.686   4.878   4.753
  492    HD1  PHE  64           2HD      PHE  64   4.564   4.655   6.913
  493    HD2  PHE  64           1HD      PHE  64   3.529   2.191   3.601
  494    HE1  PHE  64           2HE      PHE  64   3.405   3.106   8.433
  495    HE2  PHE  64           1HE      PHE  64   2.368   0.637   5.115
  496    HZ   PHE  64           HZ       PHE  64   2.306   1.093   7.534
  497    H    VAL  65           H        VAL  65   3.503   7.490   5.401
  498    HA   VAL  65           HA       VAL  65   4.827   9.639   4.185
  499    HB   VAL  65           HB       VAL  65   4.092   9.187   7.077
  500   1HG1  VAL  65          1HG1      VAL  65   5.652  10.816   7.393
  501   2HG1  VAL  65          2HG1      VAL  65   5.499  11.438   5.748
  502   3HG1  VAL  65          3HG1      VAL  65   4.277  11.832   6.958
  503   1HG2  VAL  65          1HG2      VAL  65   2.804  11.027   5.077
  504   2HG2  VAL  65          2HG2      VAL  65   2.291   9.354   5.297
  505   3HG2  VAL  65          3HG2      VAL  65   2.177  10.494   6.637
  506    H    LYS  66           H        LYS  66   6.010   7.039   6.132
  507    HA   LYS  66           HA       LYS  66   8.693   8.251   6.068
  508   1HB   LYS  66          1HB       LYS  66   9.131   6.951   8.204
  509   2HB   LYS  66          2HB       LYS  66   8.071   8.347   8.351
  510   1HG   LYS  66          1HG       LYS  66   6.767   5.747   7.837
  511   2HG   LYS  66          2HG       LYS  66   7.514   5.967   9.421
  512   1HD   LYS  66          1HD       LYS  66   5.801   8.159   8.376
  513   2HD   LYS  66          2HD       LYS  66   5.005   6.685   8.933
  514   1HE   LYS  66          1HE       LYS  66   5.722   6.964  11.111
  515   2HE   LYS  66          2HE       LYS  66   7.088   7.976  10.641
  516   1HZ   LYS  66          1HZ       LYS  66   5.431   9.704  10.013
  517   2HZ   LYS  66          2HZ       LYS  66   5.479   9.360  11.668
  518   3HZ   LYS  66          3HZ       LYS  66   4.225   8.746  10.713
  519    H    LYS  67           H        LYS  67  10.267   6.251   6.824
  520    HA   LYS  67           HA       LYS  67   9.974   4.344   4.648
  521   1HB   LYS  67          1HB       LYS  67  12.163   5.552   6.037
  522   2HB   LYS  67          2HB       LYS  67  12.301   3.805   6.185
  523   1HG   LYS  67          1HG       LYS  67  13.419   4.073   4.238
  524   2HG   LYS  67          2HG       LYS  67  11.786   3.936   3.582
  525   1HD   LYS  67          1HD       LYS  67  11.733   6.093   2.929
  526   2HD   LYS  67          2HD       LYS  67  12.593   6.654   4.365
  527   1HE   LYS  67          1HE       LYS  67  14.625   5.442   3.229
  528   2HE   LYS  67          2HE       LYS  67  13.669   5.661   1.765
  529   1HZ   LYS  67          1HZ       LYS  67  13.649   8.010   2.109
  530   2HZ   LYS  67          2HZ       LYS  67  15.254   7.486   2.206
  531   3HZ   LYS  67          3HZ       LYS  67  14.400   7.862   3.617
  532    H    GLN  68           H        GLN  68   9.141   2.388   4.914
  533    HA   GLN  68           HA       GLN  68   9.399   1.069   7.523
  534   1HB   GLN  68          1HB       GLN  68   6.863   1.287   5.894
  535   2HB   GLN  68          2HB       GLN  68   7.064   0.225   7.281
  536   1HG   GLN  68          1HG       GLN  68   7.224   3.230   7.305
  537   2HG   GLN  68          2HG       GLN  68   5.886   2.248   7.900
  538   1HE2  GLN  68          1HE2      GLN  68   7.072   4.072   9.534
  539   2HE2  GLN  68          2HE2      GLN  68   7.969   3.264  10.769
  540    H    THR  69           H        THR  69   9.266  -1.238   7.455
  541    HA   THR  69           HA       THR  69  10.229  -2.313   4.917
  542    HB   THR  69           HB       THR  69  11.104  -4.144   6.111
  543    HG1  THR  69           1HG      THR  69  10.493  -4.345   8.439
  544   1HG2  THR  69          1HG2      THR  69  12.337  -2.084   6.545
  545   2HG2  THR  69          2HG2      THR  69  12.375  -3.137   7.960
  546   3HG2  THR  69          3HG2      THR  69  11.300  -1.740   7.929
  547    H    PHE  70           H        PHE  70   9.530  -4.663   4.484
  548    HA   PHE  70           HA       PHE  70   6.786  -4.677   3.894
  549   1HB   PHE  70          1HB       PHE  70   8.128  -6.008   2.500
  550   2HB   PHE  70          2HB       PHE  70   8.916  -6.799   3.861
  551    HD1  PHE  70           1HD      PHE  70   5.528  -6.411   2.354
  552    HD2  PHE  70           2HD      PHE  70   8.275  -8.936   4.402
  553    HE1  PHE  70           1HE      PHE  70   3.934  -8.278   2.183
  554    HE2  PHE  70           2HE      PHE  70   6.686 -10.807   4.234
  555    HZ   PHE  70           HZ       PHE  70   4.512 -10.480   3.123
  556    H    ASN  71           H        ASN  71   8.602  -6.583   6.297
  557    HA   ASN  71           HA       ASN  71   6.378  -7.849   7.442
  558   1HB   ASN  71          1HB       ASN  71   9.177  -7.767   7.891
  559   2HB   ASN  71          2HB       ASN  71   8.397  -7.419   9.431
  560   1HD2  ASN  71          1HD2      ASN  71   8.132  -9.642   6.681
  561   2HD2  ASN  71          2HD2      ASN  71   7.768 -11.040   7.628
  562    H    LYS  72           H        LYS  72   8.007  -4.815   8.250
  563    HA   LYS  72           HA       LYS  72   6.521  -4.247  10.581
  564   1HB   LYS  72          1HB       LYS  72   8.699  -3.150   9.513
  565   2HB   LYS  72          2HB       LYS  72   7.516  -2.018   8.873
  566   1HG   LYS  72          1HG       LYS  72   8.003  -2.662  11.773
  567   2HG   LYS  72          2HG       LYS  72   8.422  -1.168  10.931
  568   1HD   LYS  72          1HD       LYS  72   5.991  -0.840  10.461
  569   2HD   LYS  72          2HD       LYS  72   5.657  -2.237  11.487
  570   1HE   LYS  72          1HE       LYS  72   6.925   0.375  12.291
  571   2HE   LYS  72          2HE       LYS  72   5.362  -0.260  12.801
  572   1HZ   LYS  72          1HZ       LYS  72   6.857  -0.648  14.560
  573   2HZ   LYS  72          2HZ       LYS  72   8.052  -1.263  13.533
  574   3HZ   LYS  72          3HZ       LYS  72   6.639  -2.150  13.813
  575    H    VAL  73           H        VAL  73   6.128  -3.146   7.220
  576    HA   VAL  73           HA       VAL  73   3.918  -1.508   7.559
  577    HB   VAL  73           HB       VAL  73   4.733  -3.225   5.221
  578   1HG1  VAL  73          1HG1      VAL  73   3.136  -1.592   3.977
  579   2HG1  VAL  73          2HG1      VAL  73   2.473  -3.018   4.778
  580   3HG1  VAL  73          3HG1      VAL  73   2.360  -1.438   5.553
  581   1HG2  VAL  73          1HG2      VAL  73   5.766  -1.352   4.374
  582   2HG2  VAL  73          2HG2      VAL  73   4.735  -0.241   5.277
  583   3HG2  VAL  73          3HG2      VAL  73   6.020  -1.121   6.104
  584    H    LYS  74           H        LYS  74   4.135  -4.962   7.631
  585    HA   LYS  74           HA       LYS  74   1.447  -5.601   7.066
  586   1HB   LYS  74          1HB       LYS  74   3.425  -7.092   8.801
  587   2HB   LYS  74          2HB       LYS  74   1.935  -7.755   8.142
  588   1HG   LYS  74          1HG       LYS  74   3.233  -6.792   5.914
  589   2HG   LYS  74          2HG       LYS  74   4.542  -7.438   6.906
  590   1HD   LYS  74          1HD       LYS  74   3.979  -9.380   5.901
  591   2HD   LYS  74          2HD       LYS  74   2.734  -9.423   7.153
  592   1HE   LYS  74          1HE       LYS  74   1.107  -8.511   5.650
  593   2HE   LYS  74          2HE       LYS  74   2.335  -8.212   4.421
  594   1HZ   LYS  74          1HZ       LYS  74   2.106 -10.959   5.329
  595   2HZ   LYS  74          2HZ       LYS  74   2.325 -10.348   3.767
  596   3HZ   LYS  74          3HZ       LYS  74   0.781 -10.370   4.457
  597    H    TRP  75           H        TRP  75   2.816  -3.988   9.684
  598    HA   TRP  75           HA       TRP  75   1.138  -4.890  11.785
  599   1HB   TRP  75          1HB       TRP  75   2.028  -3.124  13.066
  600   2HB   TRP  75          2HB       TRP  75   3.328  -3.568  11.963
  601    HD1  TRP  75           HD       TRP  75   2.360  -1.942   9.401
  602    HE1  TRP  75           1HE      TRP  75   2.522   0.627   9.403
  603    HE3  TRP  75           3HE      TRP  75   2.517  -1.141  14.448
  604    HZ2  TRP  75           2HZ      TRP  75   2.694   2.716  11.293
  605    HZ3  TRP  75           3HZ      TRP  75   2.681   1.172  15.271
  606    HH2  TRP  75           HH       TRP  75   2.768   3.059  13.724
  607    H    TYR  76           H        TYR  76   0.625  -2.815   9.109
  608    HA   TYR  76           HA       TYR  76  -1.874  -1.820  10.311
  609   1HB   TYR  76          1HB       TYR  76   0.159  -0.553   8.626
  610   2HB   TYR  76          2HB       TYR  76  -1.483  -0.306   8.043
  611    HD1  TYR  76           2HD      TYR  76  -2.955  -0.186  10.623
  612    HD2  TYR  76           1HD      TYR  76   0.754   1.547   9.467
  613    HE1  TYR  76           2HE      TYR  76  -3.280   1.600  12.282
  614    HE2  TYR  76           1HE      TYR  76   0.441   3.338  11.124
  615    HH   TYR  76           HH       TYR  76  -1.096   3.384  13.514
  616    H    LEU  77           H        LEU  77  -0.465  -2.903   7.226
  617    HA   LEU  77           HA       LEU  77  -3.007  -3.271   5.977
  618   1HB   LEU  77          1HB       LEU  77  -0.244  -4.219   5.245
  619   2HB   LEU  77          2HB       LEU  77  -1.667  -4.464   4.234
  620    HG   LEU  77           HG       LEU  77  -0.429  -1.815   4.980
  621   1HD1  LEU  77          1HD1      LEU  77  -0.351  -3.554   2.557
  622   2HD1  LEU  77          2HD1      LEU  77   0.946  -2.646   3.334
  623   3HD1  LEU  77          3HD1      LEU  77  -0.271  -1.801   2.377
  624   1HD2  LEU  77          1HD2      LEU  77  -2.861  -2.454   3.316
  625   2HD2  LEU  77          2HD2      LEU  77  -2.087  -0.872   3.408
  626   3HD2  LEU  77          3HD2      LEU  77  -2.826  -1.577   4.846
  627    H    GLY  78           H        GLY  78  -1.275  -5.059   8.248
  628   1HA   GLY  78          1HA       GLY  78  -1.702  -7.097   9.223
  629   2HA   GLY  78          2HA       GLY  78  -3.196  -7.146   8.299
  630    H    ALA  79           H        ALA  79  -1.498  -9.369   8.852
  631    HA   ALA  79           HA       ALA  79   0.085  -9.964   6.543
  632   1HB   ALA  79          1HB       ALA  79  -0.279 -12.380   7.650
  633   2HB   ALA  79          2HB       ALA  79   0.894 -11.206   8.249
  634   3HB   ALA  79          3HB       ALA  79  -0.680 -11.358   9.030
  635    H    ARG  80           H        ARG  80  -3.239 -10.417   7.457
  636    HA   ARG  80           HA       ARG  80  -4.013 -12.507   5.816
  637   1HB   ARG  80          1HB       ARG  80  -5.640 -10.017   6.347
  638   2HB   ARG  80          2HB       ARG  80  -6.252 -11.613   5.936
  639   1HG   ARG  80          1HG       ARG  80  -4.806 -12.157   8.170
  640   2HG   ARG  80          2HG       ARG  80  -5.394 -10.529   8.514
  641   1HD   ARG  80          1HD       ARG  80  -7.006 -12.058   9.365
  642   2HD   ARG  80          2HD       ARG  80  -7.690 -11.330   7.912
  643    HE   ARG  80           HE       ARG  80  -6.370 -13.745   7.268
  644   1HH1  ARG  80          1HH1      ARG  80  -9.251 -12.529   8.798
  645   2HH1  ARG  80          2HH1      ARG  80 -10.195 -13.936   8.435
  646   1HH2  ARG  80          1HH2      ARG  80  -7.602 -15.602   6.784
  647   2HH2  ARG  80          2HH2      ARG  80  -9.255 -15.684   7.290
  648    H    CYS  81           H        CYS  81  -3.671  -9.070   5.032
  649    HA   CYS  81           HA       CYS  81  -4.377  -9.574   2.253
  650   1HB   CYS  81          1HB       CYS  81  -3.491  -6.958   3.472
  651   2HB   CYS  81          2HB       CYS  81  -4.374  -7.199   1.970
  652    HG   CYS  81           HG       CYS  81  -6.223  -6.120   3.651
  653    H    HIS  82           H        HIS  82  -2.973  -9.645   0.588
  654    HA   HIS  82           HA       HIS  82  -0.196 -10.009   1.156
  655   1HB   HIS  82          1HB       HIS  82  -1.451 -11.239  -0.630
  656   2HB   HIS  82          2HB       HIS  82  -1.522  -9.739  -1.549
  657    HD1  HIS  82           1HD      HIS  82   1.511 -11.049   0.296
  658    HD2  HIS  82           2HD      HIS  82   0.186 -10.386  -3.585
  659    HE1  HIS  82           1HE      HIS  82   3.507 -11.466  -1.176
  660    H    ILE  83           H        ILE  83   1.444  -8.605   1.012
  661    HA   ILE  83           HA       ILE  83   0.843  -5.908  -0.009
  662    HB   ILE  83           HB       ILE  83   3.110  -6.500   1.864
  663   1HG1  ILE  83          1HG1      ILE  83   0.236  -5.934   2.616
  664   2HG1  ILE  83          2HG1      ILE  83   1.141  -7.401   2.969
  665   1HG2  ILE  83          1HG2      ILE  83   1.437  -4.022   1.495
  666   2HG2  ILE  83          2HG2      ILE  83   2.935  -4.176   2.412
  667   3HG2  ILE  83          3HG2      ILE  83   2.957  -4.327   0.655
  668   1HD1  ILE  83          1HD1      ILE  83   1.386  -4.691   4.194
  669   2HD1  ILE  83          2HD1      ILE  83   1.194  -6.263   4.972
  670   3HD1  ILE  83          3HD1      ILE  83   2.738  -5.823   4.242
  671    H    GLU  84           H        GLU  84   2.224  -4.928  -1.433
  672    HA   GLU  84           HA       GLU  84   4.681  -6.310  -2.198
  673   1HB   GLU  84          1HB       GLU  84   2.357  -6.645  -3.671
  674   2HB   GLU  84          2HB       GLU  84   3.216  -5.381  -4.540
  675   1HG   GLU  84          1HG       GLU  84   5.197  -7.200  -4.055
  676   2HG   GLU  84          2HG       GLU  84   3.790  -8.229  -4.317
  677    H    LYS  85           H        LYS  85   6.007  -4.979  -3.712
  678    HA   LYS  85           HA       LYS  85   6.010  -2.234  -2.796
  679   1HB   LYS  85          1HB       LYS  85   7.899  -3.768  -4.589
  680   2HB   LYS  85          2HB       LYS  85   8.141  -2.095  -4.104
  681   1HG   LYS  85          1HG       LYS  85   8.354  -2.729  -1.803
  682   2HG   LYS  85          2HG       LYS  85   7.920  -4.398  -2.179
  683   1HD   LYS  85          1HD       LYS  85  10.141  -3.488  -3.794
  684   2HD   LYS  85          2HD       LYS  85  10.483  -3.319  -2.071
  685   1HE   LYS  85          1HE       LYS  85   9.911  -5.658  -1.715
  686   2HE   LYS  85          2HE       LYS  85   9.508  -5.835  -3.422
  687   1HZ   LYS  85          1HZ       LYS  85  12.198  -5.028  -2.476
  688   2HZ   LYS  85          2HZ       LYS  85  11.754  -5.525  -4.030
  689   3HZ   LYS  85          3HZ       LYS  85  11.767  -6.639  -2.757
  690    H    ALA  86           H        ALA  86   5.409  -0.482  -3.926
  691    HA   ALA  86           HA       ALA  86   4.160  -0.899  -6.520
  692   1HB   ALA  86          1HB       ALA  86   3.673   0.804  -4.320
  693   2HB   ALA  86          2HB       ALA  86   4.062   1.830  -5.701
  694   3HB   ALA  86          3HB       ALA  86   2.748   0.659  -5.815
  695    H    LYS  87           H        LYS  87   4.571   0.555  -8.315
  696    HA   LYS  87           HA       LYS  87   7.135   1.943  -8.302
  697   1HB   LYS  87          1HB       LYS  87   8.050   0.775 -10.154
  698   2HB   LYS  87          2HB       LYS  87   7.510  -0.456  -9.019
  699   1HG   LYS  87          1HG       LYS  87   5.332   0.030 -10.712
  700   2HG   LYS  87          2HG       LYS  87   6.756  -0.044 -11.753
  701   1HD   LYS  87          1HD       LYS  87   6.401  -2.266 -11.668
  702   2HD   LYS  87          2HD       LYS  87   7.219  -2.147 -10.108
  703   1HE   LYS  87          1HE       LYS  87   4.943  -1.774  -9.083
  704   2HE   LYS  87          2HE       LYS  87   4.257  -2.215 -10.646
  705   1HZ   LYS  87          1HZ       LYS  87   5.202  -4.373 -10.486
  706   2HZ   LYS  87          2HZ       LYS  87   4.411  -4.071  -9.022
  707   3HZ   LYS  87          3HZ       LYS  87   6.097  -3.964  -9.111
  708    H    GLY  88           H        GLY  88   7.424   3.361 -10.141
  709   1HA   GLY  88          1HA       GLY  88   6.571   4.390 -12.140
  710   2HA   GLY  88          2HA       GLY  88   4.955   3.899 -11.653
  711    H    THR  89           H        THR  89   4.568   6.222 -12.202
  712    HA   THR  89           HA       THR  89   5.434   8.086 -10.122
  713    HB   THR  89           HB       THR  89   4.672   9.859 -11.514
  714    HG1  THR  89           1HG      THR  89   3.645   8.134 -13.479
  715   1HG2  THR  89          1HG2      THR  89   6.033   9.616 -13.415
  716   2HG2  THR  89          2HG2      THR  89   5.747   7.878 -13.504
  717   3HG2  THR  89          3HG2      THR  89   6.753   8.542 -12.216
  718    H    ASP  90           H        ASP  90   3.641   9.755  -9.534
  719    HA   ASP  90           HA       ASP  90   1.744   8.493  -7.950
  720   1HB   ASP  90          1HB       ASP  90   0.615  10.781  -7.919
  721   2HB   ASP  90          2HB       ASP  90   2.300  10.728  -7.409
  722    H    GLN  91           H        GLN  91   1.449   9.771 -11.227
  723    HA   GLN  91           HA       GLN  91  -1.348   9.384 -11.461
  724   1HB   GLN  91          1HB       GLN  91   0.653  10.524 -13.018
  725   2HB   GLN  91          2HB       GLN  91   0.098   9.158 -13.975
  726   1HG   GLN  91          1HG       GLN  91  -1.082  11.250 -14.500
  727   2HG   GLN  91          2HG       GLN  91  -2.159   9.975 -13.932
  728   1HE2  GLN  91          1HE2      GLN  91  -3.550  10.490 -12.402
  729   2HE2  GLN  91          2HE2      GLN  91  -3.450  11.864 -11.360
  730    H    GLN  92           H        GLN  92   1.441   7.345 -12.102
  731    HA   GLN  92           HA       GLN  92   0.106   5.305 -13.514
  732   1HB   GLN  92          1HB       GLN  92   2.712   5.639 -12.181
  733   2HB   GLN  92          2HB       GLN  92   2.137   3.979 -12.270
  734   1HG   GLN  92          1HG       GLN  92   1.678   4.883 -14.806
  735   2HG   GLN  92          2HG       GLN  92   3.161   5.728 -14.366
  736   1HE2  GLN  92          1HE2      GLN  92   5.039   4.625 -14.257
  737   2HE2  GLN  92          2HE2      GLN  92   5.199   2.940 -14.602
  738    H    ASN  93           H        ASN  93   0.628   5.865 -10.076
  739    HA   ASN  93           HA       ASN  93  -0.502   3.343  -9.287
  740   1HB   ASN  93          1HB       ASN  93   0.367   5.810  -7.795
  741   2HB   ASN  93          2HB       ASN  93  -0.474   4.496  -6.978
  742   1HD2  ASN  93          1HD2      ASN  93   2.031   4.588  -9.487
  743   2HD2  ASN  93          2HD2      ASN  93   3.159   3.593  -8.637
  744    H    LYS  94           H        LYS  94  -1.583   6.719  -9.306
  745    HA   LYS  94           HA       LYS  94  -4.088   6.299  -8.108
  746   1HB   LYS  94          1HB       LYS  94  -2.870   8.510  -8.581
  747   2HB   LYS  94          2HB       LYS  94  -3.556   8.401 -10.197
  748   1HG   LYS  94          1HG       LYS  94  -5.753   8.003  -8.637
  749   2HG   LYS  94          2HG       LYS  94  -4.813   9.135  -7.663
  750   1HD   LYS  94          1HD       LYS  94  -4.553  10.430  -9.906
  751   2HD   LYS  94          2HD       LYS  94  -5.958   9.486 -10.406
  752   1HE   LYS  94          1HE       LYS  94  -7.244  10.986  -9.387
  753   2HE   LYS  94          2HE       LYS  94  -6.569  10.446  -7.851
  754   1HZ   LYS  94          1HZ       LYS  94  -4.941  12.130  -7.919
  755   2HZ   LYS  94          2HZ       LYS  94  -6.400  12.888  -8.315
  756   3HZ   LYS  94          3HZ       LYS  94  -5.282  12.520  -9.530
  757    H    GLU  95           H        GLU  95  -3.061   6.201 -11.490
  758    HA   GLU  95           HA       GLU  95  -5.677   5.812 -12.546
  759   1HB   GLU  95          1HB       GLU  95  -2.915   5.393 -13.675
  760   2HB   GLU  95          2HB       GLU  95  -4.367   5.023 -14.595
  761   1HG   GLU  95          1HG       GLU  95  -3.817   7.725 -13.402
  762   2HG   GLU  95          2HG       GLU  95  -3.335   7.266 -15.034
  763    H    TYR  96           H        TYR  96  -3.107   3.671 -11.475
  764    HA   TYR  96           HA       TYR  96  -4.007   1.262 -12.536
  765   1HB   TYR  96          1HB       TYR  96  -1.824   1.600 -11.387
  766   2HB   TYR  96          2HB       TYR  96  -2.677   1.661  -9.848
  767    HD1  TYR  96           2HD      TYR  96  -1.961  -0.536 -12.754
  768    HD2  TYR  96           1HD      TYR  96  -3.208  -0.315  -8.692
  769    HE1  TYR  96           2HE      TYR  96  -1.804  -2.985 -12.578
  770    HE2  TYR  96           1HE      TYR  96  -3.053  -2.763  -8.505
  771    HH   TYR  96           HH       TYR  96  -1.744  -4.621  -9.706
  772    H    CYS  97           H        CYS  97  -4.665   2.599  -9.295
  773    HA   CYS  97           HA       CYS  97  -6.508   0.600  -8.552
  774   1HB   CYS  97          1HB       CYS  97  -6.270   3.443  -7.542
  775   2HB   CYS  97          2HB       CYS  97  -7.155   2.147  -6.747
  776    HG   CYS  97           HG       CYS  97  -4.300   0.836  -7.061
  777    H    SER  98           H        SER  98  -6.867   3.660 -10.231
  778    HA   SER  98           HA       SER  98  -9.728   3.682 -10.116
  779   1HB   SER  98          1HB       SER  98  -8.587   5.788 -10.359
  780   2HB   SER  98          2HB       SER  98  -7.756   5.229 -11.810
  781    HG   SER  98           HG       SER  98  -9.434   6.365 -12.586
  782    H    LYS  99           H        LYS  99  -7.482   1.937 -11.918
  783    HA   LYS  99           HA       LYS  99  -8.621   1.741 -14.444
  784   1HB   LYS  99          1HB       LYS  99  -6.435   0.778 -13.835
  785   2HB   LYS  99          2HB       LYS  99  -7.248  -0.442 -12.863
  786   1HG   LYS  99          1HG       LYS  99  -8.329  -1.320 -14.874
  787   2HG   LYS  99          2HG       LYS  99  -7.498  -0.103 -15.846
  788   1HD   LYS  99          1HD       LYS  99  -6.342  -2.247 -15.963
  789   2HD   LYS  99          2HD       LYS  99  -5.338  -1.035 -15.162
  790   1HE   LYS  99          1HE       LYS  99  -5.222  -2.267 -13.313
  791   2HE   LYS  99          2HE       LYS  99  -6.977  -2.420 -13.243
  792   1HZ   LYS  99          1HZ       LYS  99  -6.635  -4.559 -13.679
  793   2HZ   LYS  99          2HZ       LYS  99  -5.021  -4.315 -14.119
  794   3HZ   LYS  99          3HZ       LYS  99  -6.250  -4.097 -15.260
  795    H    GLU 100           H        GLU 100  -9.689   0.447 -11.415
  796    HA   GLU 100           HA       GLU 100 -11.402  -1.571 -12.483
  797   1HB   GLU 100          1HB       GLU 100 -11.233  -0.224  -9.792
  798   2HB   GLU 100          2HB       GLU 100 -12.446  -1.443 -10.158
  799   1HG   GLU 100          1HG       GLU 100 -10.651  -2.517  -9.039
  800   2HG   GLU 100          2HG       GLU 100 -10.600  -3.011 -10.730
  801    H    GLY 101           H        GLY 101 -11.679   1.841 -11.939
  802   1HA   GLY 101          1HA       GLY 101 -13.310   3.176 -13.022
  803   2HA   GLY 101          2HA       GLY 101 -14.359   1.770 -13.120
  804    H    ASN 102           H        ASN 102 -13.355   1.502 -10.109
  805    HA   ASN 102           HA       ASN 102 -15.221   3.471  -8.983
  806   1HB   ASN 102          1HB       ASN 102 -16.394   1.878  -7.720
  807   2HB   ASN 102          2HB       ASN 102 -16.225   1.117  -9.299
  808   1HD2  ASN 102          1HD2      ASN 102 -15.373  -0.843  -9.388
  809   2HD2  ASN 102          2HD2      ASN 102 -14.542  -1.638  -8.098
  810    H    LEU 103           H        LEU 103 -14.570   4.393  -7.115
  811    HA   LEU 103           HA       LEU 103 -12.029   3.441  -5.978
  812   1HB   LEU 103          1HB       LEU 103 -13.121   6.083  -6.573
  813   2HB   LEU 103          2HB       LEU 103 -12.435   5.955  -4.955
  814    HG   LEU 103           HG       LEU 103 -10.869   6.830  -6.691
  815   1HD1  LEU 103          1HD1      LEU 103  -9.162   6.016  -5.502
  816   2HD1  LEU 103          2HD1      LEU 103  -9.558   4.344  -5.898
  817   3HD1  LEU 103          3HD1      LEU 103 -10.397   5.159  -4.579
  818   1HD2  LEU 103          1HD2      LEU 103 -11.586   5.480  -8.573
  819   2HD2  LEU 103          2HD2      LEU 103 -11.068   4.010  -7.747
  820   3HD2  LEU 103          3HD2      LEU 103  -9.874   5.208  -8.248
  821    H    LEU 104           H        LEU 104 -12.002   2.666  -3.972
  822    HA   LEU 104           HA       LEU 104 -14.450   2.691  -2.415
  823   1HB   LEU 104          1HB       LEU 104 -13.279   0.604  -2.599
  824   2HB   LEU 104          2HB       LEU 104 -11.790   1.338  -2.007
  825    HG   LEU 104           HG       LEU 104 -12.909   1.682   0.192
  826   1HD1  LEU 104          1HD1      LEU 104 -15.013  -0.254  -0.644
  827   2HD1  LEU 104          2HD1      LEU 104 -15.235   1.461  -0.987
  828   3HD1  LEU 104          3HD1      LEU 104 -15.015   0.916   0.676
  829   1HD2  LEU 104          1HD2      LEU 104 -13.199  -1.045   0.366
  830   2HD2  LEU 104          2HD2      LEU 104 -11.685  -0.154   0.535
  831   3HD2  LEU 104          3HD2      LEU 104 -12.131  -0.849  -1.024
  832    H    MET 105           H        MET 105 -11.359   4.249  -2.447
  833    HA   MET 105           HA       MET 105 -12.186   6.066  -0.385
  834   1HB   MET 105          1HB       MET 105 -11.390   4.586   1.209
  835   2HB   MET 105          2HB       MET 105 -10.126   3.967   0.154
  836   1HG   MET 105          1HG       MET 105  -8.660   5.593   0.718
  837   2HG   MET 105          2HG       MET 105  -9.920   6.802   0.950
  838   1HE   MET 105          1HE       MET 105  -7.369   4.794   2.295
  839   2HE   MET 105          2HE       MET 105  -7.642   4.615   4.029
  840   3HE   MET 105          3HE       MET 105  -8.361   3.466   2.899
  841    H    GLU 106           H        GLU 106 -11.219   8.016  -0.615
  842    HA   GLU 106           HA       GLU 106  -8.823   8.181  -2.308
  843   1HB   GLU 106          1HB       GLU 106 -11.416   9.006  -3.060
  844   2HB   GLU 106          2HB       GLU 106 -10.507  10.473  -2.724
  845   1HG   GLU 106          1HG       GLU 106  -8.699   9.501  -4.228
  846   2HG   GLU 106          2HG       GLU 106  -9.917   8.333  -4.738
  847    H    CYS 107           H        CYS 107  -7.332   8.861  -0.894
  848    HA   CYS 107           HA       CYS 107  -7.841  11.381   0.507
  849   1HB   CYS 107          1HB       CYS 107  -6.490   9.043   1.859
  850   2HB   CYS 107          2HB       CYS 107  -6.942  10.581   2.582
  851    HG   CYS 107           HG       CYS 107  -9.518  10.088   2.932
  852    H    GLY 108           H        GLY 108  -5.643  12.091   1.592
  853   1HA   GLY 108          1HA       GLY 108  -3.510  12.853   1.228
  854   2HA   GLY 108          2HA       GLY 108  -3.191  11.280   0.513
  855    H    ALA 109           H        ALA 109  -1.750  12.907  -0.722
  856    HA   ALA 109           HA       ALA 109  -3.249  13.987  -3.016
  857   1HB   ALA 109          1HB       ALA 109  -0.669  14.999  -3.163
  858   2HB   ALA 109          2HB       ALA 109  -2.108  15.851  -2.601
  859   3HB   ALA 109          3HB       ALA 109  -1.060  15.034  -1.443
  860    HA   PRO 110           HA       PRO 110  -1.379  11.134  -5.778
  861   1HB   PRO 110          1HB       PRO 110  -1.017  12.660  -7.994
  862   2HB   PRO 110          2HB       PRO 110  -2.609  12.115  -7.453
  863   1HG   PRO 110          1HG       PRO 110  -1.279  14.767  -7.055
  864   2HG   PRO 110          2HG       PRO 110  -2.960  14.413  -7.495
  865   1HD   PRO 110          1HD       PRO 110  -2.220  15.064  -4.973
  866   2HD   PRO 110          2HD       PRO 110  -3.566  13.959  -5.318
  867    H    ARG 111           H        ARG 111   0.585  11.113  -4.360
  868    HA   ARG 111           HA       ARG 111   2.878  12.320  -5.762
  869   1HB   ARG 111          1HB       ARG 111   4.015  12.621  -3.704
  870   2HB   ARG 111          2HB       ARG 111   2.386  13.231  -3.450
  871   1HG   ARG 111          1HG       ARG 111   1.771  11.191  -2.295
  872   2HG   ARG 111          2HG       ARG 111   3.372  10.515  -2.604
  873   1HD   ARG 111          1HD       ARG 111   2.650  12.856  -0.857
  874   2HD   ARG 111          2HD       ARG 111   3.386  11.329  -0.375
  875    HE   ARG 111           HE       ARG 111   4.726  13.634  -1.394
  876   1HH1  ARG 111          1HH1      ARG 111   4.840  10.159  -1.230
  877   2HH1  ARG 111          2HH1      ARG 111   6.559  10.075  -1.427
  878   1HH2  ARG 111          1HH2      ARG 111   6.991  13.538  -1.654
  879   2HH2  ARG 111          2HH2      ARG 111   7.782  11.998  -1.667
  880    H    SER 112           H        SER 112   4.828  11.087  -5.807
  881    HA   SER 112           HA       SER 112   5.074   8.474  -4.795
  882   1HB   SER 112          1HB       SER 112   3.251   8.272  -6.655
  883   2HB   SER 112          2HB       SER 112   4.618   8.395  -7.762
  884    HG   SER 112           HG       SER 112   4.060   6.405  -5.845
  885    H    GLN 113           H        GLN 113   6.772  10.578  -4.781
  886    HA   GLN 113           HA       GLN 113   9.078   9.485  -6.101
  887   1HB   GLN 113          1HB       GLN 113   7.634  11.470  -7.468
  888   2HB   GLN 113          2HB       GLN 113   9.039  12.286  -6.795
  889   1HG   GLN 113          1HG       GLN 113  10.484  11.210  -8.146
  890   2HG   GLN 113          2HG       GLN 113   9.561   9.709  -8.119
  891   1HE2  GLN 113          1HE2      GLN 113  10.767  11.390 -10.305
  892   2HE2  GLN 113          2HE2      GLN 113   9.480  11.611 -11.435
  893    H    GLY 114           H        GLY 114  10.968  10.046  -5.093
  894   1HA   GLY 114          1HA       GLY 114  11.114  12.326  -3.331
  895   2HA   GLY 114          2HA       GLY 114  11.041  10.788  -2.483
  896    H    GLN 115           H        GLN 115  12.631  11.307  -5.577
  897    HA   GLN 115           HA       GLN 115  15.169  10.560  -4.305
  898   1HB   GLN 115          1HB       GLN 115  15.911   9.898  -6.533
  899   2HB   GLN 115          2HB       GLN 115  14.401   9.098  -6.120
  900   1HG   GLN 115          1HG       GLN 115  13.157  10.472  -7.568
  901   2HG   GLN 115          2HG       GLN 115  14.490  11.609  -7.759
  902   1HE2  GLN 115          1HE2      GLN 115  13.768  11.106 -10.055
  903   2HE2  GLN 115          2HE2      GLN 115  14.609   9.827 -10.855
  904    H    ARG 116           H        ARG 116  17.039  11.438  -5.986
  905    HA   ARG 116           HA       ARG 116  16.959  14.308  -5.570
  906   1HB   ARG 116          1HB       ARG 116  19.343  14.218  -6.276
  907   2HB   ARG 116          2HB       ARG 116  18.978  13.170  -4.912
  908   1HG   ARG 116          1HG       ARG 116  19.314  11.257  -6.107
  909   2HG   ARG 116          2HG       ARG 116  18.865  12.006  -7.641
  910   1HD   ARG 116          1HD       ARG 116  21.039  12.164  -8.087
  911   2HD   ARG 116          2HD       ARG 116  21.128  13.394  -6.827
  912    HE   ARG 116           HE       ARG 116  22.235  11.896  -5.503
  913   1HH1  ARG 116          1HH1      ARG 116  20.650  10.171  -8.078
  914   2HH1  ARG 116          2HH1      ARG 116  21.382   8.651  -7.686
  915   1HH2  ARG 116          1HH2      ARG 116  23.205   9.900  -4.976
  916   2HH2  ARG 116          2HH2      ARG 116  22.834   8.497  -5.921
  Start of MODEL    9
    1    HA   PRO   2           HA       PRO   2  37.447   5.197  12.552
    2   1HB   PRO   2          1HB       PRO   2  34.974   6.313  12.448
    3   2HB   PRO   2          2HB       PRO   2  36.305   7.011  13.379
    4   1HG   PRO   2          1HG       PRO   2  35.287   7.772  10.669
    5   2HG   PRO   2          2HG       PRO   2  35.774   8.818  12.015
    6   1HD   PRO   2          1HD       PRO   2  37.388   8.320   9.899
    7   2HD   PRO   2          2HD       PRO   2  38.018   8.604  11.534
    8    H    SER   3           H        SER   3  35.576   3.723  12.513
    9    HA   SER   3           HA       SER   3  34.547   3.134   9.833
   10   1HB   SER   3          1HB       SER   3  34.993   0.701  10.212
   11   2HB   SER   3          2HB       SER   3  36.458   1.668  10.048
   12    HG   SER   3           HG       SER   3  35.305   0.970  12.542
   13    H    LYS   4           H        LYS   4  33.033   1.013  10.201
   14    HA   LYS   4           HA       LYS   4  31.630   0.760  12.609
   15   1HB   LYS   4          1HB       LYS   4  29.499   1.918  11.904
   16   2HB   LYS   4          2HB       LYS   4  30.824   2.982  12.354
   17   1HG   LYS   4          1HG       LYS   4  30.897   2.418   9.535
   18   2HG   LYS   4          2HG       LYS   4  29.316   3.044  10.009
   19   1HD   LYS   4          1HD       LYS   4  30.150   5.079  10.605
   20   2HD   LYS   4          2HD       LYS   4  31.707   4.416  11.105
   21   1HE   LYS   4          1HE       LYS   4  31.608   3.934   8.377
   22   2HE   LYS   4          2HE       LYS   4  30.892   5.536   8.554
   23   1HZ   LYS   4          1HZ       LYS   4  33.094   5.560  10.186
   24   2HZ   LYS   4          2HZ       LYS   4  32.958   6.297   8.670
   25   3HZ   LYS   4          3HZ       LYS   4  33.616   4.744   8.798
   26    H    LYS   5           H        LYS   5  30.999  -1.276  12.410
   27    HA   LYS   5           HA       LYS   5  29.911  -2.170   9.820
   28   1HB   LYS   5          1HB       LYS   5  31.857  -3.352  11.647
   29   2HB   LYS   5          2HB       LYS   5  30.558  -4.463  11.232
   30   1HG   LYS   5          1HG       LYS   5  31.015  -3.972   8.826
   31   2HG   LYS   5          2HG       LYS   5  32.433  -3.058   9.346
   32   1HD   LYS   5          1HD       LYS   5  32.751  -5.418  10.688
   33   2HD   LYS   5          2HD       LYS   5  32.012  -5.952   9.177
   34   1HE   LYS   5          1HE       LYS   5  34.066  -5.872   8.310
   35   2HE   LYS   5          2HE       LYS   5  33.896  -4.118   8.350
   36   1HZ   LYS   5          1HZ       LYS   5  35.000  -4.028  10.436
   37   2HZ   LYS   5          2HZ       LYS   5  35.952  -4.981   9.413
   38   3HZ   LYS   5          3HZ       LYS   5  34.992  -5.712  10.599
   39    H    ASN   6           H        ASN   6  27.954  -3.163   9.760
   40    HA   ASN   6           HA       ASN   6  26.642  -3.883  12.270
   41   1HB   ASN   6          1HB       ASN   6  26.082  -1.474  10.913
   42   2HB   ASN   6          2HB       ASN   6  24.732  -2.552  10.572
   43   1HD2  ASN   6          1HD2      ASN   6  25.789  -0.251  12.613
   44   2HD2  ASN   6          2HD2      ASN   6  24.886  -0.661  14.027
   45    H    GLY   7           H        GLY   7  24.165  -4.519  11.403
   46   1HA   GLY   7          1HA       GLY   7  24.707  -6.854   9.764
   47   2HA   GLY   7          2HA       GLY   7  23.212  -6.501  10.618
   48    H    ARG   8           H        ARG   8  24.498  -6.864   7.635
   49    HA   ARG   8           HA       ARG   8  22.590  -4.985   6.407
   50   1HB   ARG   8          1HB       ARG   8  25.287  -5.149   5.952
   51   2HB   ARG   8          2HB       ARG   8  24.642  -6.153   4.661
   52   1HG   ARG   8          1HG       ARG   8  23.261  -4.324   3.883
   53   2HG   ARG   8          2HG       ARG   8  23.812  -3.315   5.222
   54   1HD   ARG   8          1HD       ARG   8  25.939  -4.497   3.567
   55   2HD   ARG   8          2HD       ARG   8  24.918  -3.312   2.753
   56    HE   ARG   8           HE       ARG   8  25.817  -2.385   5.296
   57   1HH1  ARG   8          1HH1      ARG   8  26.760  -2.809   1.972
   58   2HH1  ARG   8          2HH1      ARG   8  27.930  -1.531   2.005
   59   1HH2  ARG   8          1HH2      ARG   8  27.354  -0.701   5.352
   60   2HH2  ARG   8          2HH2      ARG   8  28.268  -0.333   3.928
   61    H    SER   9           H        SER   9  20.830  -5.915   5.624
   62    HA   SER   9           HA       SER   9  21.014  -8.695   4.660
   63   1HB   SER   9          1HB       SER   9  18.876  -7.249   6.183
   64   2HB   SER   9          2HB       SER   9  18.429  -8.582   5.120
   65    HG   SER   9           HG       SER   9  19.236  -9.938   6.508
   66    H    GLY  10           H        GLY  10  19.326  -9.244   2.993
   67   1HA   GLY  10          1HA       GLY  10  19.596  -7.486   0.780
   68   2HA   GLY  10          2HA       GLY  10  18.606  -8.937   0.832
   69    HA   PRO  11           HA       PRO  11  14.908  -6.601   1.034
   70   1HB   PRO  11          1HB       PRO  11  13.448  -7.813   2.976
   71   2HB   PRO  11          2HB       PRO  11  13.751  -8.552   1.399
   72   1HG   PRO  11          1HG       PRO  11  15.129  -9.034   4.013
   73   2HG   PRO  11          2HG       PRO  11  14.602 -10.208   2.793
   74   1HD   PRO  11          1HD       PRO  11  17.173  -9.387   3.009
   75   2HD   PRO  11          2HD       PRO  11  16.440  -9.833   1.455
   76    H    GLN  12           H        GLN  12  14.588  -4.609   1.782
   77    HA   GLN  12           HA       GLN  12  14.940  -4.105   4.660
   78   1HB   GLN  12          1HB       GLN  12  16.227  -2.793   2.359
   79   2HB   GLN  12          2HB       GLN  12  15.558  -1.691   3.556
   80   1HG   GLN  12          1HG       GLN  12  17.046  -2.302   5.160
   81   2HG   GLN  12          2HG       GLN  12  17.215  -3.942   4.537
   82   1HE2  GLN  12          1HE2      GLN  12  18.700  -1.005   4.855
   83   2HE2  GLN  12          2HE2      GLN  12  19.919  -1.175   3.643
   84    HA   PRO  13           HA       PRO  13  11.029  -2.122   4.649
   85   1HB   PRO  13          1HB       PRO  13  11.424  -0.030   6.334
   86   2HB   PRO  13          2HB       PRO  13  11.337  -1.706   6.888
   87   1HG   PRO  13          1HG       PRO  13  13.745  -0.004   6.374
   88   2HG   PRO  13          2HG       PRO  13  13.425  -1.112   7.721
   89   1HD   PRO  13          1HD       PRO  13  14.996  -1.786   5.621
   90   2HD   PRO  13          2HD       PRO  13  14.004  -2.974   6.492
   91    H    HIS  14           H        HIS  14   9.844  -0.464   3.723
   92    HA   HIS  14           HA       HIS  14  11.317   1.791   2.565
   93   1HB   HIS  14          1HB       HIS  14   9.481  -0.072   1.049
   94   2HB   HIS  14          2HB       HIS  14  10.017   1.490   0.435
   95    HD1  HIS  14           1HD      HIS  14  11.231  -1.978   1.138
   96    HD2  HIS  14           2HD      HIS  14  12.656   1.575  -0.477
   97    HE1  HIS  14           1HE      HIS  14  13.415  -2.567   0.038
   98    H    LYS  15           H        LYS  15   9.569   3.279   1.415
   99    HA   LYS  15           HA       LYS  15   7.486   3.728   3.437
  100   1HB   LYS  15          1HB       LYS  15   7.405   6.042   2.418
  101   2HB   LYS  15          2HB       LYS  15   8.899   5.627   3.248
  102   1HG   LYS  15          1HG       LYS  15   9.086   4.909   0.478
  103   2HG   LYS  15          2HG       LYS  15   8.596   6.597   0.641
  104   1HD   LYS  15          1HD       LYS  15  10.497   6.901   2.245
  105   2HD   LYS  15          2HD       LYS  15  11.028   5.270   1.830
  106   1HE   LYS  15          1HE       LYS  15  11.724   5.879  -0.253
  107   2HE   LYS  15          2HE       LYS  15  10.514   7.152  -0.404
  108   1HZ   LYS  15          1HZ       LYS  15  11.792   8.605   0.896
  109   2HZ   LYS  15          2HZ       LYS  15  12.898   7.888  -0.164
  110   3HZ   LYS  15          3HZ       LYS  15  12.814   7.373   1.445
  111    H    ARG  16           H        ARG  16   7.505   1.946   0.928
  112    HA   ARG  16           HA       ARG  16   4.863   2.804   0.000
  113   1HB   ARG  16          1HB       ARG  16   7.084   1.924  -1.853
  114   2HB   ARG  16          2HB       ARG  16   5.438   2.323  -2.326
  115   1HG   ARG  16          1HG       ARG  16   5.745   4.599  -1.918
  116   2HG   ARG  16          2HG       ARG  16   7.185   4.320  -0.938
  117   1HD   ARG  16          1HD       ARG  16   8.117   3.300  -3.169
  118   2HD   ARG  16          2HD       ARG  16   6.867   4.304  -3.903
  119    HE   ARG  16           HE       ARG  16   8.484   5.750  -2.039
  120   1HH1  ARG  16          1HH1      ARG  16   8.316   4.566  -5.309
  121   2HH1  ARG  16          2HH1      ARG  16   9.387   5.773  -5.939
  122   1HH2  ARG  16          1HH2      ARG  16   9.895   7.344  -2.857
  123   2HH2  ARG  16          2HH2      ARG  16  10.285   7.352  -4.544
  124    H    TRP  17           H        TRP  17   3.455   1.193   0.148
  125    HA   TRP  17           HA       TRP  17   4.277  -1.541  -0.409
  126   1HB   TRP  17          1HB       TRP  17   3.246  -0.625   2.273
  127   2HB   TRP  17          2HB       TRP  17   3.116  -2.299   1.740
  128    HD1  TRP  17           HD       TRP  17   5.607   0.230   3.068
  129    HE1  TRP  17           1HE      TRP  17   7.839  -0.957   3.550
  130    HE3  TRP  17           3HE      TRP  17   4.602  -4.295   0.912
  131    HZ2  TRP  17           2HZ      TRP  17   9.018  -3.478   3.079
  132    HZ3  TRP  17           3HZ      TRP  17   6.336  -6.040   0.971
  133    HH2  TRP  17           HH       TRP  17   8.498  -5.638   2.032
  134    H    VAL  18           H        VAL  18   2.685  -2.721  -1.325
  135    HA   VAL  18           HA       VAL  18   0.042  -1.446  -1.541
  136    HB   VAL  18           HB       VAL  18  -0.281  -2.705  -3.598
  137   1HG1  VAL  18          1HG1      VAL  18   1.634  -1.696  -4.933
  138   2HG1  VAL  18          2HG1      VAL  18   0.675  -0.583  -3.955
  139   3HG1  VAL  18          3HG1      VAL  18   2.260  -1.113  -3.391
  140   1HG2  VAL  18          1HG2      VAL  18   2.414  -3.639  -4.000
  141   2HG2  VAL  18          2HG2      VAL  18   1.705  -4.376  -2.563
  142   3HG2  VAL  18          3HG2      VAL  18   0.892  -4.521  -4.122
  143    H    PHE  19           H        PHE  19  -1.825  -2.909  -1.705
  144    HA   PHE  19           HA       PHE  19  -1.457  -5.495  -0.380
  145   1HB   PHE  19          1HB       PHE  19  -3.407  -5.017   1.099
  146   2HB   PHE  19          2HB       PHE  19  -2.012  -3.996   1.432
  147    HD1  PHE  19           1HD      PHE  19  -2.001  -1.639   0.578
  148    HD2  PHE  19           2HD      PHE  19  -5.478  -4.091   0.503
  149    HE1  PHE  19           1HE      PHE  19  -3.405   0.366   0.322
  150    HE2  PHE  19           2HE      PHE  19  -6.888  -2.091   0.246
  151    HZ   PHE  19           HZ       PHE  19  -5.852   0.141   0.155
  152    H    THR  20           H        THR  20  -2.960  -7.054  -0.918
  153    HA   THR  20           HA       THR  20  -5.226  -6.345  -2.598
  154    HB   THR  20           HB       THR  20  -4.638  -7.843  -4.412
  155    HG1  THR  20           1HG      THR  20  -2.041  -8.170  -3.351
  156   1HG2  THR  20          1HG2      THR  20  -2.812  -6.596  -5.412
  157   2HG2  THR  20          2HG2      THR  20  -2.332  -5.981  -3.830
  158   3HG2  THR  20          3HG2      THR  20  -3.874  -5.496  -4.535
  159    H    LEU  21           H        LEU  21  -6.923  -7.586  -2.122
  160    HA   LEU  21           HA       LEU  21  -6.491 -10.305  -1.127
  161   1HB   LEU  21          1HB       LEU  21  -6.674  -8.873   0.844
  162   2HB   LEU  21          2HB       LEU  21  -8.207  -8.240   0.247
  163    HG   LEU  21           HG       LEU  21  -8.737 -10.904   0.336
  164   1HD1  LEU  21          1HD1      LEU  21  -7.128 -10.382   2.817
  165   2HD1  LEU  21          2HD1      LEU  21  -6.452 -11.195   1.406
  166   3HD1  LEU  21          3HD1      LEU  21  -7.826 -11.902   2.256
  167   1HD2  LEU  21          1HD2      LEU  21  -9.811  -8.714   1.375
  168   2HD2  LEU  21          2HD2      LEU  21  -9.101  -9.369   2.851
  169   3HD2  LEU  21          3HD2      LEU  21 -10.260 -10.327   1.928
  170    H    ASN  22           H        ASN  22  -7.924 -11.742  -1.898
  171    HA   ASN  22           HA       ASN  22  -9.903 -10.816  -3.789
  172   1HB   ASN  22          1HB       ASN  22  -8.604 -12.743  -4.419
  173   2HB   ASN  22          2HB       ASN  22  -9.040 -13.585  -2.935
  174   1HD2  ASN  22          1HD2      ASN  22 -10.342 -12.263  -5.926
  175   2HD2  ASN  22          2HD2      ASN  22 -11.673 -13.360  -6.044
  176    H    ASN  23           H        ASN  23 -12.072 -10.810  -3.546
  177    HA   ASN  23           HA       ASN  23 -14.067 -10.693  -2.448
  178   1HB   ASN  23          1HB       ASN  23 -13.039 -13.365  -1.478
  179   2HB   ASN  23          2HB       ASN  23 -14.678 -12.792  -1.185
  180   1HD2  ASN  23          1HD2      ASN  23 -15.865 -14.114  -2.404
  181   2HD2  ASN  23          2HD2      ASN  23 -15.679 -14.326  -4.109
  182    HA   PRO  24           HA       PRO  24 -11.990  -9.213   1.470
  183   1HB   PRO  24          1HB       PRO  24 -12.666  -6.603   1.149
  184   2HB   PRO  24          2HB       PRO  24 -11.190  -7.303   0.473
  185   1HG   PRO  24          1HG       PRO  24 -13.809  -6.748  -0.867
  186   2HG   PRO  24          2HG       PRO  24 -12.164  -6.463  -1.464
  187   1HD   PRO  24          1HD       PRO  24 -13.642  -8.598  -2.231
  188   2HD   PRO  24          2HD       PRO  24 -11.874  -8.663  -2.088
  189    H    SER  25           H        SER  25 -13.048  -8.887   3.377
  190    HA   SER  25           HA       SER  25 -15.941  -9.101   3.317
  191   1HB   SER  25          1HB       SER  25 -13.803  -9.608   5.291
  192   2HB   SER  25          2HB       SER  25 -15.320  -9.011   5.963
  193    HG   SER  25           HG       SER  25 -16.065 -10.945   5.704
  194    H    GLU  26           H        GLU  26 -17.257  -7.767   4.814
  195    HA   GLU  26           HA       GLU  26 -16.916  -5.023   4.265
  196   1HB   GLU  26          1HB       GLU  26 -18.866  -6.706   5.631
  197   2HB   GLU  26          2HB       GLU  26 -18.678  -5.137   6.401
  198   1HG   GLU  26          1HG       GLU  26 -19.596  -4.019   4.670
  199   2HG   GLU  26          2HG       GLU  26 -18.949  -5.131   3.464
  200    H    ASP  27           H        ASP  27 -15.969  -7.033   6.947
  201    HA   ASP  27           HA       ASP  27 -15.392  -4.843   8.719
  202   1HB   ASP  27          1HB       ASP  27 -14.627  -7.767   8.853
  203   2HB   ASP  27          2HB       ASP  27 -14.346  -6.596  10.139
  204    H    GLU  28           H        GLU  28 -13.496  -7.033   6.676
  205    HA   GLU  28           HA       GLU  28 -10.973  -5.942   7.404
  206   1HB   GLU  28          1HB       GLU  28 -11.838  -8.148   5.973
  207   2HB   GLU  28          2HB       GLU  28 -11.082  -7.141   4.746
  208   1HG   GLU  28          1HG       GLU  28  -9.772  -7.992   7.318
  209   2HG   GLU  28          2HG       GLU  28  -9.541  -8.776   5.756
  210    H    ARG  29           H        ARG  29 -13.139  -5.442   4.638
  211    HA   ARG  29           HA       ARG  29 -11.482  -3.633   3.253
  212   1HB   ARG  29          1HB       ARG  29 -13.341  -4.751   2.155
  213   2HB   ARG  29          2HB       ARG  29 -14.488  -3.946   3.217
  214   1HG   ARG  29          1HG       ARG  29 -13.052  -1.871   2.072
  215   2HG   ARG  29          2HG       ARG  29 -13.283  -3.027   0.758
  216   1HD   ARG  29          1HD       ARG  29 -15.640  -2.504   2.453
  217   2HD   ARG  29          2HD       ARG  29 -15.096  -1.157   1.454
  218    HE   ARG  29           HE       ARG  29 -15.348  -3.653   0.038
  219   1HH1  ARG  29          1HH1      ARG  29 -16.970  -0.755   1.084
  220   2HH1  ARG  29          2HH1      ARG  29 -18.183  -0.832  -0.150
  221   1HH2  ARG  29          1HH2      ARG  29 -16.940  -3.765  -1.592
  222   2HH2  ARG  29          2HH2      ARG  29 -18.166  -2.546  -1.671
  223    H    LYS  30           H        LYS  30 -13.956  -3.177   5.724
  224    HA   LYS  30           HA       LYS  30 -13.993  -0.337   5.581
  225   1HB   LYS  30          1HB       LYS  30 -15.875  -1.509   6.533
  226   2HB   LYS  30          2HB       LYS  30 -14.851  -2.249   7.757
  227   1HG   LYS  30          1HG       LYS  30 -14.536  -0.177   8.869
  228   2HG   LYS  30          2HG       LYS  30 -15.274   0.719   7.540
  229   1HD   LYS  30          1HD       LYS  30 -16.733  -1.330   9.201
  230   2HD   LYS  30          2HD       LYS  30 -16.751   0.403   9.538
  231   1HE   LYS  30          1HE       LYS  30 -17.375   0.223   6.842
  232   2HE   LYS  30          2HE       LYS  30 -18.241  -1.126   7.575
  233   1HZ   LYS  30          1HZ       LYS  30 -18.388   1.677   8.542
  234   2HZ   LYS  30          2HZ       LYS  30 -19.310   0.368   9.086
  235   3HZ   LYS  30          3HZ       LYS  30 -19.528   0.961   7.517
  236    H    LYS  31           H        LYS  31 -12.136  -2.677   7.427
  237    HA   LYS  31           HA       LYS  31 -11.004  -0.930   9.309
  238   1HB   LYS  31          1HB       LYS  31 -10.813  -3.283   9.663
  239   2HB   LYS  31          2HB       LYS  31 -10.013  -3.517   8.114
  240   1HG   LYS  31          1HG       LYS  31  -8.530  -1.664   9.732
  241   2HG   LYS  31          2HG       LYS  31  -8.821  -3.165  10.614
  242   1HD   LYS  31          1HD       LYS  31  -8.020  -3.547   7.822
  243   2HD   LYS  31          2HD       LYS  31  -6.799  -2.758   8.822
  244   1HE   LYS  31          1HE       LYS  31  -6.626  -5.246   8.757
  245   2HE   LYS  31          2HE       LYS  31  -6.801  -4.572  10.377
  246   1HZ   LYS  31          1HZ       LYS  31  -9.131  -5.547   8.839
  247   2HZ   LYS  31          2HZ       LYS  31  -9.009  -5.276  10.504
  248   3HZ   LYS  31          3HZ       LYS  31  -8.203  -6.586   9.800
  249    H    ILE  32           H        ILE  32  -9.786  -2.010   6.146
  250    HA   ILE  32           HA       ILE  32  -7.417  -0.464   6.226
  251    HB   ILE  32           HB       ILE  32  -8.930  -1.809   4.012
  252   1HG1  ILE  32          1HG1      ILE  32  -6.118  -2.168   5.069
  253   2HG1  ILE  32          2HG1      ILE  32  -7.505  -3.126   5.573
  254   1HG2  ILE  32          1HG2      ILE  32  -6.977  -1.167   2.534
  255   2HG2  ILE  32          2HG2      ILE  32  -8.135   0.112   2.896
  256   3HG2  ILE  32          3HG2      ILE  32  -6.589   0.058   3.742
  257   1HD1  ILE  32          1HD1      ILE  32  -7.257  -4.484   3.847
  258   2HD1  ILE  32          2HD1      ILE  32  -7.272  -3.134   2.713
  259   3HD1  ILE  32          3HD1      ILE  32  -5.758  -3.638   3.465
  260    H    ARG  33           H        ARG  33 -10.629   0.127   4.861
  261    HA   ARG  33           HA       ARG  33  -9.951   2.622   3.670
  262   1HB   ARG  33          1HB       ARG  33 -11.844   1.413   2.821
  263   2HB   ARG  33          2HB       ARG  33 -12.603   1.383   4.407
  264   1HG   ARG  33          1HG       ARG  33 -13.066   3.706   4.328
  265   2HG   ARG  33          2HG       ARG  33 -12.050   3.923   2.901
  266   1HD   ARG  33          1HD       ARG  33 -13.830   3.583   1.619
  267   2HD   ARG  33          2HD       ARG  33 -13.945   1.943   2.255
  268    HE   ARG  33           HE       ARG  33 -15.133   3.788   4.042
  269   1HH1  ARG  33          1HH1      ARG  33 -15.657   2.193   0.992
  270   2HH1  ARG  33          2HH1      ARG  33 -17.385   2.255   1.109
  271   1HH2  ARG  33          1HH2      ARG  33 -17.407   3.875   4.207
  272   2HH2  ARG  33          2HH2      ARG  33 -18.379   3.212   2.937
  273    H    ASP  34           H        ASP  34 -10.724   1.640   6.866
  274    HA   ASP  34           HA       ASP  34 -11.349   4.379   7.693
  275   1HB   ASP  34          1HB       ASP  34 -11.566   1.720   9.106
  276   2HB   ASP  34          2HB       ASP  34 -11.799   3.259   9.930
  277    H    LEU  35           H        LEU  35  -8.641   2.868   7.046
  278    HA   LEU  35           HA       LEU  35  -7.098   2.996   9.405
  279   1HB   LEU  35          1HB       LEU  35  -6.488   2.902   6.486
  280   2HB   LEU  35          2HB       LEU  35  -5.192   3.252   7.627
  281    HG   LEU  35           HG       LEU  35  -6.906   0.771   7.705
  282   1HD1  LEU  35          1HD1      LEU  35  -4.948  -0.384   6.803
  283   2HD1  LEU  35          2HD1      LEU  35  -4.124   1.163   6.610
  284   3HD1  LEU  35          3HD1      LEU  35  -5.574   0.814   5.670
  285   1HD2  LEU  35          1HD2      LEU  35  -5.182  -0.049   9.232
  286   2HD2  LEU  35          2HD2      LEU  35  -5.963   1.401   9.863
  287   3HD2  LEU  35          3HD2      LEU  35  -4.357   1.507   9.141
  288    HA   PRO  36           HA       PRO  36  -6.132   7.244   9.916
  289   1HB   PRO  36          1HB       PRO  36  -3.509   7.170  10.611
  290   2HB   PRO  36          2HB       PRO  36  -4.804   6.633  11.688
  291   1HG   PRO  36          1HG       PRO  36  -2.997   5.007   9.941
  292   2HG   PRO  36          2HG       PRO  36  -3.514   4.699  11.609
  293   1HD   PRO  36          1HD       PRO  36  -4.636   3.454   9.483
  294   2HD   PRO  36          2HD       PRO  36  -5.552   3.845  10.953
  295    H    ILE  37           H        ILE  37  -6.050   8.628   8.264
  296    HA   ILE  37           HA       ILE  37  -4.519   8.198   5.914
  297    HB   ILE  37           HB       ILE  37  -5.168  10.561   5.353
  298   1HG1  ILE  37          1HG1      ILE  37  -6.704  10.369   7.952
  299   2HG1  ILE  37          2HG1      ILE  37  -5.279  11.370   7.698
  300   1HG2  ILE  37          1HG2      ILE  37  -6.730   8.225   5.511
  301   2HG2  ILE  37          2HG2      ILE  37  -7.771   9.565   5.989
  302   3HG2  ILE  37          3HG2      ILE  37  -6.945   9.603   4.432
  303   1HD1  ILE  37          1HD1      ILE  37  -8.062  11.794   6.873
  304   2HD1  ILE  37          2HD1      ILE  37  -6.802  12.958   7.279
  305   3HD1  ILE  37          3HD1      ILE  37  -6.841  12.224   5.676
  306    H    SER  38           H        SER  38  -4.005  10.054   8.844
  307    HA   SER  38           HA       SER  38  -1.813  11.588   7.919
  308   1HB   SER  38          1HB       SER  38  -3.021  10.951  10.556
  309   2HB   SER  38          2HB       SER  38  -1.343  11.493  10.567
  310    HG   SER  38           HG       SER  38  -3.605  12.847   9.530
  311    H    LEU  39           H        LEU  39  -2.126   8.310   8.898
  312    HA   LEU  39           HA       LEU  39   0.588   7.877   9.667
  313   1HB   LEU  39          1HB       LEU  39  -1.683   6.470   9.978
  314   2HB   LEU  39          2HB       LEU  39  -0.987   5.618   8.601
  315    HG   LEU  39           HG       LEU  39   0.809   6.063  10.906
  316   1HD1  LEU  39          1HD1      LEU  39  -1.417   4.034  11.023
  317   2HD1  LEU  39          2HD1      LEU  39  -1.330   5.501  11.996
  318   3HD1  LEU  39          3HD1      LEU  39  -0.113   4.241  12.192
  319   1HD2  LEU  39          1HD2      LEU  39   1.942   4.441   9.896
  320   2HD2  LEU  39          2HD2      LEU  39   0.770   4.526   8.580
  321   3HD2  LEU  39          3HD2      LEU  39   0.536   3.376   9.897
  322    H    PHE  40           H        PHE  40  -1.158   7.853   6.655
  323    HA   PHE  40           HA       PHE  40   1.340   7.137   5.267
  324   1HB   PHE  40          1HB       PHE  40  -1.379   6.588   4.105
  325   2HB   PHE  40          2HB       PHE  40   0.172   5.889   3.653
  326    HD1  PHE  40           2HD      PHE  40  -2.560   5.820   6.097
  327    HD2  PHE  40           1HD      PHE  40   1.093   4.028   4.847
  328    HE1  PHE  40           2HE      PHE  40  -3.008   3.895   7.561
  329    HE2  PHE  40           1HE      PHE  40   0.650   2.099   6.309
  330    HZ   PHE  40           HZ       PHE  40  -1.402   2.031   7.669
  331    H    ASP  41           H        ASP  41   2.130   8.822   4.213
  332    HA   ASP  41           HA       ASP  41   0.882  11.257   3.819
  333   1HB   ASP  41          1HB       ASP  41   3.371  10.053   3.098
  334   2HB   ASP  41          2HB       ASP  41   2.735  10.901   1.692
  335    H    TYR  42           H        TYR  42   0.684   8.353   1.930
  336    HA   TYR  42           HA       TYR  42  -1.305   9.639   0.215
  337   1HB   TYR  42          1HB       TYR  42   0.772   9.728  -1.070
  338   2HB   TYR  42          2HB       TYR  42   1.015   8.002  -0.831
  339    HD1  TYR  42           1HD      TYR  42  -2.164   9.728  -1.670
  340    HD2  TYR  42           2HD      TYR  42   0.970   7.196  -3.037
  341    HE1  TYR  42           1HE      TYR  42  -3.438   9.269  -3.723
  342    HE2  TYR  42           2HE      TYR  42  -0.295   6.731  -5.095
  343    HH   TYR  42           HH       TYR  42  -2.390   6.860  -6.036
  344    H    PHE  43           H        PHE  43  -3.093   8.461   0.148
  345    HA   PHE  43           HA       PHE  43  -2.890   5.542   0.413
  346   1HB   PHE  43          1HB       PHE  43  -3.692   7.032   2.509
  347   2HB   PHE  43          2HB       PHE  43  -5.235   6.842   1.682
  348    HD1  PHE  43           1HD      PHE  43  -4.288   4.031   0.552
  349    HD2  PHE  43           2HD      PHE  43  -4.553   5.781   4.423
  350    HE1  PHE  43           1HE      PHE  43  -4.542   1.793   1.542
  351    HE2  PHE  43           2HE      PHE  43  -4.806   3.546   5.420
  352    HZ   PHE  43           HZ       PHE  43  -4.800   1.548   3.979
  353    H    ILE  44           H        ILE  44  -3.706   4.671  -1.364
  354    HA   ILE  44           HA       ILE  44  -6.209   5.749  -2.450
  355    HB   ILE  44           HB       ILE  44  -4.677   6.689  -3.962
  356   1HG1  ILE  44          1HG1      ILE  44  -5.062   4.203  -5.525
  357   2HG1  ILE  44          2HG1      ILE  44  -6.516   4.902  -4.820
  358   1HG2  ILE  44          1HG2      ILE  44  -2.620   5.739  -3.429
  359   2HG2  ILE  44          2HG2      ILE  44  -3.200   4.097  -3.700
  360   3HG2  ILE  44          3HG2      ILE  44  -2.919   5.170  -5.071
  361   1HD1  ILE  44          1HD1      ILE  44  -6.604   6.421  -6.420
  362   2HD1  ILE  44          2HD1      ILE  44  -4.962   6.956  -6.061
  363   3HD1  ILE  44          3HD1      ILE  44  -5.230   5.632  -7.194
  364    H    VAL  45           H        VAL  45  -7.665   4.180  -2.435
  365    HA   VAL  45           HA       VAL  45  -6.771   1.421  -2.967
  366    HB   VAL  45           HB       VAL  45  -9.227   2.031  -1.357
  367   1HG1  VAL  45          1HG1      VAL  45  -7.954  -0.251  -0.421
  368   2HG1  VAL  45          2HG1      VAL  45  -9.361  -0.189  -1.484
  369   3HG1  VAL  45          3HG1      VAL  45  -7.741  -0.315  -2.170
  370   1HG2  VAL  45          1HG2      VAL  45  -7.730   1.620   0.668
  371   2HG2  VAL  45          2HG2      VAL  45  -6.378   1.994  -0.402
  372   3HG2  VAL  45          3HG2      VAL  45  -7.625   3.204  -0.101
  373    H    GLY  46           H        GLY  46  -7.834   0.281  -4.499
  374   1HA   GLY  46          1HA       GLY  46 -10.283   1.475  -5.634
  375   2HA   GLY  46          2HA       GLY  46  -8.971   0.939  -6.674
  376    H    GLU  47           H        GLU  47 -11.925   0.109  -5.859
  377    HA   GLU  47           HA       GLU  47 -11.481  -2.714  -5.320
  378   1HB   GLU  47          1HB       GLU  47 -13.305  -1.599  -4.153
  379   2HB   GLU  47          2HB       GLU  47 -14.029  -1.129  -5.684
  380   1HG   GLU  47          1HG       GLU  47 -15.237  -2.977  -5.588
  381   2HG   GLU  47          2HG       GLU  47 -13.752  -3.888  -5.855
  382    H    GLU  48           H        GLU  48 -11.639  -4.323  -6.775
  383    HA   GLU  48           HA       GLU  48 -12.148  -3.556  -9.563
  384   1HB   GLU  48          1HB       GLU  48  -9.964  -4.712  -8.746
  385   2HB   GLU  48          2HB       GLU  48 -10.943  -6.172  -8.719
  386   1HG   GLU  48          1HG       GLU  48 -11.151  -4.631 -11.197
  387   2HG   GLU  48          2HG       GLU  48  -9.540  -5.264 -10.861
  388    H    GLY  49           H        GLY  49 -14.024  -4.101 -10.445
  389   1HA   GLY  49          1HA       GLY  49 -15.265  -6.652  -9.737
  390   2HA   GLY  49          2HA       GLY  49 -16.205  -5.197  -9.438
  391    H    ASN  50           H        ASN  50 -14.504  -6.982 -11.986
  392    HA   ASN  50           HA       ASN  50 -15.525  -5.547 -14.167
  393   1HB   ASN  50          1HB       ASN  50 -13.803  -7.697 -13.819
  394   2HB   ASN  50          2HB       ASN  50 -15.149  -8.386 -14.721
  395   1HD2  ASN  50          1HD2      ASN  50 -12.510  -8.061 -15.678
  396   2HD2  ASN  50          2HD2      ASN  50 -12.565  -6.966 -17.014
  397    H    GLU  51           H        GLU  51 -16.757  -7.260 -15.875
  398    HA   GLU  51           HA       GLU  51 -19.448  -7.090 -15.124
  399   1HB   GLU  51          1HB       GLU  51 -18.090  -8.700 -17.285
  400   2HB   GLU  51          2HB       GLU  51 -19.836  -8.604 -17.112
  401   1HG   GLU  51          1HG       GLU  51 -18.425  -6.025 -17.199
  402   2HG   GLU  51          2HG       GLU  51 -18.380  -6.977 -18.682
  403    H    GLU  52           H        GLU  52 -20.831  -9.278 -15.537
  404    HA   GLU  52           HA       GLU  52 -20.730 -10.718 -13.185
  405   1HB   GLU  52          1HB       GLU  52 -22.432 -10.622 -15.314
  406   2HB   GLU  52          2HB       GLU  52 -21.750 -12.232 -15.497
  407   1HG   GLU  52          1HG       GLU  52 -22.534 -11.644 -12.761
  408   2HG   GLU  52          2HG       GLU  52 -23.874 -11.541 -13.902
  409    H    GLY  53           H        GLY  53 -20.084 -12.856 -12.668
  410   1HA   GLY  53          1HA       GLY  53 -18.925 -14.880 -13.073
  411   2HA   GLY  53          2HA       GLY  53 -18.221 -14.160 -14.514
  412    H    ARG  54           H        ARG  54 -17.660 -11.701 -12.760
  413    HA   ARG  54           HA       ARG  54 -15.139 -12.745 -11.669
  414   1HB   ARG  54          1HB       ARG  54 -15.150 -10.949 -13.485
  415   2HB   ARG  54          2HB       ARG  54 -15.765  -9.856 -12.253
  416   1HG   ARG  54          1HG       ARG  54 -13.631  -9.404 -11.819
  417   2HG   ARG  54          2HG       ARG  54 -13.585 -10.980 -11.026
  418   1HD   ARG  54          1HD       ARG  54 -12.976 -10.523 -13.942
  419   2HD   ARG  54          2HD       ARG  54 -11.753 -10.611 -12.675
  420    HE   ARG  54           HE       ARG  54 -13.140 -12.801 -13.885
  421   1HH1  ARG  54          1HH1      ARG  54 -11.565 -11.709 -10.979
  422   2HH1  ARG  54          2HH1      ARG  54 -11.171 -13.306 -10.436
  423   1HH2  ARG  54          1HH2      ARG  54 -12.628 -14.910 -13.181
  424   2HH2  ARG  54          2HH2      ARG  54 -11.776 -15.126 -11.689
  425    H    THR  55           H        THR  55 -14.660 -12.559  -9.558
  426    HA   THR  55           HA       THR  55 -16.735 -11.574  -7.781
  427    HB   THR  55           HB       THR  55 -14.654 -12.385  -6.161
  428    HG1  THR  55           1HG      THR  55 -13.401 -13.310  -7.694
  429   1HG2  THR  55          1HG2      THR  55 -16.084 -14.674  -6.431
  430   2HG2  THR  55          2HG2      THR  55 -17.205 -13.498  -7.117
  431   3HG2  THR  55          3HG2      THR  55 -16.604 -13.289  -5.473
  432    HA   PRO  56           HA       PRO  56 -14.876  -7.759  -6.660
  433   1HB   PRO  56          1HB       PRO  56 -15.385  -7.636  -3.997
  434   2HB   PRO  56          2HB       PRO  56 -16.640  -7.436  -5.225
  435   1HG   PRO  56          1HG       PRO  56 -15.940  -9.857  -3.610
  436   2HG   PRO  56          2HG       PRO  56 -17.539  -9.205  -4.012
  437   1HD   PRO  56          1HD       PRO  56 -16.449 -11.303  -5.331
  438   2HD   PRO  56          2HD       PRO  56 -17.528 -10.135  -6.121
  439    H    HIS  57           H        HIS  57 -12.744  -7.440  -6.637
  440    HA   HIS  57           HA       HIS  57 -11.150  -8.769  -4.544
  441   1HB   HIS  57          1HB       HIS  57 -10.636  -9.647  -6.787
  442   2HB   HIS  57          2HB       HIS  57 -10.265  -8.016  -7.338
  443    HD1  HIS  57           1HD      HIS  57  -8.844 -10.887  -5.481
  444    HD2  HIS  57           2HD      HIS  57  -7.832  -6.946  -6.322
  445    HE1  HIS  57           1HE      HIS  57  -6.411 -10.676  -4.884
  446    H    LEU  58           H        LEU  58  -9.688  -7.554  -3.412
  447    HA   LEU  58           HA       LEU  58  -9.976  -4.661  -3.677
  448   1HB   LEU  58          1HB       LEU  58  -9.724  -6.440  -1.507
  449   2HB   LEU  58          2HB       LEU  58  -8.265  -5.451  -1.519
  450    HG   LEU  58           HG       LEU  58 -11.117  -4.505  -1.284
  451   1HD1  LEU  58          1HD1      LEU  58  -8.773  -4.668   0.570
  452   2HD1  LEU  58          2HD1      LEU  58 -10.434  -5.203   0.822
  453   3HD1  LEU  58          3HD1      LEU  58 -10.052  -3.481   0.826
  454   1HD2  LEU  58          1HD2      LEU  58 -10.471  -2.600  -2.229
  455   2HD2  LEU  58          2HD2      LEU  58  -8.796  -3.144  -2.325
  456   3HD2  LEU  58          3HD2      LEU  58  -9.388  -2.363  -0.858
  457    H    GLN  59           H        GLN  59  -8.388  -3.325  -4.321
  458    HA   GLN  59           HA       GLN  59  -5.626  -4.201  -4.363
  459   1HB   GLN  59          1HB       GLN  59  -6.244  -5.079  -6.476
  460   2HB   GLN  59          2HB       GLN  59  -7.201  -3.658  -6.872
  461   1HG   GLN  59          1HG       GLN  59  -5.162  -3.657  -8.147
  462   2HG   GLN  59          2HG       GLN  59  -5.146  -2.325  -6.993
  463   1HE2  GLN  59          1HE2      GLN  59  -3.695  -2.345  -5.305
  464   2HE2  GLN  59          2HE2      GLN  59  -2.372  -3.453  -5.221
  465    H    GLY  60           H        GLY  60  -4.650  -2.548  -3.396
  466   1HA   GLY  60          1HA       GLY  60  -4.964   0.124  -4.510
  467   2HA   GLY  60          2HA       GLY  60  -5.432  -0.065  -2.827
  468    H    PHE  61           H        PHE  61  -3.519   1.716  -3.288
  469    HA   PHE  61           HA       PHE  61  -1.093   0.364  -2.321
  470   1HB   PHE  61          1HB       PHE  61  -0.501   0.922  -4.536
  471   2HB   PHE  61          2HB       PHE  61  -1.320   2.478  -4.452
  472    HD1  PHE  61           2HD      PHE  61   1.318   0.730  -2.468
  473    HD2  PHE  61           1HD      PHE  61   0.102   4.265  -4.503
  474    HE1  PHE  61           2HE      PHE  61   3.442   1.809  -1.855
  475    HE2  PHE  61           1HE      PHE  61   2.225   5.350  -3.894
  476    HZ   PHE  61           HZ       PHE  61   3.898   4.122  -2.567
  477    H    ALA  62           H        ALA  62  -0.008   1.363  -0.675
  478    HA   ALA  62           HA       ALA  62  -0.985   3.985   0.220
  479   1HB   ALA  62          1HB       ALA  62  -1.994   3.085   1.979
  480   2HB   ALA  62          2HB       ALA  62  -1.409   1.477   1.549
  481   3HB   ALA  62          3HB       ALA  62  -0.418   2.537   2.552
  482    H    ASN  63           H        ASN  63   0.622   5.359   0.603
  483    HA   ASN  63           HA       ASN  63   3.354   4.343   0.700
  484   1HB   ASN  63          1HB       ASN  63   2.800   6.184  -0.858
  485   2HB   ASN  63          2HB       ASN  63   2.353   7.193   0.515
  486   1HD2  ASN  63          1HD2      ASN  63   4.810   6.296  -1.553
  487   2HD2  ASN  63          2HD2      ASN  63   6.146   6.961  -0.682
  488    H    PHE  64           H        PHE  64   4.205   3.899   2.615
  489    HA   PHE  64           HA       PHE  64   3.132   4.859   5.065
  490   1HB   PHE  64          1HB       PHE  64   5.136   2.951   4.222
  491   2HB   PHE  64          2HB       PHE  64   5.719   3.907   5.581
  492    HD1  PHE  64           2HD      PHE  64   4.145   4.100   7.616
  493    HD2  PHE  64           1HD      PHE  64   3.758   1.133   4.589
  494    HE1  PHE  64           2HE      PHE  64   2.838   2.700   9.161
  495    HE2  PHE  64           1HE      PHE  64   2.450  -0.272   6.129
  496    HZ   PHE  64           HZ       PHE  64   1.990   0.511   8.418
  497    H    VAL  65           H        VAL  65   3.610   6.620   6.214
  498    HA   VAL  65           HA       VAL  65   5.143   8.717   5.158
  499    HB   VAL  65           HB       VAL  65   4.181   8.249   7.981
  500   1HG1  VAL  65          1HG1      VAL  65   5.777  10.444   6.787
  501   2HG1  VAL  65          2HG1      VAL  65   4.486  10.890   7.905
  502   3HG1  VAL  65          3HG1      VAL  65   5.775   9.808   8.432
  503   1HG2  VAL  65          1HG2      VAL  65   3.107  10.167   5.928
  504   2HG2  VAL  65          2HG2      VAL  65   2.507   8.517   6.094
  505   3HG2  VAL  65          3HG2      VAL  65   2.357   9.649   7.438
  506    H    LYS  66           H        LYS  66   6.014   6.010   7.127
  507    HA   LYS  66           HA       LYS  66   8.761   7.058   7.300
  508   1HB   LYS  66          1HB       LYS  66   8.946   5.667   9.423
  509   2HB   LYS  66          2HB       LYS  66   7.987   7.137   9.529
  510   1HG   LYS  66          1HG       LYS  66   6.532   4.661   8.843
  511   2HG   LYS  66          2HG       LYS  66   7.171   4.781  10.484
  512   1HD   LYS  66          1HD       LYS  66   5.728   7.137   9.400
  513   2HD   LYS  66          2HD       LYS  66   4.768   5.715   9.815
  514   1HE   LYS  66          1HE       LYS  66   5.340   5.829  12.060
  515   2HE   LYS  66          2HE       LYS  66   6.788   6.784  11.745
  516   1HZ   LYS  66          1HZ       LYS  66   5.444   8.687  11.270
  517   2HZ   LYS  66          2HZ       LYS  66   4.963   8.064  12.767
  518   3HZ   LYS  66          3HZ       LYS  66   4.017   7.787  11.392
  519    H    LYS  67           H        LYS  67  10.143   4.940   8.131
  520    HA   LYS  67           HA       LYS  67   9.932   3.120   5.875
  521   1HB   LYS  67          1HB       LYS  67  12.050   4.129   7.515
  522   2HB   LYS  67          2HB       LYS  67  12.060   2.372   7.598
  523   1HG   LYS  67          1HG       LYS  67  13.480   2.909   5.820
  524   2HG   LYS  67          2HG       LYS  67  11.969   2.404   5.059
  525   1HD   LYS  67          1HD       LYS  67  11.395   4.587   4.474
  526   2HD   LYS  67          2HD       LYS  67  12.501   5.294   5.654
  527   1HE   LYS  67          1HE       LYS  67  13.844   3.624   3.678
  528   2HE   LYS  67          2HE       LYS  67  12.983   4.984   2.960
  529   1HZ   LYS  67          1HZ       LYS  67  14.429   5.787   5.272
  530   2HZ   LYS  67          2HZ       LYS  67  14.524   6.381   3.691
  531   3HZ   LYS  67          3HZ       LYS  67  15.458   5.047   4.151
  532    H    GLN  68           H        GLN  68   8.999   1.192   5.981
  533    HA   GLN  68           HA       GLN  68   8.881  -0.197   8.564
  534   1HB   GLN  68          1HB       GLN  68   6.559   0.111   6.652
  535   2HB   GLN  68          2HB       GLN  68   6.557  -0.873   8.110
  536   1HG   GLN  68          1HG       GLN  68   7.347   1.644   8.971
  537   2HG   GLN  68          2HG       GLN  68   6.076   1.952   7.788
  538   1HE2  GLN  68          1HE2      GLN  68   5.886   2.483  10.549
  539   2HE2  GLN  68          2HE2      GLN  68   4.640   1.480  11.201
  540    H    THR  69           H        THR  69   8.696  -2.482   8.428
  541    HA   THR  69           HA       THR  69   9.839  -3.549   5.962
  542    HB   THR  69           HB       THR  69  10.549  -5.428   7.191
  543    HG1  THR  69           1HG      THR  69   9.655  -6.037   9.128
  544   1HG2  THR  69          1HG2      THR  69  10.677  -3.051   9.051
  545   2HG2  THR  69          2HG2      THR  69  11.818  -3.429   7.760
  546   3HG2  THR  69          3HG2      THR  69  11.690  -4.490   9.163
  547    H    PHE  70           H        PHE  70   9.101  -5.848   5.402
  548    HA   PHE  70           HA       PHE  70   6.410  -5.761   4.609
  549   1HB   PHE  70          1HB       PHE  70   7.748  -7.106   3.258
  550   2HB   PHE  70          2HB       PHE  70   8.513  -7.897   4.632
  551    HD1  PHE  70           1HD      PHE  70   5.323  -7.645   2.762
  552    HD2  PHE  70           2HD      PHE  70   7.720  -9.943   5.425
  553    HE1  PHE  70           1HE      PHE  70   3.758  -9.530   2.538
  554    HE2  PHE  70           2HE      PHE  70   6.159 -11.832   5.205
  555    HZ   PHE  70           HZ       PHE  70   4.175 -11.627   3.760
  556    H    ASN  71           H        ASN  71   7.980  -7.813   7.066
  557    HA   ASN  71           HA       ASN  71   5.636  -9.028   8.005
  558   1HB   ASN  71          1HB       ASN  71   8.355  -9.197   8.578
  559   2HB   ASN  71          2HB       ASN  71   7.633  -8.651  10.089
  560   1HD2  ASN  71          1HD2      ASN  71   6.070  -9.955  11.100
  561   2HD2  ASN  71          2HD2      ASN  71   5.958 -11.646  10.759
  562    H    LYS  72           H        LYS  72   7.311  -6.090   9.041
  563    HA   LYS  72           HA       LYS  72   5.684  -5.542  11.279
  564   1HB   LYS  72          1HB       LYS  72   7.965  -4.502  10.483
  565   2HB   LYS  72          2HB       LYS  72   6.921  -3.340   9.675
  566   1HG   LYS  72          1HG       LYS  72   6.585  -3.943  12.587
  567   2HG   LYS  72          2HG       LYS  72   7.796  -2.788  12.024
  568   1HD   LYS  72          1HD       LYS  72   6.095  -1.442  10.975
  569   2HD   LYS  72          2HD       LYS  72   4.858  -2.644  11.353
  570   1HE   LYS  72          1HE       LYS  72   4.478  -1.307  13.127
  571   2HE   LYS  72          2HE       LYS  72   5.845  -2.181  13.818
  572   1HZ   LYS  72          1HZ       LYS  72   6.737   0.004  12.244
  573   2HZ   LYS  72          2HZ       LYS  72   7.028  -0.323  13.878
  574   3HZ   LYS  72          3HZ       LYS  72   5.645   0.538  13.421
  575    H    VAL  73           H        VAL  73   5.558  -4.329   7.937
  576    HA   VAL  73           HA       VAL  73   3.395  -2.617   8.173
  577    HB   VAL  73           HB       VAL  73   4.309  -4.308   5.854
  578   1HG1  VAL  73          1HG1      VAL  73   2.835  -2.827   4.460
  579   2HG1  VAL  73          2HG1      VAL  73   1.982  -4.002   5.461
  580   3HG1  VAL  73          3HG1      VAL  73   2.057  -2.311   5.955
  581   1HG2  VAL  73          1HG2      VAL  73   5.432  -2.441   5.117
  582   2HG2  VAL  73          2HG2      VAL  73   4.367  -1.327   5.973
  583   3HG2  VAL  73          3HG2      VAL  73   5.576  -2.250   6.864
  584    H    LYS  74           H        LYS  74   3.471  -6.081   8.156
  585    HA   LYS  74           HA       LYS  74   0.800  -6.592   7.415
  586   1HB   LYS  74          1HB       LYS  74   2.587  -8.218   9.234
  587   2HB   LYS  74          2HB       LYS  74   1.134  -8.795   8.427
  588   1HG   LYS  74          1HG       LYS  74   2.603  -7.843   6.333
  589   2HG   LYS  74          2HG       LYS  74   3.851  -8.476   7.408
  590   1HD   LYS  74          1HD       LYS  74   3.395 -10.461   6.477
  591   2HD   LYS  74          2HD       LYS  74   1.947 -10.448   7.486
  592   1HE   LYS  74          1HE       LYS  74   0.636  -9.541   5.696
  593   2HE   LYS  74          2HE       LYS  74   2.071  -9.302   4.701
  594   1HZ   LYS  74          1HZ       LYS  74   0.959 -11.255   3.960
  595   2HZ   LYS  74          2HZ       LYS  74   0.880 -11.892   5.525
  596   3HZ   LYS  74          3HZ       LYS  74   2.374 -11.749   4.744
  597    H    TRP  75           H        TRP  75   2.067  -5.104  10.154
  598    HA   TRP  75           HA       TRP  75   0.208  -5.994  12.112
  599   1HB   TRP  75          1HB       TRP  75   1.119  -4.346  13.522
  600   2HB   TRP  75          2HB       TRP  75   2.460  -4.814  12.480
  601    HD1  TRP  75           HD       TRP  75   1.736  -3.023   9.944
  602    HE1  TRP  75           1HE      TRP  75   2.040  -0.470  10.078
  603    HE3  TRP  75           3HE      TRP  75   1.638  -2.458  15.025
  604    HZ2  TRP  75           2HZ      TRP  75   2.215   1.519  12.073
  605    HZ3  TRP  75           3HZ      TRP  75   1.881  -0.197  15.965
  606    HH2  TRP  75           HH       TRP  75   2.164   1.749  14.518
  607    H    TYR  76           H        TYR  76   0.008  -3.790   9.497
  608    HA   TYR  76           HA       TYR  76  -2.510  -2.696  10.568
  609   1HB   TYR  76          1HB       TYR  76  -0.286  -1.475   9.107
  610   2HB   TYR  76          2HB       TYR  76  -1.861  -1.105   8.412
  611    HD1  TYR  76           2HD      TYR  76  -3.517  -1.028  10.888
  612    HD2  TYR  76           1HD      TYR  76   0.348   0.557  10.082
  613    HE1  TYR  76           2HE      TYR  76  -3.873   0.697  12.605
  614    HE2  TYR  76           1HE      TYR  76   0.004   2.285  11.798
  615    HH   TYR  76           HH       TYR  76  -2.015   2.178  14.136
  616    H    LEU  77           H        LEU  77  -0.937  -3.711   7.540
  617    HA   LEU  77           HA       LEU  77  -3.391  -3.864   6.090
  618   1HB   LEU  77          1HB       LEU  77  -0.627  -4.915   5.532
  619   2HB   LEU  77          2HB       LEU  77  -1.975  -5.096   4.411
  620    HG   LEU  77           HG       LEU  77  -0.951  -2.424   5.357
  621   1HD1  LEU  77          1HD1      LEU  77   0.503  -2.293   3.598
  622   2HD1  LEU  77          2HD1      LEU  77  -0.370  -3.488   2.639
  623   3HD1  LEU  77          3HD1      LEU  77   0.640  -4.008   3.988
  624   1HD2  LEU  77          1HD2      LEU  77  -2.131  -1.667   3.288
  625   2HD2  LEU  77          2HD2      LEU  77  -3.193  -2.301   4.546
  626   3HD2  LEU  77          3HD2      LEU  77  -2.799  -3.293   3.141
  627    H    GLY  78           H        GLY  78  -1.960  -5.856   8.397
  628   1HA   GLY  78          1HA       GLY  78  -2.584  -7.904   9.235
  629   2HA   GLY  78          2HA       GLY  78  -3.999  -7.818   8.195
  630    H    ALA  79           H        ALA  79  -2.443 -10.155   8.784
  631    HA   ALA  79           HA       ALA  79  -0.754 -10.740   6.545
  632   1HB   ALA  79          1HB       ALA  79  -1.509 -13.163   7.687
  633   2HB   ALA  79          2HB       ALA  79  -0.051 -12.233   8.034
  634   3HB   ALA  79          3HB       ALA  79  -1.493 -12.015   9.026
  635    H    ARG  80           H        ARG  80  -4.136 -11.104   7.284
  636    HA   ARG  80           HA       ARG  80  -4.899 -13.104   5.531
  637   1HB   ARG  80          1HB       ARG  80  -7.109 -11.946   5.457
  638   2HB   ARG  80          2HB       ARG  80  -6.482 -12.177   7.084
  639   1HG   ARG  80          1HG       ARG  80  -5.514  -9.705   6.452
  640   2HG   ARG  80          2HG       ARG  80  -7.075  -9.718   5.628
  641   1HD   ARG  80          1HD       ARG  80  -6.643 -10.403   8.533
  642   2HD   ARG  80          2HD       ARG  80  -7.201  -8.841   7.937
  643    HE   ARG  80           HE       ARG  80  -8.972 -10.610   6.881
  644   1HH1  ARG  80          1HH1      ARG  80  -7.831  -9.944  10.102
  645   2HH1  ARG  80          2HH1      ARG  80  -9.314 -10.414  10.865
  646   1HH2  ARG  80          1HH2      ARG  80 -10.929 -11.232   7.873
  647   2HH2  ARG  80          2HH2      ARG  80 -11.075 -11.147   9.596
  648    H    CYS  81           H        CYS  81  -4.355  -9.668   4.891
  649    HA   CYS  81           HA       CYS  81  -4.954 -10.046   2.064
  650   1HB   CYS  81          1HB       CYS  81  -4.050  -7.505   3.420
  651   2HB   CYS  81          2HB       CYS  81  -4.861  -7.665   1.867
  652    HG   CYS  81           HG       CYS  81  -6.298  -6.760   4.445
  653    H    HIS  82           H        HIS  82  -3.462 -10.226   0.506
  654    HA   HIS  82           HA       HIS  82  -0.723 -10.614   1.217
  655   1HB   HIS  82          1HB       HIS  82  -2.065 -11.761  -0.664
  656   2HB   HIS  82          2HB       HIS  82  -1.729 -10.310  -1.603
  657    HD1  HIS  82           1HD      HIS  82   0.291 -12.846   0.401
  658    HD2  HIS  82           2HD      HIS  82   0.541 -10.533  -3.041
  659    HE1  HIS  82           1HE      HIS  82   2.483 -13.462  -0.665
  660    H    ILE  83           H        ILE  83   0.871  -9.174   1.280
  661    HA   ILE  83           HA       ILE  83   0.438  -6.561  -0.013
  662    HB   ILE  83           HB       ILE  83   1.872  -5.564   1.692
  663   1HG1  ILE  83          1HG1      ILE  83   1.875  -8.299   2.986
  664   2HG1  ILE  83          2HG1      ILE  83   3.243  -7.591   2.134
  665   1HG2  ILE  83          1HG2      ILE  83   0.356  -5.955   3.674
  666   2HG2  ILE  83          2HG2      ILE  83  -0.440  -5.473   2.177
  667   3HG2  ILE  83          3HG2      ILE  83  -0.473  -7.160   2.689
  668   1HD1  ILE  83          1HD1      ILE  83   3.557  -7.329   4.491
  669   2HD1  ILE  83          2HD1      ILE  83   3.245  -5.745   3.780
  670   3HD1  ILE  83          3HD1      ILE  83   1.969  -6.582   4.664
  671    H    GLU  84           H        GLU  84   2.160  -5.582  -1.083
  672    HA   GLU  84           HA       GLU  84   4.690  -6.999  -1.288
  673   1HB   GLU  84          1HB       GLU  84   2.626  -7.194  -3.296
  674   2HB   GLU  84          2HB       GLU  84   4.053  -6.411  -3.960
  675   1HG   GLU  84          1HG       GLU  84   5.351  -8.372  -2.917
  676   2HG   GLU  84          2HG       GLU  84   3.777  -9.160  -2.818
  677    H    LYS  85           H        LYS  85   6.281  -5.763  -2.611
  678    HA   LYS  85           HA       LYS  85   6.184  -2.993  -1.875
  679   1HB   LYS  85          1HB       LYS  85   8.202  -4.581  -3.468
  680   2HB   LYS  85          2HB       LYS  85   8.415  -2.897  -3.008
  681   1HG   LYS  85          1HG       LYS  85   8.270  -3.560  -0.636
  682   2HG   LYS  85          2HG       LYS  85   8.159  -5.247  -1.142
  683   1HD   LYS  85          1HD       LYS  85  10.400  -3.945  -2.404
  684   2HD   LYS  85          2HD       LYS  85  10.483  -3.772  -0.650
  685   1HE   LYS  85          1HE       LYS  85  10.539  -6.076  -0.305
  686   2HE   LYS  85          2HE       LYS  85   9.890  -6.427  -1.906
  687   1HZ   LYS  85          1HZ       LYS  85  12.189  -6.955  -1.918
  688   2HZ   LYS  85          2HZ       LYS  85  12.616  -5.462  -1.247
  689   3HZ   LYS  85          3HZ       LYS  85  12.009  -5.537  -2.824
  690    H    ALA  86           H        ALA  86   5.692  -1.266  -3.093
  691    HA   ALA  86           HA       ALA  86   4.641  -1.738  -5.762
  692   1HB   ALA  86          1HB       ALA  86   4.011   0.026  -3.657
  693   2HB   ALA  86          2HB       ALA  86   4.545   1.018  -5.015
  694   3HB   ALA  86          3HB       ALA  86   3.218  -0.124  -5.225
  695    H    LYS  87           H        LYS  87   5.212  -0.346  -7.563
  696    HA   LYS  87           HA       LYS  87   7.859   0.897  -7.391
  697   1HB   LYS  87          1HB       LYS  87   8.713  -0.254  -9.286
  698   2HB   LYS  87          2HB       LYS  87   8.053  -1.484  -8.216
  699   1HG   LYS  87          1HG       LYS  87   5.924  -0.852  -9.847
  700   2HG   LYS  87          2HG       LYS  87   7.314  -0.787 -10.933
  701   1HD   LYS  87          1HD       LYS  87   7.082  -3.008 -11.087
  702   2HD   LYS  87          2HD       LYS  87   7.796  -3.062  -9.473
  703   1HE   LYS  87          1HE       LYS  87   5.859  -4.325  -9.240
  704   2HE   LYS  87          2HE       LYS  87   5.379  -2.740  -8.637
  705   1HZ   LYS  87          1HZ       LYS  87   3.670  -3.497 -10.061
  706   2HZ   LYS  87          2HZ       LYS  87   4.760  -3.928 -11.281
  707   3HZ   LYS  87          3HZ       LYS  87   4.499  -2.297 -10.919
  708    H    GLY  88           H        GLY  88   8.176   2.622  -8.763
  709   1HA   GLY  88          1HA       GLY  88   7.559   3.802 -10.818
  710   2HA   GLY  88          2HA       GLY  88   5.896   3.332 -10.501
  711    H    THR  89           H        THR  89   5.440   5.625 -10.758
  712    HA   THR  89           HA       THR  89   6.222   7.250  -8.435
  713    HB   THR  89           HB       THR  89   5.755   9.206  -9.697
  714    HG1  THR  89           1HG      THR  89   4.515   9.219 -11.477
  715   1HG2  THR  89          1HG2      THR  89   7.376   9.098 -11.361
  716   2HG2  THR  89          2HG2      THR  89   6.938   7.452 -11.819
  717   3HG2  THR  89          3HG2      THR  89   7.811   7.746 -10.315
  718    H    ASP  90           H        ASP  90   4.443   8.948  -7.895
  719    HA   ASP  90           HA       ASP  90   2.274   7.611  -6.766
  720   1HB   ASP  90          1HB       ASP  90   1.419   9.767  -6.166
  721   2HB   ASP  90          2HB       ASP  90   3.176   9.857  -6.077
  722    H    GLN  91           H        GLN  91   2.552   9.334  -9.829
  723    HA   GLN  91           HA       GLN  91  -0.196   9.262 -10.497
  724   1HB   GLN  91          1HB       GLN  91   1.555  10.744 -11.541
  725   2HB   GLN  91          2HB       GLN  91   2.126   9.335 -12.426
  726   1HG   GLN  91          1HG       GLN  91   0.719  10.555 -13.882
  727   2HG   GLN  91          2HG       GLN  91  -0.170   9.116 -13.388
  728   1HE2  GLN  91          1HE2      GLN  91  -1.856   9.341 -11.853
  729   2HE2  GLN  91          2HE2      GLN  91  -2.663  10.854 -11.641
  730    H    GLN  92           H        GLN  92   2.469   7.031 -11.009
  731    HA   GLN  92           HA       GLN  92   1.102   5.313 -12.812
  732   1HB   GLN  92          1HB       GLN  92   3.613   5.204 -11.232
  733   2HB   GLN  92          2HB       GLN  92   2.936   3.667 -11.753
  734   1HG   GLN  92          1HG       GLN  92   2.808   5.148 -14.041
  735   2HG   GLN  92          2HG       GLN  92   4.288   5.745 -13.291
  736   1HE2  GLN  92          1HE2      GLN  92   6.069   4.480 -13.257
  737   2HE2  GLN  92          2HE2      GLN  92   6.157   2.910 -13.973
  738    H    ASN  93           H        ASN  93   1.443   5.407  -9.308
  739    HA   ASN  93           HA       ASN  93   0.093   2.898  -8.912
  740   1HB   ASN  93          1HB       ASN  93   1.070   5.073  -7.078
  741   2HB   ASN  93          2HB       ASN  93   0.065   3.760  -6.472
  742   1HD2  ASN  93          1HD2      ASN  93   2.682   3.847  -8.858
  743   2HD2  ASN  93          2HD2      ASN  93   3.674   2.675  -8.066
  744    H    LYS  94           H        LYS  94  -0.746   6.319  -8.719
  745    HA   LYS  94           HA       LYS  94  -3.307   6.034  -7.605
  746   1HB   LYS  94          1HB       LYS  94  -1.992   8.175  -7.874
  747   2HB   LYS  94          2HB       LYS  94  -2.462   8.167  -9.569
  748   1HG   LYS  94          1HG       LYS  94  -4.876   7.895  -8.399
  749   2HG   LYS  94          2HG       LYS  94  -4.026   8.837  -7.171
  750   1HD   LYS  94          1HD       LYS  94  -3.672  10.627  -8.612
  751   2HD   LYS  94          2HD       LYS  94  -3.902   9.637 -10.055
  752   1HE   LYS  94          1HE       LYS  94  -6.034  10.252 -10.124
  753   2HE   LYS  94          2HE       LYS  94  -6.293   9.513  -8.545
  754   1HZ   LYS  94          1HZ       LYS  94  -6.305  11.492  -7.535
  755   2HZ   LYS  94          2HZ       LYS  94  -6.600  12.127  -9.074
  756   3HZ   LYS  94          3HZ       LYS  94  -5.025  12.105  -8.457
  757    H    GLU  95           H        GLU  95  -2.261   6.199 -10.998
  758    HA   GLU  95           HA       GLU  95  -4.885   5.900 -12.060
  759   1HB   GLU  95          1HB       GLU  95  -2.531   6.697 -13.114
  760   2HB   GLU  95          2HB       GLU  95  -2.577   5.042 -13.704
  761   1HG   GLU  95          1HG       GLU  95  -4.928   5.589 -14.533
  762   2HG   GLU  95          2HG       GLU  95  -4.497   7.275 -14.253
  763    H    TYR  96           H        TYR  96  -2.287   3.677 -11.250
  764    HA   TYR  96           HA       TYR  96  -3.235   1.384 -12.531
  765   1HB   TYR  96          1HB       TYR  96  -1.011   1.439 -11.593
  766   2HB   TYR  96          2HB       TYR  96  -1.652   1.676  -9.971
  767    HD1  TYR  96           1HD      TYR  96  -2.688  -0.181  -8.759
  768    HD2  TYR  96           2HD      TYR  96  -0.999  -0.745 -12.623
  769    HE1  TYR  96           1HE      TYR  96  -2.714  -2.615  -8.409
  770    HE2  TYR  96           2HE      TYR  96  -1.022  -3.180 -12.284
  771    HH   TYR  96           HH       TYR  96  -2.237  -4.838 -10.914
  772    H    CYS  97           H        CYS  97  -3.897   2.618  -9.270
  773    HA   CYS  97           HA       CYS  97  -5.587   0.473  -8.507
  774   1HB   CYS  97          1HB       CYS  97  -5.477   3.301  -7.435
  775   2HB   CYS  97          2HB       CYS  97  -6.261   1.936  -6.648
  776    HG   CYS  97           HG       CYS  97  -3.562   0.595  -6.774
  777    H    SER  98           H        SER  98  -6.138   3.547 -10.105
  778    HA   SER  98           HA       SER  98  -9.006   3.356  -9.951
  779   1HB   SER  98          1HB       SER  98  -7.707   5.526 -10.071
  780   2HB   SER  98          2HB       SER  98  -7.388   5.154 -11.765
  781    HG   SER  98           HG       SER  98 -10.011   5.202 -10.716
  782    H    LYS  99           H        LYS  99  -6.624   1.963 -11.886
  783    HA   LYS  99           HA       LYS  99  -7.785   1.875 -14.416
  784   1HB   LYS  99          1HB       LYS  99  -5.502   1.115 -13.971
  785   2HB   LYS  99          2HB       LYS  99  -6.121  -0.234 -13.026
  786   1HG   LYS  99          1HG       LYS  99  -7.246  -1.078 -15.073
  787   2HG   LYS  99          2HG       LYS  99  -6.455   0.210 -15.984
  788   1HD   LYS  99          1HD       LYS  99  -5.189  -1.839 -16.204
  789   2HD   LYS  99          2HD       LYS  99  -4.262  -0.669 -15.261
  790   1HE   LYS  99          1HE       LYS  99  -4.259  -1.979 -13.449
  791   2HE   LYS  99          2HE       LYS  99  -5.972  -2.358 -13.616
  792   1HZ   LYS  99          1HZ       LYS  99  -4.847  -4.377 -13.886
  793   2HZ   LYS  99          2HZ       LYS  99  -3.673  -3.705 -14.902
  794   3HZ   LYS  99          3HZ       LYS  99  -5.258  -3.908 -15.459
  795    H    GLU 100           H        GLU 100  -8.684   0.280 -11.494
  796    HA   GLU 100           HA       GLU 100 -10.157  -1.858 -12.680
  797   1HB   GLU 100          1HB       GLU 100 -10.167  -0.643  -9.920
  798   2HB   GLU 100          2HB       GLU 100 -11.207  -1.988 -10.366
  799   1HG   GLU 100          1HG       GLU 100  -9.313  -2.901  -9.292
  800   2HG   GLU 100          2HG       GLU 100  -9.148  -3.254 -11.011
  801    H    GLY 101           H        GLY 101 -10.773   1.476 -12.142
  802   1HA   GLY 101          1HA       GLY 101 -12.551   2.691 -13.059
  803   2HA   GLY 101          2HA       GLY 101 -13.414   1.183 -13.327
  804    H    ASN 102           H        ASN 102 -12.368   0.935 -10.263
  805    HA   ASN 102           HA       ASN 102 -14.628   2.418  -9.112
  806   1HB   ASN 102          1HB       ASN 102 -14.301  -0.463  -9.253
  807   2HB   ASN 102          2HB       ASN 102 -14.427   0.088  -7.585
  808   1HD2  ASN 102          1HD2      ASN 102 -16.433  -0.986  -7.440
  809   2HD2  ASN 102          2HD2      ASN 102 -17.864  -0.293  -8.117
  810    H    LEU 103           H        LEU 103 -14.014   3.654  -7.470
  811    HA   LEU 103           HA       LEU 103 -11.422   3.129  -6.205
  812   1HB   LEU 103          1HB       LEU 103 -12.811   5.487  -7.039
  813   2HB   LEU 103          2HB       LEU 103 -12.501   5.576  -5.306
  814    HG   LEU 103           HG       LEU 103 -10.770   6.653  -6.763
  815   1HD1  LEU 103          1HD1      LEU 103  -9.585   6.385  -4.909
  816   2HD1  LEU 103          2HD1      LEU 103  -9.002   4.849  -5.548
  817   3HD1  LEU 103          3HD1      LEU 103 -10.437   4.890  -4.525
  818   1HD2  LEU 103          1HD2      LEU 103  -9.668   5.544  -8.359
  819   2HD2  LEU 103          2HD2      LEU 103 -10.963   4.353  -8.244
  820   3HD2  LEU 103          3HD2      LEU 103  -9.461   4.112  -7.350
  821    H    LEU 104           H        LEU 104 -11.332   2.306  -4.227
  822    HA   LEU 104           HA       LEU 104 -13.770   2.051  -2.667
  823   1HB   LEU 104          1HB       LEU 104 -11.817   0.306  -3.096
  824   2HB   LEU 104          2HB       LEU 104 -11.147   1.083  -1.663
  825    HG   LEU 104           HG       LEU 104 -12.364  -0.964  -1.109
  826   1HD1  LEU 104          1HD1      LEU 104 -12.443   1.367   0.219
  827   2HD1  LEU 104          2HD1      LEU 104 -13.195  -0.115   0.809
  828   3HD1  LEU 104          3HD1      LEU 104 -14.169   1.098  -0.021
  829   1HD2  LEU 104          1HD2      LEU 104 -14.273  -1.499  -2.102
  830   2HD2  LEU 104          2HD2      LEU 104 -14.220   0.017  -3.001
  831   3HD2  LEU 104          3HD2      LEU 104 -15.045  -0.057  -1.443
  832    H    MET 105           H        MET 105 -10.721   3.763  -2.582
  833    HA   MET 105           HA       MET 105 -11.744   5.557  -0.577
  834   1HB   MET 105          1HB       MET 105 -10.934   4.106   1.041
  835   2HB   MET 105          2HB       MET 105  -9.586   3.579   0.042
  836   1HG   MET 105          1HG       MET 105  -8.255   5.283   0.690
  837   2HG   MET 105          2HG       MET 105  -9.595   6.416   0.850
  838   1HE   MET 105          1HE       MET 105  -7.114   4.310   2.242
  839   2HE   MET 105          2HE       MET 105  -7.345   4.312   3.990
  840   3HE   MET 105          3HE       MET 105  -8.124   3.078   2.999
  841    H    GLU 106           H        GLU 106 -10.871   7.556  -0.768
  842    HA   GLU 106           HA       GLU 106  -8.435   7.846  -2.388
  843   1HB   GLU 106          1HB       GLU 106 -10.967   8.467  -3.307
  844   2HB   GLU 106          2HB       GLU 106 -10.355  10.017  -2.747
  845   1HG   GLU 106          1HG       GLU 106  -8.680  10.081  -4.308
  846   2HG   GLU 106          2HG       GLU 106  -8.622   8.327  -4.477
  847    H    CYS 107           H        CYS 107  -7.007   8.574  -0.936
  848    HA   CYS 107           HA       CYS 107  -7.497  11.138   0.315
  849   1HB   CYS 107          1HB       CYS 107  -7.319   8.589   1.853
  850   2HB   CYS 107          2HB       CYS 107  -6.537  10.014   2.526
  851    HG   CYS 107           HG       CYS 107  -9.805  10.128   1.568
  852    H    GLY 108           H        GLY 108  -5.433  11.660   1.751
  853   1HA   GLY 108          1HA       GLY 108  -3.134  11.874   1.886
  854   2HA   GLY 108          2HA       GLY 108  -2.981  10.467   0.844
  855    H    ALA 109           H        ALA 109  -1.200  12.336   0.369
  856    HA   ALA 109           HA       ALA 109  -2.229  13.893  -1.911
  857   1HB   ALA 109          1HB       ALA 109  -1.215  15.621  -0.954
  858   2HB   ALA 109          2HB       ALA 109  -0.464  14.581   0.257
  859   3HB   ALA 109          3HB       ALA 109   0.326  14.834  -1.299
  860    HA   PRO 110           HA       PRO 110   0.237  11.645  -4.762
  861   1HB   PRO 110          1HB       PRO 110   1.090  13.593  -6.450
  862   2HB   PRO 110          2HB       PRO 110  -0.583  13.024  -6.407
  863   1HG   PRO 110          1HG       PRO 110   0.622  15.459  -5.150
  864   2HG   PRO 110          2HG       PRO 110  -0.916  15.292  -6.016
  865   1HD   PRO 110          1HD       PRO 110  -0.764  15.346  -3.313
  866   2HD   PRO 110          2HD       PRO 110  -1.998  14.410  -4.182
  867    H    ARG 111           H        ARG 111   2.107  10.756  -4.141
  868    HA   ARG 111           HA       ARG 111   4.234  12.226  -2.952
  869   1HB   ARG 111          1HB       ARG 111   3.897   9.393  -3.885
  870   2HB   ARG 111          2HB       ARG 111   5.478   9.982  -3.387
  871   1HG   ARG 111          1HG       ARG 111   3.354  10.604  -1.487
  872   2HG   ARG 111          2HG       ARG 111   3.599   8.875  -1.743
  873   1HD   ARG 111          1HD       ARG 111   4.961   9.909   0.106
  874   2HD   ARG 111          2HD       ARG 111   5.875   9.011  -1.105
  875    HE   ARG 111           HE       ARG 111   5.688  11.823  -1.660
  876   1HH1  ARG 111          1HH1      ARG 111   7.449   9.360   0.059
  877   2HH1  ARG 111          2HH1      ARG 111   8.914  10.281   0.142
  878   1HH2  ARG 111          1HH2      ARG 111   7.611  13.046  -1.557
  879   2HH2  ARG 111          2HH2      ARG 111   9.005  12.378  -0.776
  880    H    SER 112           H        SER 112   6.382  12.488  -3.764
  881    HA   SER 112           HA       SER 112   6.830  12.152  -6.611
  882   1HB   SER 112          1HB       SER 112   7.513  14.589  -6.830
  883   2HB   SER 112          2HB       SER 112   5.780  14.292  -6.699
  884    HG   SER 112           HG       SER 112   6.621  16.011  -5.335
  885    H    GLN 113           H        GLN 113   9.090  13.195  -7.143
  886    HA   GLN 113           HA       GLN 113  10.910  12.368  -4.982
  887   1HB   GLN 113          1HB       GLN 113  10.748  11.511  -7.641
  888   2HB   GLN 113          2HB       GLN 113  12.157  12.562  -7.588
  889   1HG   GLN 113          1HG       GLN 113  13.070  11.242  -5.745
  890   2HG   GLN 113          2HG       GLN 113  11.661  10.185  -5.809
  891   1HE2  GLN 113          1HE2      GLN 113  14.228  11.466  -7.891
  892   2HE2  GLN 113          2HE2      GLN 113  14.458  10.012  -8.794
  893    H    GLY 114           H        GLY 114  10.773  14.600  -7.766
  894   1HA   GLY 114          1HA       GLY 114  11.403  16.816  -7.907
  895   2HA   GLY 114          2HA       GLY 114  11.651  16.808  -6.167
  896    H    GLN 115           H        GLN 115  13.189  14.740  -8.591
  897    HA   GLN 115           HA       GLN 115  15.731  16.124  -8.120
  898   1HB   GLN 115          1HB       GLN 115  15.042  13.519  -7.145
  899   2HB   GLN 115          2HB       GLN 115  16.315  13.362  -8.349
  900   1HG   GLN 115          1HG       GLN 115  16.543  15.374  -6.150
  901   2HG   GLN 115          2HG       GLN 115  16.949  13.681  -5.871
  902   1HE2  GLN 115          1HE2      GLN 115  17.965  16.656  -7.163
  903   2HE2  GLN 115          2HE2      GLN 115  19.481  16.130  -7.804
  904    H    ARG 116           H        ARG 116  17.457  14.878  -9.625
  905    HA   ARG 116           HA       ARG 116  16.240  14.872 -12.303
  906   1HB   ARG 116          1HB       ARG 116  18.374  16.348 -11.300
  907   2HB   ARG 116          2HB       ARG 116  19.139  15.079 -12.247
  908   1HG   ARG 116          1HG       ARG 116  18.789  16.346 -14.032
  909   2HG   ARG 116          2HG       ARG 116  17.072  15.978 -13.859
  910   1HD   ARG 116          1HD       ARG 116  18.269  18.192 -12.255
  911   2HD   ARG 116          2HD       ARG 116  17.904  18.460 -13.959
  912    HE   ARG 116           HE       ARG 116  16.035  18.300 -11.811
  913   1HH1  ARG 116          1HH1      ARG 116  16.468  17.653 -15.204
  914   2HH1  ARG 116          2HH1      ARG 116  14.783  17.795 -15.580
  915   1HH2  ARG 116          1HH2      ARG 116  13.813  18.489 -12.293
  916   2HH2  ARG 116          2HH2      ARG 116  13.274  18.271 -13.923
  Start of MODEL   10
    1    HA   PRO   2           HA       PRO   2  41.131   2.468   9.537
    2   1HB   PRO   2          1HB       PRO   2  39.014   4.050   8.920
    3   2HB   PRO   2          2HB       PRO   2  40.167   4.445  10.200
    4   1HG   PRO   2          1HG       PRO   2  40.031   5.472   7.392
    5   2HG   PRO   2          2HG       PRO   2  40.340   6.361   8.894
    6   1HD   PRO   2          1HD       PRO   2  42.323   5.620   7.205
    7   2HD   PRO   2          2HD       PRO   2  42.555   5.725   8.962
    8    H    SER   3           H        SER   3  38.818   1.738   8.848
    9    HA   SER   3           HA       SER   3  38.554   1.307   5.983
   10   1HB   SER   3          1HB       SER   3  39.889  -0.599   7.426
   11   2HB   SER   3          2HB       SER   3  38.231  -1.195   7.497
   12    HG   SER   3           HG       SER   3  38.213  -1.463   5.361
   13    H    LYS   4           H        LYS   4  36.576  -0.523   5.900
   14    HA   LYS   4           HA       LYS   4  34.487   0.402   7.738
   15   1HB   LYS   4          1HB       LYS   4  34.231   0.326   4.726
   16   2HB   LYS   4          2HB       LYS   4  32.910   0.638   5.844
   17   1HG   LYS   4          1HG       LYS   4  33.388   2.792   5.633
   18   2HG   LYS   4          2HG       LYS   4  34.851   2.475   6.568
   19   1HD   LYS   4          1HD       LYS   4  35.665   1.706   4.110
   20   2HD   LYS   4          2HD       LYS   4  34.511   2.971   3.681
   21   1HE   LYS   4          1HE       LYS   4  36.513   3.500   5.827
   22   2HE   LYS   4          2HE       LYS   4  37.035   3.539   4.143
   23   1HZ   LYS   4          1HZ       LYS   4  36.363   5.660   4.267
   24   2HZ   LYS   4          2HZ       LYS   4  35.358   5.393   5.601
   25   3HZ   LYS   4          3HZ       LYS   4  34.813   5.021   4.043
   26    H    LYS   5           H        LYS   5  32.339  -0.913   6.885
   27    HA   LYS   5           HA       LYS   5  33.170  -3.734   6.699
   28   1HB   LYS   5          1HB       LYS   5  31.104  -2.458   8.478
   29   2HB   LYS   5          2HB       LYS   5  31.049  -4.172   8.087
   30   1HG   LYS   5          1HG       LYS   5  32.712  -4.667   9.492
   31   2HG   LYS   5          2HG       LYS   5  33.664  -3.259   9.016
   32   1HD   LYS   5          1HD       LYS   5  31.832  -1.951  10.360
   33   2HD   LYS   5          2HD       LYS   5  31.574  -3.517  11.133
   34   1HE   LYS   5          1HE       LYS   5  34.291  -3.308  11.190
   35   2HE   LYS   5          2HE       LYS   5  33.801  -1.626  11.385
   36   1HZ   LYS   5          1HZ       LYS   5  32.786  -2.054  13.371
   37   2HZ   LYS   5          2HZ       LYS   5  34.041  -3.185  13.442
   38   3HZ   LYS   5          3HZ       LYS   5  32.481  -3.679  13.013
   39    H    ASN   6           H        ASN   6  31.079  -5.114   6.205
   40    HA   ASN   6           HA       ASN   6  29.102  -3.888   4.553
   41   1HB   ASN   6          1HB       ASN   6  29.748  -4.686   2.411
   42   2HB   ASN   6          2HB       ASN   6  31.177  -3.905   3.083
   43   1HD2  ASN   6          1HD2      ASN   6  29.972  -6.659   1.639
   44   2HD2  ASN   6          2HD2      ASN   6  31.297  -7.723   1.951
   45    H    GLY   7           H        GLY   7  27.561  -5.440   3.695
   46   1HA   GLY   7          1HA       GLY   7  27.423  -8.086   3.694
   47   2HA   GLY   7          2HA       GLY   7  27.396  -7.785   5.425
   48    H    ARG   8           H        ARG   8  25.310  -9.089   4.191
   49    HA   ARG   8           HA       ARG   8  23.191  -7.095   3.874
   50   1HB   ARG   8          1HB       ARG   8  23.172 -10.083   3.406
   51   2HB   ARG   8          2HB       ARG   8  21.814  -9.005   3.112
   52   1HG   ARG   8          1HG       ARG   8  24.355  -8.304   1.784
   53   2HG   ARG   8          2HG       ARG   8  23.536  -9.759   1.212
   54   1HD   ARG   8          1HD       ARG   8  21.995  -8.559   0.147
   55   2HD   ARG   8          2HD       ARG   8  21.662  -7.600   1.589
   56    HE   ARG   8           HE       ARG   8  23.970  -6.539   0.674
   57   1HH1  ARG   8          1HH1      ARG   8  20.908  -7.229  -0.831
   58   2HH1  ARG   8          2HH1      ARG   8  21.026  -5.928  -1.969
   59   1HH2  ARG   8          1HH2      ARG   8  24.137  -4.823  -0.819
   60   2HH2  ARG   8          2HH2      ARG   8  22.864  -4.561  -1.962
   61    H    SER   9           H        SER   9  20.972  -8.296   4.721
   62    HA   SER   9           HA       SER   9  21.232  -9.507   7.301
   63   1HB   SER   9          1HB       SER   9  21.755  -7.301   8.061
   64   2HB   SER   9          2HB       SER   9  20.451  -6.594   7.106
   65    HG   SER   9           HG       SER   9  20.353  -7.480   9.600
   66    H    GLY  10           H        GLY  10  19.102  -7.581   5.204
   67   1HA   GLY  10          1HA       GLY  10  17.264  -9.428   4.514
   68   2HA   GLY  10          2HA       GLY  10  16.750  -8.991   6.136
   69    HA   PRO  11           HA       PRO  11  14.689  -6.125   3.128
   70   1HB   PRO  11          1HB       PRO  11  12.221  -6.360   4.233
   71   2HB   PRO  11          2HB       PRO  11  12.831  -7.470   3.001
   72   1HG   PRO  11          1HG       PRO  11  12.716  -7.816   5.972
   73   2HG   PRO  11          2HG       PRO  11  12.327  -8.982   4.694
   74   1HD   PRO  11          1HD       PRO  11  14.681  -9.019   6.030
   75   2HD   PRO  11          2HD       PRO  11  14.539  -9.516   4.332
   76    H    GLN  12           H        GLN  12  14.377  -3.989   3.496
   77    HA   GLN  12           HA       GLN  12  14.436  -3.093   6.298
   78   1HB   GLN  12          1HB       GLN  12  15.145  -1.365   3.944
   79   2HB   GLN  12          2HB       GLN  12  15.607  -1.170   5.629
   80   1HG   GLN  12          1HG       GLN  12  16.592  -3.326   3.774
   81   2HG   GLN  12          2HG       GLN  12  17.484  -1.882   4.250
   82   1HE2  GLN  12          1HE2      GLN  12  18.589  -4.322   4.652
   83   2HE2  GLN  12          2HE2      GLN  12  18.627  -4.692   6.339
   84    HA   PRO  13           HA       PRO  13  10.480  -1.230   5.932
   85   1HB   PRO  13          1HB       PRO  13  10.771   0.939   7.539
   86   2HB   PRO  13          2HB       PRO  13  10.652  -0.710   8.163
   87   1HG   PRO  13          1HG       PRO  13  13.085   0.975   7.719
   88   2HG   PRO  13          2HG       PRO  13  12.685  -0.071   9.093
   89   1HD   PRO  13          1HD       PRO  13  14.381  -0.836   7.126
   90   2HD   PRO  13          2HD       PRO  13  13.339  -1.985   7.988
   91    H    HIS  14           H        HIS  14   9.383   0.279   4.745
   92    HA   HIS  14           HA       HIS  14  10.893   2.541   3.639
   93   1HB   HIS  14          1HB       HIS  14   9.226   0.586   2.043
   94   2HB   HIS  14          2HB       HIS  14   9.848   2.108   1.413
   95    HD1  HIS  14           1HD      HIS  14  10.792  -1.389   2.071
   96    HD2  HIS  14           2HD      HIS  14  12.706   2.178   1.135
   97    HE1  HIS  14           1HE      HIS  14  13.105  -2.041   1.333
   98    H    LYS  15           H        LYS  15   9.219   3.916   2.258
   99    HA   LYS  15           HA       LYS  15   6.959   4.414   4.064
  100   1HB   LYS  15          1HB       LYS  15   6.895   6.654   2.894
  101   2HB   LYS  15          2HB       LYS  15   8.330   6.343   3.861
  102   1HG   LYS  15          1HG       LYS  15   8.751   5.459   1.164
  103   2HG   LYS  15          2HG       LYS  15   8.208   7.138   1.183
  104   1HD   LYS  15          1HD       LYS  15   9.987   7.751   2.683
  105   2HD   LYS  15          2HD       LYS  15  10.471   6.063   2.862
  106   1HE   LYS  15          1HE       LYS  15  11.716   6.145   1.017
  107   2HE   LYS  15          2HE       LYS  15  10.396   6.845   0.082
  108   1HZ   LYS  15          1HZ       LYS  15  11.640   8.671   0.027
  109   2HZ   LYS  15          2HZ       LYS  15  12.683   8.121   1.239
  110   3HZ   LYS  15          3HZ       LYS  15  11.239   8.897   1.655
  111    H    ARG  16           H        ARG  16   7.267   2.504   1.646
  112    HA   ARG  16           HA       ARG  16   4.683   3.219   0.454
  113   1HB   ARG  16          1HB       ARG  16   6.889   2.054  -1.224
  114   2HB   ARG  16          2HB       ARG  16   5.402   2.830  -1.752
  115   1HG   ARG  16          1HG       ARG  16   6.591   4.848  -0.382
  116   2HG   ARG  16          2HG       ARG  16   7.990   3.998  -1.041
  117   1HD   ARG  16          1HD       ARG  16   5.756   4.425  -2.913
  118   2HD   ARG  16          2HD       ARG  16   6.590   5.883  -2.378
  119    HE   ARG  16           HE       ARG  16   7.570   3.933  -4.197
  120   1HH1  ARG  16          1HH1      ARG  16   8.559   6.129  -1.683
  121   2HH1  ARG  16          2HH1      ARG  16  10.173   6.303  -2.290
  122   1HH2  ARG  16          1HH2      ARG  16   9.692   4.154  -5.006
  123   2HH2  ARG  16          2HH2      ARG  16  10.816   5.180  -4.180
  124    H    TRP  17           H        TRP  17   3.281   1.597   0.564
  125    HA   TRP  17           HA       TRP  17   4.166  -1.154   0.305
  126   1HB   TRP  17          1HB       TRP  17   2.922  -0.067   2.829
  127   2HB   TRP  17          2HB       TRP  17   2.869  -1.777   2.412
  128    HD1  TRP  17           HD       TRP  17   5.176   0.892   3.776
  129    HE1  TRP  17           1HE      TRP  17   7.396  -0.193   4.496
  130    HE3  TRP  17           3HE      TRP  17   4.485  -3.768   1.790
  131    HZ2  TRP  17           2HZ      TRP  17   8.685  -2.693   4.253
  132    HZ3  TRP  17           3HZ      TRP  17   6.260  -5.448   2.077
  133    HH2  TRP  17           HH       TRP  17   8.316  -4.919   3.284
  134    H    VAL  18           H        VAL  18   2.655  -2.423  -0.631
  135    HA   VAL  18           HA       VAL  18   0.008  -1.216  -1.095
  136    HB   VAL  18           HB       VAL  18  -0.145  -2.534  -3.125
  137   1HG1  VAL  18          1HG1      VAL  18   1.877  -1.562  -4.347
  138   2HG1  VAL  18          2HG1      VAL  18   0.812  -0.428  -3.514
  139   3HG1  VAL  18          3HG1      VAL  18   2.348  -0.896  -2.785
  140   1HG2  VAL  18          1HG2      VAL  18   1.058  -4.369  -3.478
  141   2HG2  VAL  18          2HG2      VAL  18   2.565  -3.463  -3.339
  142   3HG2  VAL  18          3HG2      VAL  18   1.804  -4.134  -1.897
  143    H    PHE  19           H        PHE  19  -1.814  -2.707  -1.279
  144    HA   PHE  19           HA       PHE  19  -1.456  -5.228   0.180
  145   1HB   PHE  19          1HB       PHE  19  -3.604  -4.732   1.403
  146   2HB   PHE  19          2HB       PHE  19  -2.236  -3.728   1.871
  147    HD1  PHE  19           1HD      PHE  19  -2.092  -1.387   1.027
  148    HD2  PHE  19           2HD      PHE  19  -5.565  -3.791   0.502
  149    HE1  PHE  19           1HE      PHE  19  -3.419   0.635   0.570
  150    HE2  PHE  19           2HE      PHE  19  -6.897  -1.774   0.044
  151    HZ   PHE  19           HZ       PHE  19  -5.824   0.443   0.077
  152    H    THR  20           H        THR  20  -2.865  -6.875  -0.378
  153    HA   THR  20           HA       THR  20  -4.968  -6.354  -2.321
  154    HB   THR  20           HB       THR  20  -4.120  -8.165  -3.836
  155    HG1  THR  20           1HG      THR  20  -1.930  -8.741  -3.634
  156   1HG2  THR  20          1HG2      THR  20  -3.837  -5.725  -4.301
  157   2HG2  THR  20          2HG2      THR  20  -2.604  -6.746  -5.042
  158   3HG2  THR  20          3HG2      THR  20  -2.229  -5.827  -3.585
  159    H    LEU  21           H        LEU  21  -6.682  -7.597  -1.921
  160    HA   LEU  21           HA       LEU  21  -6.306 -10.220  -0.680
  161   1HB   LEU  21          1HB       LEU  21  -6.721  -8.591   1.124
  162   2HB   LEU  21          2HB       LEU  21  -8.236  -8.142   0.344
  163    HG   LEU  21           HG       LEU  21  -8.641 -10.785   0.644
  164   1HD1  LEU  21          1HD1      LEU  21  -6.377 -10.893   1.813
  165   2HD1  LEU  21          2HD1      LEU  21  -7.749 -11.637   2.634
  166   3HD1  LEU  21          3HD1      LEU  21  -7.163 -10.056   3.152
  167   1HD2  LEU  21          1HD2      LEU  21  -9.997  -8.768   1.397
  168   2HD2  LEU  21          2HD2      LEU  21  -9.114  -8.881   2.920
  169   3HD2  LEU  21          3HD2      LEU  21 -10.120 -10.227   2.381
  170    H    ASN  22           H        ASN  22  -7.594 -11.744  -1.520
  171    HA   ASN  22           HA       ASN  22  -9.407 -11.006  -3.643
  172   1HB   ASN  22          1HB       ASN  22  -7.896 -12.954  -3.860
  173   2HB   ASN  22          2HB       ASN  22  -8.741 -13.741  -2.530
  174   1HD2  ASN  22          1HD2      ASN  22 -10.280 -15.098  -3.072
  175   2HD2  ASN  22          2HD2      ASN  22 -11.147 -15.113  -4.566
  176    H    ASN  23           H        ASN  23 -11.570 -10.933  -3.559
  177    HA   ASN  23           HA       ASN  23 -13.660 -10.809  -2.659
  178   1HB   ASN  23          1HB       ASN  23 -13.357 -13.290  -2.977
  179   2HB   ASN  23          2HB       ASN  23 -12.903 -13.389  -1.279
  180   1HD2  ASN  23          1HD2      ASN  23 -15.489 -12.486  -3.480
  181   2HD2  ASN  23          2HD2      ASN  23 -16.781 -12.755  -2.365
  182    HA   PRO  24           HA       PRO  24 -11.968  -9.229   1.397
  183   1HB   PRO  24          1HB       PRO  24 -12.657  -6.638   0.966
  184   2HB   PRO  24          2HB       PRO  24 -11.117  -7.324   0.435
  185   1HG   PRO  24          1HG       PRO  24 -13.619  -6.842  -1.137
  186   2HG   PRO  24          2HG       PRO  24 -11.934  -6.538  -1.596
  187   1HD   PRO  24          1HD       PRO  24 -13.305  -8.714  -2.443
  188   2HD   PRO  24          2HD       PRO  24 -11.554  -8.744  -2.148
  189    H    SER  25           H        SER  25 -13.175  -8.613   3.200
  190    HA   SER  25           HA       SER  25 -16.049  -9.013   2.921
  191   1HB   SER  25          1HB       SER  25 -14.095  -9.602   4.936
  192   2HB   SER  25          2HB       SER  25 -15.354  -8.586   5.638
  193    HG   SER  25           HG       SER  25 -16.769 -10.213   4.388
  194    H    GLU  26           H        GLU  26 -17.568  -7.615   4.036
  195    HA   GLU  26           HA       GLU  26 -17.239  -4.910   3.391
  196   1HB   GLU  26          1HB       GLU  26 -19.337  -4.533   4.508
  197   2HB   GLU  26          2HB       GLU  26 -19.427  -6.068   3.655
  198   1HG   GLU  26          1HG       GLU  26 -18.801  -7.146   5.876
  199   2HG   GLU  26          2HG       GLU  26 -19.167  -5.582   6.600
  200    H    ASP  27           H        ASP  27 -16.511  -6.697   6.290
  201    HA   ASP  27           HA       ASP  27 -16.186  -4.376   7.954
  202   1HB   ASP  27          1HB       ASP  27 -15.746  -7.312   8.267
  203   2HB   ASP  27          2HB       ASP  27 -14.928  -6.222   9.383
  204    H    GLU  28           H        GLU  28 -13.974  -6.689   6.400
  205    HA   GLU  28           HA       GLU  28 -11.594  -5.441   7.251
  206   1HB   GLU  28          1HB       GLU  28 -12.225  -7.750   5.891
  207   2HB   GLU  28          2HB       GLU  28 -11.435  -6.784   4.653
  208   1HG   GLU  28          1HG       GLU  28 -10.241  -7.309   7.360
  209   2HG   GLU  28          2HG       GLU  28  -9.936  -8.313   5.943
  210    H    ARG  29           H        ARG  29 -13.427  -5.184   4.217
  211    HA   ARG  29           HA       ARG  29 -11.705  -3.387   2.925
  212   1HB   ARG  29          1HB       ARG  29 -13.413  -4.587   1.698
  213   2HB   ARG  29          2HB       ARG  29 -14.683  -3.798   2.624
  214   1HG   ARG  29          1HG       ARG  29 -13.159  -1.733   1.505
  215   2HG   ARG  29          2HG       ARG  29 -13.371  -2.933   0.229
  216   1HD   ARG  29          1HD       ARG  29 -15.773  -2.335   1.823
  217   2HD   ARG  29          2HD       ARG  29 -15.175  -1.008   0.827
  218    HE   ARG  29           HE       ARG  29 -15.379  -3.493  -0.592
  219   1HH1  ARG  29          1HH1      ARG  29 -17.106  -0.659   0.459
  220   2HH1  ARG  29          2HH1      ARG  29 -18.299  -0.762  -0.793
  221   1HH2  ARG  29          1HH2      ARG  29 -16.944  -3.639  -2.246
  222   2HH2  ARG  29          2HH2      ARG  29 -18.206  -2.457  -2.331
  223    H    LYS  30           H        LYS  30 -14.372  -2.873   5.163
  224    HA   LYS  30           HA       LYS  30 -14.487  -0.049   4.856
  225   1HB   LYS  30          1HB       LYS  30 -15.590  -2.035   6.789
  226   2HB   LYS  30          2HB       LYS  30 -15.577  -0.340   7.259
  227   1HG   LYS  30          1HG       LYS  30 -16.901   0.248   5.329
  228   2HG   LYS  30          2HG       LYS  30 -16.838  -1.417   4.745
  229   1HD   LYS  30          1HD       LYS  30 -18.165  -2.195   6.548
  230   2HD   LYS  30          2HD       LYS  30 -17.996  -0.670   7.422
  231   1HE   LYS  30          1HE       LYS  30 -19.093  -0.155   4.835
  232   2HE   LYS  30          2HE       LYS  30 -20.024  -1.436   5.609
  233   1HZ   LYS  30          1HZ       LYS  30 -19.376   0.846   7.283
  234   2HZ   LYS  30          2HZ       LYS  30 -20.811  -0.041   7.168
  235   3HZ   LYS  30          3HZ       LYS  30 -20.461   1.152   6.022
  236    H    LYS  31           H        LYS  31 -12.700  -2.216   6.965
  237    HA   LYS  31           HA       LYS  31 -11.755  -0.320   8.807
  238   1HB   LYS  31          1HB       LYS  31 -11.531  -2.635   9.335
  239   2HB   LYS  31          2HB       LYS  31 -10.624  -2.952   7.862
  240   1HG   LYS  31          1HG       LYS  31  -8.764  -1.619   8.719
  241   2HG   LYS  31          2HG       LYS  31  -9.674  -1.307  10.199
  242   1HD   LYS  31          1HD       LYS  31  -9.156  -3.307  11.059
  243   2HD   LYS  31          2HD       LYS  31  -9.506  -4.141   9.544
  244   1HE   LYS  31          1HE       LYS  31  -7.209  -4.493   9.978
  245   2HE   LYS  31          2HE       LYS  31  -7.288  -3.281   8.701
  246   1HZ   LYS  31          1HZ       LYS  31  -5.682  -2.842  10.576
  247   2HZ   LYS  31          2HZ       LYS  31  -7.028  -2.549  11.557
  248   3HZ   LYS  31          3HZ       LYS  31  -6.744  -1.580  10.200
  249    H    ILE  32           H        ILE  32 -10.294  -1.557   5.810
  250    HA   ILE  32           HA       ILE  32  -7.974   0.062   5.960
  251    HB   ILE  32           HB       ILE  32  -9.273  -1.483   3.742
  252   1HG1  ILE  32          1HG1      ILE  32  -6.526  -1.682   4.990
  253   2HG1  ILE  32          2HG1      ILE  32  -7.921  -2.613   5.526
  254   1HG2  ILE  32          1HG2      ILE  32  -6.990  -0.835   2.559
  255   2HG2  ILE  32          2HG2      ILE  32  -8.449   0.137   2.371
  256   3HG2  ILE  32          3HG2      ILE  32  -7.203   0.630   3.517
  257   1HD1  ILE  32          1HD1      ILE  32  -7.760  -4.056   3.825
  258   2HD1  ILE  32          2HD1      ILE  32  -7.348  -2.798   2.659
  259   3HD1  ILE  32          3HD1      ILE  32  -6.103  -3.462   3.718
  260    H    ARG  33           H        ARG  33 -11.094   0.453   4.341
  261    HA   ARG  33           HA       ARG  33 -10.400   2.874   3.014
  262   1HB   ARG  33          1HB       ARG  33 -12.194   1.568   2.119
  263   2HB   ARG  33          2HB       ARG  33 -13.054   1.589   3.652
  264   1HG   ARG  33          1HG       ARG  33 -13.756   3.773   3.382
  265   2HG   ARG  33          2HG       ARG  33 -12.476   4.148   2.227
  266   1HD   ARG  33          1HD       ARG  33 -14.158   3.932   0.734
  267   2HD   ARG  33          2HD       ARG  33 -13.755   2.221   0.869
  268    HE   ARG  33           HE       ARG  33 -15.770   1.866   1.893
  269   1HH1  ARG  33          1HH1      ARG  33 -15.060   5.274   1.927
  270   2HH1  ARG  33          2HH1      ARG  33 -16.619   5.726   2.534
  271   1HH2  ARG  33          1HH2      ARG  33 -17.826   2.448   2.692
  272   2HH2  ARG  33          2HH2      ARG  33 -18.191   4.117   2.969
  273    H    ASP  34           H        ASP  34 -11.367   2.102   6.215
  274    HA   ASP  34           HA       ASP  34 -12.115   4.875   6.792
  275   1HB   ASP  34          1HB       ASP  34 -13.540   2.955   7.602
  276   2HB   ASP  34          2HB       ASP  34 -12.211   2.509   8.668
  277    H    LEU  35           H        LEU  35  -9.335   3.397   6.451
  278    HA   LEU  35           HA       LEU  35  -7.966   3.717   8.893
  279   1HB   LEU  35          1HB       LEU  35  -7.149   3.484   6.033
  280   2HB   LEU  35          2HB       LEU  35  -5.947   3.937   7.239
  281    HG   LEU  35           HG       LEU  35  -7.596   1.415   7.365
  282   1HD1  LEU  35          1HD1      LEU  35  -4.782   1.820   6.362
  283   2HD1  LEU  35          2HD1      LEU  35  -6.182   1.364   5.392
  284   3HD1  LEU  35          3HD1      LEU  35  -5.566   0.262   6.623
  285   1HD2  LEU  35          1HD2      LEU  35  -6.771   2.182   9.520
  286   2HD2  LEU  35          2HD2      LEU  35  -5.138   2.316   8.866
  287   3HD2  LEU  35          3HD2      LEU  35  -5.906   0.734   9.005
  288    HA   PRO  36           HA       PRO  36  -7.163   8.017   9.224
  289   1HB   PRO  36          1HB       PRO  36  -4.595   8.067  10.104
  290   2HB   PRO  36          2HB       PRO  36  -5.947   7.549  11.117
  291   1HG   PRO  36          1HG       PRO  36  -3.974   5.888   9.597
  292   2HG   PRO  36          2HG       PRO  36  -4.601   5.657  11.240
  293   1HD   PRO  36          1HD       PRO  36  -5.531   4.259   9.116
  294   2HD   PRO  36          2HD       PRO  36  -6.560   4.701  10.493
  295    H    ILE  37           H        ILE  37  -6.986   9.329   7.524
  296    HA   ILE  37           HA       ILE  37  -5.285   8.814   5.307
  297    HB   ILE  37           HB       ILE  37  -5.957  11.120   4.569
  298   1HG1  ILE  37          1HG1      ILE  37  -7.659  11.028   7.069
  299   2HG1  ILE  37          2HG1      ILE  37  -6.250  12.060   6.847
  300   1HG2  ILE  37          1HG2      ILE  37  -8.547   9.961   5.184
  301   2HG2  ILE  37          2HG2      ILE  37  -7.746  10.179   3.629
  302   3HG2  ILE  37          3HG2      ILE  37  -7.386   8.761   4.614
  303   1HD1  ILE  37          1HD1      ILE  37  -7.688  12.757   4.688
  304   2HD1  ILE  37          2HD1      ILE  37  -8.983  12.336   5.809
  305   3HD1  ILE  37          3HD1      ILE  37  -7.799  13.567   6.250
  306    H    SER  38           H        SER  38  -5.035  10.846   8.155
  307    HA   SER  38           HA       SER  38  -2.820  12.388   7.300
  308   1HB   SER  38          1HB       SER  38  -4.438  12.168   9.645
  309   2HB   SER  38          2HB       SER  38  -2.745  12.101  10.131
  310    HG   SER  38           HG       SER  38  -2.486  14.116   9.540
  311    H    LEU  39           H        LEU  39  -3.120   9.157   8.393
  312    HA   LEU  39           HA       LEU  39  -0.462   8.850   9.404
  313   1HB   LEU  39          1HB       LEU  39  -2.708   7.398   9.641
  314   2HB   LEU  39          2HB       LEU  39  -1.908   6.495   8.356
  315    HG   LEU  39           HG       LEU  39  -0.266   7.099  10.737
  316   1HD1  LEU  39          1HD1      LEU  39  -1.235   5.334  12.068
  317   2HD1  LEU  39          2HD1      LEU  39  -2.463   5.038  10.839
  318   3HD1  LEU  39          3HD1      LEU  39  -2.458   6.559  11.730
  319   1HD2  LEU  39          1HD2      LEU  39  -0.284   4.375  10.034
  320   2HD2  LEU  39          2HD2      LEU  39   0.967   5.573   9.703
  321   3HD2  LEU  39          3HD2      LEU  39  -0.314   5.285   8.524
  322    H    PHE  40           H        PHE  40  -1.971   8.628   6.279
  323    HA   PHE  40           HA       PHE  40   0.640   7.911   5.119
  324   1HB   PHE  40          1HB       PHE  40  -1.964   7.197   3.796
  325   2HB   PHE  40          2HB       PHE  40  -0.362   6.526   3.508
  326    HD1  PHE  40           2HD      PHE  40  -3.276   6.507   5.732
  327    HD2  PHE  40           1HD      PHE  40   0.520   4.776   4.886
  328    HE1  PHE  40           2HE      PHE  40  -3.778   4.659   7.276
  329    HE2  PHE  40           1HE      PHE  40   0.022   2.924   6.428
  330    HZ   PHE  40           HZ       PHE  40  -2.128   2.865   7.626
  331    H    ASP  41           H        ASP  41   1.451   9.547   4.005
  332    HA   ASP  41           HA       ASP  41   0.185  11.921   3.395
  333   1HB   ASP  41          1HB       ASP  41   2.735  10.927   3.098
  334   2HB   ASP  41          2HB       ASP  41   2.228  11.177   1.430
  335    H    TYR  42           H        TYR  42   0.196   8.919   1.625
  336    HA   TYR  42           HA       TYR  42  -1.790  10.034  -0.209
  337   1HB   TYR  42          1HB       TYR  42   0.307  10.214  -1.431
  338   2HB   TYR  42          2HB       TYR  42   0.677   8.526  -1.100
  339    HD1  TYR  42           1HD      TYR  42  -2.587   9.959  -2.144
  340    HD2  TYR  42           2HD      TYR  42   0.780   7.608  -3.257
  341    HE1  TYR  42           1HE      TYR  42  -3.737   9.305  -4.218
  342    HE2  TYR  42           2HE      TYR  42  -0.359   6.949  -5.335
  343    HH   TYR  42           HH       TYR  42  -2.365   6.912  -6.402
  344    H    PHE  43           H        PHE  43  -3.503   8.751  -0.300
  345    HA   PHE  43           HA       PHE  43  -3.142   5.858   0.064
  346   1HB   PHE  43          1HB       PHE  43  -4.115   7.366   2.077
  347   2HB   PHE  43          2HB       PHE  43  -5.608   7.045   1.202
  348    HD1  PHE  43           1HD      PHE  43  -4.498   4.268   0.202
  349    HD2  PHE  43           2HD      PHE  43  -4.902   6.125   4.010
  350    HE1  PHE  43           1HE      PHE  43  -4.642   2.053   1.263
  351    HE2  PHE  43           2HE      PHE  43  -5.046   3.913   5.077
  352    HZ   PHE  43           HZ       PHE  43  -4.915   1.873   3.704
  353    H    ILE  44           H        ILE  44  -3.855   4.872  -1.697
  354    HA   ILE  44           HA       ILE  44  -6.357   5.791  -2.925
  355    HB   ILE  44           HB       ILE  44  -4.793   6.728  -4.410
  356   1HG1  ILE  44          1HG1      ILE  44  -5.027   4.187  -5.902
  357   2HG1  ILE  44          2HG1      ILE  44  -6.534   4.826  -5.255
  358   1HG2  ILE  44          1HG2      ILE  44  -3.249   4.189  -4.013
  359   2HG2  ILE  44          2HG2      ILE  44  -2.943   5.246  -5.391
  360   3HG2  ILE  44          3HG2      ILE  44  -2.732   5.854  -3.749
  361   1HD1  ILE  44          1HD1      ILE  44  -6.649   6.338  -6.865
  362   2HD1  ILE  44          2HD1      ILE  44  -5.012   6.905  -6.531
  363   3HD1  ILE  44          3HD1      ILE  44  -5.269   5.545  -7.624
  364    H    VAL  45           H        VAL  45  -7.747   4.164  -2.899
  365    HA   VAL  45           HA       VAL  45  -6.721   1.425  -3.279
  366    HB   VAL  45           HB       VAL  45  -9.261   1.966  -1.784
  367   1HG1  VAL  45          1HG1      VAL  45  -9.204  -0.272  -1.929
  368   2HG1  VAL  45          2HG1      VAL  45  -7.481  -0.302  -2.310
  369   3HG1  VAL  45          3HG1      VAL  45  -8.013  -0.164  -0.633
  370   1HG2  VAL  45          1HG2      VAL  45  -7.786   3.317  -0.545
  371   2HG2  VAL  45          2HG2      VAL  45  -7.837   1.780   0.319
  372   3HG2  VAL  45          3HG2      VAL  45  -6.460   2.167  -0.712
  373    H    GLY  46           H        GLY  46  -7.779   0.108  -4.700
  374   1HA   GLY  46          1HA       GLY  46 -10.195   1.188  -6.001
  375   2HA   GLY  46          2HA       GLY  46  -8.839   0.629  -6.969
  376    H    GLU  47           H        GLU  47 -11.775  -0.245  -6.357
  377    HA   GLU  47           HA       GLU  47 -11.333  -2.993  -5.517
  378   1HB   GLU  47          1HB       GLU  47 -13.305  -1.764  -4.698
  379   2HB   GLU  47          2HB       GLU  47 -13.878  -1.589  -6.351
  380   1HG   GLU  47          1HG       GLU  47 -13.326  -4.352  -5.615
  381   2HG   GLU  47          2HG       GLU  47 -14.562  -3.592  -4.613
  382    H    GLU  48           H        GLU  48 -11.287  -4.729  -6.824
  383    HA   GLU  48           HA       GLU  48 -11.440  -4.234  -9.709
  384   1HB   GLU  48          1HB       GLU  48  -9.365  -5.238  -8.801
  385   2HB   GLU  48          2HB       GLU  48 -10.302  -6.611  -8.227
  386   1HG   GLU  48          1HG       GLU  48 -10.909  -6.322 -10.953
  387   2HG   GLU  48          2HG       GLU  48  -9.161  -6.148 -10.804
  388    H    GLY  49           H        GLY  49 -12.827  -5.313 -11.041
  389   1HA   GLY  49          1HA       GLY  49 -14.382  -7.556 -10.099
  390   2HA   GLY  49          2HA       GLY  49 -15.310  -6.073 -10.266
  391    H    ASN  50           H        ASN  50 -13.192  -8.291 -12.044
  392    HA   ASN  50           HA       ASN  50 -13.693  -7.281 -14.611
  393   1HB   ASN  50          1HB       ASN  50 -12.160  -9.329 -13.535
  394   2HB   ASN  50          2HB       ASN  50 -13.321 -10.173 -14.555
  395   1HD2  ASN  50          1HD2      ASN  50 -10.330  -9.205 -14.611
  396   2HD2  ASN  50          2HD2      ASN  50 -10.150  -8.694 -16.251
  397    H    GLU  51           H        GLU  51 -14.617  -9.270 -16.205
  398    HA   GLU  51           HA       GLU  51 -17.393  -8.964 -16.079
  399   1HB   GLU  51          1HB       GLU  51 -15.579  -9.962 -17.919
  400   2HB   GLU  51          2HB       GLU  51 -16.552 -11.367 -17.504
  401   1HG   GLU  51          1HG       GLU  51 -18.579 -10.149 -18.082
  402   2HG   GLU  51          2HG       GLU  51 -17.618  -8.724 -18.474
  403    H    GLU  52           H        GLU  52 -18.858 -11.038 -16.232
  404    HA   GLU  52           HA       GLU  52 -19.138 -12.078 -13.682
  405   1HB   GLU  52          1HB       GLU  52 -20.944 -12.086 -15.331
  406   2HB   GLU  52          2HB       GLU  52 -20.077 -13.274 -16.295
  407   1HG   GLU  52          1HG       GLU  52 -20.274 -14.894 -14.479
  408   2HG   GLU  52          2HG       GLU  52 -21.145 -13.704 -13.514
  409    H    GLY  53           H        GLY  53 -18.758 -14.145 -12.779
  410   1HA   GLY  53          1HA       GLY  53 -17.802 -16.325 -12.801
  411   2HA   GLY  53          2HA       GLY  53 -16.845 -15.859 -14.200
  412    H    ARG  54           H        ARG  54 -16.200 -13.263 -12.767
  413    HA   ARG  54           HA       ARG  54 -14.029 -14.376 -11.127
  414   1HB   ARG  54          1HB       ARG  54 -13.323 -13.073 -13.090
  415   2HB   ARG  54          2HB       ARG  54 -14.227 -11.687 -12.495
  416   1HG   ARG  54          1HG       ARG  54 -12.507 -11.038 -11.265
  417   2HG   ARG  54          2HG       ARG  54 -12.440 -12.606 -10.460
  418   1HD   ARG  54          1HD       ARG  54 -11.297 -12.220 -13.204
  419   2HD   ARG  54          2HD       ARG  54 -10.371 -11.796 -11.765
  420    HE   ARG  54           HE       ARG  54 -11.266 -14.363 -11.344
  421   1HH1  ARG  54          1HH1      ARG  54  -9.306 -12.728 -13.712
  422   2HH1  ARG  54          2HH1      ARG  54  -8.344 -14.123 -14.070
  423   1HH2  ARG  54          1HH2      ARG  54 -10.006 -16.207 -11.807
  424   2HH2  ARG  54          2HH2      ARG  54  -8.743 -16.102 -12.986
  425    H    THR  55           H        THR  55 -13.792 -13.816  -9.034
  426    HA   THR  55           HA       THR  55 -15.967 -12.413  -7.758
  427    HB   THR  55           HB       THR  55 -14.106 -12.864  -5.777
  428    HG1  THR  55           1HG      THR  55 -14.008 -15.099  -7.537
  429   1HG2  THR  55          1HG2      THR  55 -16.613 -13.968  -6.677
  430   2HG2  THR  55          2HG2      THR  55 -15.998 -13.782  -5.034
  431   3HG2  THR  55          3HG2      THR  55 -15.600 -15.224  -5.968
  432    HA   PRO  56           HA       PRO  56 -14.153  -8.450  -7.247
  433   1HB   PRO  56          1HB       PRO  56 -14.930  -7.781  -4.733
  434   2HB   PRO  56          2HB       PRO  56 -16.048  -7.839  -6.101
  435   1HG   PRO  56          1HG       PRO  56 -15.568  -9.875  -3.959
  436   2HG   PRO  56          2HG       PRO  56 -17.104  -9.320  -4.652
  437   1HD   PRO  56          1HD       PRO  56 -15.928 -11.644  -5.391
  438   2HD   PRO  56          2HD       PRO  56 -16.895 -10.665  -6.512
  439    H    HIS  57           H        HIS  57 -12.056  -8.029  -7.012
  440    HA   HIS  57           HA       HIS  57 -10.664  -9.069  -4.632
  441   1HB   HIS  57          1HB       HIS  57  -9.753 -10.096  -6.598
  442   2HB   HIS  57          2HB       HIS  57  -9.637  -8.545  -7.424
  443    HD1  HIS  57           1HD      HIS  57  -7.599  -7.090  -6.925
  444    HD2  HIS  57           2HD      HIS  57  -7.742 -10.573  -4.664
  445    HE1  HIS  57           1HE      HIS  57  -5.341  -7.277  -5.834
  446    H    LEU  58           H        LEU  58  -9.471  -7.699  -3.392
  447    HA   LEU  58           HA       LEU  58  -9.821  -4.848  -3.921
  448   1HB   LEU  58          1HB       LEU  58  -9.940  -6.413  -1.618
  449   2HB   LEU  58          2HB       LEU  58  -8.446  -5.490  -1.461
  450    HG   LEU  58           HG       LEU  58 -11.243  -4.406  -1.757
  451   1HD1  LEU  58          1HD1      LEU  58  -9.268  -4.621   0.467
  452   2HD1  LEU  58          2HD1      LEU  58 -11.006  -4.917   0.471
  453   3HD1  LEU  58          3HD1      LEU  58 -10.394  -3.264   0.430
  454   1HD2  LEU  58          1HD2      LEU  58  -8.655  -3.204  -2.370
  455   2HD2  LEU  58          2HD2      LEU  58  -9.608  -2.276  -1.212
  456   3HD2  LEU  58          3HD2      LEU  58 -10.283  -2.673  -2.793
  457    H    GLN  59           H        GLN  59  -8.205  -3.512  -4.464
  458    HA   GLN  59           HA       GLN  59  -5.438  -4.282  -4.012
  459   1HB   GLN  59          1HB       GLN  59  -5.685  -5.265  -6.143
  460   2HB   GLN  59          2HB       GLN  59  -6.653  -3.924  -6.741
  461   1HG   GLN  59          1HG       GLN  59  -4.422  -3.906  -7.701
  462   2HG   GLN  59          2HG       GLN  59  -4.703  -2.477  -6.708
  463   1HE2  GLN  59          1HE2      GLN  59  -2.483  -4.725  -7.473
  464   2HE2  GLN  59          2HE2      GLN  59  -1.530  -4.717  -6.032
  465    H    GLY  60           H        GLY  60  -4.656  -2.559  -2.991
  466   1HA   GLY  60          1HA       GLY  60  -4.979   0.069  -4.241
  467   2HA   GLY  60          2HA       GLY  60  -5.506  -0.108  -2.574
  468    H    PHE  61           H        PHE  61  -3.564   1.723  -3.270
  469    HA   PHE  61           HA       PHE  61  -1.183   0.543  -2.005
  470   1HB   PHE  61          1HB       PHE  61  -0.518   0.871  -4.255
  471   2HB   PHE  61          2HB       PHE  61  -1.327   2.432  -4.348
  472    HD1  PHE  61           2HD      PHE  61   1.162   0.916  -2.014
  473    HD2  PHE  61           1HD      PHE  61   0.166   4.146  -4.601
  474    HE1  PHE  61           2HE      PHE  61   3.270   2.038  -1.420
  475    HE2  PHE  61           1HE      PHE  61   2.273   5.273  -4.012
  476    HZ   PHE  61           HZ       PHE  61   3.827   4.219  -2.418
  477    H    ALA  62           H        ALA  62  -0.208   1.730  -0.421
  478    HA   ALA  62           HA       ALA  62  -1.227   4.430   0.113
  479   1HB   ALA  62          1HB       ALA  62  -2.067   2.229   1.557
  480   2HB   ALA  62          2HB       ALA  62  -0.802   2.935   2.563
  481   3HB   ALA  62          3HB       ALA  62  -2.179   3.916   2.061
  482    H    ASN  63           H        ASN  63   0.307   5.847   0.705
  483    HA   ASN  63           HA       ASN  63   3.035   4.834   1.010
  484   1HB   ASN  63          1HB       ASN  63   1.821   7.336   0.009
  485   2HB   ASN  63          2HB       ASN  63   3.319   7.533   0.913
  486   1HD2  ASN  63          1HD2      ASN  63   2.309   7.500  -2.057
  487   2HD2  ASN  63          2HD2      ASN  63   3.590   6.668  -2.864
  488    H    PHE  64           H        PHE  64   3.727   4.510   3.011
  489    HA   PHE  64           HA       PHE  64   2.480   5.610   5.308
  490   1HB   PHE  64          1HB       PHE  64   4.591   3.710   4.732
  491   2HB   PHE  64          2HB       PHE  64   5.025   4.749   6.085
  492    HD1  PHE  64           2HD      PHE  64   3.285   4.990   7.967
  493    HD2  PHE  64           1HD      PHE  64   3.218   1.879   5.063
  494    HE1  PHE  64           2HE      PHE  64   1.880   3.630   9.461
  495    HE2  PHE  64           1HE      PHE  64   1.812   0.515   6.552
  496    HZ   PHE  64           HZ       PHE  64   1.142   1.389   8.754
  497    H    VAL  65           H        VAL  65   2.824   7.465   6.348
  498    HA   VAL  65           HA       VAL  65   4.408   9.515   5.282
  499    HB   VAL  65           HB       VAL  65   3.226   9.212   8.044
  500   1HG1  VAL  65          1HG1      VAL  65   4.769  10.818   8.517
  501   2HG1  VAL  65          2HG1      VAL  65   4.880  11.363   6.842
  502   3HG1  VAL  65          3HG1      VAL  65   3.505  11.843   7.837
  503   1HG2  VAL  65          1HG2      VAL  65   1.736   9.345   5.976
  504   2HG2  VAL  65          2HG2      VAL  65   1.423  10.501   7.270
  505   3HG2  VAL  65          3HG2      VAL  65   2.295  11.011   5.825
  506    H    LYS  66           H        LYS  66   5.177   6.946   7.455
  507    HA   LYS  66           HA       LYS  66   7.879   8.068   7.785
  508   1HB   LYS  66          1HB       LYS  66   7.921   6.818  10.001
  509   2HB   LYS  66          2HB       LYS  66   6.929   8.269   9.939
  510   1HG   LYS  66          1HG       LYS  66   5.577   5.723   9.301
  511   2HG   LYS  66          2HG       LYS  66   6.086   5.956  10.975
  512   1HD   LYS  66          1HD       LYS  66   4.686   8.207   9.639
  513   2HD   LYS  66          2HD       LYS  66   3.725   6.792  10.073
  514   1HE   LYS  66          1HE       LYS  66   4.121   7.062  12.341
  515   2HE   LYS  66          2HE       LYS  66   5.575   8.022  12.075
  516   1HZ   LYS  66          1HZ       LYS  66   2.793   8.918  11.545
  517   2HZ   LYS  66          2HZ       LYS  66   4.189   9.840  11.293
  518   3HZ   LYS  66          3HZ       LYS  66   3.747   9.387  12.862
  519    H    LYS  67           H        LYS  67   9.230   6.040   8.848
  520    HA   LYS  67           HA       LYS  67   9.216   4.072   6.708
  521   1HB   LYS  67          1HB       LYS  67  11.149   4.716   8.929
  522   2HB   LYS  67          2HB       LYS  67  11.339   3.293   7.913
  523   1HG   LYS  67          1HG       LYS  67  10.934   5.540   6.223
  524   2HG   LYS  67          2HG       LYS  67  12.177   5.947   7.409
  525   1HD   LYS  67          1HD       LYS  67  13.189   3.653   6.815
  526   2HD   LYS  67          2HD       LYS  67  12.150   3.726   5.390
  527   1HE   LYS  67          1HE       LYS  67  13.646   6.187   5.864
  528   2HE   LYS  67          2HE       LYS  67  14.679   4.783   5.598
  529   1HZ   LYS  67          1HZ       LYS  67  14.289   4.997   3.444
  530   2HZ   LYS  67          2HZ       LYS  67  13.205   6.267   3.710
  531   3HZ   LYS  67          3HZ       LYS  67  12.650   4.669   3.706
  532    H    GLN  68           H        GLN  68   8.323   2.130   6.885
  533    HA   GLN  68           HA       GLN  68   8.056   0.917   9.544
  534   1HB   GLN  68          1HB       GLN  68   5.862   0.960   7.466
  535   2HB   GLN  68          2HB       GLN  68   5.787   0.186   9.043
  536   1HG   GLN  68          1HG       GLN  68   6.181   3.141   8.660
  537   2HG   GLN  68          2HG       GLN  68   4.604   2.381   8.866
  538   1HE2  GLN  68          1HE2      GLN  68   6.774   4.100  10.457
  539   2HE2  GLN  68          2HE2      GLN  68   6.585   3.480  12.058
  540    H    THR  69           H        THR  69   7.993  -1.364   9.569
  541    HA   THR  69           HA       THR  69   9.332  -2.567   7.281
  542    HB   THR  69           HB       THR  69   9.881  -4.399   8.694
  543    HG1  THR  69           1HG      THR  69   8.931  -4.256  10.962
  544   1HG2  THR  69          1HG2      THR  69   9.988  -1.868  10.341
  545   2HG2  THR  69          2HG2      THR  69  11.174  -2.372   9.136
  546   3HG2  THR  69          3HG2      THR  69  10.961  -3.313  10.613
  547    H    PHE  70           H        PHE  70   8.679  -4.897   6.776
  548    HA   PHE  70           HA       PHE  70   6.073  -4.906   5.737
  549   1HB   PHE  70          1HB       PHE  70   7.623  -6.277   4.620
  550   2HB   PHE  70          2HB       PHE  70   8.150  -7.049   6.112
  551    HD1  PHE  70           1HD      PHE  70   4.993  -6.607   4.167
  552    HD2  PHE  70           2HD      PHE  70   7.481  -9.213   6.434
  553    HE1  PHE  70           1HE      PHE  70   3.424  -8.457   3.756
  554    HE2  PHE  70           2HE      PHE  70   5.916 -11.067   6.025
  555    HZ   PHE  70           HZ       PHE  70   3.885 -10.691   4.684
  556    H    ASN  71           H        ASN  71   7.437  -6.787   8.441
  557    HA   ASN  71           HA       ASN  71   5.023  -7.986   9.224
  558   1HB   ASN  71          1HB       ASN  71   7.716  -7.644  10.383
  559   2HB   ASN  71          2HB       ASN  71   6.425  -7.897  11.554
  560   1HD2  ASN  71          1HD2      ASN  71   8.022  -9.234   8.733
  561   2HD2  ASN  71          2HD2      ASN  71   7.562 -10.875   9.018
  562    H    LYS  72           H        LYS  72   6.571  -4.969  10.211
  563    HA   LYS  72           HA       LYS  72   4.776  -4.329  12.294
  564   1HB   LYS  72          1HB       LYS  72   6.874  -3.197  12.217
  565   2HB   LYS  72          2HB       LYS  72   6.584  -2.630  10.577
  566   1HG   LYS  72          1HG       LYS  72   6.330  -0.856  12.253
  567   2HG   LYS  72          2HG       LYS  72   4.842  -1.152  11.351
  568   1HD   LYS  72          1HD       LYS  72   4.017  -2.534  13.219
  569   2HD   LYS  72          2HD       LYS  72   5.488  -2.163  14.122
  570   1HE   LYS  72          1HE       LYS  72   3.758   0.038  13.059
  571   2HE   LYS  72          2HE       LYS  72   3.335  -0.782  14.561
  572   1HZ   LYS  72          1HZ       LYS  72   4.754   0.551  15.586
  573   2HZ   LYS  72          2HZ       LYS  72   5.276   1.223  14.124
  574   3HZ   LYS  72          3HZ       LYS  72   6.028  -0.164  14.733
  575    H    VAL  73           H        VAL  73   4.898  -3.278   8.895
  576    HA   VAL  73           HA       VAL  73   2.684  -1.611   8.884
  577    HB   VAL  73           HB       VAL  73   3.794  -3.375   6.705
  578   1HG1  VAL  73          1HG1      VAL  73   1.486  -1.466   6.656
  579   2HG1  VAL  73          2HG1      VAL  73   2.457  -1.752   5.211
  580   3HG1  VAL  73          3HG1      VAL  73   1.602  -3.090   5.979
  581   1HG2  VAL  73          1HG2      VAL  73   5.022  -1.561   6.027
  582   2HG2  VAL  73          2HG2      VAL  73   3.891  -0.397   6.716
  583   3HG2  VAL  73          3HG2      VAL  73   4.991  -1.288   7.769
  584    H    LYS  74           H        LYS  74   2.843  -5.065   9.028
  585    HA   LYS  74           HA       LYS  74   0.264  -5.687   8.073
  586   1HB   LYS  74          1HB       LYS  74   1.955  -7.161  10.101
  587   2HB   LYS  74          2HB       LYS  74   0.555  -7.823   9.268
  588   1HG   LYS  74          1HG       LYS  74   2.148  -6.934   7.207
  589   2HG   LYS  74          2HG       LYS  74   3.307  -7.567   8.379
  590   1HD   LYS  74          1HD       LYS  74   2.852  -9.526   7.345
  591   2HD   LYS  74          2HD       LYS  74   1.468  -9.530   8.440
  592   1HE   LYS  74          1HE       LYS  74   0.051  -8.604   6.725
  593   2HE   LYS  74          2HE       LYS  74   1.427  -8.414   5.639
  594   1HZ   LYS  74          1HZ       LYS  74   1.593 -10.702   5.332
  595   2HZ   LYS  74          2HZ       LYS  74  -0.074 -10.422   5.303
  596   3HZ   LYS  74          3HZ       LYS  74   0.651 -11.065   6.689
  597    H    TRP  75           H        TRP  75   1.241  -4.045  10.847
  598    HA   TRP  75           HA       TRP  75  -0.763  -4.894  12.671
  599   1HB   TRP  75          1HB       TRP  75  -0.038  -3.140  14.065
  600   2HB   TRP  75          2HB       TRP  75   1.406  -3.616  13.175
  601    HD1  TRP  75           HD       TRP  75   0.887  -1.990  10.492
  602    HE1  TRP  75           1HE      TRP  75   1.092   0.576  10.508
  603    HE3  TRP  75           3HE      TRP  75   0.256  -1.156  15.496
  604    HZ2  TRP  75           2HZ      TRP  75   1.000   2.675  12.392
  605    HZ3  TRP  75           3HZ      TRP  75   0.329   1.160  16.324
  606    HH2  TRP  75           HH       TRP  75   0.694   3.034  14.803
  607    H    TYR  76           H        TYR  76  -0.801  -2.839   9.932
  608    HA   TYR  76           HA       TYR  76  -3.430  -1.771  10.722
  609   1HB   TYR  76          1HB       TYR  76  -1.129  -0.572   9.366
  610   2HB   TYR  76          2HB       TYR  76  -2.650  -0.300   8.524
  611    HD1  TYR  76           2HD      TYR  76  -4.512  -0.112  10.836
  612    HD2  TYR  76           1HD      TYR  76  -0.629   1.529  10.264
  613    HE1  TYR  76           2HE      TYR  76  -5.057   1.706  12.400
  614    HE2  TYR  76           1HE      TYR  76  -1.162   3.351  11.828
  615    HH   TYR  76           HH       TYR  76  -4.019   3.323  13.777
  616    H    LEU  77           H        LEU  77  -1.588  -2.934   7.907
  617    HA   LEU  77           HA       LEU  77  -3.905  -3.249   6.272
  618   1HB   LEU  77          1HB       LEU  77  -1.093  -4.294   6.017
  619   2HB   LEU  77          2HB       LEU  77  -2.340  -4.535   4.795
  620    HG   LEU  77           HG       LEU  77  -1.183  -1.888   5.669
  621   1HD1  LEU  77          1HD1      LEU  77  -0.497  -1.914   3.194
  622   2HD1  LEU  77          2HD1      LEU  77  -0.767  -3.654   3.283
  623   3HD1  LEU  77          3HD1      LEU  77   0.433  -2.894   4.329
  624   1HD2  LEU  77          1HD2      LEU  77  -3.307  -2.554   3.635
  625   2HD2  LEU  77          2HD2      LEU  77  -2.514  -0.985   3.779
  626   3HD2  LEU  77          3HD2      LEU  77  -3.503  -1.599   5.105
  627    H    GLY  78           H        GLY  78  -2.641  -5.044   8.825
  628   1HA   GLY  78          1HA       GLY  78  -3.301  -7.043   9.749
  629   2HA   GLY  78          2HA       GLY  78  -4.618  -7.065   8.585
  630    H    ALA  79           H        ALA  79  -3.061  -9.311   9.479
  631    HA   ALA  79           HA       ALA  79  -1.172 -10.006   7.444
  632   1HB   ALA  79          1HB       ALA  79  -1.761 -12.377   8.582
  633   2HB   ALA  79          2HB       ALA  79  -0.624 -11.214   9.266
  634   3HB   ALA  79          3HB       ALA  79  -2.285 -11.277   9.856
  635    H    ARG  80           H        ARG  80  -4.599 -10.388   7.890
  636    HA   ARG  80           HA       ARG  80  -5.166 -12.527   6.228
  637   1HB   ARG  80          1HB       ARG  80  -7.377 -11.433   5.870
  638   2HB   ARG  80          2HB       ARG  80  -6.897 -11.517   7.560
  639   1HG   ARG  80          1HG       ARG  80  -5.919  -9.081   6.820
  640   2HG   ARG  80          2HG       ARG  80  -7.394  -9.198   5.858
  641   1HD   ARG  80          1HD       ARG  80  -7.125  -9.434   8.849
  642   2HD   ARG  80          2HD       ARG  80  -7.944  -8.163   7.943
  643    HE   ARG  80           HE       ARG  80  -9.166 -10.556   7.259
  644   1HH1  ARG  80          1HH1      ARG  80  -8.700  -8.616  10.112
  645   2HH1  ARG  80          2HH1      ARG  80 -10.176  -9.129  10.861
  646   1HH2  ARG  80          1HH2      ARG  80 -11.111 -11.239   8.234
  647   2HH2  ARG  80          2HH2      ARG  80 -11.546 -10.622   9.792
  648    H    CYS  81           H        CYS  81  -4.599  -9.140   5.391
  649    HA   CYS  81           HA       CYS  81  -4.933  -9.729   2.555
  650   1HB   CYS  81          1HB       CYS  81  -4.187  -7.082   3.799
  651   2HB   CYS  81          2HB       CYS  81  -4.849  -7.367   2.194
  652    HG   CYS  81           HG       CYS  81  -7.297  -7.035   2.865
  653    H    HIS  82           H        HIS  82  -3.305  -9.870   1.112
  654    HA   HIS  82           HA       HIS  82  -0.646 -10.252   2.087
  655   1HB   HIS  82          1HB       HIS  82  -1.694 -11.501   0.159
  656   2HB   HIS  82          2HB       HIS  82  -1.516 -10.034  -0.799
  657    HD1  HIS  82           1HD      HIS  82   0.354 -12.951   0.477
  658    HD2  HIS  82           2HD      HIS  82   1.192  -9.334  -1.388
  659    HE1  HIS  82           1HE      HIS  82   2.725 -13.148  -0.338
  660    H    ILE  83           H        ILE  83   1.026  -8.878   2.133
  661    HA   ILE  83           HA       ILE  83   0.624  -6.207   0.956
  662    HB   ILE  83           HB       ILE  83   2.603  -6.753   3.139
  663   1HG1  ILE  83          1HG1      ILE  83  -0.348  -6.185   3.484
  664   2HG1  ILE  83          2HG1      ILE  83   0.508  -7.635   3.995
  665   1HG2  ILE  83          1HG2      ILE  83   1.004  -4.301   2.419
  666   2HG2  ILE  83          2HG2      ILE  83   2.287  -4.404   3.624
  667   3HG2  ILE  83          3HG2      ILE  83   2.664  -4.616   1.914
  668   1HD1  ILE  83          1HD1      ILE  83   0.606  -4.884   5.157
  669   2HD1  ILE  83          2HD1      ILE  83   0.260  -6.421   5.950
  670   3HD1  ILE  83          3HD1      ILE  83   1.905  -6.042   5.443
  671    H    GLU  84           H        GLU  84   2.250  -5.260  -0.234
  672    HA   GLU  84           HA       GLU  84   4.776  -6.658  -0.584
  673   1HB   GLU  84          1HB       GLU  84   2.769  -7.299  -2.304
  674   2HB   GLU  84          2HB       GLU  84   3.506  -5.945  -3.149
  675   1HG   GLU  84          1HG       GLU  84   5.060  -7.304  -3.925
  676   2HG   GLU  84          2HG       GLU  84   5.613  -7.590  -2.276
  677    H    LYS  85           H        LYS  85   6.283  -5.405  -1.987
  678    HA   LYS  85           HA       LYS  85   6.125  -2.610  -1.284
  679   1HB   LYS  85          1HB       LYS  85   8.253  -3.984  -2.926
  680   2HB   LYS  85          2HB       LYS  85   8.390  -2.455  -2.069
  681   1HG   LYS  85          1HG       LYS  85   7.988  -3.777   0.057
  682   2HG   LYS  85          2HG       LYS  85   8.245  -5.224  -0.920
  683   1HD   LYS  85          1HD       LYS  85  10.320  -3.282  -1.403
  684   2HD   LYS  85          2HD       LYS  85  10.192  -3.646   0.320
  685   1HE   LYS  85          1HE       LYS  85  10.726  -5.868   0.025
  686   2HE   LYS  85          2HE       LYS  85  10.176  -5.887  -1.650
  687   1HZ   LYS  85          1HZ       LYS  85  12.146  -5.109  -2.403
  688   2HZ   LYS  85          2HZ       LYS  85  12.725  -5.851  -0.998
  689   3HZ   LYS  85          3HZ       LYS  85  12.457  -4.181  -1.023
  690    H    ALA  86           H        ALA  86   5.634  -0.943  -2.583
  691    HA   ALA  86           HA       ALA  86   4.648  -1.535  -5.248
  692   1HB   ALA  86          1HB       ALA  86   3.997   0.336  -3.243
  693   2HB   ALA  86          2HB       ALA  86   4.552   1.254  -4.643
  694   3HB   ALA  86          3HB       ALA  86   3.223   0.107  -4.811
  695    H    LYS  87           H        LYS  87   5.253  -0.240  -7.107
  696    HA   LYS  87           HA       LYS  87   7.897   1.012  -6.957
  697   1HB   LYS  87          1HB       LYS  87   8.796  -0.248  -8.756
  698   2HB   LYS  87          2HB       LYS  87   8.105  -1.417  -7.639
  699   1HG   LYS  87          1HG       LYS  87   6.022  -0.873  -9.359
  700   2HG   LYS  87          2HG       LYS  87   7.441  -0.868 -10.409
  701   1HD   LYS  87          1HD       LYS  87   7.247  -3.094 -10.441
  702   2HD   LYS  87          2HD       LYS  87   7.854  -3.061  -8.784
  703   1HE   LYS  87          1HE       LYS  87   5.628  -3.056  -7.903
  704   2HE   LYS  87          2HE       LYS  87   4.937  -2.845  -9.511
  705   1HZ   LYS  87          1HZ       LYS  87   4.719  -5.060  -9.408
  706   2HZ   LYS  87          2HZ       LYS  87   5.904  -5.247  -8.216
  707   3HZ   LYS  87          3HZ       LYS  87   6.355  -5.085  -9.838
  708    H    GLY  88           H        GLY  88   8.248   2.642  -8.442
  709   1HA   GLY  88          1HA       GLY  88   7.682   3.725 -10.548
  710   2HA   GLY  88          2HA       GLY  88   6.017   3.229 -10.283
  711    H    THR  89           H        THR  89   5.606   5.534 -10.716
  712    HA   THR  89           HA       THR  89   6.223   7.280  -8.437
  713    HB   THR  89           HB       THR  89   5.739   9.154  -9.820
  714    HG1  THR  89           1HG      THR  89   4.629   9.012 -11.698
  715   1HG2  THR  89          1HG2      THR  89   7.432   9.010 -11.413
  716   2HG2  THR  89          2HG2      THR  89   7.080   7.320 -11.777
  717   3HG2  THR  89          3HG2      THR  89   7.872   7.750 -10.261
  718    H    ASP  90           H        ASP  90   4.387   8.957  -8.048
  719    HA   ASP  90           HA       ASP  90   2.220   7.641  -6.907
  720   1HB   ASP  90          1HB       ASP  90   2.906   9.881  -6.217
  721   2HB   ASP  90          2HB       ASP  90   2.423  10.530  -7.782
  722    H    GLN  91           H        GLN  91   2.524   9.191 -10.065
  723    HA   GLN  91           HA       GLN  91  -0.193   8.954 -10.808
  724   1HB   GLN  91          1HB       GLN  91   2.359   9.567 -12.178
  725   2HB   GLN  91          2HB       GLN  91   1.062   8.959 -13.197
  726   1HG   GLN  91          1HG       GLN  91   0.652  11.251 -11.310
  727   2HG   GLN  91          2HG       GLN  91   1.278  11.478 -12.942
  728   1HE2  GLN  91          1HE2      GLN  91  -1.480  10.824 -11.006
  729   2HE2  GLN  91          2HE2      GLN  91  -2.649  10.821 -12.278
  730    H    GLN  92           H        GLN  92   2.575   6.810 -11.103
  731    HA   GLN  92           HA       GLN  92   1.385   4.936 -12.854
  732   1HB   GLN  92          1HB       GLN  92   3.775   5.027 -11.111
  733   2HB   GLN  92          2HB       GLN  92   3.170   3.423 -11.504
  734   1HG   GLN  92          1HG       GLN  92   3.153   4.649 -13.941
  735   2HG   GLN  92          2HG       GLN  92   4.566   5.368 -13.171
  736   1HE2  GLN  92          1HE2      GLN  92   6.368   4.162 -12.871
  737   2HE2  GLN  92          2HE2      GLN  92   6.542   2.532 -13.415
  738    H    ASN  93           H        ASN  93   1.528   5.179  -9.331
  739    HA   ASN  93           HA       ASN  93   0.148   2.693  -8.917
  740   1HB   ASN  93          1HB       ASN  93   0.990   4.946  -7.103
  741   2HB   ASN  93          2HB       ASN  93  -0.006   3.616  -6.518
  742   1HD2  ASN  93          1HD2      ASN  93   2.831   3.909  -8.635
  743   2HD2  ASN  93          2HD2      ASN  93   3.776   2.719  -7.813
  744    H    LYS  94           H        LYS  94  -0.702   6.115  -8.919
  745    HA   LYS  94           HA       LYS  94  -3.319   5.875  -7.930
  746   1HB   LYS  94          1HB       LYS  94  -1.971   8.002  -8.249
  747   2HB   LYS  94          2HB       LYS  94  -2.401   7.918  -9.952
  748   1HG   LYS  94          1HG       LYS  94  -4.822   7.654  -8.643
  749   2HG   LYS  94          2HG       LYS  94  -3.945   8.855  -7.692
  750   1HD   LYS  94          1HD       LYS  94  -3.457  10.058  -9.839
  751   2HD   LYS  94          2HD       LYS  94  -4.557   8.935 -10.643
  752   1HE   LYS  94          1HE       LYS  94  -6.383   9.961  -9.834
  753   2HE   LYS  94          2HE       LYS  94  -5.665  10.189  -8.240
  754   1HZ   LYS  94          1HZ       LYS  94  -5.925  12.329  -9.067
  755   2HZ   LYS  94          2HZ       LYS  94  -5.424  11.910 -10.627
  756   3HZ   LYS  94          3HZ       LYS  94  -4.294  11.997  -9.371
  757    H    GLU  95           H        GLU  95  -2.095   5.887 -11.268
  758    HA   GLU  95           HA       GLU  95  -4.660   5.528 -12.450
  759   1HB   GLU  95          1HB       GLU  95  -1.835   5.356 -13.431
  760   2HB   GLU  95          2HB       GLU  95  -3.144   4.763 -14.444
  761   1HG   GLU  95          1HG       GLU  95  -4.208   7.076 -14.018
  762   2HG   GLU  95          2HG       GLU  95  -2.582   7.550 -13.530
  763    H    TYR  96           H        TYR  96  -2.102   3.359 -11.405
  764    HA   TYR  96           HA       TYR  96  -3.025   1.007 -12.627
  765   1HB   TYR  96          1HB       TYR  96  -0.789   1.205 -11.633
  766   2HB   TYR  96          2HB       TYR  96  -1.504   1.326 -10.030
  767    HD1  TYR  96           2HD      TYR  96  -0.973  -0.939 -12.903
  768    HD2  TYR  96           1HD      TYR  96  -2.161  -0.615  -8.830
  769    HE1  TYR  96           2HE      TYR  96  -0.895  -3.388 -12.691
  770    HE2  TYR  96           1HE      TYR  96  -2.085  -3.063  -8.607
  771    HH   TYR  96           HH       TYR  96  -2.181  -5.041  -9.979
  772    H    CYS  97           H        CYS  97  -3.641   2.319  -9.380
  773    HA   CYS  97           HA       CYS  97  -5.320   0.234  -8.513
  774   1HB   CYS  97          1HB       CYS  97  -5.129   3.125  -7.655
  775   2HB   CYS  97          2HB       CYS  97  -6.130   1.933  -6.835
  776    HG   CYS  97           HG       CYS  97  -3.930   2.190  -5.240
  777    H    SER  98           H        SER  98  -5.942   3.174 -10.325
  778    HA   SER  98           HA       SER  98  -8.810   2.859 -10.197
  779   1HB   SER  98          1HB       SER  98  -8.928   4.962 -11.066
  780   2HB   SER  98          2HB       SER  98  -7.244   5.034 -10.546
  781    HG   SER  98           HG       SER  98  -8.225   5.230 -13.014
  782    H    LYS  99           H        LYS  99  -6.310   1.555 -12.042
  783    HA   LYS  99           HA       LYS  99  -7.435   1.349 -14.592
  784   1HB   LYS  99          1HB       LYS  99  -5.087   0.782 -14.031
  785   2HB   LYS  99          2HB       LYS  99  -5.655  -0.659 -13.198
  786   1HG   LYS  99          1HG       LYS  99  -6.753  -0.672 -15.812
  787   2HG   LYS  99          2HG       LYS  99  -5.026  -0.327 -15.940
  788   1HD   LYS  99          1HD       LYS  99  -6.254  -2.642 -14.440
  789   2HD   LYS  99          2HD       LYS  99  -5.482  -2.736 -16.024
  790   1HE   LYS  99          1HE       LYS  99  -3.602  -1.466 -14.439
  791   2HE   LYS  99          2HE       LYS  99  -4.299  -2.684 -13.372
  792   1HZ   LYS  99          1HZ       LYS  99  -2.335  -3.399 -14.748
  793   2HZ   LYS  99          2HZ       LYS  99  -3.347  -3.323 -16.102
  794   3HZ   LYS  99          3HZ       LYS  99  -3.698  -4.396 -14.843
  795    H    GLU 100           H        GLU 100  -8.280  -0.197 -11.647
  796    HA   GLU 100           HA       GLU 100  -9.520  -2.512 -12.765
  797   1HB   GLU 100          1HB       GLU 100  -9.658  -1.167 -10.077
  798   2HB   GLU 100          2HB       GLU 100 -10.676  -2.547 -10.464
  799   1HG   GLU 100          1HG       GLU 100  -8.978  -4.011 -10.333
  800   2HG   GLU 100          2HG       GLU 100  -7.815  -2.891 -11.040
  801    H    GLY 101           H        GLY 101 -10.377   0.756 -12.673
  802   1HA   GLY 101          1HA       GLY 101 -12.231   1.754 -13.658
  803   2HA   GLY 101          2HA       GLY 101 -12.966   0.166 -13.819
  804    H    ASN 102           H        ASN 102 -12.006   0.252 -10.719
  805    HA   ASN 102           HA       ASN 102 -14.401   1.652  -9.754
  806   1HB   ASN 102          1HB       ASN 102 -14.104  -1.147  -9.830
  807   2HB   ASN 102          2HB       ASN 102 -13.873  -0.684  -8.147
  808   1HD2  ASN 102          1HD2      ASN 102 -15.656  -0.744  -7.009
  809   2HD2  ASN 102          2HD2      ASN 102 -17.250  -0.405  -7.582
  810    H    LEU 103           H        LEU 103 -13.965   3.011  -8.148
  811    HA   LEU 103           HA       LEU 103 -11.388   2.748  -6.761
  812   1HB   LEU 103          1HB       LEU 103 -12.789   4.951  -7.906
  813   2HB   LEU 103          2HB       LEU 103 -12.627   5.225  -6.172
  814    HG   LEU 103           HG       LEU 103 -10.822   6.232  -7.586
  815   1HD1  LEU 103          1HD1      LEU 103  -9.045   4.725  -6.099
  816   2HD1  LEU 103          2HD1      LEU 103 -10.558   4.607  -5.200
  817   3HD1  LEU 103          3HD1      LEU 103  -9.876   6.190  -5.573
  818   1HD2  LEU 103          1HD2      LEU 103 -10.800   3.732  -8.789
  819   2HD2  LEU 103          2HD2      LEU 103  -9.317   3.772  -7.834
  820   3HD2  LEU 103          3HD2      LEU 103  -9.630   5.030  -9.030
  821    H    LEU 104           H        LEU 104 -11.404   2.035  -4.743
  822    HA   LEU 104           HA       LEU 104 -13.898   1.885  -3.270
  823   1HB   LEU 104          1HB       LEU 104 -12.248   0.005  -3.385
  824   2HB   LEU 104          2HB       LEU 104 -11.153   0.987  -2.414
  825    HG   LEU 104           HG       LEU 104 -13.199   1.020  -0.750
  826   1HD1  LEU 104          1HD1      LEU 104 -14.190  -0.656  -2.744
  827   2HD1  LEU 104          2HD1      LEU 104 -14.854  -0.408  -1.129
  828   3HD1  LEU 104          3HD1      LEU 104 -13.726  -1.731  -1.424
  829   1HD2  LEU 104          1HD2      LEU 104 -10.796  -0.127  -0.728
  830   2HD2  LEU 104          2HD2      LEU 104 -11.786  -1.585  -0.785
  831   3HD2  LEU 104          3HD2      LEU 104 -11.999  -0.425   0.527
  832    H    MET 105           H        MET 105 -10.750   3.470  -2.997
  833    HA   MET 105           HA       MET 105 -11.938   5.463  -1.243
  834   1HB   MET 105          1HB       MET 105 -11.143   4.171   0.502
  835   2HB   MET 105          2HB       MET 105  -9.776   3.568  -0.426
  836   1HG   MET 105          1HG       MET 105  -8.462   5.334   0.092
  837   2HG   MET 105          2HG       MET 105  -9.814   6.461   0.169
  838   1HE   MET 105          1HE       MET 105  -7.869   4.155   3.542
  839   2HE   MET 105          2HE       MET 105  -8.530   3.169   2.238
  840   3HE   MET 105          3HE       MET 105  -7.316   4.400   1.886
  841    H    GLU 106           H        GLU 106 -11.106   7.464  -1.549
  842    HA   GLU 106           HA       GLU 106  -8.603   7.716  -3.063
  843   1HB   GLU 106          1HB       GLU 106 -10.710   7.919  -4.512
  844   2HB   GLU 106          2HB       GLU 106 -10.999   9.435  -3.670
  845   1HG   GLU 106          1HG       GLU 106  -8.509   9.908  -4.402
  846   2HG   GLU 106          2HG       GLU 106  -8.907   8.730  -5.651
  847    H    CYS 107           H        CYS 107  -7.326   8.646  -1.580
  848    HA   CYS 107           HA       CYS 107  -8.005  11.302  -0.656
  849   1HB   CYS 107          1HB       CYS 107  -7.886   8.938   1.157
  850   2HB   CYS 107          2HB       CYS 107  -7.194  10.450   1.734
  851    HG   CYS 107           HG       CYS 107  -9.948  11.488   0.652
  852    H    GLY 108           H        GLY 108  -6.089  12.062   0.874
  853   1HA   GLY 108          1HA       GLY 108  -3.772  12.147   1.271
  854   2HA   GLY 108          2HA       GLY 108  -3.539  10.908   0.046
  855    H    ALA 109           H        ALA 109  -1.760  12.697  -0.254
  856    HA   ALA 109           HA       ALA 109  -2.768  14.685  -2.180
  857   1HB   ALA 109          1HB       ALA 109  -0.124  15.333  -1.537
  858   2HB   ALA 109          2HB       ALA 109  -1.591  16.158  -1.007
  859   3HB   ALA 109          3HB       ALA 109  -0.889  14.881  -0.014
  860    HA   PRO 110           HA       PRO 110  -0.583  12.822  -5.498
  861   1HB   PRO 110          1HB       PRO 110   0.322  14.979  -6.875
  862   2HB   PRO 110          2HB       PRO 110  -1.381  14.508  -6.839
  863   1HG   PRO 110          1HG       PRO 110   0.034  16.617  -5.254
  864   2HG   PRO 110          2HG       PRO 110  -1.548  16.689  -6.052
  865   1HD   PRO 110          1HD       PRO 110  -1.277  16.268  -3.391
  866   2HD   PRO 110          2HD       PRO 110  -2.605  15.568  -4.339
  867    H    ARG 111           H        ARG 111   1.168  11.741  -4.653
  868    HA   ARG 111           HA       ARG 111   3.499  13.044  -3.670
  869   1HB   ARG 111          1HB       ARG 111   2.705  10.237  -4.264
  870   2HB   ARG 111          2HB       ARG 111   4.423  10.589  -4.134
  871   1HG   ARG 111          1HG       ARG 111   2.416  11.306  -2.012
  872   2HG   ARG 111          2HG       ARG 111   3.333   9.798  -2.029
  873   1HD   ARG 111          1HD       ARG 111   4.618  12.519  -2.099
  874   2HD   ARG 111          2HD       ARG 111   4.287  11.645  -0.605
  875    HE   ARG 111           HE       ARG 111   5.692   9.852  -2.047
  876   1HH1  ARG 111          1HH1      ARG 111   6.248  13.188  -1.221
  877   2HH1  ARG 111          2HH1      ARG 111   7.974  13.037  -1.225
  878   1HH2  ARG 111          1HH2      ARG 111   7.964   9.640  -2.056
  879   2HH2  ARG 111          2HH2      ARG 111   8.949  11.019  -1.701
  880    H    SER 112           H        SER 112   5.620  13.006  -4.592
  881    HA   SER 112           HA       SER 112   5.709  12.675  -7.510
  882   1HB   SER 112          1HB       SER 112   5.486  15.144  -6.495
  883   2HB   SER 112          2HB       SER 112   7.233  14.952  -6.349
  884    HG   SER 112           HG       SER 112   6.281  15.823  -8.411
  885    H    GLN 113           H        GLN 113   7.898  12.474  -8.367
  886    HA   GLN 113           HA       GLN 113   9.617  11.056  -6.472
  887   1HB   GLN 113          1HB       GLN 113   8.897  10.658  -9.208
  888   2HB   GLN 113          2HB       GLN 113  10.637  10.894  -9.119
  889   1HG   GLN 113          1HG       GLN 113   9.987   9.147  -7.027
  890   2HG   GLN 113          2HG       GLN 113   9.074   8.596  -8.431
  891   1HE2  GLN 113          1HE2      GLN 113  10.519   8.791 -10.522
  892   2HE2  GLN 113          2HE2      GLN 113  12.062   8.028 -10.380
  893    H    GLY 114           H        GLY 114  12.003  11.304  -6.767
  894   1HA   GLY 114          1HA       GLY 114  13.032  13.684  -7.967
  895   2HA   GLY 114          2HA       GLY 114  12.856  13.867  -6.228
  896    H    GLN 115           H        GLN 115  15.326  14.146  -7.136
  897    HA   GLN 115           HA       GLN 115  16.722  11.603  -7.088
  898   1HB   GLN 115          1HB       GLN 115  17.253  14.164  -8.152
  899   2HB   GLN 115          2HB       GLN 115  18.481  13.871  -6.928
  900   1HG   GLN 115          1HG       GLN 115  19.163  11.846  -8.011
  901   2HG   GLN 115          2HG       GLN 115  17.831  11.962  -9.159
  902   1HE2  GLN 115          1HE2      GLN 115  19.506  11.805 -10.775
  903   2HE2  GLN 115          2HE2      GLN 115  20.373  13.224 -11.245
  904    H    ARG 116           H        ARG 116  16.056  14.290  -4.969
  905    HA   ARG 116           HA       ARG 116  17.422  12.849  -2.801
  906   1HB   ARG 116          1HB       ARG 116  18.073  15.463  -3.841
  907   2HB   ARG 116          2HB       ARG 116  17.571  15.580  -2.159
  908   1HG   ARG 116          1HG       ARG 116  19.534  13.475  -2.892
  909   2HG   ARG 116          2HG       ARG 116  20.080  15.152  -2.830
  910   1HD   ARG 116          1HD       ARG 116  20.173  15.074  -0.613
  911   2HD   ARG 116          2HD       ARG 116  18.475  14.606  -0.533
  912    HE   ARG 116           HE       ARG 116  20.219  12.423  -1.175
  913   1HH1  ARG 116          1HH1      ARG 116  18.864  14.316   1.413
  914   2HH1  ARG 116          2HH1      ARG 116  19.039  13.063   2.596
  915   1HH2  ARG 116          1HH2      ARG 116  20.454  10.765   0.373
  916   2HH2  ARG 116          2HH2      ARG 116  19.944  11.043   2.004
  Start of MODEL   11
    1    HA   PRO   2           HA       PRO   2  43.588  -3.816  11.729
    2   1HB   PRO   2          1HB       PRO   2  42.299  -5.270   9.833
    3   2HB   PRO   2          2HB       PRO   2  44.038  -4.955   9.785
    4   1HG   PRO   2          1HG       PRO   2  42.579  -7.395  10.724
    5   2HG   PRO   2          2HG       PRO   2  44.044  -7.280   9.732
    6   1HD   PRO   2          1HD       PRO   2  44.119  -7.827  12.383
    7   2HD   PRO   2          2HD       PRO   2  45.404  -6.922  11.558
    8    H    SER   3           H        SER   3  42.106  -3.064  13.242
    9    HA   SER   3           HA       SER   3  39.618  -4.511  13.649
   10   1HB   SER   3          1HB       SER   3  41.118  -2.881  15.280
   11   2HB   SER   3          2HB       SER   3  39.807  -1.810  14.785
   12    HG   SER   3           HG       SER   3  39.442  -3.167  16.708
   13    H    LYS   4           H        LYS   4  37.637  -3.907  12.909
   14    HA   LYS   4           HA       LYS   4  37.201  -1.371  11.620
   15   1HB   LYS   4          1HB       LYS   4  36.746  -2.172   9.414
   16   2HB   LYS   4          2HB       LYS   4  38.345  -2.751   9.862
   17   1HG   LYS   4          1HG       LYS   4  36.860  -4.841  10.664
   18   2HG   LYS   4          2HG       LYS   4  35.865  -4.248   9.332
   19   1HD   LYS   4          1HD       LYS   4  38.540  -4.198   8.439
   20   2HD   LYS   4          2HD       LYS   4  38.298  -5.753   9.238
   21   1HE   LYS   4          1HE       LYS   4  36.604  -4.591   7.029
   22   2HE   LYS   4          2HE       LYS   4  37.763  -5.910   6.871
   23   1HZ   LYS   4          1HZ       LYS   4  36.422  -7.265   8.303
   24   2HZ   LYS   4          2HZ       LYS   4  35.446  -6.671   7.056
   25   3HZ   LYS   4          3HZ       LYS   4  35.351  -5.990   8.601
   26    H    LYS   5           H        LYS   5  34.946  -1.174  10.813
   27    HA   LYS   5           HA       LYS   5  33.132  -2.989  12.263
   28   1HB   LYS   5          1HB       LYS   5  33.475  -0.152  12.526
   29   2HB   LYS   5          2HB       LYS   5  31.859  -0.485  11.918
   30   1HG   LYS   5          1HG       LYS   5  31.461  -0.572  14.154
   31   2HG   LYS   5          2HG       LYS   5  31.864  -2.265  13.860
   32   1HD   LYS   5          1HD       LYS   5  34.323  -1.233  14.327
   33   2HD   LYS   5          2HD       LYS   5  33.332  -0.197  15.357
   34   1HE   LYS   5          1HE       LYS   5  33.469  -1.830  16.874
   35   2HE   LYS   5          2HE       LYS   5  32.334  -2.714  15.855
   36   1HZ   LYS   5          1HZ       LYS   5  33.990  -4.236  15.981
   37   2HZ   LYS   5          2HZ       LYS   5  35.212  -3.085  16.186
   38   3HZ   LYS   5          3HZ       LYS   5  34.569  -3.370  14.648
   39    H    ASN   6           H        ASN   6  31.105  -3.410  11.311
   40    HA   ASN   6           HA       ASN   6  30.508  -2.355   8.687
   41   1HB   ASN   6          1HB       ASN   6  30.409  -4.598   7.620
   42   2HB   ASN   6          2HB       ASN   6  32.045  -4.127   8.073
   43   1HD2  ASN   6          1HD2      ASN   6  29.931  -6.612   8.053
   44   2HD2  ASN   6          2HD2      ASN   6  30.577  -7.564   9.342
   45    H    GLY   7           H        GLY   7  28.554  -3.894   7.802
   46   1HA   GLY   7          1HA       GLY   7  26.755  -4.435  10.067
   47   2HA   GLY   7          2HA       GLY   7  26.239  -3.331   8.802
   48    H    ARG   8           H        ARG   8  24.456  -4.714   8.370
   49    HA   ARG   8           HA       ARG   8  25.189  -6.976   6.653
   50   1HB   ARG   8          1HB       ARG   8  24.186  -7.384   9.161
   51   2HB   ARG   8          2HB       ARG   8  22.715  -7.363   8.197
   52   1HG   ARG   8          1HG       ARG   8  24.684  -8.972   6.890
   53   2HG   ARG   8          2HG       ARG   8  24.513  -9.486   8.569
   54   1HD   ARG   8          1HD       ARG   8  22.121  -9.731   8.284
   55   2HD   ARG   8          2HD       ARG   8  22.229  -9.111   6.637
   56    HE   ARG   8           HE       ARG   8  22.830 -11.774   7.529
   57   1HH1  ARG   8          1HH1      ARG   8  23.442  -9.371   5.086
   58   2HH1  ARG   8          2HH1      ARG   8  23.890 -10.528   3.876
   59   1HH2  ARG   8          1HH2      ARG   8  23.418 -13.306   5.945
   60   2HH2  ARG   8          2HH2      ARG   8  23.875 -12.766   4.365
   61    H    SER   9           H        SER   9  23.724  -7.427   4.977
   62    HA   SER   9           HA       SER   9  22.103  -5.136   4.210
   63   1HB   SER   9          1HB       SER   9  22.164  -5.981   2.011
   64   2HB   SER   9          2HB       SER   9  23.753  -6.375   2.666
   65    HG   SER   9           HG       SER   9  22.448  -8.083   1.513
   66    H    GLY  10           H        GLY  10  20.165  -6.204   2.639
   67   1HA   GLY  10          1HA       GLY  10  18.512  -8.111   2.920
   68   2HA   GLY  10          2HA       GLY  10  18.493  -7.630   4.610
   69    HA   PRO  11           HA       PRO  11  15.047  -5.451   2.363
   70   1HB   PRO  11          1HB       PRO  11  13.114  -6.144   4.139
   71   2HB   PRO  11          2HB       PRO  11  13.563  -7.159   2.763
   72   1HG   PRO  11          1HG       PRO  11  14.391  -7.383   5.631
   73   2HG   PRO  11          2HG       PRO  11  13.905  -8.663   4.503
   74   1HD   PRO  11          1HD       PRO  11  16.497  -8.145   5.090
   75   2HD   PRO  11          2HD       PRO  11  15.978  -8.739   3.499
   76    H    GLN  12           H        GLN  12  14.347  -3.427   2.860
   77    HA   GLN  12           HA       GLN  12  14.730  -2.478   5.618
   78   1HB   GLN  12          1HB       GLN  12  15.311  -0.728   3.245
   79   2HB   GLN  12          2HB       GLN  12  15.803  -0.509   4.919
   80   1HG   GLN  12          1HG       GLN  12  16.982  -2.890   4.265
   81   2HG   GLN  12          2HG       GLN  12  17.093  -1.978   2.761
   82   1HE2  GLN  12          1HE2      GLN  12  19.100  -2.824   4.821
   83   2HE2  GLN  12          2HE2      GLN  12  19.945  -1.372   5.227
   84    HA   PRO  13           HA       PRO  13  10.691  -0.785   5.338
   85   1HB   PRO  13          1HB       PRO  13  10.925   1.398   6.935
   86   2HB   PRO  13          2HB       PRO  13  10.890  -0.254   7.565
   87   1HG   PRO  13          1HG       PRO  13  13.239   1.533   7.062
   88   2HG   PRO  13          2HG       PRO  13  12.915   0.474   8.447
   89   1HD   PRO  13          1HD       PRO  13  14.597  -0.223   6.443
   90   2HD   PRO  13          2HD       PRO  13  13.624  -1.414   7.331
   91    H    HIS  14           H        HIS  14   9.484   0.732   4.242
   92    HA   HIS  14           HA       HIS  14  10.890   3.018   3.060
   93   1HB   HIS  14          1HB       HIS  14   9.207   1.021   1.535
   94   2HB   HIS  14          2HB       HIS  14   9.768   2.556   0.880
   95    HD1  HIS  14           1HD      HIS  14  10.904  -0.887   1.711
   96    HD2  HIS  14           2HD      HIS  14  12.523   2.660   0.276
   97    HE1  HIS  14           1HE      HIS  14  13.178  -1.496   0.827
   98    H    LYS  15           H        LYS  15   9.122   4.346   1.748
   99    HA   LYS  15           HA       LYS  15   6.921   4.778   3.643
  100   1HB   LYS  15          1HB       LYS  15   6.760   7.025   2.486
  101   2HB   LYS  15          2HB       LYS  15   8.226   6.745   3.416
  102   1HG   LYS  15          1HG       LYS  15   8.590   5.894   0.696
  103   2HG   LYS  15          2HG       LYS  15   8.028   7.566   0.757
  104   1HD   LYS  15          1HD       LYS  15   9.832   8.006   2.449
  105   2HD   LYS  15          2HD       LYS  15  10.452   6.388   2.108
  106   1HE   LYS  15          1HE       LYS  15  11.405   7.049   0.197
  107   2HE   LYS  15          2HE       LYS  15   9.972   7.944  -0.304
  108   1HZ   LYS  15          1HZ       LYS  15  12.314   9.062   0.407
  109   2HZ   LYS  15          2HZ       LYS  15  11.441   9.173   1.852
  110   3HZ   LYS  15          3HZ       LYS  15  10.822   9.859   0.434
  111    H    ARG  16           H        ARG  16   7.142   2.855   1.264
  112    HA   ARG  16           HA       ARG  16   4.510   3.512   0.165
  113   1HB   ARG  16          1HB       ARG  16   6.870   2.675  -1.531
  114   2HB   ARG  16          2HB       ARG  16   5.226   2.927  -2.104
  115   1HG   ARG  16          1HG       ARG  16   5.380   5.292  -1.484
  116   2HG   ARG  16          2HG       ARG  16   7.039   5.031  -0.942
  117   1HD   ARG  16          1HD       ARG  16   7.428   4.122  -3.328
  118   2HD   ARG  16          2HD       ARG  16   5.924   4.953  -3.721
  119    HE   ARG  16           HE       ARG  16   7.422   6.844  -2.458
  120   1HH1  ARG  16          1HH1      ARG  16   7.918   4.759  -5.201
  121   2HH1  ARG  16          2HH1      ARG  16   8.968   5.868  -6.019
  122   1HH2  ARG  16          1HH2      ARG  16   8.803   8.313  -3.525
  123   2HH2  ARG  16          2HH2      ARG  16   9.471   7.889  -5.065
  124    H    TRP  17           H        TRP  17   3.184   1.827   0.288
  125    HA   TRP  17           HA       TRP  17   4.194  -0.878  -0.045
  126   1HB   TRP  17          1HB       TRP  17   2.951   0.127   2.512
  127   2HB   TRP  17          2HB       TRP  17   2.935  -1.579   2.073
  128    HD1  TRP  17           HD       TRP  17   5.191   1.128   3.442
  129    HE1  TRP  17           1HE      TRP  17   7.453   0.095   4.105
  130    HE3  TRP  17           3HE      TRP  17   4.598  -3.512   1.381
  131    HZ2  TRP  17           2HZ      TRP  17   8.808  -2.362   3.794
  132    HZ3  TRP  17           3HZ      TRP  17   6.425  -5.145   1.608
  133    HH2  TRP  17           HH       TRP  17   8.485  -4.580   2.789
  134    H    VAL  18           H        VAL  18   2.733  -2.203  -0.981
  135    HA   VAL  18           HA       VAL  18   0.036  -1.108  -1.421
  136    HB   VAL  18           HB       VAL  18  -0.076  -2.520  -3.421
  137   1HG1  VAL  18          1HG1      VAL  18   2.351  -0.738  -3.258
  138   2HG1  VAL  18          2HG1      VAL  18   1.646  -1.333  -4.763
  139   3HG1  VAL  18          3HG1      VAL  18   0.713  -0.268  -3.710
  140   1HG2  VAL  18          1HG2      VAL  18   2.752  -3.155  -3.574
  141   2HG2  VAL  18          2HG2      VAL  18   1.961  -3.955  -2.215
  142   3HG2  VAL  18          3HG2      VAL  18   1.347  -4.184  -3.853
  143    H    PHE  19           H        PHE  19  -1.749  -2.613  -1.504
  144    HA   PHE  19           HA       PHE  19  -1.293  -5.141  -0.084
  145   1HB   PHE  19          1HB       PHE  19  -3.361  -4.705   1.258
  146   2HB   PHE  19          2HB       PHE  19  -2.025  -3.622   1.634
  147    HD1  PHE  19           1HD      PHE  19  -2.049  -1.295   0.708
  148    HD2  PHE  19           2HD      PHE  19  -5.424  -3.881   0.502
  149    HE1  PHE  19           1HE      PHE  19  -3.507   0.645   0.300
  150    HE2  PHE  19           2HE      PHE  19  -6.886  -1.945   0.092
  151    HZ   PHE  19           HZ       PHE  19  -5.928   0.321  -0.010
  152    H    THR  20           H        THR  20  -2.691  -6.807  -0.606
  153    HA   THR  20           HA       THR  20  -4.888  -6.304  -2.446
  154    HB   THR  20           HB       THR  20  -4.132  -7.855  -4.138
  155    HG1  THR  20           1HG      THR  20  -2.089  -8.838  -3.976
  156   1HG2  THR  20          1HG2      THR  20  -1.885  -5.933  -3.529
  157   2HG2  THR  20          2HG2      THR  20  -3.410  -5.476  -4.288
  158   3HG2  THR  20          3HG2      THR  20  -2.320  -6.595  -5.104
  159    H    LEU  21           H        LEU  21  -6.554  -7.595  -1.992
  160    HA   LEU  21           HA       LEU  21  -6.062 -10.226  -0.808
  161   1HB   LEU  21          1HB       LEU  21  -6.432  -8.663   1.046
  162   2HB   LEU  21          2HB       LEU  21  -7.971  -8.189   0.331
  163    HG   LEU  21           HG       LEU  21  -8.369 -10.842   0.577
  164   1HD1  LEU  21          1HD1      LEU  21  -6.073 -10.967   1.684
  165   2HD1  LEU  21          2HD1      LEU  21  -7.421 -11.736   2.520
  166   3HD1  LEU  21          3HD1      LEU  21  -6.828 -10.166   3.062
  167   1HD2  LEU  21          1HD2      LEU  21  -9.934 -10.263   2.120
  168   2HD2  LEU  21          2HD2      LEU  21  -9.533  -8.651   1.526
  169   3HD2  LEU  21          3HD2      LEU  21  -8.823  -9.239   3.030
  170    H    ASN  22           H        ASN  22  -7.252 -11.747  -1.754
  171    HA   ASN  22           HA       ASN  22  -9.212 -11.021  -3.727
  172   1HB   ASN  22          1HB       ASN  22  -7.672 -12.892  -4.116
  173   2HB   ASN  22          2HB       ASN  22  -8.347 -13.745  -2.730
  174   1HD2  ASN  22          1HD2      ASN  22  -8.799 -15.463  -4.205
  175   2HD2  ASN  22          2HD2      ASN  22 -10.203 -15.399  -5.209
  176    H    ASN  23           H        ASN  23 -11.381 -11.100  -3.582
  177    HA   ASN  23           HA       ASN  23 -13.437 -11.087  -2.598
  178   1HB   ASN  23          1HB       ASN  23 -13.128 -13.515  -2.961
  179   2HB   ASN  23          2HB       ASN  23 -12.416 -13.651  -1.356
  180   1HD2  ASN  23          1HD2      ASN  23 -15.246 -11.908  -2.588
  181   2HD2  ASN  23          2HD2      ASN  23 -16.378 -12.632  -1.503
  182    HA   PRO  24           HA       PRO  24 -11.666  -9.439   1.400
  183   1HB   PRO  24          1HB       PRO  24 -12.482  -6.880   1.005
  184   2HB   PRO  24          2HB       PRO  24 -10.933  -7.496   0.417
  185   1HG   PRO  24          1HG       PRO  24 -13.507  -7.120  -1.064
  186   2HG   PRO  24          2HG       PRO  24 -11.853  -6.741  -1.581
  187   1HD   PRO  24          1HD       PRO  24 -13.157  -8.972  -2.389
  188   2HD   PRO  24          2HD       PRO  24 -11.398  -8.926  -2.155
  189    H    SER  25           H        SER  25 -12.834  -8.893   3.247
  190    HA   SER  25           HA       SER  25 -15.697  -9.409   3.064
  191   1HB   SER  25          1HB       SER  25 -13.701 -10.072   4.935
  192   2HB   SER  25          2HB       SER  25 -14.766  -8.930   5.754
  193    HG   SER  25           HG       SER  25 -16.511 -10.344   4.865
  194    H    GLU  26           H        GLU  26 -17.215  -8.092   4.316
  195    HA   GLU  26           HA       GLU  26 -17.043  -5.371   3.654
  196   1HB   GLU  26          1HB       GLU  26 -19.026  -5.137   5.208
  197   2HB   GLU  26          2HB       GLU  26 -19.206  -6.308   3.910
  198   1HG   GLU  26          1HG       GLU  26 -19.578  -7.947   5.347
  199   2HG   GLU  26          2HG       GLU  26 -18.112  -7.566   6.249
  200    H    ASP  27           H        ASP  27 -16.086  -7.135   6.500
  201    HA   ASP  27           HA       ASP  27 -15.770  -4.800   8.151
  202   1HB   ASP  27          1HB       ASP  27 -15.828  -7.594   8.564
  203   2HB   ASP  27          2HB       ASP  27 -14.241  -7.043   9.095
  204    H    GLU  28           H        GLU  28 -13.558  -7.044   6.500
  205    HA   GLU  28           HA       GLU  28 -11.186  -5.706   7.234
  206   1HB   GLU  28          1HB       GLU  28 -11.805  -8.050   5.914
  207   2HB   GLU  28          2HB       GLU  28 -11.079  -7.069   4.649
  208   1HG   GLU  28          1HG       GLU  28  -9.852  -7.860   7.276
  209   2HG   GLU  28          2HG       GLU  28  -9.367  -8.378   5.662
  210    H    ARG  29           H        ARG  29 -13.125  -5.581   4.255
  211    HA   ARG  29           HA       ARG  29 -11.536  -3.726   2.884
  212   1HB   ARG  29          1HB       ARG  29 -13.247  -5.028   1.751
  213   2HB   ARG  29          2HB       ARG  29 -14.508  -4.243   2.693
  214   1HG   ARG  29          1HG       ARG  29 -13.138  -2.146   1.504
  215   2HG   ARG  29          2HG       ARG  29 -13.219  -3.390   0.254
  216   1HD   ARG  29          1HD       ARG  29 -15.700  -2.928   1.779
  217   2HD   ARG  29          2HD       ARG  29 -15.183  -1.605   0.735
  218    HE   ARG  29           HE       ARG  29 -15.195  -4.188  -0.541
  219   1HH1  ARG  29          1HH1      ARG  29 -17.047  -1.343   0.230
  220   2HH1  ARG  29          2HH1      ARG  29 -18.174  -1.566  -1.066
  221   1HH2  ARG  29          1HH2      ARG  29 -16.673  -4.493  -2.252
  222   2HH2  ARG  29          2HH2      ARG  29 -17.961  -3.359  -2.477
  223    H    LYS  30           H        LYS  30 -14.189  -3.282   5.166
  224    HA   LYS  30           HA       LYS  30 -14.389  -0.465   4.838
  225   1HB   LYS  30          1HB       LYS  30 -16.218  -1.823   5.764
  226   2HB   LYS  30          2HB       LYS  30 -15.227  -2.205   7.165
  227   1HG   LYS  30          1HG       LYS  30 -15.201   0.146   7.803
  228   2HG   LYS  30          2HG       LYS  30 -16.171   0.547   6.383
  229   1HD   LYS  30          1HD       LYS  30 -17.018  -1.271   8.640
  230   2HD   LYS  30          2HD       LYS  30 -17.545   0.398   8.409
  231   1HE   LYS  30          1HE       LYS  30 -18.269  -0.478   6.051
  232   2HE   LYS  30          2HE       LYS  30 -18.234  -2.052   6.845
  233   1HZ   LYS  30          1HZ       LYS  30 -20.016   0.227   7.311
  234   2HZ   LYS  30          2HZ       LYS  30 -19.644  -0.776   8.622
  235   3HZ   LYS  30          3HZ       LYS  30 -20.375  -1.425   7.241
  236    H    LYS  31           H        LYS  31 -12.513  -2.562   6.937
  237    HA   LYS  31           HA       LYS  31 -11.616  -0.641   8.774
  238   1HB   LYS  31          1HB       LYS  31 -11.285  -2.946   9.283
  239   2HB   LYS  31          2HB       LYS  31 -10.394  -3.218   7.791
  240   1HG   LYS  31          1HG       LYS  31  -8.570  -1.824   8.621
  241   2HG   LYS  31          2HG       LYS  31  -9.465  -1.542  10.116
  242   1HD   LYS  31          1HD       LYS  31  -8.843  -3.511  10.972
  243   2HD   LYS  31          2HD       LYS  31  -9.221  -4.369   9.477
  244   1HE   LYS  31          1HE       LYS  31  -6.897  -4.648   9.851
  245   2HE   LYS  31          2HE       LYS  31  -7.060  -3.472   8.548
  246   1HZ   LYS  31          1HZ       LYS  31  -7.031  -1.962  10.820
  247   2HZ   LYS  31          2HZ       LYS  31  -5.735  -2.184   9.757
  248   3HZ   LYS  31          3HZ       LYS  31  -5.878  -3.161  11.130
  249    H    ILE  32           H        ILE  32 -10.107  -1.819   5.773
  250    HA   ILE  32           HA       ILE  32  -7.870  -0.096   5.898
  251    HB   ILE  32           HB       ILE  32  -9.132  -1.675   3.683
  252   1HG1  ILE  32          1HG1      ILE  32  -6.365  -1.768   4.898
  253   2HG1  ILE  32          2HG1      ILE  32  -7.712  -2.765   5.436
  254   1HG2  ILE  32          1HG2      ILE  32  -8.396  -0.009   2.317
  255   2HG2  ILE  32          2HG2      ILE  32  -7.155   0.524   3.450
  256   3HG2  ILE  32          3HG2      ILE  32  -6.896  -0.922   2.474
  257   1HD1  ILE  32          1HD1      ILE  32  -7.494  -4.187   3.728
  258   2HD1  ILE  32          2HD1      ILE  32  -7.175  -2.900   2.564
  259   3HD1  ILE  32          3HD1      ILE  32  -5.874  -3.502   3.591
  260    H    ARG  33           H        ARG  33 -11.017   0.176   4.303
  261    HA   ARG  33           HA       ARG  33 -10.438   2.637   2.997
  262   1HB   ARG  33          1HB       ARG  33 -12.185   1.268   2.105
  263   2HB   ARG  33          2HB       ARG  33 -13.030   1.237   3.648
  264   1HG   ARG  33          1HG       ARG  33 -13.763   3.442   3.426
  265   2HG   ARG  33          2HG       ARG  33 -12.579   3.802   2.168
  266   1HD   ARG  33          1HD       ARG  33 -14.262   3.445   0.737
  267   2HD   ARG  33          2HD       ARG  33 -13.988   1.734   1.064
  268    HE   ARG  33           HE       ARG  33 -15.710   2.601   3.026
  269   1HH1  ARG  33          1HH1      ARG  33 -15.710   2.464  -0.453
  270   2HH1  ARG  33          2HH1      ARG  33 -17.430   2.291  -0.576
  271   1HH2  ARG  33          1HH2      ARG  33 -17.975   2.375   2.877
  272   2HH2  ARG  33          2HH2      ARG  33 -18.717   2.242   1.318
  273    H    ASP  34           H        ASP  34 -11.333   1.799   6.200
  274    HA   ASP  34           HA       ASP  34 -12.191   4.534   6.809
  275   1HB   ASP  34          1HB       ASP  34 -13.521   2.537   7.613
  276   2HB   ASP  34          2HB       ASP  34 -12.168   2.160   8.676
  277    H    LEU  35           H        LEU  35  -9.357   3.175   6.427
  278    HA   LEU  35           HA       LEU  35  -7.986   3.550   8.867
  279   1HB   LEU  35          1HB       LEU  35  -7.178   3.306   6.006
  280   2HB   LEU  35          2HB       LEU  35  -5.984   3.813   7.200
  281    HG   LEU  35           HG       LEU  35  -7.547   1.238   7.346
  282   1HD1  LEU  35          1HD1      LEU  35  -4.840   1.861   6.207
  283   2HD1  LEU  35          2HD1      LEU  35  -6.181   1.002   5.451
  284   3HD1  LEU  35          3HD1      LEU  35  -5.280   0.247   6.766
  285   1HD2  LEU  35          1HD2      LEU  35  -5.142   2.231   8.872
  286   2HD2  LEU  35          2HD2      LEU  35  -5.871   0.632   9.023
  287   3HD2  LEU  35          3HD2      LEU  35  -6.780   2.065   9.505
  288    HA   PRO  36           HA       PRO  36  -7.317   7.877   9.142
  289   1HB   PRO  36          1HB       PRO  36  -4.748   8.018  10.009
  290   2HB   PRO  36          2HB       PRO  36  -6.080   7.471  11.035
  291   1HG   PRO  36          1HG       PRO  36  -4.062   5.854   9.526
  292   2HG   PRO  36          2HG       PRO  36  -4.674   5.624  11.174
  293   1HD   PRO  36          1HD       PRO  36  -5.569   4.171   9.072
  294   2HD   PRO  36          2HD       PRO  36  -6.606   4.598  10.449
  295    H    ILE  37           H        ILE  37  -7.194   9.167   7.419
  296    HA   ILE  37           HA       ILE  37  -5.490   8.679   5.201
  297    HB   ILE  37           HB       ILE  37  -6.234  10.950   4.435
  298   1HG1  ILE  37          1HG1      ILE  37  -7.881  10.862   6.972
  299   2HG1  ILE  37          2HG1      ILE  37  -6.519  11.940   6.683
  300   1HG2  ILE  37          1HG2      ILE  37  -8.803   9.798   5.063
  301   2HG2  ILE  37          2HG2      ILE  37  -7.965   9.901   3.516
  302   3HG2  ILE  37          3HG2      ILE  37  -7.640   8.553   4.606
  303   1HD1  ILE  37          1HD1      ILE  37  -8.154  13.365   6.102
  304   2HD1  ILE  37          2HD1      ILE  37  -8.034  12.533   4.552
  305   3HD1  ILE  37          3HD1      ILE  37  -9.288  12.075   5.703
  306    H    SER  38           H        SER  38  -5.280  10.753   8.023
  307    HA   SER  38           HA       SER  38  -3.121  12.352   7.141
  308   1HB   SER  38          1HB       SER  38  -2.961  13.118   9.394
  309   2HB   SER  38          2HB       SER  38  -4.674  12.826   9.096
  310    HG   SER  38           HG       SER  38  -4.642  11.400  10.628
  311    H    LEU  39           H        LEU  39  -3.310   9.125   8.294
  312    HA   LEU  39           HA       LEU  39  -0.627   8.908   9.252
  313   1HB   LEU  39          1HB       LEU  39  -2.840   7.386   9.514
  314   2HB   LEU  39          2HB       LEU  39  -1.986   6.486   8.262
  315    HG   LEU  39           HG       LEU  39  -0.395   7.217  10.639
  316   1HD1  LEU  39          1HD1      LEU  39  -1.310   5.434  12.002
  317   2HD1  LEU  39          2HD1      LEU  39  -2.539   5.102  10.782
  318   3HD1  LEU  39          3HD1      LEU  39  -2.553   6.635  11.653
  319   1HD2  LEU  39          1HD2      LEU  39   0.495   5.879   8.786
  320   2HD2  LEU  39          2HD2      LEU  39  -0.747   4.660   9.076
  321   3HD2  LEU  39          3HD2      LEU  39   0.483   4.976  10.301
  322    H    PHE  40           H        PHE  40  -2.180   8.605   6.156
  323    HA   PHE  40           HA       PHE  40   0.429   7.937   4.962
  324   1HB   PHE  40          1HB       PHE  40  -2.183   7.168   3.685
  325   2HB   PHE  40          2HB       PHE  40  -0.574   6.527   3.371
  326    HD1  PHE  40           2HD      PHE  40  -3.462   6.443   5.619
  327    HD2  PHE  40           1HD      PHE  40   0.381   4.821   4.770
  328    HE1  PHE  40           2HE      PHE  40  -3.902   4.592   7.179
  329    HE2  PHE  40           1HE      PHE  40  -0.054   2.967   6.328
  330    HZ   PHE  40           HZ       PHE  40  -2.197   2.852   7.536
  331    H    ASP  41           H        ASP  41   1.193   9.601   3.857
  332    HA   ASP  41           HA       ASP  41  -0.138  11.936   3.236
  333   1HB   ASP  41          1HB       ASP  41   2.439  10.902   2.834
  334   2HB   ASP  41          2HB       ASP  41   1.874  11.378   1.235
  335    H    TYR  42           H        TYR  42  -0.061   8.925   1.490
  336    HA   TYR  42           HA       TYR  42  -2.051   9.996  -0.370
  337   1HB   TYR  42          1HB       TYR  42   0.080  10.138  -1.561
  338   2HB   TYR  42          2HB       TYR  42   0.400   8.440  -1.223
  339    HD1  TYR  42           1HD      TYR  42  -2.838   9.918  -2.270
  340    HD2  TYR  42           2HD      TYR  42   0.518   7.561  -3.405
  341    HE1  TYR  42           1HE      TYR  42  -3.989   9.292  -4.351
  342    HE2  TYR  42           2HE      TYR  42  -0.624   6.929  -5.490
  343    HH   TYR  42           HH       TYR  42  -2.710   6.857  -6.497
  344    H    PHE  43           H        PHE  43  -3.764   8.712  -0.454
  345    HA   PHE  43           HA       PHE  43  -3.410   5.829  -0.011
  346   1HB   PHE  43          1HB       PHE  43  -4.403   7.382   1.952
  347   2HB   PHE  43          2HB       PHE  43  -5.887   7.059   1.062
  348    HD1  PHE  43           1HD      PHE  43  -4.728   4.249   0.145
  349    HD2  PHE  43           2HD      PHE  43  -5.299   6.190   3.889
  350    HE1  PHE  43           1HE      PHE  43  -4.911   2.058   1.248
  351    HE2  PHE  43           2HE      PHE  43  -5.482   4.002   4.999
  352    HZ   PHE  43           HZ       PHE  43  -5.288   1.932   3.679
  353    H    ILE  44           H        ILE  44  -4.074   4.818  -1.777
  354    HA   ILE  44           HA       ILE  44  -6.582   5.668  -3.038
  355    HB   ILE  44           HB       ILE  44  -5.037   6.644  -4.517
  356   1HG1  ILE  44          1HG1      ILE  44  -5.183   4.078  -5.984
  357   2HG1  ILE  44          2HG1      ILE  44  -6.713   4.696  -5.371
  358   1HG2  ILE  44          1HG2      ILE  44  -2.952   5.857  -3.850
  359   2HG2  ILE  44          2HG2      ILE  44  -3.413   4.169  -4.064
  360   3HG2  ILE  44          3HG2      ILE  44  -3.136   5.193  -5.473
  361   1HD1  ILE  44          1HD1      ILE  44  -5.651   5.347  -7.760
  362   2HD1  ILE  44          2HD1      ILE  44  -6.775   6.368  -6.861
  363   3HD1  ILE  44          3HD1      ILE  44  -5.039   6.665  -6.760
  364    H    VAL  45           H        VAL  45  -7.924   4.001  -3.008
  365    HA   VAL  45           HA       VAL  45  -6.816   1.291  -3.363
  366    HB   VAL  45           HB       VAL  45  -9.389   1.784  -1.904
  367   1HG1  VAL  45          1HG1      VAL  45  -8.030  -0.329  -0.764
  368   2HG1  VAL  45          2HG1      VAL  45  -9.322  -0.446  -1.959
  369   3HG1  VAL  45          3HG1      VAL  45  -7.636  -0.463  -2.477
  370   1HG2  VAL  45          1HG2      VAL  45  -7.977   1.611   0.212
  371   2HG2  VAL  45          2HG2      VAL  45  -6.602   2.035  -0.807
  372   3HG2  VAL  45          3HG2      VAL  45  -7.954   3.154  -0.642
  373    H    GLY  46           H        GLY  46  -7.868  -0.102  -4.738
  374   1HA   GLY  46          1HA       GLY  46 -10.198   0.997  -6.184
  375   2HA   GLY  46          2HA       GLY  46  -8.856   0.248  -7.037
  376    H    GLU  47           H        GLU  47 -11.787  -0.415  -6.788
  377    HA   GLU  47           HA       GLU  47 -11.509  -3.159  -5.757
  378   1HB   GLU  47          1HB       GLU  47 -14.091  -3.059  -5.822
  379   2HB   GLU  47          2HB       GLU  47 -13.249  -2.203  -4.538
  380   1HG   GLU  47          1HG       GLU  47 -13.479  -0.112  -5.780
  381   2HG   GLU  47          2HG       GLU  47 -14.330  -0.971  -7.062
  382    H    GLU  48           H        GLU  48 -11.802  -4.852  -7.090
  383    HA   GLU  48           HA       GLU  48 -12.781  -4.304  -9.813
  384   1HB   GLU  48          1HB       GLU  48 -10.395  -4.576  -9.962
  385   2HB   GLU  48          2HB       GLU  48 -10.450  -6.031  -8.977
  386   1HG   GLU  48          1HG       GLU  48 -10.138  -6.395 -11.435
  387   2HG   GLU  48          2HG       GLU  48 -11.475  -7.277 -10.698
  388    H    GLY  49           H        GLY  49 -14.680  -5.290 -10.021
  389   1HA   GLY  49          1HA       GLY  49 -14.899  -8.124  -9.684
  390   2HA   GLY  49          2HA       GLY  49 -15.774  -7.248  -8.437
  391    H    ASN  50           H        ASN  50 -15.388  -6.157 -11.757
  392    HA   ASN  50           HA       ASN  50 -18.300  -6.219 -12.044
  393   1HB   ASN  50          1HB       ASN  50 -16.535  -4.226 -12.586
  394   2HB   ASN  50          2HB       ASN  50 -16.666  -4.981 -14.172
  395   1HD2  ASN  50          1HD2      ASN  50 -18.939  -4.306 -11.530
  396   2HD2  ASN  50          2HD2      ASN  50 -20.105  -3.496 -12.515
  397    H    GLU  51           H        GLU  51 -16.949  -8.688 -12.218
  398    HA   GLU  51           HA       GLU  51 -17.624  -9.410 -14.973
  399   1HB   GLU  51          1HB       GLU  51 -14.988  -9.787 -13.635
  400   2HB   GLU  51          2HB       GLU  51 -15.566 -11.068 -14.690
  401   1HG   GLU  51          1HG       GLU  51 -15.942  -8.634 -16.062
  402   2HG   GLU  51          2HG       GLU  51 -14.319  -8.603 -15.375
  403    H    GLU  52           H        GLU  52 -19.322 -10.702 -14.654
  404    HA   GLU  52           HA       GLU  52 -19.919 -12.175 -12.383
  405   1HB   GLU  52          1HB       GLU  52 -21.067 -11.777 -14.913
  406   2HB   GLU  52          2HB       GLU  52 -20.892 -13.518 -14.748
  407   1HG   GLU  52          1HG       GLU  52 -22.455 -13.662 -13.138
  408   2HG   GLU  52          2HG       GLU  52 -22.001 -12.123 -12.408
  409    H    GLY  53           H        GLY  53 -19.710 -14.355 -11.820
  410   1HA   GLY  53          1HA       GLY  53 -18.924 -16.566 -12.095
  411   2HA   GLY  53          2HA       GLY  53 -17.960 -16.028 -13.463
  412    H    ARG  54           H        ARG  54 -17.068 -13.691 -11.706
  413    HA   ARG  54           HA       ARG  54 -15.126 -15.196 -10.078
  414   1HB   ARG  54          1HB       ARG  54 -14.093 -14.287 -12.130
  415   2HB   ARG  54          2HB       ARG  54 -14.605 -12.672 -11.659
  416   1HG   ARG  54          1HG       ARG  54 -13.028 -12.498 -10.013
  417   2HG   ARG  54          2HG       ARG  54 -12.941 -14.243  -9.762
  418   1HD   ARG  54          1HD       ARG  54 -11.256 -14.444 -11.204
  419   2HD   ARG  54          2HD       ARG  54 -12.120 -13.525 -12.436
  420    HE   ARG  54           HE       ARG  54 -11.069 -11.810 -10.434
  421   1HH1  ARG  54          1HH1      ARG  54 -10.159 -13.699 -13.213
  422   2HH1  ARG  54          2HH1      ARG  54  -8.793 -12.707 -13.603
  423   1HH2  ARG  54          1HH2      ARG  54  -9.274 -10.496 -10.938
  424   2HH2  ARG  54          2HH2      ARG  54  -8.290 -10.886 -12.308
  425    H    THR  55           H        THR  55 -14.449 -14.250  -8.139
  426    HA   THR  55           HA       THR  55 -16.396 -12.468  -6.952
  427    HB   THR  55           HB       THR  55 -14.446 -12.841  -5.039
  428    HG1  THR  55           1HG      THR  55 -13.716 -14.920  -5.229
  429   1HG2  THR  55          1HG2      THR  55 -16.122 -13.864  -3.917
  430   2HG2  THR  55          2HG2      THR  55 -16.459 -14.987  -5.235
  431   3HG2  THR  55          3HG2      THR  55 -17.091 -13.343  -5.294
  432    HA   PRO  56           HA       PRO  56 -14.152  -8.702  -7.150
  433   1HB   PRO  56          1HB       PRO  56 -14.678  -7.594  -4.727
  434   2HB   PRO  56          2HB       PRO  56 -15.890  -7.723  -6.008
  435   1HG   PRO  56          1HG       PRO  56 -15.472  -9.469  -3.613
  436   2HG   PRO  56          2HG       PRO  56 -16.987  -8.851  -4.296
  437   1HD   PRO  56          1HD       PRO  56 -16.111 -11.375  -4.739
  438   2HD   PRO  56          2HD       PRO  56 -17.050 -10.466  -5.940
  439    H    HIS  57           H        HIS  57 -12.105  -8.031  -6.852
  440    HA   HIS  57           HA       HIS  57 -10.595  -9.184  -4.598
  441   1HB   HIS  57          1HB       HIS  57  -9.815 -10.163  -6.658
  442   2HB   HIS  57          2HB       HIS  57  -9.676  -8.579  -7.414
  443    HD1  HIS  57           1HD      HIS  57  -7.899 -10.936  -5.166
  444    HD2  HIS  57           2HD      HIS  57  -7.428  -7.061  -6.589
  445    HE1  HIS  57           1HE      HIS  57  -5.529 -10.301  -4.615
  446    H    LEU  58           H        LEU  58  -9.220  -7.866  -3.454
  447    HA   LEU  58           HA       LEU  58  -9.649  -5.002  -3.817
  448   1HB   LEU  58          1HB       LEU  58  -9.417  -6.692  -1.586
  449   2HB   LEU  58          2HB       LEU  58  -7.988  -5.661  -1.570
  450    HG   LEU  58           HG       LEU  58 -10.873  -4.793  -1.479
  451   1HD1  LEU  58          1HD1      LEU  58  -8.598  -4.799   0.474
  452   2HD1  LEU  58          2HD1      LEU  58 -10.230  -5.435   0.669
  453   3HD1  LEU  58          3HD1      LEU  58  -9.961  -3.693   0.647
  454   1HD2  LEU  58          1HD2      LEU  58  -8.550  -3.395  -2.464
  455   2HD2  LEU  58          2HD2      LEU  58  -9.220  -2.591  -1.045
  456   3HD2  LEU  58          3HD2      LEU  58 -10.241  -2.896  -2.451
  457    H    GLN  59           H        GLN  59  -8.118  -3.613  -4.472
  458    HA   GLN  59           HA       GLN  59  -5.311  -4.317  -4.353
  459   1HB   GLN  59          1HB       GLN  59  -5.765  -5.335  -6.440
  460   2HB   GLN  59          2HB       GLN  59  -6.802  -4.009  -6.950
  461   1HG   GLN  59          1HG       GLN  59  -4.704  -3.937  -8.136
  462   2HG   GLN  59          2HG       GLN  59  -4.850  -2.538  -7.073
  463   1HE2  GLN  59          1HE2      GLN  59  -3.424  -2.268  -5.422
  464   2HE2  GLN  59          2HE2      GLN  59  -2.051  -3.284  -5.166
  465    H    GLY  60           H        GLY  60  -4.479  -2.561  -3.434
  466   1HA   GLY  60          1HA       GLY  60  -4.895   0.026  -4.700
  467   2HA   GLY  60          2HA       GLY  60  -5.440  -0.105  -3.035
  468    H    PHE  61           H        PHE  61  -3.612   1.765  -3.497
  469    HA   PHE  61           HA       PHE  61  -1.168   0.616  -2.333
  470   1HB   PHE  61          1HB       PHE  61  -0.490   1.084  -4.543
  471   2HB   PHE  61          2HB       PHE  61  -1.398   2.591  -4.593
  472    HD1  PHE  61           2HD      PHE  61   1.215   1.120  -2.365
  473    HD2  PHE  61           1HD      PHE  61  -0.071   4.447  -4.688
  474    HE1  PHE  61           2HE      PHE  61   3.239   2.356  -1.709
  475    HE2  PHE  61           1HE      PHE  61   1.952   5.688  -4.036
  476    HZ   PHE  61           HZ       PHE  61   3.609   4.643  -2.544
  477    H    ALA  62           H        ALA  62  -0.236   1.766  -0.693
  478    HA   ALA  62           HA       ALA  62  -1.410   4.370  -0.005
  479   1HB   ALA  62          1HB       ALA  62  -2.467   3.490   1.738
  480   2HB   ALA  62          2HB       ALA  62  -1.728   1.913   1.458
  481   3HB   ALA  62          3HB       ALA  62  -0.892   3.117   2.438
  482    H    ASN  63           H        ASN  63   0.090   5.861   0.378
  483    HA   ASN  63           HA       ASN  63   2.870   5.033   0.644
  484   1HB   ASN  63          1HB       ASN  63   2.245   6.784  -1.001
  485   2HB   ASN  63          2HB       ASN  63   1.711   7.811   0.327
  486   1HD2  ASN  63          1HD2      ASN  63   4.073   7.533  -1.773
  487   2HD2  ASN  63          2HD2      ASN  63   5.423   8.082  -0.845
  488    H    PHE  64           H        PHE  64   3.681   4.731   2.603
  489    HA   PHE  64           HA       PHE  64   2.435   5.695   4.971
  490   1HB   PHE  64          1HB       PHE  64   4.651   3.939   4.282
  491   2HB   PHE  64          2HB       PHE  64   5.015   4.940   5.684
  492    HD1  PHE  64           2HD      PHE  64   3.631   4.788   7.708
  493    HD2  PHE  64           1HD      PHE  64   3.033   2.197   4.384
  494    HE1  PHE  64           2HE      PHE  64   2.319   3.270   9.132
  495    HE2  PHE  64           1HE      PHE  64   1.719   0.675   5.803
  496    HZ   PHE  64           HZ       PHE  64   1.362   1.210   8.180
  497    H    VAL  65           H        VAL  65   2.721   7.543   6.038
  498    HA   VAL  65           HA       VAL  65   4.181   9.685   4.973
  499    HB   VAL  65           HB       VAL  65   3.064   9.273   7.745
  500   1HG1  VAL  65          1HG1      VAL  65   4.629  11.511   6.586
  501   2HG1  VAL  65          2HG1      VAL  65   3.251  11.917   7.611
  502   3HG1  VAL  65          3HG1      VAL  65   4.558  10.916   8.244
  503   1HG2  VAL  65          1HG2      VAL  65   2.057  11.051   5.536
  504   2HG2  VAL  65          2HG2      VAL  65   1.505   9.391   5.762
  505   3HG2  VAL  65          3HG2      VAL  65   1.230  10.591   7.025
  506    H    LYS  66           H        LYS  66   5.101   7.133   7.118
  507    HA   LYS  66           HA       LYS  66   7.763   8.364   7.394
  508   1HB   LYS  66          1HB       LYS  66   7.914   7.101   9.590
  509   2HB   LYS  66          2HB       LYS  66   6.836   8.489   9.569
  510   1HG   LYS  66          1HG       LYS  66   5.628   5.873   8.923
  511   2HG   LYS  66          2HG       LYS  66   6.156   6.118  10.590
  512   1HD   LYS  66          1HD       LYS  66   4.589   8.289   9.303
  513   2HD   LYS  66          2HD       LYS  66   3.730   6.815   9.755
  514   1HE   LYS  66          1HE       LYS  66   4.137   7.113  12.009
  515   2HE   LYS  66          2HE       LYS  66   5.554   8.123  11.725
  516   1HZ   LYS  66          1HZ       LYS  66   4.283   9.974  11.386
  517   2HZ   LYS  66          2HZ       LYS  66   3.316   9.166  12.514
  518   3HZ   LYS  66          3HZ       LYS  66   2.926   9.106  10.869
  519    H    LYS  67           H        LYS  67   9.230   6.388   8.392
  520    HA   LYS  67           HA       LYS  67   9.244   4.443   6.229
  521   1HB   LYS  67          1HB       LYS  67  11.237   4.859   8.464
  522   2HB   LYS  67          2HB       LYS  67  11.465   3.842   7.047
  523   1HG   LYS  67          1HG       LYS  67  10.906   6.763   6.742
  524   2HG   LYS  67          2HG       LYS  67  12.535   6.187   7.102
  525   1HD   LYS  67          1HD       LYS  67  11.969   4.541   5.088
  526   2HD   LYS  67          2HD       LYS  67  10.901   5.874   4.643
  527   1HE   LYS  67          1HE       LYS  67  13.777   6.354   5.343
  528   2HE   LYS  67          2HE       LYS  67  13.307   5.856   3.719
  529   1HZ   LYS  67          1HZ       LYS  67  11.602   7.862   4.166
  530   2HZ   LYS  67          2HZ       LYS  67  13.099   8.052   3.402
  531   3HZ   LYS  67          3HZ       LYS  67  12.940   8.401   5.050
  532    H    GLN  68           H        GLN  68   8.406   2.480   6.421
  533    HA   GLN  68           HA       GLN  68   8.328   1.214   9.068
  534   1HB   GLN  68          1HB       GLN  68   6.027   1.320   7.110
  535   2HB   GLN  68          2HB       GLN  68   6.057   0.356   8.581
  536   1HG   GLN  68          1HG       GLN  68   6.052   3.351   8.346
  537   2HG   GLN  68          2HG       GLN  68   4.798   2.316   9.025
  538   1HE2  GLN  68          1HE2      GLN  68   6.297   0.625  10.583
  539   2HE2  GLN  68          2HE2      GLN  68   7.024   1.520  11.871
  540    H    THR  69           H        THR  69   8.238  -1.094   9.031
  541    HA   THR  69           HA       THR  69   9.530  -2.204   6.660
  542    HB   THR  69           HB       THR  69  10.269  -3.998   7.995
  543    HG1  THR  69           1HG      THR  69   9.311  -4.587   9.898
  544   1HG2  THR  69          1HG2      THR  69  11.283  -2.932   9.968
  545   2HG2  THR  69          2HG2      THR  69  10.208  -1.549   9.763
  546   3HG2  THR  69          3HG2      THR  69  11.416  -1.916   8.533
  547    H    PHE  70           H        PHE  70   8.924  -4.580   6.206
  548    HA   PHE  70           HA       PHE  70   6.279  -4.649   5.266
  549   1HB   PHE  70          1HB       PHE  70   7.809  -5.993   4.094
  550   2HB   PHE  70          2HB       PHE  70   8.417  -6.742   5.567
  551    HD1  PHE  70           1HD      PHE  70   5.225  -6.416   3.663
  552    HD2  PHE  70           2HD      PHE  70   7.760  -8.890   6.023
  553    HE1  PHE  70           1HE      PHE  70   3.685  -8.306   3.330
  554    HE2  PHE  70           2HE      PHE  70   6.224 -10.784   5.694
  555    HZ   PHE  70           HZ       PHE  70   4.184 -10.494   4.345
  556    H    ASN  71           H        ASN  71   7.790  -6.469   7.932
  557    HA   ASN  71           HA       ASN  71   5.447  -7.735   8.813
  558   1HB   ASN  71          1HB       ASN  71   7.858  -6.969  10.474
  559   2HB   ASN  71          2HB       ASN  71   6.673  -8.212  10.864
  560   1HD2  ASN  71          1HD2      ASN  71   9.523  -7.446   9.164
  561   2HD2  ASN  71          2HD2      ASN  71   9.780  -8.991   8.435
  562    H    LYS  72           H        LYS  72   6.935  -4.665   9.745
  563    HA   LYS  72           HA       LYS  72   5.162  -4.058  11.855
  564   1HB   LYS  72          1HB       LYS  72   7.448  -2.962  11.045
  565   2HB   LYS  72          2HB       LYS  72   6.347  -1.860  10.229
  566   1HG   LYS  72          1HG       LYS  72   6.463  -2.425  13.183
  567   2HG   LYS  72          2HG       LYS  72   6.977  -0.949  12.364
  568   1HD   LYS  72          1HD       LYS  72   4.623  -0.662  11.575
  569   2HD   LYS  72          2HD       LYS  72   4.171  -2.032  12.592
  570   1HE   LYS  72          1HE       LYS  72   5.307   0.617  13.471
  571   2HE   LYS  72          2HE       LYS  72   3.697  -0.022  13.798
  572   1HZ   LYS  72          1HZ       LYS  72   4.859  -0.412  15.749
  573   2HZ   LYS  72          2HZ       LYS  72   6.280  -0.861  14.950
  574   3HZ   LYS  72          3HZ       LYS  72   4.950  -1.906  14.960
  575    H    VAL  73           H        VAL  73   5.186  -3.043   8.445
  576    HA   VAL  73           HA       VAL  73   2.938  -1.424   8.462
  577    HB   VAL  73           HB       VAL  73   4.057  -3.185   6.289
  578   1HG1  VAL  73          1HG1      VAL  73   1.924  -3.025   5.480
  579   2HG1  VAL  73          2HG1      VAL  73   1.605  -1.500   6.310
  580   3HG1  VAL  73          3HG1      VAL  73   2.600  -1.522   4.853
  581   1HG2  VAL  73          1HG2      VAL  73   4.021  -0.203   6.267
  582   2HG2  VAL  73          2HG2      VAL  73   5.199  -1.042   7.276
  583   3HG2  VAL  73          3HG2      VAL  73   5.173  -1.320   5.534
  584    H    LYS  74           H        LYS  74   3.174  -4.873   8.643
  585    HA   LYS  74           HA       LYS  74   0.586  -5.558   7.760
  586   1HB   LYS  74          1HB       LYS  74   2.347  -6.979   9.766
  587   2HB   LYS  74          2HB       LYS  74   0.952  -7.677   8.955
  588   1HG   LYS  74          1HG       LYS  74   2.494  -6.767   6.867
  589   2HG   LYS  74          2HG       LYS  74   3.686  -7.359   8.027
  590   1HD   LYS  74          1HD       LYS  74   3.268  -9.339   7.019
  591   2HD   LYS  74          2HD       LYS  74   1.896  -9.368   8.130
  592   1HE   LYS  74          1HE       LYS  74   0.433  -8.507   6.427
  593   2HE   LYS  74          2HE       LYS  74   1.788  -8.267   5.325
  594   1HZ   LYS  74          1HZ       LYS  74   2.128 -10.658   5.278
  595   2HZ   LYS  74          2HZ       LYS  74   0.556 -10.272   4.788
  596   3HZ   LYS  74          3HZ       LYS  74   0.831 -10.890   6.338
  597    H    TRP  75           H        TRP  75   1.597  -3.866  10.491
  598    HA   TRP  75           HA       TRP  75  -0.330  -4.736  12.381
  599   1HB   TRP  75          1HB       TRP  75   0.375  -2.930  13.720
  600   2HB   TRP  75          2HB       TRP  75   1.809  -3.387  12.806
  601    HD1  TRP  75           HD       TRP  75   1.165  -1.834  10.100
  602    HE1  TRP  75           1HE      TRP  75   1.308   0.735  10.056
  603    HE3  TRP  75           3HE      TRP  75   0.671  -0.909  15.104
  604    HZ2  TRP  75           2HZ      TRP  75   1.224   2.872  11.899
  605    HZ3  TRP  75           3HZ      TRP  75   0.714   1.425  15.881
  606    HH2  TRP  75           HH       TRP  75   0.985   3.275  14.311
  607    H    TYR  76           H        TYR  76  -0.511  -2.730   9.610
  608    HA   TYR  76           HA       TYR  76  -3.151  -1.735  10.458
  609   1HB   TYR  76          1HB       TYR  76  -0.928  -0.484   9.018
  610   2HB   TYR  76          2HB       TYR  76  -2.483  -0.268   8.223
  611    HD1  TYR  76           2HD      TYR  76  -4.277  -0.104  10.588
  612    HD2  TYR  76           1HD      TYR  76  -0.461   1.639   9.880
  613    HE1  TYR  76           2HE      TYR  76  -4.825   1.716  12.149
  614    HE2  TYR  76           1HE      TYR  76  -0.998   3.464  11.439
  615    HH   TYR  76           HH       TYR  76  -2.610   3.726  13.479
  616    H    LEU  77           H        LEU  77  -1.347  -2.876   7.609
  617    HA   LEU  77           HA       LEU  77  -3.697  -3.292   6.044
  618   1HB   LEU  77          1HB       LEU  77  -0.864  -4.259   5.718
  619   2HB   LEU  77          2HB       LEU  77  -2.138  -4.529   4.531
  620    HG   LEU  77           HG       LEU  77  -0.985  -1.868   5.365
  621   1HD1  LEU  77          1HD1      LEU  77   0.573  -2.647   3.903
  622   2HD1  LEU  77          2HD1      LEU  77  -0.579  -1.976   2.749
  623   3HD1  LEU  77          3HD1      LEU  77  -0.566  -3.709   3.075
  624   1HD2  LEU  77          1HD2      LEU  77  -3.276  -2.572   3.546
  625   2HD2  LEU  77          2HD2      LEU  77  -2.422  -1.031   3.461
  626   3HD2  LEU  77          3HD2      LEU  77  -3.278  -1.486   4.935
  627    H    GLY  78           H        GLY  78  -2.271  -5.019   8.569
  628   1HA   GLY  78          1HA       GLY  78  -2.827  -7.030   9.535
  629   2HA   GLY  78          2HA       GLY  78  -4.194  -7.101   8.433
  630    H    ALA  79           H        ALA  79  -2.561  -9.302   9.261
  631    HA   ALA  79           HA       ALA  79  -0.725  -9.959   7.165
  632   1HB   ALA  79          1HB       ALA  79  -0.121 -11.102   9.030
  633   2HB   ALA  79          2HB       ALA  79  -1.785 -11.311   9.578
  634   3HB   ALA  79          3HB       ALA  79  -1.146 -12.334   8.292
  635    H    ARG  80           H        ARG  80  -4.127 -10.411   7.720
  636    HA   ARG  80           HA       ARG  80  -4.703 -12.562   6.076
  637   1HB   ARG  80          1HB       ARG  80  -6.365 -10.059   6.414
  638   2HB   ARG  80          2HB       ARG  80  -6.948 -11.625   5.865
  639   1HG   ARG  80          1HG       ARG  80  -5.638 -11.988   8.360
  640   2HG   ARG  80          2HG       ARG  80  -6.767 -10.640   8.507
  641   1HD   ARG  80          1HD       ARG  80  -7.929 -12.656   9.067
  642   2HD   ARG  80          2HD       ARG  80  -8.526 -12.089   7.507
  643    HE   ARG  80           HE       ARG  80  -6.572 -13.836   6.832
  644   1HH1  ARG  80          1HH1      ARG  80  -9.361 -14.037   8.905
  645   2HH1  ARG  80          2HH1      ARG  80  -9.600 -15.732   8.638
  646   1HH2  ARG  80          1HH2      ARG  80  -6.876 -16.068   6.472
  647   2HH2  ARG  80          2HH2      ARG  80  -8.185 -16.887   7.254
  648    H    CYS  81           H        CYS  81  -4.243  -9.162   5.222
  649    HA   CYS  81           HA       CYS  81  -4.643  -9.766   2.397
  650   1HB   CYS  81          1HB       CYS  81  -3.942  -7.095   3.618
  651   2HB   CYS  81          2HB       CYS  81  -4.637  -7.402   2.031
  652    HG   CYS  81           HG       CYS  81  -6.149  -7.304   5.049
  653    H    HIS  82           H        HIS  82  -3.054  -9.849   0.904
  654    HA   HIS  82           HA       HIS  82  -0.359 -10.161   1.801
  655   1HB   HIS  82          1HB       HIS  82  -1.507 -11.380  -0.140
  656   2HB   HIS  82          2HB       HIS  82  -1.223  -9.915  -1.076
  657    HD1  HIS  82           1HD      HIS  82   1.123 -11.735   1.302
  658    HD2  HIS  82           2HD      HIS  82   0.858 -10.574  -2.679
  659    HE1  HIS  82           1HE      HIS  82   3.330 -12.362   0.270
  660    H    ILE  83           H        ILE  83   1.282  -8.746   1.795
  661    HA   ILE  83           HA       ILE  83   0.767  -6.077   0.659
  662    HB   ILE  83           HB       ILE  83   2.831  -6.601   2.771
  663   1HG1  ILE  83          1HG1      ILE  83  -0.116  -6.076   3.207
  664   2HG1  ILE  83          2HG1      ILE  83   0.777  -7.514   3.689
  665   1HG2  ILE  83          1HG2      ILE  83   2.853  -4.459   1.578
  666   2HG2  ILE  83          2HG2      ILE  83   1.188  -4.170   2.079
  667   3HG2  ILE  83          3HG2      ILE  83   2.469  -4.253   3.287
  668   1HD1  ILE  83          1HD1      ILE  83   0.568  -6.309   5.653
  669   2HD1  ILE  83          2HD1      ILE  83   2.192  -5.899   5.098
  670   3HD1  ILE  83          3HD1      ILE  83   0.864  -4.765   4.854
  671    H    GLU  84           H        GLU  84   2.339  -5.064  -0.560
  672    HA   GLU  84           HA       GLU  84   4.853  -6.455  -1.056
  673   1HB   GLU  84          1HB       GLU  84   2.778  -5.893  -3.169
  674   2HB   GLU  84          2HB       GLU  84   4.473  -6.153  -3.558
  675   1HG   GLU  84          1HG       GLU  84   4.320  -8.364  -2.421
  676   2HG   GLU  84          2HG       GLU  84   2.585  -8.099  -2.258
  677    H    LYS  85           H        LYS  85   6.332  -5.134  -2.428
  678    HA   LYS  85           HA       LYS  85   6.234  -2.384  -1.543
  679   1HB   LYS  85          1HB       LYS  85   8.298  -3.847  -3.200
  680   2HB   LYS  85          2HB       LYS  85   8.483  -2.225  -2.546
  681   1HG   LYS  85          1HG       LYS  85   8.099  -3.310  -0.258
  682   2HG   LYS  85          2HG       LYS  85   8.405  -4.839  -1.085
  683   1HD   LYS  85          1HD       LYS  85  10.531  -3.611  -1.969
  684   2HD   LYS  85          2HD       LYS  85  10.256  -2.543  -0.591
  685   1HE   LYS  85          1HE       LYS  85  11.129  -4.038   0.801
  686   2HE   LYS  85          2HE       LYS  85  10.007  -5.275   0.236
  687   1HZ   LYS  85          1HZ       LYS  85  11.733  -5.247  -1.774
  688   2HZ   LYS  85          2HZ       LYS  85  11.910  -6.250  -0.424
  689   3HZ   LYS  85          3HZ       LYS  85  12.773  -4.798  -0.518
  690    H    ALA  86           H        ALA  86   5.742  -0.638  -2.735
  691    HA   ALA  86           HA       ALA  86   4.737  -1.069  -5.429
  692   1HB   ALA  86          1HB       ALA  86   4.546   1.658  -4.724
  693   2HB   ALA  86          2HB       ALA  86   3.256   0.456  -4.798
  694   3HB   ALA  86          3HB       ALA  86   4.132   0.718  -3.290
  695    H    LYS  87           H        LYS  87   5.320   0.365  -7.192
  696    HA   LYS  87           HA       LYS  87   7.893   1.720  -6.959
  697   1HB   LYS  87          1HB       LYS  87   8.861   0.568  -8.854
  698   2HB   LYS  87          2HB       LYS  87   8.404  -0.609  -7.629
  699   1HG   LYS  87          1HG       LYS  87   6.552  -1.346  -8.876
  700   2HG   LYS  87          2HG       LYS  87   6.629   0.046  -9.959
  701   1HD   LYS  87          1HD       LYS  87   7.548  -1.682 -11.224
  702   2HD   LYS  87          2HD       LYS  87   8.963  -0.841 -10.588
  703   1HE   LYS  87          1HE       LYS  87   8.013  -2.921  -8.798
  704   2HE   LYS  87          2HE       LYS  87   8.427  -3.550 -10.392
  705   1HZ   LYS  87          1HZ       LYS  87  10.205  -1.903  -8.675
  706   2HZ   LYS  87          2HZ       LYS  87  10.602  -2.524 -10.197
  707   3HZ   LYS  87          3HZ       LYS  87  10.328  -3.575  -8.899
  708    H    GLY  88           H        GLY  88   8.279   3.274  -8.582
  709   1HA   GLY  88          1HA       GLY  88   7.661   4.326 -10.673
  710   2HA   GLY  88          2HA       GLY  88   6.010   3.792 -10.393
  711    H    THR  89           H        THR  89   5.222   5.905 -10.668
  712    HA   THR  89           HA       THR  89   5.884   7.754  -8.469
  713    HB   THR  89           HB       THR  89   5.336   9.611  -9.872
  714    HG1  THR  89           1HG      THR  89   4.647   9.204 -12.075
  715   1HG2  THR  89          1HG2      THR  89   6.907   7.779 -11.671
  716   2HG2  THR  89          2HG2      THR  89   7.578   8.434 -10.176
  717   3HG2  THR  89          3HG2      THR  89   7.072   9.523 -11.468
  718    H    ASP  90           H        ASP  90   3.985   9.378  -8.136
  719    HA   ASP  90           HA       ASP  90   1.843   8.013  -7.020
  720   1HB   ASP  90          1HB       ASP  90   2.488  10.338  -6.449
  721   2HB   ASP  90          2HB       ASP  90   1.848  10.876  -7.999
  722    H    GLN  91           H        GLN  91   2.173   9.448 -10.224
  723    HA   GLN  91           HA       GLN  91  -0.527   9.073 -11.009
  724   1HB   GLN  91          1HB       GLN  91   2.016   9.799 -12.341
  725   2HB   GLN  91          2HB       GLN  91   0.773   9.103 -13.372
  726   1HG   GLN  91          1HG       GLN  91   0.376  11.489 -11.582
  727   2HG   GLN  91          2HG       GLN  91   0.736  11.568 -13.306
  728   1HE2  GLN  91          1HE2      GLN  91  -1.661  11.044 -10.913
  729   2HE2  GLN  91          2HE2      GLN  91  -3.006  10.854 -11.980
  730    H    GLN  92           H        GLN  92   2.361   7.082 -11.204
  731    HA   GLN  92           HA       GLN  92   1.311   5.110 -12.938
  732   1HB   GLN  92          1HB       GLN  92   3.525   4.976 -10.889
  733   2HB   GLN  92          2HB       GLN  92   3.162   3.686 -12.027
  734   1HG   GLN  92          1HG       GLN  92   3.405   5.754 -13.727
  735   2HG   GLN  92          2HG       GLN  92   4.509   6.266 -12.451
  736   1HE2  GLN  92          1HE2      GLN  92   6.518   5.658 -12.745
  737   2HE2  GLN  92          2HE2      GLN  92   7.049   4.239 -13.576
  738    H    ASN  93           H        ASN  93   1.378   5.431  -9.420
  739    HA   ASN  93           HA       ASN  93   0.124   2.879  -8.984
  740   1HB   ASN  93          1HB       ASN  93   0.847   5.192  -7.194
  741   2HB   ASN  93          2HB       ASN  93  -0.099   3.831  -6.598
  742   1HD2  ASN  93          1HD2      ASN  93   2.752   4.223  -8.680
  743   2HD2  ASN  93          2HD2      ASN  93   3.734   3.081  -7.834
  744    H    LYS  94           H        LYS  94  -0.888   6.257  -9.036
  745    HA   LYS  94           HA       LYS  94  -3.501   5.901  -8.071
  746   1HB   LYS  94          1HB       LYS  94  -2.291   8.091  -8.361
  747   2HB   LYS  94          2HB       LYS  94  -2.610   7.967 -10.086
  748   1HG   LYS  94          1HG       LYS  94  -5.094   7.596  -8.960
  749   2HG   LYS  94          2HG       LYS  94  -4.350   8.817  -7.925
  750   1HD   LYS  94          1HD       LYS  94  -3.684   9.944 -10.166
  751   2HD   LYS  94          2HD       LYS  94  -4.950   8.927 -10.857
  752   1HE   LYS  94          1HE       LYS  94  -6.415  10.486 -10.248
  753   2HE   LYS  94          2HE       LYS  94  -6.089  10.044  -8.572
  754   1HZ   LYS  94          1HZ       LYS  94  -4.212  11.885  -9.826
  755   2HZ   LYS  94          2HZ       LYS  94  -4.811  11.859  -8.244
  756   3HZ   LYS  94          3HZ       LYS  94  -5.756  12.494  -9.496
  757    H    GLU  95           H        GLU  95  -2.241   5.936 -11.394
  758    HA   GLU  95           HA       GLU  95  -4.773   5.446 -12.601
  759   1HB   GLU  95          1HB       GLU  95  -1.937   5.263 -13.595
  760   2HB   GLU  95          2HB       GLU  95  -3.304   4.819 -14.607
  761   1HG   GLU  95          1HG       GLU  95  -3.536   7.439 -13.315
  762   2HG   GLU  95          2HG       GLU  95  -2.214   7.294 -14.472
  763    H    TYR  96           H        TYR  96  -2.132   3.411 -11.499
  764    HA   TYR  96           HA       TYR  96  -2.834   1.006 -12.710
  765   1HB   TYR  96          1HB       TYR  96  -0.727   1.286 -11.523
  766   2HB   TYR  96          2HB       TYR  96  -1.581   1.477  -9.996
  767    HD1  TYR  96           2HD      TYR  96  -0.571  -0.912 -12.599
  768    HD2  TYR  96           1HD      TYR  96  -2.458  -0.432  -8.816
  769    HE1  TYR  96           2HE      TYR  96  -0.446  -3.342 -12.234
  770    HE2  TYR  96           1HE      TYR  96  -2.337  -2.860  -8.440
  771    HH   TYR  96           HH       TYR  96  -2.190  -4.989 -10.200
  772    H    CYS  97           H        CYS  97  -3.845   2.302  -9.556
  773    HA   CYS  97           HA       CYS  97  -5.538   0.120  -8.915
  774   1HB   CYS  97          1HB       CYS  97  -5.689   2.957  -7.877
  775   2HB   CYS  97          2HB       CYS  97  -6.369   1.524  -7.115
  776    HG   CYS  97           HG       CYS  97  -3.470   0.531  -7.193
  777    H    SER  98           H        SER  98  -6.028   3.155 -10.605
  778    HA   SER  98           HA       SER  98  -8.886   2.926 -10.689
  779   1HB   SER  98          1HB       SER  98  -8.876   4.951 -11.838
  780   2HB   SER  98          2HB       SER  98  -7.391   5.062 -10.894
  781    HG   SER  98           HG       SER  98  -7.729   4.980 -13.593
  782    H    LYS  99           H        LYS  99  -6.363   1.445 -12.354
  783    HA   LYS  99           HA       LYS  99  -7.303   1.222 -14.962
  784   1HB   LYS  99          1HB       LYS  99  -5.079   0.466 -14.275
  785   2HB   LYS  99          2HB       LYS  99  -5.798  -0.825 -13.322
  786   1HG   LYS  99          1HG       LYS  99  -6.784  -1.017 -15.982
  787   2HG   LYS  99          2HG       LYS  99  -5.026  -0.864 -16.038
  788   1HD   LYS  99          1HD       LYS  99  -6.567  -2.863 -14.382
  789   2HD   LYS  99          2HD       LYS  99  -5.735  -3.210 -15.899
  790   1HE   LYS  99          1HE       LYS  99  -3.826  -1.953 -14.310
  791   2HE   LYS  99          2HE       LYS  99  -4.684  -3.031 -13.210
  792   1HZ   LYS  99          1HZ       LYS  99  -2.795  -3.671 -15.223
  793   2HZ   LYS  99          2HZ       LYS  99  -4.248  -4.486 -15.512
  794   3HZ   LYS  99          3HZ       LYS  99  -3.458  -4.668 -14.028
  795    H    GLU 100           H        GLU 100  -8.450  -0.240 -12.048
  796    HA   GLU 100           HA       GLU 100  -9.861  -2.402 -13.265
  797   1HB   GLU 100          1HB       GLU 100 -10.443  -1.121 -10.594
  798   2HB   GLU 100          2HB       GLU 100 -10.861  -2.749 -11.109
  799   1HG   GLU 100          1HG       GLU 100  -8.096  -1.678 -10.601
  800   2HG   GLU 100          2HG       GLU 100  -8.990  -2.822  -9.601
  801    H    GLY 101           H        GLY 101 -10.499   0.957 -12.798
  802   1HA   GLY 101          1HA       GLY 101 -12.178   2.132 -13.969
  803   2HA   GLY 101          2HA       GLY 101 -13.070   0.629 -14.152
  804    H    ASN 102           H        ASN 102 -12.314   0.388 -11.085
  805    HA   ASN 102           HA       ASN 102 -14.417   2.179 -10.087
  806   1HB   ASN 102          1HB       ASN 102 -15.097  -0.322 -10.538
  807   2HB   ASN 102          2HB       ASN 102 -14.244  -0.616  -9.026
  808   1HD2  ASN 102          1HD2      ASN 102 -16.068  -1.198  -7.905
  809   2HD2  ASN 102          2HD2      ASN 102 -17.301  -0.070  -7.468
  810    H    LEU 103           H        LEU 103 -13.743   3.316  -8.399
  811    HA   LEU 103           HA       LEU 103 -11.354   2.419  -6.957
  812   1HB   LEU 103          1HB       LEU 103 -12.706   5.113  -7.005
  813   2HB   LEU 103          2HB       LEU 103 -11.213   4.730  -6.151
  814    HG   LEU 103           HG       LEU 103 -11.652   4.888  -9.125
  815   1HD1  LEU 103          1HD1      LEU 103  -9.476   6.276  -7.662
  816   2HD1  LEU 103          2HD1      LEU 103 -11.118   6.894  -7.482
  817   3HD1  LEU 103          3HD1      LEU 103 -10.390   6.780  -9.084
  818   1HD2  LEU 103          1HD2      LEU 103  -9.313   3.783  -7.583
  819   2HD2  LEU 103          2HD2      LEU 103  -9.220   4.293  -9.269
  820   3HD2  LEU 103          3HD2      LEU 103 -10.286   2.965  -8.806
  821    H    LEU 104           H        LEU 104 -11.429   1.781  -4.896
  822    HA   LEU 104           HA       LEU 104 -14.006   1.681  -3.567
  823   1HB   LEU 104          1HB       LEU 104 -12.488  -0.274  -3.627
  824   2HB   LEU 104          2HB       LEU 104 -11.329   0.633  -2.659
  825    HG   LEU 104           HG       LEU 104 -13.335   0.790  -0.972
  826   1HD1  LEU 104          1HD1      LEU 104 -14.623  -0.594  -2.909
  827   2HD1  LEU 104          2HD1      LEU 104 -15.053  -0.636  -1.200
  828   3HD1  LEU 104          3HD1      LEU 104 -14.043  -1.909  -1.886
  829   1HD2  LEU 104          1HD2      LEU 104 -12.291  -0.828   0.261
  830   2HD2  LEU 104          2HD2      LEU 104 -11.046  -0.515  -0.949
  831   3HD2  LEU 104          3HD2      LEU 104 -12.106  -1.916  -1.115
  832    H    MET 105           H        MET 105 -11.054   3.480  -3.407
  833    HA   MET 105           HA       MET 105 -12.205   5.304  -1.509
  834   1HB   MET 105          1HB       MET 105 -11.409   3.937   0.195
  835   2HB   MET 105          2HB       MET 105  -9.992   3.445  -0.723
  836   1HG   MET 105          1HG       MET 105  -8.773   5.218  -0.060
  837   2HG   MET 105          2HG       MET 105 -10.161   6.304  -0.041
  838   1HE   MET 105          1HE       MET 105  -8.104   4.376   3.385
  839   2HE   MET 105          2HE       MET 105  -8.656   3.153   2.241
  840   3HE   MET 105          3HE       MET 105  -7.645   4.487   1.685
  841    H    GLU 106           H        GLU 106 -11.394   7.323  -1.754
  842    HA   GLU 106           HA       GLU 106  -8.887   7.640  -3.252
  843   1HB   GLU 106          1HB       GLU 106 -11.233   7.957  -4.514
  844   2HB   GLU 106          2HB       GLU 106 -11.069   9.568  -3.830
  845   1HG   GLU 106          1HG       GLU 106  -8.722   8.437  -5.236
  846   2HG   GLU 106          2HG       GLU 106 -10.106   8.923  -6.212
  847    H    CYS 107           H        CYS 107  -7.605   8.539  -1.759
  848    HA   CYS 107           HA       CYS 107  -8.314  11.146  -0.722
  849   1HB   CYS 107          1HB       CYS 107  -8.106   8.715   0.994
  850   2HB   CYS 107          2HB       CYS 107  -7.451  10.224   1.618
  851    HG   CYS 107           HG       CYS 107 -10.696   9.591   0.754
  852    H    GLY 108           H        GLY 108  -6.386  11.883   0.802
  853   1HA   GLY 108          1HA       GLY 108  -4.061  11.987   1.164
  854   2HA   GLY 108          2HA       GLY 108  -3.830  10.816  -0.127
  855    H    ALA 109           H        ALA 109  -2.093  12.663  -0.360
  856    HA   ALA 109           HA       ALA 109  -3.178  14.720  -2.168
  857   1HB   ALA 109          1HB       ALA 109  -0.442  15.169  -1.340
  858   2HB   ALA 109          2HB       ALA 109  -1.851  16.221  -1.201
  859   3HB   ALA 109          3HB       ALA 109  -1.527  15.013   0.042
  860    HA   PRO 110           HA       PRO 110  -1.009  13.074  -5.609
  861   1HB   PRO 110          1HB       PRO 110  -0.178  15.318  -6.891
  862   2HB   PRO 110          2HB       PRO 110  -1.869  14.804  -6.852
  863   1HG   PRO 110          1HG       PRO 110  -0.477  16.866  -5.187
  864   2HG   PRO 110          2HG       PRO 110  -2.073  16.940  -5.955
  865   1HD   PRO 110          1HD       PRO 110  -1.746  16.395  -3.323
  866   2HD   PRO 110          2HD       PRO 110  -3.074  15.710  -4.282
  867    H    ARG 111           H        ARG 111   0.774  12.002  -4.793
  868    HA   ARG 111           HA       ARG 111   3.096  13.327  -3.821
  869   1HB   ARG 111          1HB       ARG 111   2.344  10.519  -4.466
  870   2HB   ARG 111          2HB       ARG 111   4.058  10.901  -4.364
  871   1HG   ARG 111          1HG       ARG 111   2.039  11.431  -2.194
  872   2HG   ARG 111          2HG       ARG 111   3.138  10.051  -2.250
  873   1HD   ARG 111          1HD       ARG 111   3.847  12.966  -1.994
  874   2HD   ARG 111          2HD       ARG 111   4.103  11.687  -0.808
  875    HE   ARG 111           HE       ARG 111   5.522  10.845  -2.956
  876   1HH1  ARG 111          1HH1      ARG 111   5.442  13.814  -1.140
  877   2HH1  ARG 111          2HH1      ARG 111   7.109  14.189  -1.430
  878   1HH2  ARG 111          1HH2      ARG 111   7.717  11.328  -3.345
  879   2HH2  ARG 111          2HH2      ARG 111   8.402  12.774  -2.685
  880    H    SER 112           H        SER 112   5.200  13.354  -4.782
  881    HA   SER 112           HA       SER 112   5.626  12.690  -7.515
  882   1HB   SER 112          1HB       SER 112   5.962  15.040  -8.323
  883   2HB   SER 112          2HB       SER 112   4.280  14.640  -7.976
  884    HG   SER 112           HG       SER 112   5.672  16.633  -6.996
  885    H    GLN 113           H        GLN 113   7.786  12.846  -8.109
  886    HA   GLN 113           HA       GLN 113   9.619  13.228  -5.883
  887   1HB   GLN 113          1HB       GLN 113   9.713  11.840  -8.506
  888   2HB   GLN 113          2HB       GLN 113  11.237  12.450  -7.875
  889   1HG   GLN 113          1HG       GLN 113   9.389  10.680  -6.299
  890   2HG   GLN 113          2HG       GLN 113  10.696  10.068  -7.311
  891   1HE2  GLN 113          1HE2      GLN 113   9.848  11.604  -4.354
  892   2HE2  GLN 113          2HE2      GLN 113  11.428  11.622  -3.655
  893    H    GLY 114           H        GLY 114   9.309  14.348  -9.254
  894   1HA   GLY 114          1HA       GLY 114   9.557  16.702  -9.757
  895   2HA   GLY 114          2HA       GLY 114  10.723  16.806  -8.446
  896    H    GLN 115           H        GLN 115  12.788  16.858  -9.016
  897    HA   GLN 115           HA       GLN 115  13.508  15.892 -11.700
  898   1HB   GLN 115          1HB       GLN 115  14.924  17.927  -9.971
  899   2HB   GLN 115          2HB       GLN 115  15.400  17.446 -11.594
  900   1HG   GLN 115          1HG       GLN 115  12.831  18.201 -12.007
  901   2HG   GLN 115          2HG       GLN 115  13.307  19.293 -10.708
  902   1HE2  GLN 115          1HE2      GLN 115  14.908  20.814 -11.074
  903   2HE2  GLN 115          2HE2      GLN 115  15.452  21.222 -12.662
  904    H    ARG 116           H        ARG 116  13.537  13.739 -10.547
  905    HA   ARG 116           HA       ARG 116  14.668  11.972  -9.664
  906   1HB   ARG 116          1HB       ARG 116  17.145  13.544 -10.384
  907   2HB   ARG 116          2HB       ARG 116  17.007  11.800 -10.205
  908   1HG   ARG 116          1HG       ARG 116  15.463  11.772 -12.144
  909   2HG   ARG 116          2HG       ARG 116  15.761  13.499 -12.354
  910   1HD   ARG 116          1HD       ARG 116  18.076  11.622 -12.215
  911   2HD   ARG 116          2HD       ARG 116  17.139  11.724 -13.706
  912    HE   ARG 116           HE       ARG 116  18.961  13.684 -12.670
  913   1HH1  ARG 116          1HH1      ARG 116  16.170  13.167 -14.685
  914   2HH1  ARG 116          2HH1      ARG 116  16.437  14.586 -15.643
  915   1HH2  ARG 116          1HH2      ARG 116  19.324  15.554 -13.924
  916   2HH2  ARG 116          2HH2      ARG 116  18.232  15.942 -15.210
  Start of MODEL   12
    1    HA   PRO   2           HA       PRO   2  38.474  -2.941  17.681
    2   1HB   PRO   2          1HB       PRO   2  37.050  -1.629  15.778
    3   2HB   PRO   2          2HB       PRO   2  38.453  -0.921  16.586
    4   1HG   PRO   2          1HG       PRO   2  38.275  -2.230  13.900
    5   2HG   PRO   2          2HG       PRO   2  39.133  -0.751  14.369
    6   1HD   PRO   2          1HD       PRO   2  40.390  -3.130  14.062
    7   2HD   PRO   2          2HD       PRO   2  40.920  -1.915  15.244
    8    H    SER   3           H        SER   3  38.406  -4.835  14.793
    9    HA   SER   3           HA       SER   3  36.987  -6.428  14.003
   10   1HB   SER   3          1HB       SER   3  35.566  -6.569  16.631
   11   2HB   SER   3          2HB       SER   3  36.074  -7.875  15.561
   12    HG   SER   3           HG       SER   3  37.615  -6.375  17.385
   13    H    LYS   4           H        LYS   4  36.229  -3.701  13.683
   14    HA   LYS   4           HA       LYS   4  33.448  -3.374  14.241
   15   1HB   LYS   4          1HB       LYS   4  35.542  -1.869  12.775
   16   2HB   LYS   4          2HB       LYS   4  33.878  -1.574  12.286
   17   1HG   LYS   4          1HG       LYS   4  33.304  -0.644  14.310
   18   2HG   LYS   4          2HG       LYS   4  34.596  -1.475  15.179
   19   1HD   LYS   4          1HD       LYS   4  36.182  -0.033  13.740
   20   2HD   LYS   4          2HD       LYS   4  34.754   0.957  13.430
   21   1HE   LYS   4          1HE       LYS   4  35.724   0.239  16.191
   22   2HE   LYS   4          2HE       LYS   4  36.193   1.714  15.346
   23   1HZ   LYS   4          1HZ       LYS   4  34.382   2.266  16.727
   24   2HZ   LYS   4          2HZ       LYS   4  33.480   0.923  16.235
   25   3HZ   LYS   4          3HZ       LYS   4  33.754   2.197  15.157
   26    H    LYS   5           H        LYS   5  32.524  -5.299  13.395
   27    HA   LYS   5           HA       LYS   5  32.361  -5.360  10.452
   28   1HB   LYS   5          1HB       LYS   5  32.435  -7.537  12.498
   29   2HB   LYS   5          2HB       LYS   5  31.540  -7.808  11.009
   30   1HG   LYS   5          1HG       LYS   5  34.411  -6.922  11.051
   31   2HG   LYS   5          2HG       LYS   5  33.921  -8.617  11.034
   32   1HD   LYS   5          1HD       LYS   5  32.523  -7.970   8.970
   33   2HD   LYS   5          2HD       LYS   5  33.528  -6.519   8.925
   34   1HE   LYS   5          1HE       LYS   5  34.733  -7.908   7.557
   35   2HE   LYS   5          2HE       LYS   5  35.486  -8.257   9.112
   36   1HZ   LYS   5          1HZ       LYS   5  33.877 -10.153   9.289
   37   2HZ   LYS   5          2HZ       LYS   5  35.055 -10.319   8.087
   38   3HZ   LYS   5          3HZ       LYS   5  33.474  -9.884   7.668
   39    H    ASN   6           H        ASN   6  30.571  -4.158  10.052
   40    HA   ASN   6           HA       ASN   6  28.148  -4.620  11.608
   41   1HB   ASN   6          1HB       ASN   6  27.239  -2.705  10.315
   42   2HB   ASN   6          2HB       ASN   6  28.724  -2.303  11.171
   43   1HD2  ASN   6          1HD2      ASN   6  27.147  -1.866   8.377
   44   2HD2  ASN   6          2HD2      ASN   6  28.478  -1.611   7.305
   45    H    GLY   7           H        GLY   7  26.117  -5.093  10.590
   46   1HA   GLY   7          1HA       GLY   7  26.431  -6.993   8.407
   47   2HA   GLY   7          2HA       GLY   7  24.987  -6.749   9.380
   48    H    ARG   8           H        ARG   8  24.602  -7.052   6.758
   49    HA   ARG   8           HA       ARG   8  23.616  -4.433   5.974
   50   1HB   ARG   8          1HB       ARG   8  25.660  -5.988   4.419
   51   2HB   ARG   8          2HB       ARG   8  24.518  -4.940   3.589
   52   1HG   ARG   8          1HG       ARG   8  25.465  -3.310   5.569
   53   2HG   ARG   8          2HG       ARG   8  26.885  -4.272   5.153
   54   1HD   ARG   8          1HD       ARG   8  26.852  -3.561   2.922
   55   2HD   ARG   8          2HD       ARG   8  25.191  -2.983   3.040
   56    HE   ARG   8           HE       ARG   8  25.983  -0.991   3.833
   57   1HH1  ARG   8          1HH1      ARG   8  28.486  -3.395   4.109
   58   2HH1  ARG   8          2HH1      ARG   8  29.704  -2.260   4.588
   59   1HH2  ARG   8          1HH2      ARG   8  27.577   0.513   4.463
   60   2HH2  ARG   8          2HH2      ARG   8  29.186  -0.038   4.790
   61    H    SER   9           H        SER   9  21.592  -5.429   6.415
   62    HA   SER   9           HA       SER   9  20.699  -7.813   5.222
   63   1HB   SER   9          1HB       SER   9  18.376  -6.531   5.594
   64   2HB   SER   9          2HB       SER   9  19.290  -7.230   6.930
   65    HG   SER   9           HG       SER   9  18.597  -4.989   7.202
   66    H    GLY  10           H        GLY  10  18.972  -8.003   3.584
   67   1HA   GLY  10          1HA       GLY  10  19.678  -6.430   1.249
   68   2HA   GLY  10          2HA       GLY  10  18.632  -7.842   1.281
   69    HA   PRO  11           HA       PRO  11  15.022  -5.367   1.147
   70   1HB   PRO  11          1HB       PRO  11  13.383  -6.472   3.008
   71   2HB   PRO  11          2HB       PRO  11  13.770  -7.265   1.477
   72   1HG   PRO  11          1HG       PRO  11  14.938  -7.722   4.195
   73   2HG   PRO  11          2HG       PRO  11  14.455  -8.910   2.970
   74   1HD   PRO  11          1HD       PRO  11  17.033  -8.176   3.352
   75   2HD   PRO  11          2HD       PRO  11  16.398  -8.639   1.760
   76    H    GLN  12           H        GLN  12  14.558  -3.381   1.851
   77    HA   GLN  12           HA       GLN  12  14.889  -2.786   4.715
   78   1HB   GLN  12          1HB       GLN  12  16.037  -1.426   2.345
   79   2HB   GLN  12          2HB       GLN  12  15.426  -0.385   3.624
   80   1HG   GLN  12          1HG       GLN  12  16.872  -1.514   5.236
   81   2HG   GLN  12          2HG       GLN  12  17.485  -2.556   3.953
   82   1HE2  GLN  12          1HE2      GLN  12  17.070   0.880   4.721
   83   2HE2  GLN  12          2HE2      GLN  12  18.573   1.391   4.040
   84    HA   PRO  13           HA       PRO  13  10.898  -0.969   4.682
   85   1HB   PRO  13          1HB       PRO  13  11.217   1.185   6.302
   86   2HB   PRO  13          2HB       PRO  13  11.205  -0.477   6.905
   87   1HG   PRO  13          1HG       PRO  13  13.535   1.310   6.321
   88   2HG   PRO  13          2HG       PRO  13  13.273   0.229   7.702
   89   1HD   PRO  13          1HD       PRO  13  14.855  -0.440   5.609
   90   2HD   PRO  13          2HD       PRO  13  13.920  -1.642   6.522
   91    H    HIS  14           H        HIS  14   9.645   0.577   3.678
   92    HA   HIS  14           HA       HIS  14  11.008   2.872   2.461
   93   1HB   HIS  14          1HB       HIS  14   9.268   0.872   1.010
   94   2HB   HIS  14          2HB       HIS  14   9.705   2.444   0.348
   95    HD1  HIS  14           1HD      HIS  14  11.135  -0.921   1.151
   96    HD2  HIS  14           2HD      HIS  14  12.322   2.655  -0.600
   97    HE1  HIS  14           1HE      HIS  14  13.341  -1.412   0.048
   98    H    LYS  15           H        LYS  15   9.190   4.242   1.271
   99    HA   LYS  15           HA       LYS  15   7.093   4.655   3.286
  100   1HB   LYS  15          1HB       LYS  15   6.901   6.931   2.203
  101   2HB   LYS  15          2HB       LYS  15   8.420   6.610   3.029
  102   1HG   LYS  15          1HG       LYS  15   8.626   5.817   0.285
  103   2HG   LYS  15          2HG       LYS  15   8.044   7.480   0.393
  104   1HD   LYS  15          1HD       LYS  15  10.352   6.622   2.081
  105   2HD   LYS  15          2HD       LYS  15  10.613   6.970   0.371
  106   1HE   LYS  15          1HE       LYS  15  10.831   9.103   0.993
  107   2HE   LYS  15          2HE       LYS  15   9.083   9.096   1.215
  108   1HZ   LYS  15          1HZ       LYS  15   9.956   9.899   3.211
  109   2HZ   LYS  15          2HZ       LYS  15  11.189   8.742   3.261
  110   3HZ   LYS  15          3HZ       LYS  15   9.586   8.283   3.547
  111    H    ARG  16           H        ARG  16   7.184   2.795   0.841
  112    HA   ARG  16           HA       ARG  16   4.501   3.494  -0.100
  113   1HB   ARG  16          1HB       ARG  16   6.684   2.600  -1.986
  114   2HB   ARG  16          2HB       ARG  16   5.049   3.094  -2.405
  115   1HG   ARG  16          1HG       ARG  16   5.732   5.350  -1.315
  116   2HG   ARG  16          2HG       ARG  16   7.377   4.765  -1.577
  117   1HD   ARG  16          1HD       ARG  16   6.521   4.286  -3.992
  118   2HD   ARG  16          2HD       ARG  16   5.262   5.448  -3.576
  119    HE   ARG  16           HE       ARG  16   6.800   7.110  -3.826
  120   1HH1  ARG  16          1HH1      ARG  16   8.487   4.113  -3.284
  121   2HH1  ARG  16          2HH1      ARG  16  10.058   4.801  -3.531
  122   1HH2  ARG  16          1HH2      ARG  16   8.862   8.028  -4.154
  123   2HH2  ARG  16          2HH2      ARG  16  10.270   7.028  -4.025
  124    H    TRP  17           H        TRP  17   3.178   1.815   0.080
  125    HA   TRP  17           HA       TRP  17   4.144  -0.885  -0.398
  126   1HB   TRP  17          1HB       TRP  17   3.044   0.040   2.254
  127   2HB   TRP  17          2HB       TRP  17   3.031  -1.652   1.765
  128    HD1  TRP  17           HD       TRP  17   5.338   1.078   3.032
  129    HE1  TRP  17           1HE      TRP  17   7.640   0.057   3.564
  130    HE3  TRP  17           3HE      TRP  17   4.652  -3.568   1.012
  131    HZ2  TRP  17           2HZ      TRP  17   8.987  -2.394   3.178
  132    HZ3  TRP  17           3HZ      TRP  17   6.497  -5.192   1.135
  133    HH2  TRP  17           HH       TRP  17   8.619  -4.615   2.195
  134    H    VAL  18           H        VAL  18   2.621  -2.171  -1.288
  135    HA   VAL  18           HA       VAL  18  -0.083  -1.040  -1.550
  136    HB   VAL  18           HB       VAL  18  -0.330  -2.400  -3.561
  137   1HG1  VAL  18          1HG1      VAL  18   2.151  -0.696  -3.461
  138   2HG1  VAL  18          2HG1      VAL  18   1.431  -1.292  -4.958
  139   3HG1  VAL  18          3HG1      VAL  18   0.520  -0.201  -3.913
  140   1HG2  VAL  18          1HG2      VAL  18   0.967  -4.145  -4.035
  141   2HG2  VAL  18          2HG2      VAL  18   2.430  -3.168  -3.912
  142   3HG2  VAL  18          3HG2      VAL  18   1.742  -3.910  -2.468
  143    H    PHE  19           H        PHE  19  -1.874  -2.602  -1.675
  144    HA   PHE  19           HA       PHE  19  -1.380  -5.102  -0.223
  145   1HB   PHE  19          1HB       PHE  19  -3.432  -4.667   1.148
  146   2HB   PHE  19          2HB       PHE  19  -2.092  -3.580   1.498
  147    HD1  PHE  19           1HD      PHE  19  -2.138  -1.255   0.584
  148    HD2  PHE  19           2HD      PHE  19  -5.505  -3.852   0.396
  149    HE1  PHE  19           1HE      PHE  19  -3.605   0.681   0.189
  150    HE2  PHE  19           2HE      PHE  19  -6.977  -1.921   0.000
  151    HZ   PHE  19           HZ       PHE  19  -6.028   0.349  -0.105
  152    H    THR  20           H        THR  20  -2.748  -6.785  -0.732
  153    HA   THR  20           HA       THR  20  -5.010  -6.323  -2.499
  154    HB   THR  20           HB       THR  20  -4.255  -7.871  -4.222
  155    HG1  THR  20           1HG      THR  20  -1.982  -8.516  -4.136
  156   1HG2  THR  20          1HG2      THR  20  -2.681  -6.466  -5.317
  157   2HG2  THR  20          2HG2      THR  20  -2.073  -5.838  -3.785
  158   3HG2  THR  20          3HG2      THR  20  -3.693  -5.409  -4.334
  159    H    LEU  21           H        LEU  21  -6.619  -7.676  -2.018
  160    HA   LEU  21           HA       LEU  21  -6.005 -10.306  -0.891
  161   1HB   LEU  21          1HB       LEU  21  -6.364  -8.811   1.007
  162   2HB   LEU  21          2HB       LEU  21  -7.923  -8.330   0.338
  163    HG   LEU  21           HG       LEU  21  -8.162 -11.063   0.544
  164   1HD1  LEU  21          1HD1      LEU  21  -6.808 -10.102   3.054
  165   2HD1  LEU  21          2HD1      LEU  21  -6.005 -11.062   1.813
  166   3HD1  LEU  21          3HD1      LEU  21  -7.381 -11.729   2.691
  167   1HD2  LEU  21          1HD2      LEU  21  -9.801 -10.596   2.144
  168   2HD2  LEU  21          2HD2      LEU  21  -9.710  -9.124   1.176
  169   3HD2  LEU  21          3HD2      LEU  21  -8.932  -9.190   2.758
  170    H    ASN  22           H        ASN  22  -7.370 -11.895  -1.528
  171    HA   ASN  22           HA       ASN  22  -9.310 -11.228  -3.571
  172   1HB   ASN  22          1HB       ASN  22  -7.596 -13.283  -3.373
  173   2HB   ASN  22          2HB       ASN  22  -9.006 -14.030  -2.627
  174   1HD2  ASN  22          1HD2      ASN  22  -8.278 -15.257  -4.769
  175   2HD2  ASN  22          2HD2      ASN  22  -9.251 -14.867  -6.142
  176    H    ASN  23           H        ASN  23 -11.489 -11.388  -3.422
  177    HA   ASN  23           HA       ASN  23 -13.530 -11.316  -2.407
  178   1HB   ASN  23          1HB       ASN  23 -12.287 -13.884  -1.570
  179   2HB   ASN  23          2HB       ASN  23 -13.749 -13.391  -0.721
  180   1HD2  ASN  23          1HD2      ASN  23 -15.677 -13.125  -1.908
  181   2HD2  ASN  23          2HD2      ASN  23 -15.899 -13.906  -3.433
  182    HA   PRO  24           HA       PRO  24 -11.712  -9.385   1.448
  183   1HB   PRO  24          1HB       PRO  24 -12.508  -6.854   0.874
  184   2HB   PRO  24          2HB       PRO  24 -10.967  -7.524   0.326
  185   1HG   PRO  24          1HG       PRO  24 -13.544  -7.233  -1.169
  186   2HG   PRO  24          2HG       PRO  24 -11.890  -6.906  -1.717
  187   1HD   PRO  24          1HD       PRO  24 -13.215  -9.179  -2.359
  188   2HD   PRO  24          2HD       PRO  24 -11.454  -9.131  -2.135
  189    H    SER  25           H        SER  25 -12.875  -8.950   3.273
  190    HA   SER  25           HA       SER  25 -15.767  -9.259   3.071
  191   1HB   SER  25          1HB       SER  25 -13.941 -10.305   4.823
  192   2HB   SER  25          2HB       SER  25 -14.590  -8.954   5.752
  193    HG   SER  25           HG       SER  25 -16.705  -9.814   5.235
  194    H    GLU  26           H        GLU  26 -17.208  -7.880   4.306
  195    HA   GLU  26           HA       GLU  26 -16.904  -5.175   3.757
  196   1HB   GLU  26          1HB       GLU  26 -18.845  -6.845   5.029
  197   2HB   GLU  26          2HB       GLU  26 -18.605  -5.413   6.019
  198   1HG   GLU  26          1HG       GLU  26 -18.955  -4.049   3.936
  199   2HG   GLU  26          2HG       GLU  26 -19.455  -5.541   3.142
  200    H    ASP  27           H        ASP  27 -15.872  -7.034   6.517
  201    HA   ASP  27           HA       ASP  27 -15.331  -4.753   8.180
  202   1HB   ASP  27          1HB       ASP  27 -14.491  -7.649   8.424
  203   2HB   ASP  27          2HB       ASP  27 -14.201  -6.418   9.650
  204    H    GLU  28           H        GLU  28 -13.438  -6.918   6.125
  205    HA   GLU  28           HA       GLU  28 -10.893  -5.936   6.793
  206   1HB   GLU  28          1HB       GLU  28 -12.002  -7.779   4.918
  207   2HB   GLU  28          2HB       GLU  28 -10.907  -6.709   4.054
  208   1HG   GLU  28          1HG       GLU  28  -9.126  -7.721   4.892
  209   2HG   GLU  28          2HG       GLU  28  -9.744  -7.591   6.538
  210    H    ARG  29           H        ARG  29 -13.081  -5.058   4.128
  211    HA   ARG  29           HA       ARG  29 -11.396  -3.039   3.071
  212   1HB   ARG  29          1HB       ARG  29 -14.381  -3.424   2.785
  213   2HB   ARG  29          2HB       ARG  29 -13.405  -2.331   1.813
  214   1HG   ARG  29          1HG       ARG  29 -12.615  -3.981   0.514
  215   2HG   ARG  29          2HG       ARG  29 -12.479  -5.116   1.858
  216   1HD   ARG  29          1HD       ARG  29 -14.143  -5.875   0.253
  217   2HD   ARG  29          2HD       ARG  29 -14.898  -5.478   1.796
  218    HE   ARG  29           HE       ARG  29 -14.917  -3.326  -0.119
  219   1HH1  ARG  29          1HH1      ARG  29 -16.585  -6.141   1.070
  220   2HH1  ARG  29          2HH1      ARG  29 -18.134  -5.631   0.485
  221   1HH2  ARG  29          1HH2      ARG  29 -16.951  -2.644  -0.894
  222   2HH2  ARG  29          2HH2      ARG  29 -18.341  -3.643  -0.633
  223    H    LYS  30           H        LYS  30 -13.993  -3.039   5.444
  224    HA   LYS  30           HA       LYS  30 -14.304  -0.243   5.654
  225   1HB   LYS  30          1HB       LYS  30 -15.994  -1.734   6.527
  226   2HB   LYS  30          2HB       LYS  30 -14.841  -2.452   7.645
  227   1HG   LYS  30          1HG       LYS  30 -15.326  -0.936   9.179
  228   2HG   LYS  30          2HG       LYS  30 -14.927   0.373   8.065
  229   1HD   LYS  30          1HD       LYS  30 -17.219   0.588   8.858
  230   2HD   LYS  30          2HD       LYS  30 -17.191   0.252   7.125
  231   1HE   LYS  30          1HE       LYS  30 -17.732  -2.062   7.518
  232   2HE   LYS  30          2HE       LYS  30 -17.604  -1.835   9.262
  233   1HZ   LYS  30          1HZ       LYS  30 -19.628  -0.603   7.472
  234   2HZ   LYS  30          2HZ       LYS  30 -19.478  -0.277   9.125
  235   3HZ   LYS  30          3HZ       LYS  30 -19.902  -1.830   8.605
  236    H    LYS  31           H        LYS  31 -12.248  -2.545   7.384
  237    HA   LYS  31           HA       LYS  31 -11.200  -0.750   9.276
  238   1HB   LYS  31          1HB       LYS  31 -10.903  -3.084   9.645
  239   2HB   LYS  31          2HB       LYS  31 -10.115  -3.300   8.087
  240   1HG   LYS  31          1HG       LYS  31  -8.206  -1.988   8.872
  241   2HG   LYS  31          2HG       LYS  31  -8.996  -1.784  10.437
  242   1HD   LYS  31          1HD       LYS  31  -8.439  -3.851  11.116
  243   2HD   LYS  31          2HD       LYS  31  -8.808  -4.568   9.546
  244   1HE   LYS  31          1HE       LYS  31  -6.469  -4.849   9.967
  245   2HE   LYS  31          2HE       LYS  31  -6.658  -3.644   8.694
  246   1HZ   LYS  31          1HZ       LYS  31  -6.253  -2.972  11.555
  247   2HZ   LYS  31          2HZ       LYS  31  -6.231  -1.905  10.243
  248   3HZ   LYS  31          3HZ       LYS  31  -5.001  -3.053  10.420
  249    H    ILE  32           H        ILE  32  -9.857  -1.837   6.160
  250    HA   ILE  32           HA       ILE  32  -7.595  -0.148   6.237
  251    HB   ILE  32           HB       ILE  32  -8.987  -1.622   4.026
  252   1HG1  ILE  32          1HG1      ILE  32  -6.170  -1.811   5.108
  253   2HG1  ILE  32          2HG1      ILE  32  -7.511  -2.802   5.671
  254   1HG2  ILE  32          1HG2      ILE  32  -8.280   0.080   2.689
  255   2HG2  ILE  32          2HG2      ILE  32  -6.982   0.549   3.785
  256   3HG2  ILE  32          3HG2      ILE  32  -6.791  -0.863   2.747
  257   1HD1  ILE  32          1HD1      ILE  32  -5.776  -3.504   3.716
  258   2HD1  ILE  32          2HD1      ILE  32  -7.402  -4.162   3.902
  259   3HD1  ILE  32          3HD1      ILE  32  -7.109  -2.838   2.773
  260    H    ARG  33           H        ARG  33 -10.822   0.239   4.849
  261    HA   ARG  33           HA       ARG  33 -10.270   2.728   3.580
  262   1HB   ARG  33          1HB       ARG  33 -12.098   1.412   2.763
  263   2HB   ARG  33          2HB       ARG  33 -12.851   1.369   4.352
  264   1HG   ARG  33          1HG       ARG  33 -13.430   3.670   4.232
  265   2HG   ARG  33          2HG       ARG  33 -12.448   3.901   2.784
  266   1HD   ARG  33          1HD       ARG  33 -14.117   3.253   1.461
  267   2HD   ARG  33          2HD       ARG  33 -14.374   1.787   2.406
  268    HE   ARG  33           HE       ARG  33 -15.519   3.724   3.917
  269   1HH1  ARG  33          1HH1      ARG  33 -15.850   2.751   0.591
  270   2HH1  ARG  33          2HH1      ARG  33 -17.509   3.236   0.478
  271   1HH2  ARG  33          1HH2      ARG  33 -17.703   4.366   3.781
  272   2HH2  ARG  33          2HH2      ARG  33 -18.562   4.155   2.293
  273    H    ASP  34           H        ASP  34 -11.002   1.802   6.804
  274    HA   ASP  34           HA       ASP  34 -11.762   4.529   7.551
  275   1HB   ASP  34          1HB       ASP  34 -13.092   2.570   8.389
  276   2HB   ASP  34          2HB       ASP  34 -11.673   2.068   9.304
  277    H    LEU  35           H        LEU  35  -8.980   3.130   6.952
  278    HA   LEU  35           HA       LEU  35  -7.452   3.418   9.307
  279   1HB   LEU  35          1HB       LEU  35  -6.829   3.243   6.395
  280   2HB   LEU  35          2HB       LEU  35  -5.554   3.692   7.525
  281    HG   LEU  35           HG       LEU  35  -7.156   1.143   7.698
  282   1HD1  LEU  35          1HD1      LEU  35  -5.081   0.066   6.873
  283   2HD1  LEU  35          2HD1      LEU  35  -4.435   1.667   6.513
  284   3HD1  LEU  35          3HD1      LEU  35  -5.871   1.085   5.671
  285   1HD2  LEU  35          1HD2      LEU  35  -6.237   1.885   9.825
  286   2HD2  LEU  35          2HD2      LEU  35  -4.641   2.053   9.094
  287   3HD2  LEU  35          3HD2      LEU  35  -5.381   0.458   9.241
  288    HA   PRO  36           HA       PRO  36  -6.688   7.724   9.654
  289   1HB   PRO  36          1HB       PRO  36  -4.066   7.799  10.356
  290   2HB   PRO  36          2HB       PRO  36  -5.338   7.245  11.451
  291   1HG   PRO  36          1HG       PRO  36  -3.451   5.638   9.772
  292   2HG   PRO  36          2HG       PRO  36  -3.960   5.372  11.450
  293   1HD   PRO  36          1HD       PRO  36  -5.015   3.993   9.372
  294   2HD   PRO  36          2HD       PRO  36  -5.953   4.398  10.824
  295    H    ILE  37           H        ILE  37  -6.664   9.044   7.948
  296    HA   ILE  37           HA       ILE  37  -5.100   8.594   5.622
  297    HB   ILE  37           HB       ILE  37  -5.865  10.902   4.967
  298   1HG1  ILE  37          1HG1      ILE  37  -7.444  10.716   7.541
  299   2HG1  ILE  37          2HG1      ILE  37  -6.052  11.766   7.298
  300   1HG2  ILE  37          1HG2      ILE  37  -8.405   9.733   5.649
  301   2HG2  ILE  37          2HG2      ILE  37  -7.616   9.863   4.078
  302   3HG2  ILE  37          3HG2      ILE  37  -7.265   8.492   5.129
  303   1HD1  ILE  37          1HD1      ILE  37  -7.610  13.286   6.784
  304   2HD1  ILE  37          2HD1      ILE  37  -7.601  12.491   5.209
  305   3HD1  ILE  37          3HD1      ILE  37  -8.825  12.066   6.405
  306    H    SER  38           H        SER  38  -4.698  10.584   8.479
  307    HA   SER  38           HA       SER  38  -2.582  12.192   7.498
  308   1HB   SER  38          1HB       SER  38  -3.240  11.440  10.357
  309   2HB   SER  38          2HB       SER  38  -2.188  12.764   9.855
  310    HG   SER  38           HG       SER  38  -4.981  12.506   9.546
  311    H    LEU  39           H        LEU  39  -2.739   8.947   8.600
  312    HA   LEU  39           HA       LEU  39  -0.016   8.685   9.418
  313   1HB   LEU  39          1HB       LEU  39  -2.214   7.177   9.766
  314   2HB   LEU  39          2HB       LEU  39  -1.465   6.308   8.428
  315    HG   LEU  39           HG       LEU  39   0.280   6.933  10.734
  316   1HD1  LEU  39          1HD1      LEU  39  -1.839   6.290  11.817
  317   2HD1  LEU  39          2HD1      LEU  39  -0.557   5.107  12.071
  318   3HD1  LEU  39          3HD1      LEU  39  -1.831   4.787  10.894
  319   1HD2  LEU  39          1HD2      LEU  39  -0.155   4.417   9.130
  320   2HD2  LEU  39          2HD2      LEU  39   1.187   4.766  10.220
  321   3HD2  LEU  39          3HD2      LEU  39   1.008   5.679   8.721
  322    H    PHE  40           H        PHE  40  -1.722   8.448   6.392
  323    HA   PHE  40           HA       PHE  40   0.824   7.795   5.060
  324   1HB   PHE  40          1HB       PHE  40  -1.854   7.093   3.886
  325   2HB   PHE  40          2HB       PHE  40  -0.270   6.440   3.482
  326    HD1  PHE  40           2HD      PHE  40  -3.036   6.351   5.884
  327    HD2  PHE  40           1HD      PHE  40   0.708   4.667   4.762
  328    HE1  PHE  40           2HE      PHE  40  -3.430   4.465   7.415
  329    HE2  PHE  40           1HE      PHE  40   0.320   2.778   6.290
  330    HZ   PHE  40           HZ       PHE  40  -1.750   2.676   7.620
  331    H    ASP  41           H        ASP  41   1.559   9.453   3.926
  332    HA   ASP  41           HA       ASP  41   0.233  11.830   3.442
  333   1HB   ASP  41          1HB       ASP  41   2.732  10.600   2.609
  334   2HB   ASP  41          2HB       ASP  41   2.054  11.619   1.342
  335    H    TYR  42           H        TYR  42   0.138   8.853   1.656
  336    HA   TYR  42           HA       TYR  42  -1.901  10.004  -0.095
  337   1HB   TYR  42          1HB       TYR  42   0.165  10.128  -1.391
  338   2HB   TYR  42          2HB       TYR  42   0.478   8.423  -1.091
  339    HD1  TYR  42           1HD      TYR  42  -2.772   9.984  -1.976
  340    HD2  TYR  42           2HD      TYR  42   0.464   7.542  -3.270
  341    HE1  TYR  42           1HE      TYR  42  -4.031   9.401  -4.007
  342    HE2  TYR  42           2HE      TYR  42  -0.786   6.954  -5.305
  343    HH   TYR  42           HH       TYR  42  -3.978   8.354  -5.970
  344    H    PHE  43           H        PHE  43  -3.643   8.755  -0.128
  345    HA   PHE  43           HA       PHE  43  -3.330   5.859   0.249
  346   1HB   PHE  43          1HB       PHE  43  -4.200   7.397   2.282
  347   2HB   PHE  43          2HB       PHE  43  -5.730   7.114   1.457
  348    HD1  PHE  43           1HD      PHE  43  -4.665   4.301   0.442
  349    HD2  PHE  43           2HD      PHE  43  -5.024   6.188   4.240
  350    HE1  PHE  43           1HE      PHE  43  -4.836   2.095   1.518
  351    HE2  PHE  43           2HE      PHE  43  -5.195   3.986   5.322
  352    HZ   PHE  43           HZ       PHE  43  -5.100   1.935   3.962
  353    H    ILE  44           H        ILE  44  -4.105   4.886  -1.492
  354    HA   ILE  44           HA       ILE  44  -6.640   5.825  -2.631
  355    HB   ILE  44           HB       ILE  44  -5.136   6.763  -4.172
  356   1HG1  ILE  44          1HG1      ILE  44  -5.411   4.214  -5.648
  357   2HG1  ILE  44          2HG1      ILE  44  -6.897   4.862  -4.963
  358   1HG2  ILE  44          1HG2      ILE  44  -3.318   5.268  -5.215
  359   2HG2  ILE  44          2HG2      ILE  44  -3.047   5.916  -3.598
  360   3HG2  ILE  44          3HG2      ILE  44  -3.562   4.242  -3.802
  361   1HD1  ILE  44          1HD1      ILE  44  -5.534   6.993  -6.226
  362   2HD1  ILE  44          2HD1      ILE  44  -5.558   5.623  -7.338
  363   3HD1  ILE  44          3HD1      ILE  44  -7.068   6.245  -6.672
  364    H    VAL  45           H        VAL  45  -8.034   4.203  -2.555
  365    HA   VAL  45           HA       VAL  45  -7.032   1.460  -2.968
  366    HB   VAL  45           HB       VAL  45  -9.529   2.049  -1.412
  367   1HG1  VAL  45          1HG1      VAL  45  -8.048  -0.278  -2.177
  368   2HG1  VAL  45          2HG1      VAL  45  -8.095  -0.157  -0.417
  369   3HG1  VAL  45          3HG1      VAL  45  -9.597  -0.169  -1.343
  370   1HG2  VAL  45          1HG2      VAL  45  -8.030   3.308  -0.150
  371   2HG2  VAL  45          2HG2      VAL  45  -7.996   1.729   0.634
  372   3HG2  VAL  45          3HG2      VAL  45  -6.692   2.201  -0.455
  373    H    GLY  46           H        GLY  46  -8.405  -0.002  -4.086
  374   1HA   GLY  46          1HA       GLY  46 -10.774   1.092  -5.392
  375   2HA   GLY  46          2HA       GLY  46  -9.441   0.635  -6.442
  376    H    GLU  47           H        GLU  47 -12.306  -0.402  -5.664
  377    HA   GLU  47           HA       GLU  47 -11.650  -3.169  -5.032
  378   1HB   GLU  47          1HB       GLU  47 -13.541  -2.275  -3.858
  379   2HB   GLU  47          2HB       GLU  47 -14.275  -1.715  -5.354
  380   1HG   GLU  47          1HG       GLU  47 -15.147  -3.723  -5.834
  381   2HG   GLU  47          2HG       GLU  47 -13.734  -4.596  -5.244
  382    H    GLU  48           H        GLU  48 -11.680  -4.815  -6.451
  383    HA   GLU  48           HA       GLU  48 -12.207  -4.149  -9.258
  384   1HB   GLU  48          1HB       GLU  48  -9.983  -5.093  -8.628
  385   2HB   GLU  48          2HB       GLU  48 -10.796  -6.568  -8.122
  386   1HG   GLU  48          1HG       GLU  48 -11.653  -6.824 -10.436
  387   2HG   GLU  48          2HG       GLU  48 -10.684  -5.428 -10.903
  388    H    GLY  49           H        GLY  49 -13.899  -4.964 -10.321
  389   1HA   GLY  49          1HA       GLY  49 -15.101  -7.477  -9.516
  390   2HA   GLY  49          2HA       GLY  49 -16.112  -6.062  -9.268
  391    H    ASN  50           H        ASN  50 -14.366  -7.921 -11.710
  392    HA   ASN  50           HA       ASN  50 -15.305  -6.558 -13.972
  393   1HB   ASN  50          1HB       ASN  50 -13.554  -8.587 -13.577
  394   2HB   ASN  50          2HB       ASN  50 -14.923  -9.479 -14.235
  395   1HD2  ASN  50          1HD2      ASN  50 -12.188  -7.763 -14.978
  396   2HD2  ASN  50          2HD2      ASN  50 -12.511  -7.439 -16.644
  397    H    GLU  51           H        GLU  51 -16.535  -8.314 -15.636
  398    HA   GLU  51           HA       GLU  51 -19.234  -8.035 -15.012
  399   1HB   GLU  51          1HB       GLU  51 -17.659  -9.325 -17.107
  400   2HB   GLU  51          2HB       GLU  51 -19.174 -10.155 -16.784
  401   1HG   GLU  51          1HG       GLU  51 -20.177  -8.683 -18.091
  402   2HG   GLU  51          2HG       GLU  51 -19.838  -7.453 -16.875
  403    H    GLU  52           H        GLU  52 -20.757 -10.067 -15.117
  404    HA   GLU  52           HA       GLU  52 -20.660 -11.350 -12.675
  405   1HB   GLU  52          1HB       GLU  52 -22.370 -11.340 -14.905
  406   2HB   GLU  52          2HB       GLU  52 -21.976 -13.029 -14.618
  407   1HG   GLU  52          1HG       GLU  52 -22.730 -12.842 -12.321
  408   2HG   GLU  52          2HG       GLU  52 -23.070 -11.128 -12.557
  409    H    GLY  53           H        GLY  53 -20.052 -13.399 -11.971
  410   1HA   GLY  53          1HA       GLY  53 -19.161 -15.591 -12.324
  411   2HA   GLY  53          2HA       GLY  53 -18.459 -15.025 -13.832
  412    H    ARG  54           H        ARG  54 -17.605 -12.527 -12.268
  413    HA   ARG  54           HA       ARG  54 -15.124 -13.717 -11.246
  414   1HB   ARG  54          1HB       ARG  54 -14.836 -12.095 -13.043
  415   2HB   ARG  54          2HB       ARG  54 -15.736 -10.892 -12.130
  416   1HG   ARG  54          1HG       ARG  54 -13.434 -10.370 -11.918
  417   2HG   ARG  54          2HG       ARG  54 -13.963 -11.030 -10.369
  418   1HD   ARG  54          1HD       ARG  54 -13.106 -13.212 -11.929
  419   2HD   ARG  54          2HD       ARG  54 -11.891 -11.949 -12.121
  420    HE   ARG  54           HE       ARG  54 -12.302 -12.014  -9.448
  421   1HH1  ARG  54          1HH1      ARG  54 -11.553 -14.453 -11.817
  422   2HH1  ARG  54          2HH1      ARG  54 -10.678 -15.451 -10.704
  423   1HH2  ARG  54          1HH2      ARG  54 -11.152 -13.320  -7.973
  424   2HH2  ARG  54          2HH2      ARG  54 -10.451 -14.806  -8.517
  425    H    THR  55           H        THR  55 -14.502 -13.493  -9.173
  426    HA   THR  55           HA       THR  55 -16.422 -12.441  -7.287
  427    HB   THR  55           HB       THR  55 -14.192 -13.117  -5.807
  428    HG1  THR  55           1HG      THR  55 -13.295 -14.906  -6.739
  429   1HG2  THR  55          1HG2      THR  55 -16.683 -13.777  -5.647
  430   2HG2  THR  55          2HG2      THR  55 -15.475 -14.914  -5.047
  431   3HG2  THR  55          3HG2      THR  55 -16.222 -15.170  -6.624
  432    HA   PRO  56           HA       PRO  56 -14.618  -8.525  -6.467
  433   1HB   PRO  56          1HB       PRO  56 -14.929  -8.307  -3.779
  434   2HB   PRO  56          2HB       PRO  56 -16.280  -8.198  -4.914
  435   1HG   PRO  56          1HG       PRO  56 -15.375 -10.526  -3.263
  436   2HG   PRO  56          2HG       PRO  56 -17.022  -9.942  -3.567
  437   1HD   PRO  56          1HD       PRO  56 -15.961 -12.058  -4.882
  438   2HD   PRO  56          2HD       PRO  56 -17.137 -10.960  -5.631
  439    H    HIS  57           H        HIS  57 -12.654  -7.646  -6.070
  440    HA   HIS  57           HA       HIS  57 -10.814  -9.019  -4.253
  441   1HB   HIS  57          1HB       HIS  57 -10.186  -9.969  -6.343
  442   2HB   HIS  57          2HB       HIS  57 -10.289  -8.413  -7.162
  443    HD1  HIS  57           1HD      HIS  57  -8.174  -7.103  -7.335
  444    HD2  HIS  57           2HD      HIS  57  -7.927 -10.125  -4.494
  445    HE1  HIS  57           1HE      HIS  57  -5.772  -7.131  -6.591
  446    H    LEU  58           H        LEU  58  -9.444  -7.685  -3.166
  447    HA   LEU  58           HA       LEU  58  -9.893  -4.821  -3.507
  448   1HB   LEU  58          1HB       LEU  58  -9.675  -6.445  -1.287
  449   2HB   LEU  58          2HB       LEU  58  -8.115  -5.626  -1.347
  450    HG   LEU  58           HG       LEU  58 -10.839  -4.352  -1.127
  451   1HD1  LEU  58          1HD1      LEU  58  -9.852  -3.467   0.986
  452   2HD1  LEU  58          2HD1      LEU  58  -8.476  -4.540   0.731
  453   3HD1  LEU  58          3HD1      LEU  58 -10.088  -5.215   0.968
  454   1HD2  LEU  58          1HD2      LEU  58  -9.529  -2.969  -2.579
  455   2HD2  LEU  58          2HD2      LEU  58  -8.126  -3.097  -1.518
  456   3HD2  LEU  58          3HD2      LEU  58  -9.560  -2.219  -0.983
  457    H    GLN  59           H        GLN  59  -8.396  -3.431  -4.236
  458    HA   GLN  59           HA       GLN  59  -5.588  -4.158  -4.282
  459   1HB   GLN  59          1HB       GLN  59  -6.171  -5.115  -6.364
  460   2HB   GLN  59          2HB       GLN  59  -7.230  -3.773  -6.775
  461   1HG   GLN  59          1HG       GLN  59  -5.207  -3.680  -8.086
  462   2HG   GLN  59          2HG       GLN  59  -5.283  -2.306  -6.983
  463   1HE2  GLN  59          1HE2      GLN  59  -3.749  -2.068  -5.433
  464   2HE2  GLN  59          2HE2      GLN  59  -2.371  -3.098  -5.277
  465    H    GLY  60           H        GLY  60  -4.685  -2.435  -3.368
  466   1HA   GLY  60          1HA       GLY  60  -5.144   0.189  -4.541
  467   2HA   GLY  60          2HA       GLY  60  -5.593   0.019  -2.851
  468    H    PHE  61           H        PHE  61  -3.786   1.883  -3.328
  469    HA   PHE  61           HA       PHE  61  -1.287   0.680  -2.356
  470   1HB   PHE  61          1HB       PHE  61  -0.730   1.204  -4.587
  471   2HB   PHE  61          2HB       PHE  61  -1.626   2.719  -4.544
  472    HD1  PHE  61           2HD      PHE  61   1.105   1.159  -2.526
  473    HD2  PHE  61           1HD      PHE  61  -0.296   4.573  -4.647
  474    HE1  PHE  61           2HE      PHE  61   3.174   2.360  -1.953
  475    HE2  PHE  61           1HE      PHE  61   1.772   5.779  -4.078
  476    HZ   PHE  61           HZ       PHE  61   3.510   4.673  -2.729
  477    H    ALA  62           H        ALA  62  -0.251   1.775  -0.741
  478    HA   ALA  62           HA       ALA  62  -1.350   4.371   0.083
  479   1HB   ALA  62          1HB       ALA  62  -2.343   3.435   1.837
  480   2HB   ALA  62          2HB       ALA  62  -1.599   1.871   1.503
  481   3HB   ALA  62          3HB       ALA  62  -0.736   3.071   2.466
  482    H    ASN  63           H        ASN  63   0.191   5.830   0.423
  483    HA   ASN  63           HA       ASN  63   2.967   4.940   0.562
  484   1HB   ASN  63          1HB       ASN  63   2.372   6.670  -1.087
  485   2HB   ASN  63          2HB       ASN  63   1.824   7.721   0.216
  486   1HD2  ASN  63          1HD2      ASN  63   4.259   7.249  -1.844
  487   2HD2  ASN  63          2HD2      ASN  63   5.577   7.892  -0.931
  488    H    PHE  64           H        PHE  64   3.821   4.623   2.501
  489    HA   PHE  64           HA       PHE  64   2.693   5.642   4.899
  490   1HB   PHE  64          1HB       PHE  64   4.799   3.808   4.151
  491   2HB   PHE  64          2HB       PHE  64   5.326   4.856   5.464
  492    HD1  PHE  64           2HD      PHE  64   3.758   5.051   7.494
  493    HD2  PHE  64           1HD      PHE  64   3.497   1.948   4.593
  494    HE1  PHE  64           2HE      PHE  64   2.522   3.658   9.101
  495    HE2  PHE  64           1HE      PHE  64   2.259   0.549   6.195
  496    HZ   PHE  64           HZ       PHE  64   1.771   1.403   8.453
  497    H    VAL  65           H        VAL  65   3.097   7.458   6.000
  498    HA   VAL  65           HA       VAL  65   4.493   9.600   4.848
  499    HB   VAL  65           HB       VAL  65   3.599   9.178   7.700
  500   1HG1  VAL  65          1HG1      VAL  65   5.052  11.415   6.407
  501   2HG1  VAL  65          2HG1      VAL  65   3.751  11.829   7.525
  502   3HG1  VAL  65          3HG1      VAL  65   5.105  10.840   8.073
  503   1HG2  VAL  65          1HG2      VAL  65   1.692  10.455   7.140
  504   2HG2  VAL  65          2HG2      VAL  65   2.387  10.957   5.598
  505   3HG2  VAL  65          3HG2      VAL  65   1.885   9.283   5.836
  506    H    LYS  66           H        LYS  66   5.545   7.017   6.892
  507    HA   LYS  66           HA       LYS  66   8.234   8.213   6.968
  508   1HB   LYS  66          1HB       LYS  66   8.535   6.968   9.158
  509   2HB   LYS  66          2HB       LYS  66   7.479   8.373   9.206
  510   1HG   LYS  66          1HG       LYS  66   6.176   5.779   8.676
  511   2HG   LYS  66          2HG       LYS  66   6.849   6.010  10.292
  512   1HD   LYS  66          1HD       LYS  66   5.236   8.227   9.159
  513   2HD   LYS  66          2HD       LYS  66   4.374   6.765   9.644
  514   1HE   LYS  66          1HE       LYS  66   6.308   7.542  11.640
  515   2HE   LYS  66          2HE       LYS  66   5.202   8.868  11.284
  516   1HZ   LYS  66          1HZ       LYS  66   3.985   7.785  12.836
  517   2HZ   LYS  66          2HZ       LYS  66   4.658   6.271  12.497
  518   3HZ   LYS  66          3HZ       LYS  66   3.462   6.909  11.486
  519    H    LYS  67           H        LYS  67   9.738   6.216   7.876
  520    HA   LYS  67           HA       LYS  67   9.609   4.288   5.715
  521   1HB   LYS  67          1HB       LYS  67  11.655   4.824   7.868
  522   2HB   LYS  67          2HB       LYS  67  11.809   3.517   6.701
  523   1HG   LYS  67          1HG       LYS  67  11.276   6.109   5.476
  524   2HG   LYS  67          2HG       LYS  67  12.780   6.054   6.397
  525   1HD   LYS  67          1HD       LYS  67  12.435   3.675   4.788
  526   2HD   LYS  67          2HD       LYS  67  12.372   5.137   3.800
  527   1HE   LYS  67          1HE       LYS  67  14.480   5.745   5.327
  528   2HE   LYS  67          2HE       LYS  67  14.608   3.987   5.368
  529   1HZ   LYS  67          1HZ       LYS  67  15.870   5.022   3.540
  530   2HZ   LYS  67          2HZ       LYS  67  14.422   5.595   2.879
  531   3HZ   LYS  67          3HZ       LYS  67  14.700   3.930   2.989
  532    H    GLN  68           H        GLN  68   8.742   2.334   5.885
  533    HA   GLN  68           HA       GLN  68   8.631   1.048   8.523
  534   1HB   GLN  68          1HB       GLN  68   6.346   1.125   6.546
  535   2HB   GLN  68          2HB       GLN  68   6.353   0.273   8.084
  536   1HG   GLN  68          1HG       GLN  68   6.410   3.244   7.636
  537   2HG   GLN  68          2HG       GLN  68   5.119   2.285   8.359
  538   1HE2  GLN  68          1HE2      GLN  68   6.557   0.672  10.055
  539   2HE2  GLN  68          2HE2      GLN  68   7.279   1.636  11.293
  540    H    THR  69           H        THR  69   8.606  -1.233   8.496
  541    HA   THR  69           HA       THR  69   9.832  -2.359   6.101
  542    HB   THR  69           HB       THR  69  10.548  -4.187   7.441
  543    HG1  THR  69           1HG      THR  69   9.480  -4.824   9.167
  544   1HG2  THR  69          1HG2      THR  69  11.817  -2.143   7.819
  545   2HG2  THR  69          2HG2      THR  69  11.719  -3.084   9.307
  546   3HG2  THR  69          3HG2      THR  69  10.697  -1.663   9.093
  547    H    PHE  70           H        PHE  70   9.213  -4.688   5.592
  548    HA   PHE  70           HA       PHE  70   6.533  -4.771   4.771
  549   1HB   PHE  70          1HB       PHE  70   7.953  -6.085   3.477
  550   2HB   PHE  70          2HB       PHE  70   8.746  -6.788   4.883
  551    HD1  PHE  70           1HD      PHE  70   5.559  -6.768   2.989
  552    HD2  PHE  70           2HD      PHE  70   8.066  -8.852   5.725
  553    HE1  PHE  70           1HE      PHE  70   4.102  -8.743   2.815
  554    HE2  PHE  70           2HE      PHE  70   6.614 -10.831   5.555
  555    HZ   PHE  70           HZ       PHE  70   4.629 -10.779   4.097
  556    H    ASN  71           H        ASN  71   8.172  -6.687   7.293
  557    HA   ASN  71           HA       ASN  71   5.868  -7.968   8.248
  558   1HB   ASN  71          1HB       ASN  71   8.597  -8.005   8.843
  559   2HB   ASN  71          2HB       ASN  71   7.822  -7.497  10.341
  560   1HD2  ASN  71          1HD2      ASN  71   7.233  -9.840   7.737
  561   2HD2  ASN  71          2HD2      ASN  71   6.852 -11.161   8.784
  562    H    LYS  72           H        LYS  72   7.405  -4.928   9.174
  563    HA   LYS  72           HA       LYS  72   5.786  -4.392  11.423
  564   1HB   LYS  72          1HB       LYS  72   7.833  -3.189  11.179
  565   2HB   LYS  72          2HB       LYS  72   7.369  -2.593   9.590
  566   1HG   LYS  72          1HG       LYS  72   7.218  -0.869  11.328
  567   2HG   LYS  72          2HG       LYS  72   5.659  -1.198  10.567
  568   1HD   LYS  72          1HD       LYS  72   5.068  -2.651  12.468
  569   2HD   LYS  72          2HD       LYS  72   6.607  -2.250  13.233
  570   1HE   LYS  72          1HE       LYS  72   4.807  -0.032  12.392
  571   2HE   LYS  72          2HE       LYS  72   4.391  -0.954  13.836
  572   1HZ   LYS  72          1HZ       LYS  72   7.099   0.165  13.482
  573   2HZ   LYS  72          2HZ       LYS  72   6.318  -0.288  14.912
  574   3HZ   LYS  72          3HZ       LYS  72   5.843   1.116  14.098
  575    H    VAL  73           H        VAL  73   5.561  -3.278   8.050
  576    HA   VAL  73           HA       VAL  73   3.308  -1.680   8.273
  577    HB   VAL  73           HB       VAL  73   4.269  -3.376   5.974
  578   1HG1  VAL  73          1HG1      VAL  73   2.738  -1.972   4.572
  579   2HG1  VAL  73          2HG1      VAL  73   1.924  -3.137   5.618
  580   3HG1  VAL  73          3HG1      VAL  73   1.972  -1.431   6.065
  581   1HG2  VAL  73          1HG2      VAL  73   5.349  -1.503   5.207
  582   2HG2  VAL  73          2HG2      VAL  73   4.244  -0.397   6.023
  583   3HG2  VAL  73          3HG2      VAL  73   5.476  -1.254   6.948
  584    H    LYS  74           H        LYS  74   3.578  -5.131   8.340
  585    HA   LYS  74           HA       LYS  74   0.939  -5.815   7.624
  586   1HB   LYS  74          1HB       LYS  74   2.830  -7.276   9.477
  587   2HB   LYS  74          2HB       LYS  74   1.400  -7.962   8.718
  588   1HG   LYS  74          1HG       LYS  74   2.756  -7.027   6.557
  589   2HG   LYS  74          2HG       LYS  74   4.077  -7.501   7.629
  590   1HD   LYS  74          1HD       LYS  74   3.764  -9.577   6.866
  591   2HD   LYS  74          2HD       LYS  74   2.292  -9.597   7.839
  592   1HE   LYS  74          1HE       LYS  74   0.971  -8.898   5.969
  593   2HE   LYS  74          2HE       LYS  74   2.411  -8.614   4.993
  594   1HZ   LYS  74          1HZ       LYS  74   2.399 -11.272   5.952
  595   2HZ   LYS  74          2HZ       LYS  74   2.397 -10.720   4.354
  596   3HZ   LYS  74          3HZ       LYS  74   0.934 -10.948   5.171
  597    H    TRP  75           H        TRP  75   2.124  -4.180  10.318
  598    HA   TRP  75           HA       TRP  75   0.313  -5.115  12.301
  599   1HB   TRP  75          1HB       TRP  75   1.141  -3.391  13.668
  600   2HB   TRP  75          2HB       TRP  75   2.503  -3.807  12.631
  601    HD1  TRP  75           HD       TRP  75   1.711  -2.117  10.061
  602    HE1  TRP  75           1HE      TRP  75   1.857   0.451  10.137
  603    HE3  TRP  75           3HE      TRP  75   1.506  -1.441  15.125
  604    HZ2  TRP  75           2HZ      TRP  75   1.883   2.494  12.085
  605    HZ3  TRP  75           3HZ      TRP  75   1.598   0.852  16.013
  606    HH2  TRP  75           HH       TRP  75   1.784   2.777  14.523
  607    H    TYR  76           H        TYR  76   0.002  -2.993   9.629
  608    HA   TYR  76           HA       TYR  76  -2.567  -1.999  10.673
  609   1HB   TYR  76          1HB       TYR  76  -0.408  -0.710   9.177
  610   2HB   TYR  76          2HB       TYR  76  -1.996  -0.446   8.464
  611    HD1  TYR  76           2HD      TYR  76  -3.668  -0.378  10.931
  612    HD2  TYR  76           1HD      TYR  76   0.112   1.384  10.088
  613    HE1  TYR  76           2HE      TYR  76  -4.124   1.380  12.589
  614    HE2  TYR  76           1HE      TYR  76  -0.334   3.147  11.744
  615    HH   TYR  76           HH       TYR  76  -3.117   3.019  13.858
  616    H    LEU  77           H        LEU  77  -0.949  -3.025   7.672
  617    HA   LEU  77           HA       LEU  77  -3.392  -3.342   6.232
  618   1HB   LEU  77          1HB       LEU  77  -0.576  -4.263   5.708
  619   2HB   LEU  77          2HB       LEU  77  -1.911  -4.570   4.598
  620    HG   LEU  77           HG       LEU  77  -1.058  -1.803   5.430
  621   1HD1  LEU  77          1HD1      LEU  77   0.424  -1.665   3.706
  622   2HD1  LEU  77          2HD1      LEU  77  -0.390  -2.908   2.756
  623   3HD1  LEU  77          3HD1      LEU  77   0.626  -3.367   4.123
  624   1HD2  LEU  77          1HD2      LEU  77  -2.810  -2.874   3.224
  625   2HD2  LEU  77          2HD2      LEU  77  -2.271  -1.198   3.342
  626   3HD2  LEU  77          3HD2      LEU  77  -3.304  -1.883   4.598
  627    H    GLY  78           H        GLY  78  -1.873  -5.189   8.601
  628   1HA   GLY  78          1HA       GLY  78  -2.404  -7.236   9.504
  629   2HA   GLY  78          2HA       GLY  78  -3.815  -7.252   8.457
  630    H    ALA  79           H        ALA  79  -2.145  -9.488   9.131
  631    HA   ALA  79           HA       ALA  79  -0.420 -10.064   6.918
  632   1HB   ALA  79          1HB       ALA  79   0.343 -11.430   8.504
  633   2HB   ALA  79          2HB       ALA  79  -1.158 -11.328   9.424
  634   3HB   ALA  79          3HB       ALA  79  -1.010 -12.487   8.103
  635    H    ARG  80           H        ARG  80  -3.785 -10.554   7.646
  636    HA   ARG  80           HA       ARG  80  -4.446 -12.649   5.965
  637   1HB   ARG  80          1HB       ARG  80  -6.115 -10.171   6.419
  638   2HB   ARG  80          2HB       ARG  80  -6.697 -11.761   5.943
  639   1HG   ARG  80          1HG       ARG  80  -5.410 -12.366   8.243
  640   2HG   ARG  80          2HG       ARG  80  -5.970 -10.728   8.590
  641   1HD   ARG  80          1HD       ARG  80  -7.765 -11.987   9.295
  642   2HD   ARG  80          2HD       ARG  80  -8.234 -11.601   7.640
  643    HE   ARG  80           HE       ARG  80  -6.817 -14.039   7.691
  644   1HH1  ARG  80          1HH1      ARG  80  -9.890 -12.662   8.577
  645   2HH1  ARG  80          2HH1      ARG  80 -10.755 -14.153   8.402
  646   1HH2  ARG  80          1HH2      ARG  80  -7.946 -16.008   7.458
  647   2HH2  ARG  80          2HH2      ARG  80  -9.649 -16.055   7.767
  648    H    CYS  81           H        CYS  81  -4.093  -9.211   5.197
  649    HA   CYS  81           HA       CYS  81  -4.627  -9.730   2.381
  650   1HB   CYS  81          1HB       CYS  81  -3.857  -7.093   3.632
  651   2HB   CYS  81          2HB       CYS  81  -4.665  -7.361   2.092
  652    HG   CYS  81           HG       CYS  81  -6.045  -7.949   5.170
  653    H    HIS  82           H        HIS  82  -3.111  -9.903   0.848
  654    HA   HIS  82           HA       HIS  82  -0.364 -10.118   1.597
  655   1HB   HIS  82          1HB       HIS  82  -1.614 -11.420  -0.238
  656   2HB   HIS  82          2HB       HIS  82  -1.370  -9.991  -1.238
  657    HD1  HIS  82           1HD      HIS  82   0.509 -12.788   0.414
  658    HD2  HIS  82           2HD      HIS  82   1.210  -9.644  -2.209
  659    HE1  HIS  82           1HE      HIS  82   2.814 -13.185  -0.510
  660    H    ILE  83           H        ILE  83   1.154  -8.597   1.613
  661    HA   ILE  83           HA       ILE  83   0.593  -6.060   0.220
  662    HB   ILE  83           HB       ILE  83   1.995  -4.939   1.880
  663   1HG1  ILE  83          1HG1      ILE  83   2.104  -7.613   3.290
  664   2HG1  ILE  83          2HG1      ILE  83   3.440  -6.910   2.385
  665   1HG2  ILE  83          1HG2      ILE  83  -0.292  -6.588   2.920
  666   2HG2  ILE  83          2HG2      ILE  83   0.500  -5.343   3.886
  667   3HG2  ILE  83          3HG2      ILE  83  -0.309  -4.910   2.379
  668   1HD1  ILE  83          1HD1      ILE  83   2.167  -5.801   4.874
  669   2HD1  ILE  83          2HD1      ILE  83   3.769  -6.524   4.726
  670   3HD1  ILE  83          3HD1      ILE  83   3.418  -4.988   3.934
  671    H    GLU  84           H        GLU  84   2.255  -5.042  -0.904
  672    HA   GLU  84           HA       GLU  84   4.852  -6.338  -1.074
  673   1HB   GLU  84          1HB       GLU  84   2.829  -6.880  -2.973
  674   2HB   GLU  84          2HB       GLU  84   3.988  -5.818  -3.761
  675   1HG   GLU  84          1HG       GLU  84   5.422  -7.812  -2.331
  676   2HG   GLU  84          2HG       GLU  84   4.175  -8.597  -3.298
  677    H    LYS  85           H        LYS  85   6.375  -5.074  -2.446
  678    HA   LYS  85           HA       LYS  85   6.124  -2.282  -1.825
  679   1HB   LYS  85          1HB       LYS  85   8.249  -3.837  -3.308
  680   2HB   LYS  85          2HB       LYS  85   8.365  -2.121  -2.940
  681   1HG   LYS  85          1HG       LYS  85   8.530  -2.510  -0.637
  682   2HG   LYS  85          2HG       LYS  85   7.955  -4.172  -0.791
  683   1HD   LYS  85          1HD       LYS  85  10.280  -3.844  -2.413
  684   2HD   LYS  85          2HD       LYS  85  10.624  -3.231  -0.794
  685   1HE   LYS  85          1HE       LYS  85  11.068  -5.387  -0.333
  686   2HE   LYS  85          2HE       LYS  85   9.316  -5.528  -0.204
  687   1HZ   LYS  85          1HZ       LYS  85   9.747  -5.857  -2.847
  688   2HZ   LYS  85          2HZ       LYS  85   9.549  -7.115  -1.735
  689   3HZ   LYS  85          3HZ       LYS  85  11.103  -6.617  -2.179
  690    H    ALA  86           H        ALA  86   5.561  -0.642  -3.129
  691    HA   ALA  86           HA       ALA  86   4.578  -1.292  -5.787
  692   1HB   ALA  86          1HB       ALA  86   4.348   1.493  -5.127
  693   2HB   ALA  86          2HB       ALA  86   3.079   0.295  -5.385
  694   3HB   ALA  86          3HB       ALA  86   3.787   0.497  -3.783
  695    H    LYS  87           H        LYS  87   5.103   0.042  -7.644
  696    HA   LYS  87           HA       LYS  87   7.703   1.394  -7.493
  697   1HB   LYS  87          1HB       LYS  87   8.573   0.240  -9.385
  698   2HB   LYS  87          2HB       LYS  87   7.972  -0.987  -8.278
  699   1HG   LYS  87          1HG       LYS  87   5.802  -0.454  -9.902
  700   2HG   LYS  87          2HG       LYS  87   7.182  -0.392 -11.001
  701   1HD   LYS  87          1HD       LYS  87   6.694  -2.649  -9.065
  702   2HD   LYS  87          2HD       LYS  87   6.124  -2.657 -10.736
  703   1HE   LYS  87          1HE       LYS  87   8.929  -1.953 -10.551
  704   2HE   LYS  87          2HE       LYS  87   8.598  -3.520  -9.815
  705   1HZ   LYS  87          1HZ       LYS  87   7.656  -2.787 -12.527
  706   2HZ   LYS  87          2HZ       LYS  87   7.689  -4.324 -11.823
  707   3HZ   LYS  87          3HZ       LYS  87   9.136  -3.556 -12.246
  708    H    GLY  88           H        GLY  88   7.969   3.106  -8.893
  709   1HA   GLY  88          1HA       GLY  88   7.316   4.240 -10.959
  710   2HA   GLY  88          2HA       GLY  88   5.668   3.722 -10.640
  711    H    THR  89           H        THR  89   5.284   6.067 -11.002
  712    HA   THR  89           HA       THR  89   5.952   7.715  -8.667
  713    HB   THR  89           HB       THR  89   5.464   9.643  -9.963
  714    HG1  THR  89           1HG      THR  89   4.192   9.612 -11.695
  715   1HG2  THR  89          1HG2      THR  89   7.105   9.542 -11.613
  716   2HG2  THR  89          2HG2      THR  89   6.720   7.872 -12.031
  717   3HG2  THR  89          3HG2      THR  89   7.562   8.233 -10.524
  718    H    ASP  90           H        ASP  90   4.135   9.386  -8.175
  719    HA   ASP  90           HA       ASP  90   1.990   8.048  -7.028
  720   1HB   ASP  90          1HB       ASP  90   2.735  10.300  -6.349
  721   2HB   ASP  90          2HB       ASP  90   2.104  10.956  -7.857
  722    H    GLN  91           H        GLN  91   2.218   9.674 -10.154
  723    HA   GLN  91           HA       GLN  91  -0.514   9.450 -10.841
  724   1HB   GLN  91          1HB       GLN  91   1.848   9.574 -12.722
  725   2HB   GLN  91          2HB       GLN  91   0.181   9.991 -13.097
  726   1HG   GLN  91          1HG       GLN  91   1.853  11.426 -11.050
  727   2HG   GLN  91          2HG       GLN  91   1.688  11.936 -12.730
  728   1HE2  GLN  91          1HE2      GLN  91  -0.727  11.992 -13.424
  729   2HE2  GLN  91          2HE2      GLN  91  -1.773  12.835 -12.338
  730    H    GLN  92           H        GLN  92   2.246   7.314 -11.246
  731    HA   GLN  92           HA       GLN  92   0.966   5.471 -12.988
  732   1HB   GLN  92          1HB       GLN  92   3.468   5.527 -11.390
  733   2HB   GLN  92          2HB       GLN  92   2.861   3.946 -11.864
  734   1HG   GLN  92          1HG       GLN  92   2.689   5.353 -14.199
  735   2HG   GLN  92          2HG       GLN  92   4.142   6.024 -13.459
  736   1HE2  GLN  92          1HE2      GLN  92   5.964   4.816 -13.361
  737   2HE2  GLN  92          2HE2      GLN  92   6.113   3.233 -14.035
  738    H    ASN  93           H        ASN  93   1.264   5.732  -9.491
  739    HA   ASN  93           HA       ASN  93   0.040   3.177  -8.991
  740   1HB   ASN  93          1HB       ASN  93   0.866   5.489  -7.251
  741   2HB   ASN  93          2HB       ASN  93  -0.070   4.148  -6.597
  742   1HD2  ASN  93          1HD2      ASN  93   2.560   4.255  -8.967
  743   2HD2  ASN  93          2HD2      ASN  93   3.612   3.191  -8.103
  744    H    LYS  94           H        LYS  94  -0.978   6.563  -8.886
  745    HA   LYS  94           HA       LYS  94  -3.551   6.149  -7.842
  746   1HB   LYS  94          1HB       LYS  94  -2.401   8.357  -8.031
  747   2HB   LYS  94          2HB       LYS  94  -2.688   8.316  -9.765
  748   1HG   LYS  94          1HG       LYS  94  -4.930   8.713  -9.547
  749   2HG   LYS  94          2HG       LYS  94  -5.009   8.010  -7.930
  750   1HD   LYS  94          1HD       LYS  94  -4.851  10.045  -7.053
  751   2HD   LYS  94          2HD       LYS  94  -3.266  10.238  -7.806
  752   1HE   LYS  94          1HE       LYS  94  -4.131  11.352  -9.641
  753   2HE   LYS  94          2HE       LYS  94  -5.745  10.679  -9.416
  754   1HZ   LYS  94          1HZ       LYS  94  -5.071  12.199  -7.154
  755   2HZ   LYS  94          2HZ       LYS  94  -6.309  12.472  -8.274
  756   3HZ   LYS  94          3HZ       LYS  94  -4.775  13.138  -8.531
  757    H    GLU  95           H        GLU  95  -2.409   6.331 -11.201
  758    HA   GLU  95           HA       GLU  95  -4.982   5.912 -12.345
  759   1HB   GLU  95          1HB       GLU  95  -2.175   5.801 -13.411
  760   2HB   GLU  95          2HB       GLU  95  -3.538   5.311 -14.408
  761   1HG   GLU  95          1HG       GLU  95  -4.264   7.777 -13.322
  762   2HG   GLU  95          2HG       GLU  95  -2.573   7.945 -13.791
  763    H    TYR  96           H        TYR  96  -2.266   3.800 -11.555
  764    HA   TYR  96           HA       TYR  96  -3.138   1.463 -12.789
  765   1HB   TYR  96          1HB       TYR  96  -0.917   1.574 -11.890
  766   2HB   TYR  96          2HB       TYR  96  -1.528   1.869 -10.266
  767    HD1  TYR  96           1HD      TYR  96  -2.533   0.042  -8.965
  768    HD2  TYR  96           2HD      TYR  96  -0.836  -0.649 -12.805
  769    HE1  TYR  96           1HE      TYR  96  -2.493  -2.374  -8.505
  770    HE2  TYR  96           2HE      TYR  96  -0.793  -3.067 -12.357
  771    HH   TYR  96           HH       TYR  96  -0.725  -4.483  -9.912
  772    H    CYS  97           H        CYS  97  -3.854   2.715  -9.551
  773    HA   CYS  97           HA       CYS  97  -5.427   0.503  -8.736
  774   1HB   CYS  97          1HB       CYS  97  -4.401   2.114  -7.158
  775   2HB   CYS  97          2HB       CYS  97  -5.512   3.354  -7.729
  776    HG   CYS  97           HG       CYS  97  -7.805   1.938  -6.846
  777    H    SER  98           H        SER  98  -6.144   3.503 -10.408
  778    HA   SER  98           HA       SER  98  -8.997   3.152 -10.253
  779   1HB   SER  98          1HB       SER  98  -9.173   5.200 -11.369
  780   2HB   SER  98          2HB       SER  98  -7.659   5.372 -10.481
  781    HG   SER  98           HG       SER  98  -7.069   5.945 -12.465
  782    H    LYS  99           H        LYS  99  -6.536   1.854 -12.149
  783    HA   LYS  99           HA       LYS  99  -7.676   1.656 -14.683
  784   1HB   LYS  99          1HB       LYS  99  -5.357   1.028 -14.206
  785   2HB   LYS  99          2HB       LYS  99  -5.912  -0.338 -13.247
  786   1HG   LYS  99          1HG       LYS  99  -7.087  -0.473 -15.848
  787   2HG   LYS  99          2HG       LYS  99  -5.340  -0.265 -15.997
  788   1HD   LYS  99          1HD       LYS  99  -6.716  -2.362 -14.317
  789   2HD   LYS  99          2HD       LYS  99  -5.993  -2.636 -15.904
  790   1HE   LYS  99          1HE       LYS  99  -3.968  -1.415 -14.492
  791   2HE   LYS  99          2HE       LYS  99  -4.739  -2.437 -13.279
  792   1HZ   LYS  99          1HZ       LYS  99  -3.646  -4.141 -14.140
  793   2HZ   LYS  99          2HZ       LYS  99  -3.024  -3.188 -15.390
  794   3HZ   LYS  99          3HZ       LYS  99  -4.515  -3.964 -15.581
  795    H    GLU 100           H        GLU 100  -8.537   0.105 -11.736
  796    HA   GLU 100           HA       GLU 100  -9.861  -2.155 -12.866
  797   1HB   GLU 100          1HB       GLU 100 -10.016  -0.834 -10.159
  798   2HB   GLU 100          2HB       GLU 100 -10.954  -2.261 -10.575
  799   1HG   GLU 100          1HG       GLU 100  -9.235  -3.588 -10.166
  800   2HG   GLU 100          2HG       GLU 100  -8.196  -2.664 -11.248
  801    H    GLY 101           H        GLY 101 -10.667   1.156 -12.512
  802   1HA   GLY 101          1HA       GLY 101 -12.490   2.254 -13.457
  803   2HA   GLY 101          2HA       GLY 101 -13.234   0.693 -13.772
  804    H    ASN 102           H        ASN 102 -12.330   0.497 -10.660
  805    HA   ASN 102           HA       ASN 102 -14.778   1.771  -9.641
  806   1HB   ASN 102          1HB       ASN 102 -14.153  -1.043  -9.727
  807   2HB   ASN 102          2HB       ASN 102 -14.313  -0.509  -8.056
  808   1HD2  ASN 102          1HD2      ASN 102 -16.284  -0.154  -7.245
  809   2HD2  ASN 102          2HD2      ASN 102 -17.754  -0.246  -8.150
  810    H    LEU 103           H        LEU 103 -14.392   3.113  -8.013
  811    HA   LEU 103           HA       LEU 103 -11.833   2.896  -6.591
  812   1HB   LEU 103          1HB       LEU 103 -13.288   5.076  -7.684
  813   2HB   LEU 103          2HB       LEU 103 -13.223   5.289  -5.936
  814    HG   LEU 103           HG       LEU 103 -11.408   6.445  -7.197
  815   1HD1  LEU 103          1HD1      LEU 103 -11.017   4.527  -4.987
  816   2HD1  LEU 103          2HD1      LEU 103 -10.740   6.268  -5.047
  817   3HD1  LEU 103          3HD1      LEU 103  -9.558   5.163  -5.748
  818   1HD2  LEU 103          1HD2      LEU 103 -11.204   3.987  -8.507
  819   2HD2  LEU 103          2HD2      LEU 103  -9.742   4.118  -7.529
  820   3HD2  LEU 103          3HD2      LEU 103 -10.145   5.386  -8.687
  821    H    LEU 104           H        LEU 104 -11.742   2.494  -4.460
  822    HA   LEU 104           HA       LEU 104 -14.291   2.123  -3.050
  823   1HB   LEU 104          1HB       LEU 104 -12.352   0.336  -3.350
  824   2HB   LEU 104          2HB       LEU 104 -11.719   1.155  -1.923
  825    HG   LEU 104           HG       LEU 104 -12.941  -0.790  -1.233
  826   1HD1  LEU 104          1HD1      LEU 104 -13.154   1.408   0.028
  827   2HD1  LEU 104          2HD1      LEU 104 -14.362   0.170   0.367
  828   3HD1  LEU 104          3HD1      LEU 104 -14.765   1.530  -0.681
  829   1HD2  LEU 104          1HD2      LEU 104 -14.509  -0.350  -3.438
  830   2HD2  LEU 104          2HD2      LEU 104 -15.586   0.081  -2.109
  831   3HD2  LEU 104          3HD2      LEU 104 -14.841  -1.518  -2.159
  832    H    MET 105           H        MET 105 -11.112   3.630  -2.773
  833    HA   MET 105           HA       MET 105 -12.213   5.532  -0.866
  834   1HB   MET 105          1HB       MET 105 -11.367   4.087   0.748
  835   2HB   MET 105          2HB       MET 105 -10.003   3.605  -0.252
  836   1HG   MET 105          1HG       MET 105  -8.721   5.326   0.423
  837   2HG   MET 105          2HG       MET 105 -10.081   6.441   0.527
  838   1HE   MET 105          1HE       MET 105  -8.545   3.203   2.688
  839   2HE   MET 105          2HE       MET 105  -7.545   4.525   2.086
  840   3HE   MET 105          3HE       MET 105  -7.914   4.413   3.807
  841    H    GLU 106           H        GLU 106 -11.372   7.540  -1.090
  842    HA   GLU 106           HA       GLU 106  -8.934   7.854  -2.698
  843   1HB   GLU 106          1HB       GLU 106 -11.406   8.312  -3.754
  844   2HB   GLU 106          2HB       GLU 106 -11.001   9.906  -3.133
  845   1HG   GLU 106          1HG       GLU 106  -8.965   9.933  -4.436
  846   2HG   GLU 106          2HG       GLU 106  -9.279   8.295  -5.003
  847    H    CYS 107           H        CYS 107  -7.557   8.680  -1.249
  848    HA   CYS 107           HA       CYS 107  -8.162  11.262  -0.086
  849   1HB   CYS 107          1HB       CYS 107  -7.887   8.769   1.533
  850   2HB   CYS 107          2HB       CYS 107  -7.196  10.256   2.171
  851    HG   CYS 107           HG       CYS 107  -9.395  11.322   2.992
  852    H    GLY 108           H        GLY 108  -6.139  11.912   1.354
  853   1HA   GLY 108          1HA       GLY 108  -3.806  12.009   1.581
  854   2HA   GLY 108          2HA       GLY 108  -3.653  10.827   0.290
  855    H    ALA 109           H        ALA 109  -1.905  12.679   0.000
  856    HA   ALA 109           HA       ALA 109  -3.043  14.704  -1.811
  857   1HB   ALA 109          1HB       ALA 109  -1.945  16.069  -0.399
  858   2HB   ALA 109          2HB       ALA 109  -0.872  14.790   0.172
  859   3HB   ALA 109          3HB       ALA 109  -0.537  15.606  -1.356
  860    HA   PRO 110           HA       PRO 110  -0.931  13.021  -5.270
  861   1HB   PRO 110          1HB       PRO 110  -0.143  15.251  -6.603
  862   2HB   PRO 110          2HB       PRO 110  -1.829  14.726  -6.522
  863   1HG   PRO 110          1HG       PRO 110  -0.418  16.823  -4.918
  864   2HG   PRO 110          2HG       PRO 110  -2.030  16.874  -5.654
  865   1HD   PRO 110          1HD       PRO 110  -1.647  16.372  -3.021
  866   2HD   PRO 110          2HD       PRO 110  -2.988  15.663  -3.942
  867    H    ARG 111           H        ARG 111   0.892  11.961  -4.607
  868    HA   ARG 111           HA       ARG 111   3.211  13.274  -3.610
  869   1HB   ARG 111          1HB       ARG 111   2.485  10.492  -4.377
  870   2HB   ARG 111          2HB       ARG 111   4.196  10.891  -4.304
  871   1HG   ARG 111          1HG       ARG 111   2.280  11.389  -2.041
  872   2HG   ARG 111          2HG       ARG 111   3.235   9.915  -2.213
  873   1HD   ARG 111          1HD       ARG 111   4.472  12.655  -2.182
  874   2HD   ARG 111          2HD       ARG 111   4.186  11.729  -0.710
  875    HE   ARG 111           HE       ARG 111   5.564   9.999  -2.263
  876   1HH1  ARG 111          1HH1      ARG 111   6.121  13.293  -1.285
  877   2HH1  ARG 111          2HH1      ARG 111   7.847  13.151  -1.326
  878   1HH2  ARG 111          1HH2      ARG 111   7.835   9.799  -2.320
  879   2HH2  ARG 111          2HH2      ARG 111   8.821  11.163  -1.916
  880    H    SER 112           H        SER 112   5.296  13.385  -4.605
  881    HA   SER 112           HA       SER 112   5.428  13.082  -7.497
  882   1HB   SER 112          1HB       SER 112   4.749  15.548  -6.480
  883   2HB   SER 112          2HB       SER 112   6.499  15.680  -6.651
  884    HG   SER 112           HG       SER 112   5.237  16.267  -8.549
  885    H    GLN 113           H        GLN 113   7.309  12.191  -8.010
  886    HA   GLN 113           HA       GLN 113   9.367  11.845  -6.065
  887   1HB   GLN 113          1HB       GLN 113   8.693  10.771  -8.654
  888   2HB   GLN 113          2HB       GLN 113  10.402  11.184  -8.596
  889   1HG   GLN 113          1HG       GLN 113   9.660   9.839  -6.184
  890   2HG   GLN 113          2HG       GLN 113   9.136   8.896  -7.578
  891   1HE2  GLN 113          1HE2      GLN 113  11.936  10.643  -6.301
  892   2HE2  GLN 113          2HE2      GLN 113  13.123   9.565  -6.944
  893    H    GLY 114           H        GLY 114   9.437  13.392  -9.286
  894   1HA   GLY 114          1HA       GLY 114  10.370  15.499  -9.776
  895   2HA   GLY 114          2HA       GLY 114  11.148  15.496  -8.199
  896    H    GLN 115           H        GLN 115  11.507  14.861 -11.525
  897    HA   GLN 115           HA       GLN 115  14.030  13.430 -11.122
  898   1HB   GLN 115          1HB       GLN 115  12.545  12.446 -12.759
  899   2HB   GLN 115          2HB       GLN 115  12.415  13.975 -13.616
  900   1HG   GLN 115          1HG       GLN 115  14.364  13.693 -14.690
  901   2HG   GLN 115          2HG       GLN 115  15.149  12.958 -13.294
  902   1HE2  GLN 115          1HE2      GLN 115  14.872  10.729 -12.921
  903   2HE2  GLN 115          2HE2      GLN 115  14.406   9.659 -14.195
  904    H    ARG 116           H        ARG 116  15.956  14.373 -11.380
  905    HA   ARG 116           HA       ARG 116  17.546  15.955 -11.754
  906   1HB   ARG 116          1HB       ARG 116  16.123  15.749 -14.111
  907   2HB   ARG 116          2HB       ARG 116  16.097  17.477 -13.787
  908   1HG   ARG 116          1HG       ARG 116  17.997  17.209 -15.077
  909   2HG   ARG 116          2HG       ARG 116  18.635  17.228 -13.431
  910   1HD   ARG 116          1HD       ARG 116  19.006  14.925 -13.421
  911   2HD   ARG 116          2HD       ARG 116  17.911  14.650 -14.775
  912    HE   ARG 116           HE       ARG 116  19.974  16.240 -15.722
  913   1HH1  ARG 116          1HH1      ARG 116  19.582  13.055 -14.372
  914   2HH1  ARG 116          2HH1      ARG 116  20.928  12.383 -15.232
  915   1HH2  ARG 116          1HH2      ARG 116  21.748  15.368 -16.859
  916   2HH2  ARG 116          2HH2      ARG 116  22.160  13.700 -16.645
  Start of MODEL   13
    1    HA   PRO   2           HA       PRO   2  30.637   4.796  19.646
    2   1HB   PRO   2          1HB       PRO   2  31.305   5.545  17.124
    3   2HB   PRO   2          2HB       PRO   2  31.478   6.614  18.521
    4   1HG   PRO   2          1HG       PRO   2  33.552   4.960  17.133
    5   2HG   PRO   2          2HG       PRO   2  33.664   6.627  17.727
    6   1HD   PRO   2          1HD       PRO   2  34.688   4.523  19.089
    7   2HD   PRO   2          2HD       PRO   2  34.036   5.960  19.902
    8    H    SER   3           H        SER   3  29.391   4.156  17.595
    9    HA   SER   3           HA       SER   3  30.167   1.417  16.830
   10   1HB   SER   3          1HB       SER   3  28.013   1.944  18.289
   11   2HB   SER   3          2HB       SER   3  27.314   2.294  16.708
   12    HG   SER   3           HG       SER   3  27.286   0.236  16.287
   13    H    LYS   4           H        LYS   4  30.512   1.065  14.743
   14    HA   LYS   4           HA       LYS   4  29.452   3.012  12.801
   15   1HB   LYS   4          1HB       LYS   4  32.111   2.305  13.299
   16   2HB   LYS   4          2HB       LYS   4  31.691   1.453  11.819
   17   1HG   LYS   4          1HG       LYS   4  30.854   4.268  11.920
   18   2HG   LYS   4          2HG       LYS   4  32.598   3.993  11.915
   19   1HD   LYS   4          1HD       LYS   4  30.999   2.427   9.979
   20   2HD   LYS   4          2HD       LYS   4  31.134   4.160   9.676
   21   1HE   LYS   4          1HE       LYS   4  33.709   3.276  10.371
   22   2HE   LYS   4          2HE       LYS   4  33.065   2.079   9.248
   23   1HZ   LYS   4          1HZ       LYS   4  33.117   3.523   7.552
   24   2HZ   LYS   4          2HZ       LYS   4  34.242   4.357   8.499
   25   3HZ   LYS   4          3HZ       LYS   4  32.620   4.838   8.492
   26    H    LYS   5           H        LYS   5  28.483   2.270  10.952
   27    HA   LYS   5           HA       LYS   5  28.164  -0.650  10.713
   28   1HB   LYS   5          1HB       LYS   5  25.862  -0.116   9.784
   29   2HB   LYS   5          2HB       LYS   5  26.077   0.126  11.513
   30   1HG   LYS   5          1HG       LYS   5  26.714   2.550  10.150
   31   2HG   LYS   5          2HG       LYS   5  25.143   1.965   9.597
   32   1HD   LYS   5          1HD       LYS   5  25.802   2.047  12.519
   33   2HD   LYS   5          2HD       LYS   5  25.254   3.500  11.680
   34   1HE   LYS   5          1HE       LYS   5  23.335   1.969  10.832
   35   2HE   LYS   5          2HE       LYS   5  23.795   0.935  12.183
   36   1HZ   LYS   5          1HZ       LYS   5  22.163   3.171  12.252
   37   2HZ   LYS   5          2HZ       LYS   5  23.588   3.616  13.047
   38   3HZ   LYS   5          3HZ       LYS   5  22.716   2.263  13.568
   39    H    ASN   6           H        ASN   6  26.965  -0.987   8.400
   40    HA   ASN   6           HA       ASN   6  28.178   0.688   6.356
   41   1HB   ASN   6          1HB       ASN   6  28.860  -2.228   6.738
   42   2HB   ASN   6          2HB       ASN   6  29.090  -1.395   5.204
   43   1HD2  ASN   6          1HD2      ASN   6  30.172  -1.734   8.474
   44   2HD2  ASN   6          2HD2      ASN   6  31.629  -0.822   8.305
   45    H    GLY   7           H        GLY   7  27.664  -0.558   4.103
   46   1HA   GLY   7          1HA       GLY   7  24.877  -0.396   3.801
   47   2HA   GLY   7          2HA       GLY   7  25.990  -1.067   2.618
   48    H    ARG   8           H        ARG   8  23.397  -2.056   3.064
   49    HA   ARG   8           HA       ARG   8  24.035  -4.731   4.114
   50   1HB   ARG   8          1HB       ARG   8  21.737  -2.949   4.731
   51   2HB   ARG   8          2HB       ARG   8  21.396  -4.665   4.555
   52   1HG   ARG   8          1HG       ARG   8  23.212  -5.090   6.241
   53   2HG   ARG   8          2HG       ARG   8  23.248  -3.348   6.520
   54   1HD   ARG   8          1HD       ARG   8  21.334  -3.376   7.695
   55   2HD   ARG   8          2HD       ARG   8  20.568  -4.525   6.598
   56    HE   ARG   8           HE       ARG   8  22.513  -5.870   8.106
   57   1HH1  ARG   8          1HH1      ARG   8  19.418  -4.327   8.502
   58   2HH1  ARG   8          2HH1      ARG   8  18.946  -5.322   9.839
   59   1HH2  ARG   8          1HH2      ARG   8  21.904  -7.186   9.866
   60   2HH2  ARG   8          2HH2      ARG   8  20.362  -6.948  10.615
   61    H    SER   9           H        SER   9  23.225  -6.472   2.983
   62    HA   SER   9           HA       SER   9  22.250  -5.848   0.293
   63   1HB   SER   9          1HB       SER   9  24.190  -7.622   1.216
   64   2HB   SER   9          2HB       SER   9  22.823  -8.656   0.801
   65    HG   SER   9           HG       SER   9  23.997  -8.388  -1.049
   66    H    GLY  10           H        GLY  10  20.753  -7.627  -0.634
   67   1HA   GLY  10          1HA       GLY  10  18.837  -8.938  -0.471
   68   2HA   GLY  10          2HA       GLY  10  18.919  -8.794   1.279
   69    HA   PRO  11           HA       PRO  11  15.378  -6.217  -0.286
   70   1HB   PRO  11          1HB       PRO  11  13.557  -7.213   1.464
   71   2HB   PRO  11          2HB       PRO  11  13.895  -7.962  -0.101
   72   1HG   PRO  11          1HG       PRO  11  14.910  -8.708   2.615
   73   2HG   PRO  11          2HG       PRO  11  14.328  -9.759   1.311
   74   1HD   PRO  11          1HD       PRO  11  16.962  -9.368   1.801
   75   2HD   PRO  11          2HD       PRO  11  16.328  -9.661   0.169
   76    H    GLN  12           H        GLN  12  14.738  -4.316   0.619
   77    HA   GLN  12           HA       GLN  12  15.280  -3.891   3.475
   78   1HB   GLN  12          1HB       GLN  12  16.424  -2.464   1.155
   79   2HB   GLN  12          2HB       GLN  12  15.850  -1.442   2.466
   80   1HG   GLN  12          1HG       GLN  12  17.314  -3.494   3.681
   81   2HG   GLN  12          2HG       GLN  12  18.254  -2.987   2.279
   82   1HE2  GLN  12          1HE2      GLN  12  17.790  -0.351   2.113
   83   2HE2  GLN  12          2HE2      GLN  12  18.352   0.463   3.529
   84    HA   PRO  13           HA       PRO  13  11.363  -1.934   3.711
   85   1HB   PRO  13          1HB       PRO  13  11.826   0.102   5.447
   86   2HB   PRO  13          2HB       PRO  13  11.772  -1.593   5.947
   87   1HG   PRO  13          1HG       PRO  13  14.146   0.141   5.382
   88   2HG   PRO  13          2HG       PRO  13  13.893  -1.014   6.703
   89   1HD   PRO  13          1HD       PRO  13  15.369  -1.607   4.512
   90   2HD   PRO  13          2HD       PRO  13  14.423  -2.829   5.385
   91    H    HIS  14           H        HIS  14  10.128  -0.245   2.906
   92    HA   HIS  14           HA       HIS  14  11.540   2.051   1.752
   93   1HB   HIS  14          1HB       HIS  14   9.617   0.250   0.269
   94   2HB   HIS  14          2HB       HIS  14  10.148   1.823  -0.320
   95    HD1  HIS  14           1HD      HIS  14  11.326  -1.687   0.196
   96    HD2  HIS  14           2HD      HIS  14  12.757   1.903  -1.331
   97    HE1  HIS  14           1HE      HIS  14  13.450  -2.271  -1.017
   98    H    LYS  15           H        LYS  15   9.726   3.566   0.736
   99    HA   LYS  15           HA       LYS  15   7.754   3.946   2.880
  100   1HB   LYS  15          1HB       LYS  15   7.615   6.292   1.929
  101   2HB   LYS  15          2HB       LYS  15   9.142   5.858   2.687
  102   1HG   LYS  15          1HG       LYS  15   9.212   5.223  -0.112
  103   2HG   LYS  15          2HG       LYS  15   8.740   6.907   0.128
  104   1HD   LYS  15          1HD       LYS  15  10.961   7.260   0.248
  105   2HD   LYS  15          2HD       LYS  15  10.775   6.686   1.906
  106   1HE   LYS  15          1HE       LYS  15  11.583   4.563   1.389
  107   2HE   LYS  15          2HE       LYS  15  11.279   4.763  -0.335
  108   1HZ   LYS  15          1HZ       LYS  15  13.245   5.756  -0.645
  109   2HZ   LYS  15          2HZ       LYS  15  13.678   5.051   0.830
  110   3HZ   LYS  15          3HZ       LYS  15  13.151   6.658   0.783
  111    H    ARG  16           H        ARG  16   7.643   2.246   0.319
  112    HA   ARG  16           HA       ARG  16   4.950   3.115  -0.434
  113   1HB   ARG  16          1HB       ARG  16   6.975   2.246  -2.496
  114   2HB   ARG  16          2HB       ARG  16   5.358   2.877  -2.780
  115   1HG   ARG  16          1HG       ARG  16   6.377   4.828  -3.121
  116   2HG   ARG  16          2HG       ARG  16   6.523   4.902  -1.363
  117   1HD   ARG  16          1HD       ARG  16   8.671   5.345  -2.376
  118   2HD   ARG  16          2HD       ARG  16   8.722   3.800  -1.529
  119    HE   ARG  16           HE       ARG  16   8.099   3.592  -4.334
  120   1HH1  ARG  16          1HH1      ARG  16  10.626   3.703  -1.942
  121   2HH1  ARG  16          2HH1      ARG  16  11.786   2.889  -2.940
  122   1HH2  ARG  16          1HH2      ARG  16   9.616   2.520  -5.658
  123   2HH2  ARG  16          2HH2      ARG  16  11.210   2.218  -5.054
  124    H    TRP  17           H        TRP  17   3.571   1.482  -0.268
  125    HA   TRP  17           HA       TRP  17   4.397  -1.218  -0.975
  126   1HB   TRP  17          1HB       TRP  17   3.484  -0.407   1.781
  127   2HB   TRP  17          2HB       TRP  17   3.319  -2.060   1.195
  128    HD1  TRP  17           HD       TRP  17   5.884   0.407   2.497
  129    HE1  TRP  17           1HE      TRP  17   8.129  -0.806   2.830
  130    HE3  TRP  17           3HE      TRP  17   4.755  -4.029   0.221
  131    HZ2  TRP  17           2HZ      TRP  17   9.271  -3.312   2.209
  132    HZ3  TRP  17           3HZ      TRP  17   6.480  -5.782   0.132
  133    HH2  TRP  17           HH       TRP  17   8.691  -5.428   1.106
  134    H    VAL  18           H        VAL  18   2.783  -2.384  -1.871
  135    HA   VAL  18           HA       VAL  18   0.119  -1.135  -1.932
  136    HB   VAL  18           HB       VAL  18  -0.272  -2.347  -4.015
  137   1HG1  VAL  18          1HG1      VAL  18   1.421  -1.186  -5.425
  138   2HG1  VAL  18          2HG1      VAL  18   0.658  -0.145  -4.221
  139   3HG1  VAL  18          3HG1      VAL  18   2.290  -0.760  -3.951
  140   1HG2  VAL  18          1HG2      VAL  18   1.809  -3.983  -3.127
  141   2HG2  VAL  18          2HG2      VAL  18   0.935  -4.104  -4.654
  142   3HG2  VAL  18          3HG2      VAL  18   2.432  -3.176  -4.566
  143    H    PHE  19           H        PHE  19  -1.737  -2.614  -2.072
  144    HA   PHE  19           HA       PHE  19  -1.280  -5.225  -0.816
  145   1HB   PHE  19          1HB       PHE  19  -3.309  -4.782   0.633
  146   2HB   PHE  19          2HB       PHE  19  -1.865  -3.865   1.051
  147    HD1  PHE  19           1HD      PHE  19  -1.708  -1.467   0.417
  148    HD2  PHE  19           2HD      PHE  19  -5.300  -3.707  -0.032
  149    HE1  PHE  19           1HE      PHE  19  -2.989   0.627   0.249
  150    HE2  PHE  19           2HE      PHE  19  -6.586  -1.616  -0.201
  151    HZ   PHE  19           HZ       PHE  19  -5.431   0.554  -0.061
  152    H    THR  20           H        THR  20  -2.751  -6.817  -1.354
  153    HA   THR  20           HA       THR  20  -5.040  -6.146  -3.020
  154    HB   THR  20           HB       THR  20  -4.435  -7.590  -4.853
  155    HG1  THR  20           1HG      THR  20  -3.042  -9.124  -4.455
  156   1HG2  THR  20          1HG2      THR  20  -2.026  -5.865  -4.299
  157   2HG2  THR  20          2HG2      THR  20  -3.586  -5.212  -4.800
  158   3HG2  THR  20          3HG2      THR  20  -2.705  -6.308  -5.864
  159    H    LEU  21           H        LEU  21  -6.712  -7.417  -2.537
  160    HA   LEU  21           HA       LEU  21  -6.228 -10.131  -1.554
  161   1HB   LEU  21          1HB       LEU  21  -6.434  -8.652   0.407
  162   2HB   LEU  21          2HB       LEU  21  -8.019  -8.139  -0.169
  163    HG   LEU  21           HG       LEU  21  -8.339 -10.841  -0.039
  164   1HD1  LEU  21          1HD1      LEU  21  -6.254 -11.338   0.965
  165   2HD1  LEU  21          2HD1      LEU  21  -7.462 -11.435   2.246
  166   3HD1  LEU  21          3HD1      LEU  21  -6.418 -10.019   2.125
  167   1HD2  LEU  21          1HD2      LEU  21  -9.892 -10.360   1.557
  168   2HD2  LEU  21          2HD2      LEU  21  -9.583  -8.728   0.963
  169   3HD2  LEU  21          3HD2      LEU  21  -8.811  -9.287   2.447
  170    H    ASN  22           H        ASN  22  -7.710 -11.600  -2.215
  171    HA   ASN  22           HA       ASN  22  -9.698 -10.697  -4.125
  172   1HB   ASN  22          1HB       ASN  22 -10.035 -13.176  -4.479
  173   2HB   ASN  22          2HB       ASN  22  -8.411 -12.587  -4.821
  174   1HD2  ASN  22          1HD2      ASN  22 -10.273 -14.797  -3.095
  175   2HD2  ASN  22          2HD2      ASN  22  -9.027 -15.441  -2.087
  176    H    ASN  23           H        ASN  23 -11.853 -10.679  -3.828
  177    HA   ASN  23           HA       ASN  23 -13.831 -10.606  -2.700
  178   1HB   ASN  23          1HB       ASN  23 -13.773 -12.995  -3.172
  179   2HB   ASN  23          2HB       ASN  23 -12.812 -13.283  -1.723
  180   1HD2  ASN  23          1HD2      ASN  23 -15.642 -11.223  -2.226
  181   2HD2  ASN  23          2HD2      ASN  23 -16.640 -12.011  -1.057
  182    HA   PRO  24           HA       PRO  24 -11.705  -9.212   1.221
  183   1HB   PRO  24          1HB       PRO  24 -12.413  -6.601   0.981
  184   2HB   PRO  24          2HB       PRO  24 -10.942  -7.268   0.262
  185   1HG   PRO  24          1HG       PRO  24 -13.590  -6.706  -1.017
  186   2HG   PRO  24          2HG       PRO  24 -11.958  -6.387  -1.635
  187   1HD   PRO  24          1HD       PRO  24 -13.428  -8.517  -2.432
  188   2HD   PRO  24          2HD       PRO  24 -11.657  -8.567  -2.322
  189    H    SER  25           H        SER  25 -12.723  -8.848   3.162
  190    HA   SER  25           HA       SER  25 -15.628  -9.085   3.134
  191   1HB   SER  25          1HB       SER  25 -13.469  -9.780   5.008
  192   2HB   SER  25          2HB       SER  25 -14.914  -9.126   5.779
  193    HG   SER  25           HG       SER  25 -14.518 -11.555   4.644
  194    H    GLU  26           H        GLU  26 -16.953  -7.771   4.555
  195    HA   GLU  26           HA       GLU  26 -16.533  -5.024   4.210
  196   1HB   GLU  26          1HB       GLU  26 -18.474  -4.707   5.643
  197   2HB   GLU  26          2HB       GLU  26 -18.755  -6.033   4.524
  198   1HG   GLU  26          1HG       GLU  26 -18.261  -7.639   6.288
  199   2HG   GLU  26          2HG       GLU  26 -17.957  -6.317   7.412
  200    H    ASP  27           H        ASP  27 -15.637  -7.191   6.784
  201    HA   ASP  27           HA       ASP  27 -15.044  -5.132   8.691
  202   1HB   ASP  27          1HB       ASP  27 -15.562  -7.706   9.029
  203   2HB   ASP  27          2HB       ASP  27 -13.813  -7.847   8.874
  204    H    GLU  28           H        GLU  28 -13.083  -7.253   6.615
  205    HA   GLU  28           HA       GLU  28 -10.586  -6.192   7.370
  206   1HB   GLU  28          1HB       GLU  28 -11.476  -8.238   5.715
  207   2HB   GLU  28          2HB       GLU  28 -10.679  -7.124   4.613
  208   1HG   GLU  28          1HG       GLU  28  -9.097  -8.758   5.352
  209   2HG   GLU  28          2HG       GLU  28  -8.672  -7.195   6.047
  210    H    ARG  29           H        ARG  29 -12.674  -5.482   4.579
  211    HA   ARG  29           HA       ARG  29 -11.035  -3.540   3.403
  212   1HB   ARG  29          1HB       ARG  29 -12.887  -4.528   2.191
  213   2HB   ARG  29          2HB       ARG  29 -14.040  -3.849   3.333
  214   1HG   ARG  29          1HG       ARG  29 -12.574  -1.672   2.381
  215   2HG   ARG  29          2HG       ARG  29 -12.900  -2.680   0.970
  216   1HD   ARG  29          1HD       ARG  29 -15.168  -2.295   2.807
  217   2HD   ARG  29          2HD       ARG  29 -14.621  -0.845   1.965
  218    HE   ARG  29           HE       ARG  29 -14.993  -3.130   0.253
  219   1HH1  ARG  29          1HH1      ARG  29 -16.508  -0.368   1.736
  220   2HH1  ARG  29          2HH1      ARG  29 -17.771  -0.262   0.554
  221   1HH2  ARG  29          1HH2      ARG  29 -16.651  -3.001  -1.308
  222   2HH2  ARG  29          2HH2      ARG  29 -17.852  -1.761  -1.176
  223    H    LYS  30           H        LYS  30 -13.401  -3.331   5.985
  224    HA   LYS  30           HA       LYS  30 -13.523  -0.491   6.079
  225   1HB   LYS  30          1HB       LYS  30 -14.420  -2.736   7.812
  226   2HB   LYS  30          2HB       LYS  30 -14.269  -1.152   8.561
  227   1HG   LYS  30          1HG       LYS  30 -15.776  -0.220   6.862
  228   2HG   LYS  30          2HG       LYS  30 -15.953  -1.829   6.157
  229   1HD   LYS  30          1HD       LYS  30 -16.726  -2.569   8.476
  230   2HD   LYS  30          2HD       LYS  30 -16.875  -0.849   8.846
  231   1HE   LYS  30          1HE       LYS  30 -18.193  -0.942   6.501
  232   2HE   LYS  30          2HE       LYS  30 -18.516  -2.570   7.095
  233   1HZ   LYS  30          1HZ       LYS  30 -19.430  -0.004   8.121
  234   2HZ   LYS  30          2HZ       LYS  30 -19.040  -1.175   9.277
  235   3HZ   LYS  30          3HZ       LYS  30 -20.212  -1.504   8.102
  236    H    LYS  31           H        LYS  31 -11.505  -2.914   7.628
  237    HA   LYS  31           HA       LYS  31 -10.306  -1.273   9.568
  238   1HB   LYS  31          1HB       LYS  31 -10.056  -3.640   9.750
  239   2HB   LYS  31          2HB       LYS  31  -9.336  -3.752   8.149
  240   1HG   LYS  31          1HG       LYS  31  -7.800  -1.980   9.806
  241   2HG   LYS  31          2HG       LYS  31  -8.020  -3.539  10.604
  242   1HD   LYS  31          1HD       LYS  31  -7.364  -3.736   7.757
  243   2HD   LYS  31          2HD       LYS  31  -6.105  -2.977   8.734
  244   1HE   LYS  31          1HE       LYS  31  -5.885  -5.452   8.514
  245   2HE   LYS  31          2HE       LYS  31  -5.985  -4.878  10.177
  246   1HZ   LYS  31          1HZ       LYS  31  -8.391  -5.791   8.730
  247   2HZ   LYS  31          2HZ       LYS  31  -8.147  -5.663  10.398
  248   3HZ   LYS  31          3HZ       LYS  31  -7.380  -6.891   9.524
  249    H    ILE  32           H        ILE  32  -9.166  -2.177   6.315
  250    HA   ILE  32           HA       ILE  32  -6.855  -0.566   6.363
  251    HB   ILE  32           HB       ILE  32  -8.447  -1.807   4.145
  252   1HG1  ILE  32          1HG1      ILE  32  -5.584  -2.171   5.054
  253   2HG1  ILE  32          2HG1      ILE  32  -6.930  -3.190   5.550
  254   1HG2  ILE  32          1HG2      ILE  32  -6.153   0.118   3.881
  255   2HG2  ILE  32          2HG2      ILE  32  -6.580  -1.037   2.620
  256   3HG2  ILE  32          3HG2      ILE  32  -7.739   0.196   3.115
  257   1HD1  ILE  32          1HD1      ILE  32  -5.266  -3.511   3.332
  258   2HD1  ILE  32          2HD1      ILE  32  -6.715  -4.432   3.736
  259   3HD1  ILE  32          3HD1      ILE  32  -6.833  -3.015   2.693
  260    H    ARG  33           H        ARG  33 -10.150   0.043   5.237
  261    HA   ARG  33           HA       ARG  33  -9.577   2.616   4.150
  262   1HB   ARG  33          1HB       ARG  33 -11.989   0.976   4.646
  263   2HB   ARG  33          2HB       ARG  33 -12.240   2.716   4.606
  264   1HG   ARG  33          1HG       ARG  33 -10.839   2.542   2.392
  265   2HG   ARG  33          2HG       ARG  33 -11.397   0.869   2.436
  266   1HD   ARG  33          1HD       ARG  33 -13.053   3.379   2.345
  267   2HD   ARG  33          2HD       ARG  33 -12.975   2.086   1.149
  268    HE   ARG  33           HE       ARG  33 -13.869   0.803   3.339
  269   1HH1  ARG  33          1HH1      ARG  33 -14.881   3.729   1.748
  270   2HH1  ARG  33          2HH1      ARG  33 -16.542   3.562   2.212
  271   1HH2  ARG  33          1HH2      ARG  33 -16.052   0.571   3.957
  272   2HH2  ARG  33          2HH2      ARG  33 -17.207   1.766   3.470
  273    H    ASP  34           H        ASP  34 -10.169   1.427   7.315
  274    HA   ASP  34           HA       ASP  34 -10.822   4.086   8.344
  275   1HB   ASP  34          1HB       ASP  34 -10.866   1.334   9.574
  276   2HB   ASP  34          2HB       ASP  34 -11.039   2.794  10.543
  277    H    LEU  35           H        LEU  35  -8.104   2.726   7.439
  278    HA   LEU  35           HA       LEU  35  -6.428   2.835   9.721
  279   1HB   LEU  35          1HB       LEU  35  -5.987   2.789   6.769
  280   2HB   LEU  35          2HB       LEU  35  -4.636   3.153   7.840
  281    HG   LEU  35           HG       LEU  35  -6.289   0.637   8.005
  282   1HD1  LEU  35          1HD1      LEU  35  -5.122   0.733   5.869
  283   2HD1  LEU  35          2HD1      LEU  35  -4.401  -0.477   6.930
  284   3HD1  LEU  35          3HD1      LEU  35  -3.607   1.081   6.702
  285   1HD2  LEU  35          1HD2      LEU  35  -5.197   1.243  10.087
  286   2HD2  LEU  35          2HD2      LEU  35  -3.657   1.429   9.248
  287   3HD2  LEU  35          3HD2      LEU  35  -4.410  -0.162   9.368
  288    HA   PRO  36           HA       PRO  36  -5.542   7.103  10.219
  289   1HB   PRO  36          1HB       PRO  36  -2.882   7.089  10.762
  290   2HB   PRO  36          2HB       PRO  36  -4.099   6.510  11.906
  291   1HG   PRO  36          1HG       PRO  36  -2.355   4.945  10.042
  292   2HG   PRO  36          2HG       PRO  36  -2.768   4.610  11.733
  293   1HD   PRO  36          1HD       PRO  36  -3.979   3.355   9.662
  294   2HD   PRO  36          2HD       PRO  36  -4.818   3.710  11.186
  295    H    ILE  37           H        ILE  37  -5.583   8.509   8.585
  296    HA   ILE  37           HA       ILE  37  -4.195   8.138   6.140
  297    HB   ILE  37           HB       ILE  37  -4.921  10.478   5.635
  298   1HG1  ILE  37          1HG1      ILE  37  -6.162  10.288   8.389
  299   2HG1  ILE  37          2HG1      ILE  37  -4.844  11.359   7.927
  300   1HG2  ILE  37          1HG2      ILE  37  -7.466   9.520   6.464
  301   2HG2  ILE  37          2HG2      ILE  37  -6.737   9.470   4.860
  302   3HG2  ILE  37          3HG2      ILE  37  -6.477   8.140   5.987
  303   1HD1  ILE  37          1HD1      ILE  37  -7.737  11.568   7.392
  304   2HD1  ILE  37          2HD1      ILE  37  -6.547  12.824   7.734
  305   3HD1  ILE  37          3HD1      ILE  37  -6.647  12.119   6.121
  306    H    SER  38           H        SER  38  -3.542  10.008   9.043
  307    HA   SER  38           HA       SER  38  -1.440  11.583   8.020
  308   1HB   SER  38          1HB       SER  38  -2.595  10.994  10.634
  309   2HB   SER  38          2HB       SER  38  -0.847  11.216  10.708
  310    HG   SER  38           HG       SER  38  -2.414  13.038   9.257
  311    H    LEU  39           H        LEU  39  -1.610   8.275   8.956
  312    HA   LEU  39           HA       LEU  39   1.163   7.885   9.493
  313   1HB   LEU  39          1HB       LEU  39  -1.072   6.416   9.909
  314   2HB   LEU  39          2HB       LEU  39  -0.401   5.597   8.500
  315    HG   LEU  39           HG       LEU  39   1.494   6.090  10.703
  316   1HD1  LEU  39          1HD1      LEU  39   0.672   4.260  12.062
  317   2HD1  LEU  39          2HD1      LEU  39  -0.715   4.059  10.992
  318   3HD1  LEU  39          3HD1      LEU  39  -0.547   5.531  11.949
  319   1HD2  LEU  39          1HD2      LEU  39   0.818   3.683   9.015
  320   2HD2  LEU  39          2HD2      LEU  39   2.183   3.818  10.123
  321   3HD2  LEU  39          3HD2      LEU  39   2.102   4.848   8.693
  322    H    PHE  40           H        PHE  40  -0.802   7.918   6.626
  323    HA   PHE  40           HA       PHE  40   1.591   7.276   5.032
  324   1HB   PHE  40          1HB       PHE  40  -1.200   6.697   4.070
  325   2HB   PHE  40          2HB       PHE  40   0.325   6.042   3.482
  326    HD1  PHE  40           2HD      PHE  40  -2.200   5.863   6.136
  327    HD2  PHE  40           1HD      PHE  40   1.365   4.168   4.544
  328    HE1  PHE  40           2HE      PHE  40  -2.495   3.894   7.582
  329    HE2  PHE  40           1HE      PHE  40   1.076   2.196   5.986
  330    HZ   PHE  40           HZ       PHE  40  -0.856   2.057   7.509
  331    H    ASP  41           H        ASP  41   2.269   9.046   4.036
  332    HA   ASP  41           HA       ASP  41   0.902  11.435   3.767
  333   1HB   ASP  41          1HB       ASP  41   3.324  10.248   2.552
  334   2HB   ASP  41          2HB       ASP  41   2.604  11.588   1.665
  335    H    TYR  42           H        TYR  42   0.786   8.590   1.773
  336    HA   TYR  42           HA       TYR  42  -1.296   9.865   0.148
  337   1HB   TYR  42          1HB       TYR  42   0.759   9.935  -1.184
  338   2HB   TYR  42          2HB       TYR  42   0.977   8.203  -0.959
  339    HD1  TYR  42           1HD      TYR  42  -2.239   9.899  -1.656
  340    HD2  TYR  42           2HD      TYR  42   0.909   7.500  -3.217
  341    HE1  TYR  42           1HE      TYR  42  -3.574   9.474  -3.677
  342    HE2  TYR  42           2HE      TYR  42  -0.418   7.068  -5.243
  343    HH   TYR  42           HH       TYR  42  -3.576   8.598  -5.732
  344    H    PHE  43           H        PHE  43  -3.090   8.693   0.130
  345    HA   PHE  43           HA       PHE  43  -2.892   5.775   0.405
  346   1HB   PHE  43          1HB       PHE  43  -3.633   7.277   2.513
  347   2HB   PHE  43          2HB       PHE  43  -5.198   7.093   1.727
  348    HD1  PHE  43           1HD      PHE  43  -4.229   4.268   0.590
  349    HD2  PHE  43           2HD      PHE  43  -4.521   6.043   4.448
  350    HE1  PHE  43           1HE      PHE  43  -4.471   2.035   1.595
  351    HE2  PHE  43           2HE      PHE  43  -4.763   3.813   5.459
  352    HZ   PHE  43           HZ       PHE  43  -4.737   1.805   4.033
  353    H    ILE  44           H        ILE  44  -3.747   4.907  -1.355
  354    HA   ILE  44           HA       ILE  44  -6.285   5.971  -2.370
  355    HB   ILE  44           HB       ILE  44  -4.800   6.942  -3.911
  356   1HG1  ILE  44          1HG1      ILE  44  -5.212   4.475  -5.495
  357   2HG1  ILE  44          2HG1      ILE  44  -6.650   5.147  -4.735
  358   1HG2  ILE  44          1HG2      ILE  44  -3.068   5.443  -5.090
  359   2HG2  ILE  44          2HG2      ILE  44  -2.721   6.005  -3.456
  360   3HG2  ILE  44          3HG2      ILE  44  -3.297   4.359  -3.719
  361   1HD1  ILE  44          1HD1      ILE  44  -4.815   6.844  -6.382
  362   2HD1  ILE  44          2HD1      ILE  44  -6.098   5.878  -7.112
  363   3HD1  ILE  44          3HD1      ILE  44  -6.497   7.134  -5.941
  364    H    VAL  45           H        VAL  45  -7.721   4.385  -2.334
  365    HA   VAL  45           HA       VAL  45  -6.823   1.651  -2.976
  366    HB   VAL  45           HB       VAL  45  -9.161   2.123  -1.167
  367   1HG1  VAL  45          1HG1      VAL  45  -9.138  -0.102  -1.505
  368   2HG1  VAL  45          2HG1      VAL  45  -7.442  -0.116  -1.993
  369   3HG1  VAL  45          3HG1      VAL  45  -7.868  -0.082  -0.282
  370   1HG2  VAL  45          1HG2      VAL  45  -7.614   3.354   0.051
  371   2HG2  VAL  45          2HG2      VAL  45  -7.438   1.732   0.723
  372   3HG2  VAL  45          3HG2      VAL  45  -6.262   2.335  -0.445
  373    H    GLY  46           H        GLY  46  -7.980   0.556  -4.466
  374   1HA   GLY  46          1HA       GLY  46 -10.537   1.739  -5.348
  375   2HA   GLY  46          2HA       GLY  46  -9.311   1.249  -6.508
  376    H    GLU  47           H        GLU  47 -12.159   0.356  -5.848
  377    HA   GLU  47           HA       GLU  47 -11.725  -2.445  -5.177
  378   1HB   GLU  47          1HB       GLU  47 -13.682  -0.928  -4.360
  379   2HB   GLU  47          2HB       GLU  47 -14.382  -1.277  -5.934
  380   1HG   GLU  47          1HG       GLU  47 -13.423  -3.606  -4.411
  381   2HG   GLU  47          2HG       GLU  47 -14.814  -2.758  -3.739
  382    H    GLU  48           H        GLU  48 -11.785  -4.093  -6.594
  383    HA   GLU  48           HA       GLU  48 -12.402  -3.442  -9.402
  384   1HB   GLU  48          1HB       GLU  48 -10.052  -3.871  -9.210
  385   2HB   GLU  48          2HB       GLU  48 -10.336  -5.321  -8.257
  386   1HG   GLU  48          1HG       GLU  48 -11.489  -5.197 -10.988
  387   2HG   GLU  48          2HG       GLU  48  -9.749  -5.431 -10.823
  388    H    GLY  49           H        GLY  49 -14.368  -4.236  -9.818
  389   1HA   GLY  49          1HA       GLY  49 -14.836  -7.020  -9.888
  390   2HA   GLY  49          2HA       GLY  49 -15.631  -6.337  -8.477
  391    H    ASN  50           H        ASN  50 -15.406  -6.114 -11.998
  392    HA   ASN  50           HA       ASN  50 -18.185  -5.136 -12.018
  393   1HB   ASN  50          1HB       ASN  50 -15.951  -3.783 -12.985
  394   2HB   ASN  50          2HB       ASN  50 -16.691  -4.477 -14.425
  395   1HD2  ASN  50          1HD2      ASN  50 -18.021  -3.153 -11.416
  396   2HD2  ASN  50          2HD2      ASN  50 -19.044  -1.989 -12.181
  397    H    GLU  51           H        GLU  51 -17.231  -7.877 -12.092
  398    HA   GLU  51           HA       GLU  51 -18.239  -8.634 -14.754
  399   1HB   GLU  51          1HB       GLU  51 -15.853  -9.580 -13.269
  400   2HB   GLU  51          2HB       GLU  51 -16.792 -10.807 -14.107
  401   1HG   GLU  51          1HG       GLU  51 -15.948  -8.323 -15.533
  402   2HG   GLU  51          2HG       GLU  51 -14.819  -9.659 -15.317
  403    H    GLU  52           H        GLU  52 -20.264  -9.299 -14.410
  404    HA   GLU  52           HA       GLU  52 -21.365 -10.246 -12.059
  405   1HB   GLU  52          1HB       GLU  52 -22.479  -9.565 -14.313
  406   2HB   GLU  52          2HB       GLU  52 -22.319 -11.270 -14.713
  407   1HG   GLU  52          1HG       GLU  52 -23.476 -11.601 -12.384
  408   2HG   GLU  52          2HG       GLU  52 -24.033  -9.953 -12.672
  409    H    GLY  53           H        GLY  53 -21.667 -12.235 -11.130
  410   1HA   GLY  53          1HA       GLY  53 -21.566 -14.578 -10.978
  411   2HA   GLY  53          2HA       GLY  53 -20.667 -14.615 -12.487
  412    H    ARG  54           H        ARG  54 -18.980 -12.358 -11.178
  413    HA   ARG  54           HA       ARG  54 -17.206 -14.206  -9.728
  414   1HB   ARG  54          1HB       ARG  54 -16.411 -13.130 -11.895
  415   2HB   ARG  54          2HB       ARG  54 -16.393 -11.606 -11.018
  416   1HG   ARG  54          1HG       ARG  54 -14.695 -12.357  -9.557
  417   2HG   ARG  54          2HG       ARG  54 -14.870 -14.026 -10.101
  418   1HD   ARG  54          1HD       ARG  54 -14.077 -13.368 -12.329
  419   2HD   ARG  54          2HD       ARG  54 -13.879 -11.711 -11.760
  420    HE   ARG  54           HE       ARG  54 -12.429 -13.515 -10.125
  421   1HH1  ARG  54          1HH1      ARG  54 -12.369 -11.967 -13.243
  422   2HH1  ARG  54          2HH1      ARG  54 -10.642 -12.013 -13.377
  423   1HH2  ARG  54          1HH2      ARG  54 -10.155 -13.581 -10.290
  424   2HH2  ARG  54          2HH2      ARG  54  -9.384 -12.933 -11.698
  425    H    THR  55           H        THR  55 -15.836 -13.188  -8.036
  426    HA   THR  55           HA       THR  55 -17.492 -11.437  -6.382
  427    HB   THR  55           HB       THR  55 -15.285 -12.084  -4.858
  428    HG1  THR  55           1HG      THR  55 -16.034 -14.488  -6.147
  429   1HG2  THR  55          1HG2      THR  55 -17.501 -14.030  -4.789
  430   2HG2  THR  55          2HG2      THR  55 -17.969 -12.335  -4.660
  431   3HG2  THR  55          3HG2      THR  55 -16.832 -13.026  -3.503
  432    HA   PRO  56           HA       PRO  56 -14.985  -7.859  -6.795
  433   1HB   PRO  56          1HB       PRO  56 -15.007  -6.853  -4.273
  434   2HB   PRO  56          2HB       PRO  56 -16.418  -6.810  -5.337
  435   1HG   PRO  56          1HG       PRO  56 -15.772  -8.719  -3.123
  436   2HG   PRO  56          2HG       PRO  56 -17.317  -7.943  -3.516
  437   1HD   PRO  56          1HD       PRO  56 -16.754 -10.499  -4.208
  438   2HD   PRO  56          2HD       PRO  56 -17.792  -9.449  -5.195
  439    H    HIS  57           H        HIS  57 -12.972  -6.848  -6.190
  440    HA   HIS  57           HA       HIS  57 -11.193  -8.442  -4.498
  441   1HB   HIS  57          1HB       HIS  57 -10.736  -9.302  -6.695
  442   2HB   HIS  57          2HB       HIS  57 -10.641  -7.678  -7.369
  443    HD1  HIS  57           1HD      HIS  57  -8.633 -10.275  -5.703
  444    HD2  HIS  57           2HD      HIS  57  -8.267  -6.240  -6.626
  445    HE1  HIS  57           1HE      HIS  57  -6.192  -9.739  -5.422
  446    H    LEU  58           H        LEU  58  -9.666  -7.273  -3.413
  447    HA   LEU  58           HA       LEU  58  -9.941  -4.371  -3.563
  448   1HB   LEU  58          1HB       LEU  58  -9.636  -6.195  -1.466
  449   2HB   LEU  58          2HB       LEU  58  -8.113  -5.312  -1.542
  450    HG   LEU  58           HG       LEU  58 -10.868  -4.171  -1.106
  451   1HD1  LEU  58          1HD1      LEU  58 -10.048  -5.063   0.911
  452   2HD1  LEU  58          2HD1      LEU  58  -9.710  -3.334   0.987
  453   3HD1  LEU  58          3HD1      LEU  58  -8.416  -4.469   0.604
  454   1HD2  LEU  58          1HD2      LEU  58  -9.152  -2.108  -0.711
  455   2HD2  LEU  58          2HD2      LEU  58 -10.065  -2.379  -2.196
  456   3HD2  LEU  58          3HD2      LEU  58  -8.392  -2.926  -2.076
  457    H    GLN  59           H        GLN  59  -8.392  -3.034  -4.283
  458    HA   GLN  59           HA       GLN  59  -5.638  -3.898  -4.485
  459   1HB   GLN  59          1HB       GLN  59  -6.363  -4.784  -6.561
  460   2HB   GLN  59          2HB       GLN  59  -7.341  -3.365  -6.911
  461   1HG   GLN  59          1HG       GLN  59  -5.376  -3.349  -8.289
  462   2HG   GLN  59          2HG       GLN  59  -5.287  -2.030  -7.124
  463   1HE2  GLN  59          1HE2      GLN  59  -3.797  -2.143  -5.439
  464   2HE2  GLN  59          2HE2      GLN  59  -2.458  -3.233  -5.473
  465    H    GLY  60           H        GLY  60  -4.622  -2.237  -3.573
  466   1HA   GLY  60          1HA       GLY  60  -4.994   0.428  -4.679
  467   2HA   GLY  60          2HA       GLY  60  -5.404   0.247  -2.980
  468    H    PHE  61           H        PHE  61  -3.550   2.031  -3.373
  469    HA   PHE  61           HA       PHE  61  -1.065   0.684  -2.569
  470   1HB   PHE  61          1HB       PHE  61  -0.558   1.327  -4.780
  471   2HB   PHE  61          2HB       PHE  61  -1.402   2.863  -4.618
  472    HD1  PHE  61           2HD      PHE  61   1.350   1.091  -2.817
  473    HD2  PHE  61           1HD      PHE  61  -0.029   4.689  -4.626
  474    HE1  PHE  61           2HE      PHE  61   3.475   2.191  -2.242
  475    HE2  PHE  61           1HE      PHE  61   2.094   5.794  -4.055
  476    HZ   PHE  61           HZ       PHE  61   3.849   4.545  -2.861
  477    H    ALA  62           H        ALA  62   0.078   1.653  -0.940
  478    HA   ALA  62           HA       ALA  62  -0.931   4.212   0.097
  479   1HB   ALA  62          1HB       ALA  62  -0.336   2.976   2.408
  480   2HB   ALA  62          2HB       ALA  62  -1.950   2.987   1.696
  481   3HB   ALA  62          3HB       ALA  62  -0.891   1.596   1.459
  482    H    ASN  63           H        ASN  63   0.646   5.631   0.442
  483    HA   ASN  63           HA       ASN  63   3.412   4.730   0.324
  484   1HB   ASN  63          1HB       ASN  63   2.638   6.655  -1.058
  485   2HB   ASN  63          2HB       ASN  63   2.326   7.552   0.425
  486   1HD2  ASN  63          1HD2      ASN  63   4.304   7.661  -1.952
  487   2HD2  ASN  63          2HD2      ASN  63   5.816   7.978  -1.177
  488    H    PHE  64           H        PHE  64   4.401   4.198   2.148
  489    HA   PHE  64           HA       PHE  64   3.456   5.003   4.716
  490   1HB   PHE  64          1HB       PHE  64   5.366   3.119   3.655
  491   2HB   PHE  64          2HB       PHE  64   6.074   4.010   4.999
  492    HD1  PHE  64           2HD      PHE  64   4.604   4.178   7.142
  493    HD2  PHE  64           1HD      PHE  64   4.063   1.270   4.081
  494    HE1  PHE  64           2HE      PHE  64   3.404   2.733   8.731
  495    HE2  PHE  64           1HE      PHE  64   2.861  -0.179   5.666
  496    HZ   PHE  64           HZ       PHE  64   2.532   0.551   7.995
  497    H    VAL  65           H        VAL  65   3.945   6.764   5.844
  498    HA   VAL  65           HA       VAL  65   5.509   8.852   4.817
  499    HB   VAL  65           HB       VAL  65   4.605   8.367   7.658
  500   1HG1  VAL  65          1HG1      VAL  65   6.182   9.962   8.037
  501   2HG1  VAL  65          2HG1      VAL  65   6.105  10.590   6.390
  502   3HG1  VAL  65          3HG1      VAL  65   4.849  11.010   7.555
  503   1HG2  VAL  65          1HG2      VAL  65   2.871   8.586   5.812
  504   2HG2  VAL  65          2HG2      VAL  65   2.727   9.704   7.169
  505   3HG2  VAL  65          3HG2      VAL  65   3.417  10.254   5.642
  506    H    LYS  66           H        LYS  66   6.359   6.069   6.663
  507    HA   LYS  66           HA       LYS  66   9.109   7.096   6.910
  508   1HB   LYS  66          1HB       LYS  66   7.427   5.611   8.893
  509   2HB   LYS  66          2HB       LYS  66   9.172   5.390   8.904
  510   1HG   LYS  66          1HG       LYS  66   8.922   7.082  10.426
  511   2HG   LYS  66          2HG       LYS  66   9.217   7.997   8.946
  512   1HD   LYS  66          1HD       LYS  66   7.386   9.072   9.929
  513   2HD   LYS  66          2HD       LYS  66   6.665   8.040   8.692
  514   1HE   LYS  66          1HE       LYS  66   5.335   7.288  10.322
  515   2HE   LYS  66          2HE       LYS  66   6.745   6.395  10.892
  516   1HZ   LYS  66          1HZ       LYS  66   7.106   8.843  11.975
  517   2HZ   LYS  66          2HZ       LYS  66   6.429   7.517  12.777
  518   3HZ   LYS  66          3HZ       LYS  66   5.424   8.671  12.055
  519    H    LYS  67           H        LYS  67  10.515   4.958   7.562
  520    HA   LYS  67           HA       LYS  67  10.240   3.247   5.221
  521   1HB   LYS  67          1HB       LYS  67  12.450   3.557   7.258
  522   2HB   LYS  67          2HB       LYS  67  12.501   2.408   5.927
  523   1HG   LYS  67          1HG       LYS  67  11.999   5.273   5.310
  524   2HG   LYS  67          2HG       LYS  67  13.634   4.767   5.741
  525   1HD   LYS  67          1HD       LYS  67  12.319   3.020   3.795
  526   2HD   LYS  67          2HD       LYS  67  12.563   4.673   3.227
  527   1HE   LYS  67          1HE       LYS  67  14.817   3.272   4.580
  528   2HE   LYS  67          2HE       LYS  67  14.420   2.829   2.921
  529   1HZ   LYS  67          1HZ       LYS  67  14.510   5.656   3.263
  530   2HZ   LYS  67          2HZ       LYS  67  15.349   4.682   2.165
  531   3HZ   LYS  67          3HZ       LYS  67  15.974   4.939   3.716
  532    H    GLN  68           H        GLN  68   9.322   1.313   5.315
  533    HA   GLN  68           HA       GLN  68   9.442  -0.202   7.827
  534   1HB   GLN  68          1HB       GLN  68   6.965   0.113   6.123
  535   2HB   GLN  68          2HB       GLN  68   7.107  -0.891   7.559
  536   1HG   GLN  68          1HG       GLN  68   7.905   1.604   8.427
  537   2HG   GLN  68          2HG       GLN  68   6.580   1.947   7.316
  538   1HE2  GLN  68          1HE2      GLN  68   6.591   2.349  10.140
  539   2HE2  GLN  68          2HE2      GLN  68   5.349   1.351  10.806
  540    H    THR  69           H        THR  69   9.212  -2.494   7.582
  541    HA   THR  69           HA       THR  69  10.208  -3.416   4.994
  542    HB   THR  69           HB       THR  69  11.015  -5.347   6.070
  543    HG1  THR  69           1HG      THR  69  10.171  -6.156   7.899
  544   1HG2  THR  69          1HG2      THR  69  11.242  -3.072   8.044
  545   2HG2  THR  69          2HG2      THR  69  12.304  -3.372   6.668
  546   3HG2  THR  69          3HG2      THR  69  12.269  -4.505   8.019
  547    H    PHE  70           H        PHE  70   9.455  -5.734   4.423
  548    HA   PHE  70           HA       PHE  70   6.730  -5.625   3.764
  549   1HB   PHE  70          1HB       PHE  70   7.990  -6.947   2.323
  550   2HB   PHE  70          2HB       PHE  70   8.827  -7.762   3.640
  551    HD1  PHE  70           1HD      PHE  70   5.584  -7.509   1.880
  552    HD2  PHE  70           2HD      PHE  70   8.036  -9.795   4.502
  553    HE1  PHE  70           1HE      PHE  70   4.009  -9.392   1.705
  554    HE2  PHE  70           2HE      PHE  70   6.467 -11.682   4.331
  555    HZ   PHE  70           HZ       PHE  70   4.451 -11.482   2.931
  556    H    ASN  71           H        ASN  71   8.409  -7.729   6.102
  557    HA   ASN  71           HA       ASN  71   6.099  -8.946   7.130
  558   1HB   ASN  71          1HB       ASN  71   8.589  -9.594   7.430
  559   2HB   ASN  71          2HB       ASN  71   8.562  -8.473   8.789
  560   1HD2  ASN  71          1HD2      ASN  71   9.100 -11.175   9.075
  561   2HD2  ASN  71          2HD2      ASN  71   7.816 -11.910   9.967
  562    H    LYS  72           H        LYS  72   7.859  -6.048   8.126
  563    HA   LYS  72           HA       LYS  72   6.381  -5.537  10.474
  564   1HB   LYS  72          1HB       LYS  72   8.612  -4.482   9.482
  565   2HB   LYS  72          2HB       LYS  72   7.486  -3.270   8.885
  566   1HG   LYS  72          1HG       LYS  72   7.899  -4.074  11.757
  567   2HG   LYS  72          2HG       LYS  72   8.412  -2.567  10.995
  568   1HD   LYS  72          1HD       LYS  72   6.003  -2.099  10.497
  569   2HD   LYS  72          2HD       LYS  72   5.588  -3.510  11.473
  570   1HE   LYS  72          1HE       LYS  72   6.973  -0.991  12.374
  571   2HE   LYS  72          2HE       LYS  72   5.378  -1.570  12.852
  572   1HZ   LYS  72          1HZ       LYS  72   6.933  -2.037  14.589
  573   2HZ   LYS  72          2HZ       LYS  72   7.990  -2.811  13.520
  574   3HZ   LYS  72          3HZ       LYS  72   6.489  -3.505  13.874
  575    H    VAL  73           H        VAL  73   6.058  -4.244   7.174
  576    HA   VAL  73           HA       VAL  73   3.922  -2.530   7.585
  577    HB   VAL  73           HB       VAL  73   4.672  -4.168   5.171
  578   1HG1  VAL  73          1HG1      VAL  73   2.328  -3.811   4.943
  579   2HG1  VAL  73          2HG1      VAL  73   2.473  -2.130   5.460
  580   3HG1  VAL  73          3HG1      VAL  73   3.141  -2.637   3.908
  581   1HG2  VAL  73          1HG2      VAL  73   4.789  -1.194   5.356
  582   2HG2  VAL  73          2HG2      VAL  73   6.031  -2.153   6.161
  583   3HG2  VAL  73          3HG2      VAL  73   5.791  -2.305   4.421
  584    H    LYS  74           H        LYS  74   3.978  -5.993   7.469
  585    HA   LYS  74           HA       LYS  74   1.262  -6.471   6.883
  586   1HB   LYS  74          1HB       LYS  74   3.154  -8.156   8.534
  587   2HB   LYS  74          2HB       LYS  74   1.646  -8.703   7.813
  588   1HG   LYS  74          1HG       LYS  74   3.000  -7.681   5.660
  589   2HG   LYS  74          2HG       LYS  74   4.289  -8.401   6.629
  590   1HD   LYS  74          1HD       LYS  74   3.716 -10.372   5.764
  591   2HD   LYS  74          2HD       LYS  74   2.216 -10.265   6.689
  592   1HE   LYS  74          1HE       LYS  74   1.040  -9.348   4.859
  593   2HE   LYS  74          2HE       LYS  74   2.527  -9.011   3.973
  594   1HZ   LYS  74          1HZ       LYS  74   2.542 -11.051   3.123
  595   2HZ   LYS  74          2HZ       LYS  74   0.952 -11.211   3.676
  596   3HZ   LYS  74          3HZ       LYS  74   2.236 -11.785   4.616
  597    H    TRP  75           H        TRP  75   2.706  -5.064   9.576
  598    HA   TRP  75           HA       TRP  75   0.971  -6.005  11.622
  599   1HB   TRP  75          1HB       TRP  75   1.985  -4.411  13.020
  600   2HB   TRP  75          2HB       TRP  75   3.251  -4.839  11.872
  601    HD1  TRP  75           HD       TRP  75   2.396  -2.965   9.457
  602    HE1  TRP  75           1HE      TRP  75   2.694  -0.416   9.660
  603    HE3  TRP  75           3HE      TRP  75   2.551  -2.570  14.551
  604    HZ2  TRP  75           2HZ      TRP  75   2.959   1.507  11.709
  605    HZ3  TRP  75           3HZ      TRP  75   2.829  -0.340  15.554
  606    HH2  TRP  75           HH       TRP  75   3.030   1.654  14.160
  607    H    TYR  76           H        TYR  76   0.617  -3.728   9.088
  608    HA   TYR  76           HA       TYR  76  -1.816  -2.647  10.351
  609   1HB   TYR  76          1HB       TYR  76   0.314  -1.406   8.777
  610   2HB   TYR  76          2HB       TYR  76  -1.297  -1.017   8.184
  611    HD1  TYR  76           2HD      TYR  76  -2.801  -0.981  10.757
  612    HD2  TYR  76           1HD      TYR  76   1.015   0.606   9.749
  613    HE1  TYR  76           2HE      TYR  76  -3.045   0.712  12.524
  614    HE2  TYR  76           1HE      TYR  76   0.783   2.303  11.514
  615    HH   TYR  76           HH       TYR  76  -0.437   2.676  13.560
  616    H    LEU  77           H        LEU  77  -0.463  -3.599   7.198
  617    HA   LEU  77           HA       LEU  77  -2.987  -3.682   5.891
  618   1HB   LEU  77          1HB       LEU  77  -0.297  -4.836   5.193
  619   2HB   LEU  77          2HB       LEU  77  -1.706  -4.969   4.142
  620    HG   LEU  77           HG       LEU  77  -0.438  -2.372   5.008
  621   1HD1  LEU  77          1HD1      LEU  77   0.554  -2.239   2.864
  622   2HD1  LEU  77          2HD1      LEU  77  -0.317  -3.662   2.294
  623   3HD1  LEU  77          3HD1      LEU  77   0.956  -3.834   3.502
  624   1HD2  LEU  77          1HD2      LEU  77  -1.865  -1.371   3.318
  625   2HD2  LEU  77          2HD2      LEU  77  -2.840  -2.221   4.518
  626   3HD2  LEU  77          3HD2      LEU  77  -2.554  -2.950   2.937
  627    H    GLY  78           H        GLY  78  -0.920  -6.128   7.399
  628   1HA   GLY  78          1HA       GLY  78  -1.784  -8.039   8.506
  629   2HA   GLY  78          2HA       GLY  78  -3.251  -7.899   7.549
  630    H    ALA  79           H        ALA  79  -1.624 -10.255   7.995
  631    HA   ALA  79           HA       ALA  79  -0.120 -10.780   5.614
  632   1HB   ALA  79          1HB       ALA  79  -0.832 -12.250   8.065
  633   2HB   ALA  79          2HB       ALA  79  -0.555 -13.238   6.630
  634   3HB   ALA  79          3HB       ALA  79   0.705 -12.146   7.206
  635    H    ARG  80           H        ARG  80  -3.430 -11.144   6.593
  636    HA   ARG  80           HA       ARG  80  -4.342 -13.139   4.915
  637   1HB   ARG  80          1HB       ARG  80  -5.782 -10.572   5.611
  638   2HB   ARG  80          2HB       ARG  80  -6.533 -12.055   5.037
  639   1HG   ARG  80          1HG       ARG  80  -4.879 -12.118   7.516
  640   2HG   ARG  80          2HG       ARG  80  -6.522 -11.475   7.575
  641   1HD   ARG  80          1HD       ARG  80  -6.036 -14.100   6.248
  642   2HD   ARG  80          2HD       ARG  80  -6.050 -14.022   8.010
  643    HE   ARG  80           HE       ARG  80  -8.326 -12.730   6.910
  644   1HH1  ARG  80          1HH1      ARG  80  -6.982 -15.870   7.586
  645   2HH1  ARG  80          2HH1      ARG  80  -8.525 -16.643   7.733
  646   1HH2  ARG  80          1HH2      ARG  80 -10.364 -13.737   7.101
  647   2HH2  ARG  80          2HH2      ARG  80 -10.448 -15.429   7.456
  648    H    CYS  81           H        CYS  81  -3.685  -9.753   4.186
  649    HA   CYS  81           HA       CYS  81  -4.432 -10.204   1.387
  650   1HB   CYS  81          1HB       CYS  81  -4.382  -7.782   1.145
  651   2HB   CYS  81          2HB       CYS  81  -5.390  -8.226   2.517
  652    HG   CYS  81           HG       CYS  81  -2.410  -6.618   2.486
  653    H    HIS  82           H        HIS  82  -2.978 -10.174  -0.242
  654    HA   HIS  82           HA       HIS  82  -0.210 -10.472   0.407
  655   1HB   HIS  82          1HB       HIS  82  -1.530 -11.609  -1.494
  656   2HB   HIS  82          2HB       HIS  82  -1.289 -10.105  -2.379
  657    HD1  HIS  82           1HD      HIS  82   0.593 -13.047  -1.002
  658    HD2  HIS  82           2HD      HIS  82   1.266  -9.716  -3.392
  659    HE1  HIS  82           1HE      HIS  82   2.868 -13.396  -2.016
  660    H    ILE  83           H        ILE  83   1.323  -8.967   0.492
  661    HA   ILE  83           HA       ILE  83   0.747  -6.328  -0.688
  662    HB   ILE  83           HB       ILE  83   2.151  -5.326   1.035
  663   1HG1  ILE  83          1HG1      ILE  83   2.352  -8.129   2.158
  664   2HG1  ILE  83          2HG1      ILE  83   3.664  -7.233   1.399
  665   1HG2  ILE  83          1HG2      ILE  83   0.686  -5.740   2.980
  666   2HG2  ILE  83          2HG2      ILE  83  -0.214  -5.488   1.485
  667   3HG2  ILE  83          3HG2      ILE  83  -0.013  -7.117   2.129
  668   1HD1  ILE  83          1HD1      ILE  83   3.531  -5.561   3.185
  669   2HD1  ILE  83          2HD1      ILE  83   2.253  -6.504   3.953
  670   3HD1  ILE  83          3HD1      ILE  83   3.876  -7.177   3.801
  671    H    GLU  84           H        GLU  84   2.392  -5.243  -1.765
  672    HA   GLU  84           HA       GLU  84   4.989  -6.519  -2.045
  673   1HB   GLU  84          1HB       GLU  84   2.919  -6.845  -3.994
  674   2HB   GLU  84          2HB       GLU  84   4.199  -5.861  -4.690
  675   1HG   GLU  84          1HG       GLU  84   4.819  -8.424  -3.276
  676   2HG   GLU  84          2HG       GLU  84   4.313  -8.408  -4.964
  677    H    LYS  85           H        LYS  85   6.494  -5.166  -3.350
  678    HA   LYS  85           HA       LYS  85   6.267  -2.427  -2.535
  679   1HB   LYS  85          1HB       LYS  85   8.332  -3.995  -4.060
  680   2HB   LYS  85          2HB       LYS  85   8.456  -2.249  -3.890
  681   1HG   LYS  85          1HG       LYS  85   8.830  -2.362  -1.614
  682   2HG   LYS  85          2HG       LYS  85   8.099  -3.963  -1.471
  683   1HD   LYS  85          1HD       LYS  85  10.642  -3.476  -3.003
  684   2HD   LYS  85          2HD       LYS  85  10.630  -3.842  -1.276
  685   1HE   LYS  85          1HE       LYS  85   9.238  -5.889  -1.898
  686   2HE   LYS  85          2HE       LYS  85   9.717  -5.565  -3.563
  687   1HZ   LYS  85          1HZ       LYS  85  11.868  -5.625  -1.613
  688   2HZ   LYS  85          2HZ       LYS  85  11.814  -6.245  -3.186
  689   3HZ   LYS  85          3HZ       LYS  85  11.111  -7.108  -1.912
  690    H    ALA  86           H        ALA  86   5.664  -0.694  -3.693
  691    HA   ALA  86           HA       ALA  86   4.545  -1.135  -6.331
  692   1HB   ALA  86          1HB       ALA  86   4.406   1.601  -5.628
  693   2HB   ALA  86          2HB       ALA  86   3.108   0.407  -5.642
  694   3HB   ALA  86          3HB       ALA  86   4.056   0.661  -4.177
  695    H    LYS  87           H        LYS  87   5.023   0.283  -8.138
  696    HA   LYS  87           HA       LYS  87   7.662   1.554  -8.066
  697   1HB   LYS  87          1HB       LYS  87   8.363   0.469 -10.115
  698   2HB   LYS  87          2HB       LYS  87   7.971  -0.752  -8.911
  699   1HG   LYS  87          1HG       LYS  87   5.973  -1.335  -9.992
  700   2HG   LYS  87          2HG       LYS  87   5.991   0.122 -10.989
  701   1HD   LYS  87          1HD       LYS  87   7.950  -0.700 -12.180
  702   2HD   LYS  87          2HD       LYS  87   7.987  -2.137 -11.156
  703   1HE   LYS  87          1HE       LYS  87   5.543  -1.449 -12.745
  704   2HE   LYS  87          2HE       LYS  87   6.899  -2.283 -13.501
  705   1HZ   LYS  87          1HZ       LYS  87   5.686  -4.051 -12.787
  706   2HZ   LYS  87          2HZ       LYS  87   5.040  -3.237 -11.454
  707   3HZ   LYS  87          3HZ       LYS  87   6.629  -3.813 -11.403
  708    H    GLY  88           H        GLY  88   7.925   3.267  -9.485
  709   1HA   GLY  88          1HA       GLY  88   7.187   4.450 -11.495
  710   2HA   GLY  88          2HA       GLY  88   5.544   3.989 -11.077
  711    H    THR  89           H        THR  89   5.710   6.518 -11.566
  712    HA   THR  89           HA       THR  89   6.466   8.069  -9.246
  713    HB   THR  89           HB       THR  89   5.881  10.008 -10.493
  714    HG1  THR  89           1HG      THR  89   4.735   9.787 -12.512
  715   1HG2  THR  89          1HG2      THR  89   7.869   8.546 -11.267
  716   2HG2  THR  89          2HG2      THR  89   7.317   9.845 -12.324
  717   3HG2  THR  89          3HG2      THR  89   6.855   8.177 -12.661
  718    H    ASP  90           H        ASP  90   4.775   9.813  -8.568
  719    HA   ASP  90           HA       ASP  90   2.746   8.568  -7.145
  720   1HB   ASP  90          1HB       ASP  90   1.889  10.790  -6.676
  721   2HB   ASP  90          2HB       ASP  90   3.650  10.820  -6.638
  722    H    GLN  91           H        GLN  91   2.638  10.130 -10.311
  723    HA   GLN  91           HA       GLN  91  -0.175   9.921 -10.639
  724   1HB   GLN  91          1HB       GLN  91   2.142  10.587 -12.373
  725   2HB   GLN  91          2HB       GLN  91   0.669  10.064 -13.179
  726   1HG   GLN  91          1HG       GLN  91   0.909  12.365 -11.254
  727   2HG   GLN  91          2HG       GLN  91   0.778  12.485 -13.008
  728   1HE2  GLN  91          1HE2      GLN  91  -1.176  11.026 -13.800
  729   2HE2  GLN  91          2HE2      GLN  91  -2.665  11.370 -12.995
  730    H    GLN  92           H        GLN  92   2.539   7.833 -11.431
  731    HA   GLN  92           HA       GLN  92   1.120   6.013 -13.063
  732   1HB   GLN  92          1HB       GLN  92   3.753   6.131 -11.764
  733   2HB   GLN  92          2HB       GLN  92   3.122   4.503 -11.970
  734   1HG   GLN  92          1HG       GLN  92   2.644   5.657 -14.413
  735   2HG   GLN  92          2HG       GLN  92   4.188   6.360 -13.935
  736   1HE2  GLN  92          1HE2      GLN  92   5.987   5.080 -13.816
  737   2HE2  GLN  92          2HE2      GLN  92   6.027   3.447 -14.376
  738    H    ASN  93           H        ASN  93   1.671   6.208  -9.594
  739    HA   ASN  93           HA       ASN  93   0.524   3.644  -9.029
  740   1HB   ASN  93          1HB       ASN  93   1.349   5.992  -7.336
  741   2HB   ASN  93          2HB       ASN  93   0.495   4.620  -6.636
  742   1HD2  ASN  93          1HD2      ASN  93   2.958   4.728  -9.169
  743   2HD2  ASN  93          2HD2      ASN  93   4.106   3.740  -8.337
  744    H    LYS  94           H        LYS  94  -0.592   7.001  -8.798
  745    HA   LYS  94           HA       LYS  94  -3.113   6.466  -7.685
  746   1HB   LYS  94          1HB       LYS  94  -2.086   8.713  -7.781
  747   2HB   LYS  94          2HB       LYS  94  -2.324   8.733  -9.524
  748   1HG   LYS  94          1HG       LYS  94  -4.569   9.084  -9.357
  749   2HG   LYS  94          2HG       LYS  94  -4.694   8.266  -7.798
  750   1HD   LYS  94          1HD       LYS  94  -4.535  10.206  -6.722
  751   2HD   LYS  94          2HD       LYS  94  -3.015  10.575  -7.542
  752   1HE   LYS  94          1HE       LYS  94  -4.421  11.316  -9.514
  753   2HE   LYS  94          2HE       LYS  94  -5.816  11.210  -8.442
  754   1HZ   LYS  94          1HZ       LYS  94  -4.785  12.826  -6.983
  755   2HZ   LYS  94          2HZ       LYS  94  -4.926  13.459  -8.546
  756   3HZ   LYS  94          3HZ       LYS  94  -3.426  12.913  -7.987
  757    H    GLU  95           H        GLU  95  -2.073   6.763 -11.064
  758    HA   GLU  95           HA       GLU  95  -4.670   6.348 -12.153
  759   1HB   GLU  95          1HB       GLU  95  -2.604   7.425 -13.263
  760   2HB   GLU  95          2HB       GLU  95  -2.105   5.776 -13.613
  761   1HG   GLU  95          1HG       GLU  95  -4.802   6.024 -14.409
  762   2HG   GLU  95          2HG       GLU  95  -3.934   7.429 -15.025
  763    H    TYR  96           H        TYR  96  -1.981   4.248 -11.328
  764    HA   TYR  96           HA       TYR  96  -2.743   1.927 -12.656
  765   1HB   TYR  96          1HB       TYR  96  -0.588   2.078 -11.582
  766   2HB   TYR  96          2HB       TYR  96  -1.338   2.269 -10.001
  767    HD1  TYR  96           1HD      TYR  96  -2.437   0.344  -8.911
  768    HD2  TYR  96           2HD      TYR  96  -0.323  -0.084 -12.578
  769    HE1  TYR  96           1HE      TYR  96  -2.364  -2.092  -8.577
  770    HE2  TYR  96           2HE      TYR  96  -0.245  -2.521 -12.256
  771    HH   TYR  96           HH       TYR  96  -0.561  -4.191 -10.759
  772    H    CYS  97           H        CYS  97  -3.599   2.999  -9.374
  773    HA   CYS  97           HA       CYS  97  -5.275   0.782  -8.815
  774   1HB   CYS  97          1HB       CYS  97  -5.324   3.536  -7.564
  775   2HB   CYS  97          2HB       CYS  97  -6.023   2.071  -6.884
  776    HG   CYS  97           HG       CYS  97  -3.200   0.961  -7.091
  777    H    SER  98           H        SER  98  -5.818   3.932 -10.256
  778    HA   SER  98           HA       SER  98  -8.658   3.841 -10.167
  779   1HB   SER  98          1HB       SER  98  -7.263   5.922 -10.468
  780   2HB   SER  98          2HB       SER  98  -6.956   5.397 -12.123
  781    HG   SER  98           HG       SER  98  -9.055   6.718 -11.190
  782    H    LYS  99           H        LYS  99  -6.401   2.143 -11.992
  783    HA   LYS  99           HA       LYS  99  -7.575   1.928 -14.505
  784   1HB   LYS  99          1HB       LYS  99  -6.168   0.125 -14.871
  785   2HB   LYS  99          2HB       LYS  99  -5.338   0.966 -13.569
  786   1HG   LYS  99          1HG       LYS  99  -5.251  -1.105 -12.691
  787   2HG   LYS  99          2HG       LYS  99  -6.864  -0.681 -12.114
  788   1HD   LYS  99          1HD       LYS  99  -7.899  -2.090 -13.564
  789   2HD   LYS  99          2HD       LYS  99  -6.685  -1.858 -14.824
  790   1HE   LYS  99          1HE       LYS  99  -5.413  -3.138 -12.646
  791   2HE   LYS  99          2HE       LYS  99  -6.932  -3.984 -12.935
  792   1HZ   LYS  99          1HZ       LYS  99  -4.641  -3.626 -14.752
  793   2HZ   LYS  99          2HZ       LYS  99  -6.184  -3.915 -15.381
  794   3HZ   LYS  99          3HZ       LYS  99  -5.468  -5.045 -14.345
  795    H    GLU 100           H        GLU 100  -8.609   0.686 -11.466
  796    HA   GLU 100           HA       GLU 100 -10.229  -1.442 -12.457
  797   1HB   GLU 100          1HB       GLU 100 -10.569   0.038  -9.847
  798   2HB   GLU 100          2HB       GLU 100 -11.114  -1.589 -10.230
  799   1HG   GLU 100          1HG       GLU 100  -8.297  -0.632  -9.832
  800   2HG   GLU 100          2HG       GLU 100  -9.197  -1.801  -8.868
  801    H    GLY 101           H        GLY 101 -10.614   1.973 -12.204
  802   1HA   GLY 101          1HA       GLY 101 -12.277   3.268 -13.191
  803   2HA   GLY 101          2HA       GLY 101 -13.192   1.802 -13.511
  804    H    ASN 102           H        ASN 102 -12.413   1.491 -10.389
  805    HA   ASN 102           HA       ASN 102 -14.638   3.132  -9.397
  806   1HB   ASN 102          1HB       ASN 102 -15.120   0.577  -9.865
  807   2HB   ASN 102          2HB       ASN 102 -14.293   0.362  -8.325
  808   1HD2  ASN 102          1HD2      ASN 102 -15.681   0.130  -6.743
  809   2HD2  ASN 102          2HD2      ASN 102 -17.170   0.986  -6.554
  810    H    LEU 103           H        LEU 103 -14.059   4.301  -7.695
  811    HA   LEU 103           HA       LEU 103 -11.575   3.658  -6.308
  812   1HB   LEU 103          1HB       LEU 103 -12.953   6.051  -7.019
  813   2HB   LEU 103          2HB       LEU 103 -12.765   6.007  -5.267
  814    HG   LEU 103           HG       LEU 103 -10.947   7.236  -6.318
  815   1HD1  LEU 103          1HD1      LEU 103 -10.635   5.730  -4.275
  816   2HD1  LEU 103          2HD1      LEU 103  -9.187   6.266  -5.128
  817   3HD1  LEU 103          3HD1      LEU 103  -9.800   4.631  -5.374
  818   1HD2  LEU 103          1HD2      LEU 103 -10.634   4.704  -7.890
  819   2HD2  LEU 103          2HD2      LEU 103  -9.272   5.796  -7.640
  820   3HD2  LEU 103          3HD2      LEU 103 -10.722   6.368  -8.466
  821    H    LEU 104           H        LEU 104 -11.444   3.034  -4.222
  822    HA   LEU 104           HA       LEU 104 -13.982   2.587  -2.808
  823   1HB   LEU 104          1HB       LEU 104 -12.368   0.677  -3.384
  824   2HB   LEU 104          2HB       LEU 104 -11.349   1.333  -2.104
  825    HG   LEU 104           HG       LEU 104 -13.124   0.933  -0.476
  826   1HD1  LEU 104          1HD1      LEU 104 -15.217   0.881  -1.233
  827   2HD1  LEU 104          2HD1      LEU 104 -14.890  -0.780  -1.726
  828   3HD1  LEU 104          3HD1      LEU 104 -14.697   0.537  -2.883
  829   1HD2  LEU 104          1HD2      LEU 104 -13.123  -1.717  -1.638
  830   2HD2  LEU 104          2HD2      LEU 104 -12.349  -1.130  -0.166
  831   3HD2  LEU 104          3HD2      LEU 104 -11.529  -0.966  -1.720
  832    H    MET 105           H        MET 105 -10.980   4.277  -2.686
  833    HA   MET 105           HA       MET 105 -11.846   5.819  -0.437
  834   1HB   MET 105          1HB       MET 105 -11.023   4.149   0.966
  835   2HB   MET 105          2HB       MET 105  -9.685   3.767  -0.109
  836   1HG   MET 105          1HG       MET 105  -8.350   5.344   0.769
  837   2HG   MET 105          2HG       MET 105  -9.672   6.487   0.998
  838   1HE   MET 105          1HE       MET 105  -7.996   3.149   3.050
  839   2HE   MET 105          2HE       MET 105  -7.172   4.499   2.271
  840   3HE   MET 105          3HE       MET 105  -7.388   4.490   4.022
  841    H    GLU 106           H        GLU 106 -10.930   7.807  -0.454
  842    HA   GLU 106           HA       GLU 106  -8.550   8.209  -2.135
  843   1HB   GLU 106          1HB       GLU 106 -10.943   8.902  -3.064
  844   2HB   GLU 106          2HB       GLU 106 -10.646  10.326  -2.077
  845   1HG   GLU 106          1HG       GLU 106  -8.399   9.553  -3.784
  846   2HG   GLU 106          2HG       GLU 106  -9.858  10.019  -4.657
  847    H    CYS 107           H        CYS 107  -7.031   8.732  -0.688
  848    HA   CYS 107           HA       CYS 107  -7.459  11.099   0.954
  849   1HB   CYS 107          1HB       CYS 107  -6.660   8.408   2.070
  850   2HB   CYS 107          2HB       CYS 107  -6.408   9.921   2.932
  851    HG   CYS 107           HG       CYS 107  -9.308   8.287   2.293
  852    H    GLY 108           H        GLY 108  -5.275  11.561   2.187
  853   1HA   GLY 108          1HA       GLY 108  -3.054  12.119   2.017
  854   2HA   GLY 108          2HA       GLY 108  -2.847  10.641   1.087
  855    H    ALA 109           H        ALA 109  -1.248  12.485   0.258
  856    HA   ALA 109           HA       ALA 109  -2.568  13.863  -1.986
  857   1HB   ALA 109          1HB       ALA 109   0.191  14.633  -1.395
  858   2HB   ALA 109          2HB       ALA 109  -1.235  15.634  -1.669
  859   3HB   ALA 109          3HB       ALA 109  -0.940  14.937  -0.076
  860    HA   PRO 110           HA       PRO 110  -0.459  11.422  -4.961
  861   1HB   PRO 110          1HB       PRO 110   0.110  13.245  -6.890
  862   2HB   PRO 110          2HB       PRO 110  -1.527  12.655  -6.578
  863   1HG   PRO 110          1HG       PRO 110  -0.228  15.199  -5.683
  864   2HG   PRO 110          2HG       PRO 110  -1.863  14.941  -6.317
  865   1HD   PRO 110          1HD       PRO 110  -1.352  15.209  -3.672
  866   2HD   PRO 110          2HD       PRO 110  -2.666  14.188  -4.292
  867    H    ARG 111           H        ARG 111   1.387  11.045  -3.521
  868    HA   ARG 111           HA       ARG 111   3.788  12.503  -4.416
  869   1HB   ARG 111          1HB       ARG 111   4.777  12.138  -2.233
  870   2HB   ARG 111          2HB       ARG 111   3.228  12.952  -2.049
  871   1HG   ARG 111          1HG       ARG 111   2.279  11.203  -0.979
  872   2HG   ARG 111          2HG       ARG 111   3.191  10.004  -1.898
  873   1HD   ARG 111          1HD       ARG 111   4.261  11.723   0.337
  874   2HD   ARG 111          2HD       ARG 111   3.857  10.011   0.449
  875    HE   ARG 111           HE       ARG 111   5.660  10.057  -1.549
  876   1HH1  ARG 111          1HH1      ARG 111   5.665  11.401   1.663
  877   2HH1  ARG 111          2HH1      ARG 111   7.382  11.279   1.853
  878   1HH2  ARG 111          1HH2      ARG 111   7.923   9.891  -1.311
  879   2HH2  ARG 111          2HH2      ARG 111   8.666  10.420   0.160
  880    H    SER 112           H        SER 112   5.699  11.296  -4.700
  881    HA   SER 112           HA       SER 112   5.262   8.392  -4.965
  882   1HB   SER 112          1HB       SER 112   7.423   9.309  -6.624
  883   2HB   SER 112          2HB       SER 112   5.922   8.516  -7.102
  884    HG   SER 112           HG       SER 112   6.566  11.227  -7.031
  885    H    GLN 113           H        GLN 113   7.773   7.519  -5.438
  886    HA   GLN 113           HA       GLN 113   8.909   7.259  -2.938
  887   1HB   GLN 113          1HB       GLN 113   9.449   5.735  -4.737
  888   2HB   GLN 113          2HB       GLN 113  10.220   7.026  -5.649
  889   1HG   GLN 113          1HG       GLN 113  11.273   6.490  -2.940
  890   2HG   GLN 113          2HG       GLN 113  11.578   5.272  -4.178
  891   1HE2  GLN 113          1HE2      GLN 113  12.245   6.370  -6.354
  892   2HE2  GLN 113          2HE2      GLN 113  13.514   7.533  -6.208
  893    H    GLY 114           H        GLY 114   9.747   9.556  -5.506
  894   1HA   GLY 114          1HA       GLY 114  10.497  11.761  -5.100
  895   2HA   GLY 114          2HA       GLY 114  10.970  11.276  -3.478
  896    H    GLN 115           H        GLN 115  11.800  10.751  -6.894
  897    HA   GLN 115           HA       GLN 115  14.446   9.835  -6.251
  898   1HB   GLN 115          1HB       GLN 115  13.216   9.053  -8.255
  899   2HB   GLN 115          2HB       GLN 115  13.301  10.679  -8.919
  900   1HG   GLN 115          1HG       GLN 115  15.380  10.389  -9.651
  901   2HG   GLN 115          2HG       GLN 115  15.902   9.646  -8.139
  902   1HE2  GLN 115          1HE2      GLN 115  16.638   7.676  -8.394
  903   2HE2  GLN 115          2HE2      GLN 115  16.087   6.516  -9.549
  904    H    ARG 116           H        ARG 116  13.124  12.753  -7.807
  905    HA   ARG 116           HA       ARG 116  15.619  14.145  -7.085
  906   1HB   ARG 116          1HB       ARG 116  14.138  14.017  -9.613
  907   2HB   ARG 116          2HB       ARG 116  14.536  15.654  -9.108
  908   1HG   ARG 116          1HG       ARG 116  16.913  14.488  -8.714
  909   2HG   ARG 116          2HG       ARG 116  16.293  13.465 -10.012
  910   1HD   ARG 116          1HD       ARG 116  15.672  16.031 -10.835
  911   2HD   ARG 116          2HD       ARG 116  17.262  16.203 -10.094
  912    HE   ARG 116           HE       ARG 116  16.653  14.919 -12.568
  913   1HH1  ARG 116          1HH1      ARG 116  18.822  14.883  -9.845
  914   2HH1  ARG 116          2HH1      ARG 116  20.126  14.161 -10.727
  915   1HH2  ARG 116          1HH2      ARG 116  18.363  13.967 -13.740
  916   2HH2  ARG 116          2HH2      ARG 116  19.864  13.641 -12.943
  Start of MODEL   14
    1    HA   PRO   2           HA       PRO   2  33.814  -0.627  17.568
    2   1HB   PRO   2          1HB       PRO   2  35.786  -2.328  16.801
    3   2HB   PRO   2          2HB       PRO   2  36.078  -0.921  17.830
    4   1HG   PRO   2          1HG       PRO   2  35.748  -3.795  18.600
    5   2HG   PRO   2          2HG       PRO   2  36.918  -2.604  19.197
    6   1HD   PRO   2          1HD       PRO   2  34.686  -3.270  20.577
    7   2HD   PRO   2          2HD       PRO   2  35.397  -1.644  20.639
    8    H    SER   3           H        SER   3  32.720  -1.131  15.772
    9    HA   SER   3           HA       SER   3  32.115  -3.962  15.237
   10   1HB   SER   3          1HB       SER   3  29.857  -3.493  14.739
   11   2HB   SER   3          2HB       SER   3  30.175  -2.579  16.213
   12    HG   SER   3           HG       SER   3  29.134  -1.235  14.769
   13    H    LYS   4           H        LYS   4  31.848  -4.531  13.042
   14    HA   LYS   4           HA       LYS   4  32.520  -2.507  11.042
   15   1HB   LYS   4          1HB       LYS   4  34.389  -4.406  12.024
   16   2HB   LYS   4          2HB       LYS   4  33.956  -4.894  10.390
   17   1HG   LYS   4          1HG       LYS   4  34.763  -2.925   9.454
   18   2HG   LYS   4          2HG       LYS   4  34.724  -2.065  10.995
   19   1HD   LYS   4          1HD       LYS   4  36.505  -4.445  10.624
   20   2HD   LYS   4          2HD       LYS   4  37.002  -2.855  10.042
   21   1HE   LYS   4          1HE       LYS   4  36.014  -2.509  12.664
   22   2HE   LYS   4          2HE       LYS   4  37.083  -3.911  12.697
   23   1HZ   LYS   4          1HZ       LYS   4  37.735  -1.145  12.436
   24   2HZ   LYS   4          2HZ       LYS   4  38.421  -2.064  11.192
   25   3HZ   LYS   4          3HZ       LYS   4  38.739  -2.456  12.807
   26    H    LYS   5           H        LYS   5  30.697  -2.625   9.869
   27    HA   LYS   5           HA       LYS   5  29.924  -5.272   8.830
   28   1HB   LYS   5          1HB       LYS   5  28.151  -2.971   9.655
   29   2HB   LYS   5          2HB       LYS   5  27.581  -4.333   8.699
   30   1HG   LYS   5          1HG       LYS   5  27.219  -5.488  10.546
   31   2HG   LYS   5          2HG       LYS   5  28.928  -5.365  10.972
   32   1HD   LYS   5          1HD       LYS   5  28.399  -3.083  11.919
   33   2HD   LYS   5          2HD       LYS   5  26.693  -3.485  11.711
   34   1HE   LYS   5          1HE       LYS   5  28.699  -4.991  13.386
   35   2HE   LYS   5          2HE       LYS   5  27.409  -3.951  13.986
   36   1HZ   LYS   5          1HZ       LYS   5  27.213  -6.613  12.743
   37   2HZ   LYS   5          2HZ       LYS   5  25.898  -5.552  12.673
   38   3HZ   LYS   5          3HZ       LYS   5  26.505  -6.047  14.172
   39    H    ASN   6           H        ASN   6  30.016  -5.453   6.691
   40    HA   ASN   6           HA       ASN   6  29.134  -3.553   4.845
   41   1HB   ASN   6          1HB       ASN   6  31.815  -3.090   5.823
   42   2HB   ASN   6          2HB       ASN   6  31.836  -3.429   4.095
   43   1HD2  ASN   6          1HD2      ASN   6  32.408  -0.953   5.492
   44   2HD2  ASN   6          2HD2      ASN   6  31.302   0.221   4.871
   45    H    GLY   7           H        GLY   7  28.263  -5.243   3.735
   46   1HA   GLY   7          1HA       GLY   7  30.020  -6.718   2.006
   47   2HA   GLY   7          2HA       GLY   7  29.268  -7.731   3.230
   48    H    ARG   8           H        ARG   8  26.975  -7.957   3.236
   49    HA   ARG   8           HA       ARG   8  25.854  -7.753   0.555
   50   1HB   ARG   8          1HB       ARG   8  24.129  -9.257   1.347
   51   2HB   ARG   8          2HB       ARG   8  25.707  -9.888   1.798
   52   1HG   ARG   8          1HG       ARG   8  25.414  -9.270   4.060
   53   2HG   ARG   8          2HG       ARG   8  23.999  -8.286   3.679
   54   1HD   ARG   8          1HD       ARG   8  23.662 -11.012   2.781
   55   2HD   ARG   8          2HD       ARG   8  24.028 -10.947   4.505
   56    HE   ARG   8           HE       ARG   8  22.057  -9.041   3.945
   57   1HH1  ARG   8          1HH1      ARG   8  22.469 -12.498   4.004
   58   2HH1  ARG   8          2HH1      ARG   8  20.807 -12.820   4.373
   59   1HH2  ARG   8          1HH2      ARG   8  19.867  -9.453   4.429
   60   2HH2  ARG   8          2HH2      ARG   8  19.328 -11.087   4.613
   61    H    SER   9           H        SER   9  23.197  -7.565   0.944
   62    HA   SER   9           HA       SER   9  22.591  -5.293   2.638
   63   1HB   SER   9          1HB       SER   9  23.523  -4.576   0.255
   64   2HB   SER   9          2HB       SER   9  21.864  -4.920  -0.234
   65    HG   SER   9           HG       SER   9  21.138  -3.390   1.210
   66    H    GLY  10           H        GLY  10  20.821  -6.006   3.631
   67   1HA   GLY  10          1HA       GLY  10  18.950  -7.748   2.238
   68   2HA   GLY  10          2HA       GLY  10  18.919  -7.336   3.947
   69    HA   PRO  11           HA       PRO  11  15.534  -5.025   1.716
   70   1HB   PRO  11          1HB       PRO  11  13.535  -5.842   3.361
   71   2HB   PRO  11          2HB       PRO  11  14.037  -6.754   1.933
   72   1HG   PRO  11          1HG       PRO  11  14.754  -7.189   4.806
   73   2HG   PRO  11          2HG       PRO  11  14.313  -8.381   3.571
   74   1HD   PRO  11          1HD       PRO  11  16.880  -7.914   4.293
   75   2HD   PRO  11          2HD       PRO  11  16.424  -8.389   2.644
   76    H    GLN  12           H        GLN  12  14.641  -3.093   2.380
   77    HA   GLN  12           HA       GLN  12  15.020  -2.325   5.191
   78   1HB   GLN  12          1HB       GLN  12  15.613   0.000   4.237
   79   2HB   GLN  12          2HB       GLN  12  16.851  -1.250   4.226
   80   1HG   GLN  12          1HG       GLN  12  15.178  -1.098   1.812
   81   2HG   GLN  12          2HG       GLN  12  16.231   0.285   2.107
   82   1HE2  GLN  12          1HE2      GLN  12  16.343  -1.724   0.002
   83   2HE2  GLN  12          2HE2      GLN  12  17.904  -2.455   0.118
   84    HA   PRO  13           HA       PRO  13  10.954  -0.686   5.039
   85   1HB   PRO  13          1HB       PRO  13  11.162   1.478   6.665
   86   2HB   PRO  13          2HB       PRO  13  11.188  -0.183   7.269
   87   1HG   PRO  13          1HG       PRO  13  13.474   1.677   6.744
   88   2HG   PRO  13          2HG       PRO  13  13.210   0.588   8.119
   89   1HD   PRO  13          1HD       PRO  13  14.867  -0.030   6.068
   90   2HD   PRO  13          2HD       PRO  13  13.948  -1.261   6.957
   91    H    HIS  14           H        HIS  14   9.746   0.660   3.808
   92    HA   HIS  14           HA       HIS  14  11.058   3.033   2.661
   93   1HB   HIS  14          1HB       HIS  14   9.198   1.169   1.174
   94   2HB   HIS  14          2HB       HIS  14  10.014   2.584   0.514
   95    HD1  HIS  14           1HD      HIS  14  10.348  -0.985   0.790
   96    HD2  HIS  14           2HD      HIS  14  12.972   2.229   0.586
   97    HE1  HIS  14           1HE      HIS  14  12.564  -1.967   0.117
   98    H    LYS  15           H        LYS  15   9.232   4.360   1.435
   99    HA   LYS  15           HA       LYS  15   7.124   4.794   3.432
  100   1HB   LYS  15          1HB       LYS  15   6.903   7.037   2.277
  101   2HB   LYS  15          2HB       LYS  15   8.415   6.761   3.132
  102   1HG   LYS  15          1HG       LYS  15   8.644   5.898   0.401
  103   2HG   LYS  15          2HG       LYS  15   8.076   7.568   0.480
  104   1HD   LYS  15          1HD       LYS  15   9.977   7.905   2.187
  105   2HD   LYS  15          2HD       LYS  15  10.616   6.385   1.555
  106   1HE   LYS  15          1HE       LYS  15  10.392   7.463  -0.752
  107   2HE   LYS  15          2HE       LYS  15  10.186   8.985   0.112
  108   1HZ   LYS  15          1HZ       LYS  15  12.418   7.646   1.159
  109   2HZ   LYS  15          2HZ       LYS  15  12.369   9.122   0.336
  110   3HZ   LYS  15          3HZ       LYS  15  12.568   7.680  -0.526
  111    H    ARG  16           H        ARG  16   7.227   2.860   1.058
  112    HA   ARG  16           HA       ARG  16   4.543   3.508   0.087
  113   1HB   ARG  16          1HB       ARG  16   6.840   2.703  -1.708
  114   2HB   ARG  16          2HB       ARG  16   5.165   2.876  -2.214
  115   1HG   ARG  16          1HG       ARG  16   5.696   4.960  -2.766
  116   2HG   ARG  16          2HG       ARG  16   5.716   5.300  -1.034
  117   1HD   ARG  16          1HD       ARG  16   7.790   6.068  -1.662
  118   2HD   ARG  16          2HD       ARG  16   8.168   4.413  -1.187
  119    HE   ARG  16           HE       ARG  16   7.549   4.662  -3.972
  120   1HH1  ARG  16          1HH1      ARG  16  10.060   4.989  -1.584
  121   2HH1  ARG  16          2HH1      ARG  16  11.349   4.738  -2.714
  122   1HH2  ARG  16          1HH2      ARG  16   9.236   4.331  -5.471
  123   2HH2  ARG  16          2HH2      ARG  16  10.879   4.365  -4.925
  124    H    TRP  17           H        TRP  17   3.223   1.817   0.230
  125    HA   TRP  17           HA       TRP  17   4.222  -0.885  -0.124
  126   1HB   TRP  17          1HB       TRP  17   3.084   0.112   2.486
  127   2HB   TRP  17          2HB       TRP  17   3.088  -1.595   2.050
  128    HD1  TRP  17           HD       TRP  17   5.357   1.184   3.270
  129    HE1  TRP  17           1HE      TRP  17   7.662   0.197   3.854
  130    HE3  TRP  17           3HE      TRP  17   4.737  -3.516   1.355
  131    HZ2  TRP  17           2HZ      TRP  17   9.035  -2.249   3.543
  132    HZ3  TRP  17           3HZ      TRP  17   6.594  -5.119   1.539
  133    HH2  TRP  17           HH       TRP  17   8.698  -4.496   2.610
  134    H    VAL  18           H        VAL  18   2.722  -2.210  -0.994
  135    HA   VAL  18           HA       VAL  18   0.002  -1.124  -1.296
  136    HB   VAL  18           HB       VAL  18  -0.214  -2.436  -3.313
  137   1HG1  VAL  18          1HG1      VAL  18   0.725  -0.283  -3.672
  138   2HG1  VAL  18          2HG1      VAL  18   2.324  -0.823  -3.158
  139   3HG1  VAL  18          3HG1      VAL  18   1.638  -1.412  -4.673
  140   1HG2  VAL  18          1HG2      VAL  18   0.975  -4.276  -3.670
  141   2HG2  VAL  18          2HG2      VAL  18   2.467  -3.336  -3.711
  142   3HG2  VAL  18          3HG2      VAL  18   1.867  -3.972  -2.179
  143    H    PHE  19           H        PHE  19  -1.756  -2.724  -1.425
  144    HA   PHE  19           HA       PHE  19  -1.221  -5.205   0.044
  145   1HB   PHE  19          1HB       PHE  19  -3.321  -4.791   1.377
  146   2HB   PHE  19          2HB       PHE  19  -1.972  -3.729   1.769
  147    HD1  PHE  19           1HD      PHE  19  -1.970  -1.389   0.910
  148    HD2  PHE  19           2HD      PHE  19  -5.364  -3.935   0.580
  149    HE1  PHE  19           1HE      PHE  19  -3.400   0.575   0.517
  150    HE2  PHE  19           2HE      PHE  19  -6.800  -1.977   0.186
  151    HZ   PHE  19           HZ       PHE  19  -5.818   0.282   0.153
  152    H    THR  20           H        THR  20  -2.569  -6.915  -0.448
  153    HA   THR  20           HA       THR  20  -4.810  -6.499  -2.256
  154    HB   THR  20           HB       THR  20  -4.026  -8.053  -3.943
  155    HG1  THR  20           1HG      THR  20  -1.642  -8.177  -2.381
  156   1HG2  THR  20          1HG2      THR  20  -3.413  -5.615  -4.083
  157   2HG2  THR  20          2HG2      THR  20  -2.367  -6.702  -4.998
  158   3HG2  THR  20          3HG2      THR  20  -1.826  -6.052  -3.451
  159    H    LEU  21           H        LEU  21  -6.423  -7.841  -1.764
  160    HA   LEU  21           HA       LEU  21  -5.824 -10.448  -0.578
  161   1HB   LEU  21          1HB       LEU  21  -6.218  -8.846   1.261
  162   2HB   LEU  21          2HB       LEU  21  -7.809  -8.501   0.587
  163    HG   LEU  21           HG       LEU  21  -7.806 -11.253   0.924
  164   1HD1  LEU  21          1HD1      LEU  21  -7.247 -11.288   3.451
  165   2HD1  LEU  21          2HD1      LEU  21  -6.224  -9.903   3.072
  166   3HD1  LEU  21          3HD1      LEU  21  -5.941 -11.452   2.277
  167   1HD2  LEU  21          1HD2      LEU  21  -8.842  -9.317   2.970
  168   2HD2  LEU  21          2HD2      LEU  21  -9.541 -10.848   2.442
  169   3HD2  LEU  21          3HD2      LEU  21  -9.563  -9.450   1.366
  170    H    ASN  22           H        ASN  22  -7.185 -12.049  -1.194
  171    HA   ASN  22           HA       ASN  22  -9.086 -11.432  -3.285
  172   1HB   ASN  22          1HB       ASN  22  -7.407 -13.550  -2.842
  173   2HB   ASN  22          2HB       ASN  22  -8.956 -14.209  -2.323
  174   1HD2  ASN  22          1HD2      ASN  22 -10.516 -14.640  -3.811
  175   2HD2  ASN  22          2HD2      ASN  22 -10.270 -14.515  -5.516
  176    H    ASN  23           H        ASN  23 -11.273 -11.587  -3.182
  177    HA   ASN  23           HA       ASN  23 -13.335 -11.466  -2.217
  178   1HB   ASN  23          1HB       ASN  23 -12.146 -13.940  -0.985
  179   2HB   ASN  23          2HB       ASN  23 -13.780 -13.422  -0.580
  180   1HD2  ASN  23          1HD2      ASN  23 -15.110 -14.742  -1.597
  181   2HD2  ASN  23          2HD2      ASN  23 -15.033 -15.164  -3.271
  182    HA   PRO  24           HA       PRO  24 -11.598  -9.334   1.567
  183   1HB   PRO  24          1HB       PRO  24 -12.385  -6.838   0.844
  184   2HB   PRO  24          2HB       PRO  24 -10.832  -7.533   0.363
  185   1HG   PRO  24          1HG       PRO  24 -13.379  -7.326  -1.196
  186   2HG   PRO  24          2HG       PRO  24 -11.714  -7.025  -1.728
  187   1HD   PRO  24          1HD       PRO  24 -13.025  -9.331  -2.275
  188   2HD   PRO  24          2HD       PRO  24 -11.269  -9.268  -2.019
  189    H    SER  25           H        SER  25 -12.813  -9.009   3.346
  190    HA   SER  25           HA       SER  25 -15.710  -9.175   3.058
  191   1HB   SER  25          1HB       SER  25 -13.770  -9.658   5.279
  192   2HB   SER  25          2HB       SER  25 -15.434  -9.250   5.694
  193    HG   SER  25           HG       SER  25 -15.842 -11.268   5.317
  194    H    GLU  26           H        GLU  26 -17.120  -7.776   4.307
  195    HA   GLU  26           HA       GLU  26 -16.643  -5.064   3.881
  196   1HB   GLU  26          1HB       GLU  26 -18.717  -6.689   5.097
  197   2HB   GLU  26          2HB       GLU  26 -18.502  -5.172   5.959
  198   1HG   GLU  26          1HG       GLU  26 -18.961  -3.897   4.019
  199   2HG   GLU  26          2HG       GLU  26 -18.868  -5.320   2.982
  200    H    ASP  27           H        ASP  27 -15.891  -7.103   6.604
  201    HA   ASP  27           HA       ASP  27 -15.403  -5.007   8.471
  202   1HB   ASP  27          1HB       ASP  27 -15.263  -7.897   8.430
  203   2HB   ASP  27          2HB       ASP  27 -13.852  -7.214   9.234
  204    H    GLU  28           H        GLU  28 -13.272  -7.014   6.450
  205    HA   GLU  28           HA       GLU  28 -10.867  -5.773   7.263
  206   1HB   GLU  28          1HB       GLU  28 -11.671  -7.818   5.414
  207   2HB   GLU  28          2HB       GLU  28 -10.543  -6.727   4.621
  208   1HG   GLU  28          1HG       GLU  28  -9.195  -8.381   5.542
  209   2HG   GLU  28          2HG       GLU  28  -9.064  -7.036   6.674
  210    H    ARG  29           H        ARG  29 -12.921  -5.298   4.398
  211    HA   ARG  29           HA       ARG  29 -11.383  -3.300   3.185
  212   1HB   ARG  29          1HB       ARG  29 -14.198  -4.224   2.990
  213   2HB   ARG  29          2HB       ARG  29 -13.840  -2.628   2.346
  214   1HG   ARG  29          1HG       ARG  29 -12.418  -3.463   0.715
  215   2HG   ARG  29          2HG       ARG  29 -12.177  -4.988   1.570
  216   1HD   ARG  29          1HD       ARG  29 -13.593  -5.569  -0.182
  217   2HD   ARG  29          2HD       ARG  29 -14.692  -5.359   1.180
  218    HE   ARG  29           HE       ARG  29 -14.355  -2.979  -0.386
  219   1HH1  ARG  29          1HH1      ARG  29 -16.094  -5.981  -0.100
  220   2HH1  ARG  29          2HH1      ARG  29 -17.465  -5.424  -1.002
  221   1HH2  ARG  29          1HH2      ARG  29 -16.154  -2.234  -1.575
  222   2HH2  ARG  29          2HH2      ARG  29 -17.497  -3.293  -1.841
  223    H    LYS  30           H        LYS  30 -13.862  -3.130   5.675
  224    HA   LYS  30           HA       LYS  30 -14.101  -0.296   5.678
  225   1HB   LYS  30          1HB       LYS  30 -15.842  -1.779   6.590
  226   2HB   LYS  30          2HB       LYS  30 -14.740  -2.288   7.862
  227   1HG   LYS  30          1HG       LYS  30 -14.673   0.006   8.715
  228   2HG   LYS  30          2HG       LYS  30 -15.799   0.501   7.449
  229   1HD   LYS  30          1HD       LYS  30 -16.574  -1.775   9.198
  230   2HD   LYS  30          2HD       LYS  30 -16.625  -0.150   9.883
  231   1HE   LYS  30          1HE       LYS  30 -17.951  -0.899   7.285
  232   2HE   LYS  30          2HE       LYS  30 -18.770  -0.962   8.845
  233   1HZ   LYS  30          1HZ       LYS  30 -18.862   1.161   7.318
  234   2HZ   LYS  30          2HZ       LYS  30 -17.419   1.527   8.121
  235   3HZ   LYS  30          3HZ       LYS  30 -18.841   1.287   9.005
  236    H    LYS  31           H        LYS  31 -12.059  -2.588   7.386
  237    HA   LYS  31           HA       LYS  31 -11.023  -0.853   9.335
  238   1HB   LYS  31          1HB       LYS  31 -10.688  -3.217   9.558
  239   2HB   LYS  31          2HB       LYS  31  -9.850  -3.302   8.014
  240   1HG   LYS  31          1HG       LYS  31  -8.510  -1.435   9.712
  241   2HG   LYS  31          2HG       LYS  31  -8.744  -2.958  10.574
  242   1HD   LYS  31          1HD       LYS  31  -7.863  -3.275   7.799
  243   2HD   LYS  31          2HD       LYS  31  -6.706  -2.430   8.830
  244   1HE   LYS  31          1HE       LYS  31  -6.397  -4.903   8.756
  245   2HE   LYS  31          2HE       LYS  31  -6.651  -4.253  10.376
  246   1HZ   LYS  31          1HZ       LYS  31  -7.928  -6.344   9.686
  247   2HZ   LYS  31          2HZ       LYS  31  -8.915  -5.296   8.798
  248   3HZ   LYS  31          3HZ       LYS  31  -8.784  -5.116  10.475
  249    H    ILE  32           H        ILE  32  -9.714  -1.759   6.148
  250    HA   ILE  32           HA       ILE  32  -7.516   0.039   6.297
  251    HB   ILE  32           HB       ILE  32  -8.695  -1.018   3.738
  252   1HG1  ILE  32          1HG1      ILE  32  -6.886  -2.447   5.697
  253   2HG1  ILE  32          2HG1      ILE  32  -8.522  -2.913   5.247
  254   1HG2  ILE  32          1HG2      ILE  32  -6.856  -0.206   2.793
  255   2HG2  ILE  32          2HG2      ILE  32  -6.467   0.562   4.331
  256   3HG2  ILE  32          3HG2      ILE  32  -5.828  -1.039   3.959
  257   1HD1  ILE  32          1HD1      ILE  32  -6.000  -3.471   3.937
  258   2HD1  ILE  32          2HD1      ILE  32  -7.567  -4.262   3.767
  259   3HD1  ILE  32          3HD1      ILE  32  -7.206  -2.810   2.834
  260    H    ARG  33           H        ARG  33 -10.768   0.244   4.973
  261    HA   ARG  33           HA       ARG  33 -10.362   2.727   3.627
  262   1HB   ARG  33          1HB       ARG  33 -12.137   1.224   2.925
  263   2HB   ARG  33          2HB       ARG  33 -12.896   1.334   4.508
  264   1HG   ARG  33          1HG       ARG  33 -13.763   3.403   4.106
  265   2HG   ARG  33          2HG       ARG  33 -12.473   3.847   2.986
  266   1HD   ARG  33          1HD       ARG  33 -13.563   3.011   1.206
  267   2HD   ARG  33          2HD       ARG  33 -14.143   1.606   2.099
  268    HE   ARG  33           HE       ARG  33 -16.102   2.714   2.488
  269   1HH1  ARG  33          1HH1      ARG  33 -13.677   5.015   1.515
  270   2HH1  ARG  33          2HH1      ARG  33 -14.789   6.339   1.411
  271   1HH2  ARG  33          1HH2      ARG  33 -17.576   4.451   2.355
  272   2HH2  ARG  33          2HH2      ARG  33 -17.006   6.018   1.890
  273    H    ASP  34           H        ASP  34 -10.957   1.832   6.882
  274    HA   ASP  34           HA       ASP  34 -11.831   4.541   7.589
  275   1HB   ASP  34          1HB       ASP  34 -11.818   1.943   9.129
  276   2HB   ASP  34          2HB       ASP  34 -12.185   3.496   9.875
  277    H    LEU  35           H        LEU  35  -9.009   3.177   7.019
  278    HA   LEU  35           HA       LEU  35  -7.487   3.585   9.361
  279   1HB   LEU  35          1HB       LEU  35  -6.867   3.298   6.459
  280   2HB   LEU  35          2HB       LEU  35  -5.599   3.839   7.556
  281    HG   LEU  35           HG       LEU  35  -7.120   1.247   7.828
  282   1HD1  LEU  35          1HD1      LEU  35  -4.253   1.252   7.154
  283   2HD1  LEU  35          2HD1      LEU  35  -5.347   1.763   5.870
  284   3HD1  LEU  35          3HD1      LEU  35  -5.548   0.180   6.620
  285   1HD2  LEU  35          1HD2      LEU  35  -6.274   2.145   9.942
  286   2HD2  LEU  35          2HD2      LEU  35  -4.661   2.277   9.242
  287   3HD2  LEU  35          3HD2      LEU  35  -5.400   0.690   9.461
  288    HA   PRO  36           HA       PRO  36  -6.814   7.916   9.543
  289   1HB   PRO  36          1HB       PRO  36  -4.196   8.072  10.244
  290   2HB   PRO  36          2HB       PRO  36  -5.458   7.534  11.358
  291   1HG   PRO  36          1HG       PRO  36  -3.536   5.904   9.744
  292   2HG   PRO  36          2HG       PRO  36  -4.041   5.692  11.430
  293   1HD   PRO  36          1HD       PRO  36  -5.064   4.213   9.406
  294   2HD   PRO  36          2HD       PRO  36  -6.013   4.653  10.840
  295    H    ILE  37           H        ILE  37  -6.821   9.163   7.782
  296    HA   ILE  37           HA       ILE  37  -5.237   8.659   5.481
  297    HB   ILE  37           HB       ILE  37  -6.062  10.904   4.717
  298   1HG1  ILE  37          1HG1      ILE  37  -7.591  10.829   7.328
  299   2HG1  ILE  37          2HG1      ILE  37  -6.245  11.909   6.980
  300   1HG2  ILE  37          1HG2      ILE  37  -8.602   9.844   5.376
  301   2HG2  ILE  37          2HG2      ILE  37  -7.699   9.671   3.872
  302   3HG2  ILE  37          3HG2      ILE  37  -7.495   8.488   5.163
  303   1HD1  ILE  37          1HD1      ILE  37  -9.049  12.037   6.117
  304   2HD1  ILE  37          2HD1      ILE  37  -7.891  13.330   6.435
  305   3HD1  ILE  37          3HD1      ILE  37  -7.850  12.467   4.898
  306    H    SER  38           H        SER  38  -4.889  10.760   8.262
  307    HA   SER  38           HA       SER  38  -2.810  12.382   7.219
  308   1HB   SER  38          1HB       SER  38  -2.358  12.715   9.776
  309   2HB   SER  38          2HB       SER  38  -3.854  13.329   9.072
  310    HG   SER  38           HG       SER  38  -3.444  11.088  10.716
  311    H    LEU  39           H        LEU  39  -2.895   9.184   8.462
  312    HA   LEU  39           HA       LEU  39  -0.176   9.016   9.306
  313   1HB   LEU  39          1HB       LEU  39  -2.338   7.467   9.685
  314   2HB   LEU  39          2HB       LEU  39  -1.559   6.574   8.381
  315    HG   LEU  39           HG       LEU  39   0.175   7.307  10.654
  316   1HD1  LEU  39          1HD1      LEU  39  -1.926   6.715  11.791
  317   2HD1  LEU  39          2HD1      LEU  39  -0.647   5.537  12.082
  318   3HD1  LEU  39          3HD1      LEU  39  -1.936   5.173  10.935
  319   1HD2  LEU  39          1HD2      LEU  39   1.071   5.105  10.249
  320   2HD2  LEU  39          2HD2      LEU  39   0.910   5.961   8.715
  321   3HD2  LEU  39          3HD2      LEU  39  -0.265   4.723   9.162
  322    H    PHE  40           H        PHE  40  -1.837   8.643   6.270
  323    HA   PHE  40           HA       PHE  40   0.734   7.982   4.992
  324   1HB   PHE  40          1HB       PHE  40  -1.928   7.248   3.799
  325   2HB   PHE  40          2HB       PHE  40  -0.337   6.593   3.425
  326    HD1  PHE  40           2HD      PHE  40  -3.123   6.549   5.808
  327    HD2  PHE  40           1HD      PHE  40   0.628   4.844   4.743
  328    HE1  PHE  40           2HE      PHE  40  -3.526   4.693   7.372
  329    HE2  PHE  40           1HE      PHE  40   0.231   2.985   6.305
  330    HZ   PHE  40           HZ       PHE  40  -1.848   2.909   7.623
  331    H    ASP  41           H        ASP  41   1.484   9.575   3.779
  332    HA   ASP  41           HA       ASP  41   0.148  11.949   3.229
  333   1HB   ASP  41          1HB       ASP  41   2.716  10.988   2.863
  334   2HB   ASP  41          2HB       ASP  41   2.159  11.276   1.217
  335    H    TYR  42           H        TYR  42   0.023   8.912   1.601
  336    HA   TYR  42           HA       TYR  42  -1.945   9.993  -0.256
  337   1HB   TYR  42          1HB       TYR  42   0.147  10.130  -1.511
  338   2HB   TYR  42          2HB       TYR  42   0.482   8.436  -1.171
  339    HD1  TYR  42           1HD      TYR  42  -2.769   9.935  -2.160
  340    HD2  TYR  42           2HD      TYR  42   0.521   7.501  -3.324
  341    HE1  TYR  42           1HE      TYR  42  -3.976   9.291  -4.204
  342    HE2  TYR  42           2HE      TYR  42  -0.677   6.851  -5.372
  343    HH   TYR  42           HH       TYR  42  -3.813   8.264  -6.193
  344    H    PHE  43           H        PHE  43  -3.663   8.712  -0.290
  345    HA   PHE  43           HA       PHE  43  -3.302   5.830   0.153
  346   1HB   PHE  43          1HB       PHE  43  -4.239   7.390   2.136
  347   2HB   PHE  43          2HB       PHE  43  -5.747   7.069   1.287
  348    HD1  PHE  43           1HD      PHE  43  -4.615   4.254   0.347
  349    HD2  PHE  43           2HD      PHE  43  -5.093   6.206   4.099
  350    HE1  PHE  43           1HE      PHE  43  -4.776   2.066   1.462
  351    HE2  PHE  43           2HE      PHE  43  -5.254   4.022   5.219
  352    HZ   PHE  43           HZ       PHE  43  -5.095   1.948   3.901
  353    H    ILE  44           H        ILE  44  -4.018   4.809  -1.587
  354    HA   ILE  44           HA       ILE  44  -6.552   5.669  -2.791
  355    HB   ILE  44           HB       ILE  44  -5.041   6.617  -4.319
  356   1HG1  ILE  44          1HG1      ILE  44  -5.229   4.036  -5.754
  357   2HG1  ILE  44          2HG1      ILE  44  -6.743   4.664  -5.110
  358   1HG2  ILE  44          1HG2      ILE  44  -2.945   5.826  -3.687
  359   2HG2  ILE  44          2HG2      ILE  44  -3.417   4.139  -3.879
  360   3HG2  ILE  44          3HG2      ILE  44  -3.167   5.151  -5.301
  361   1HD1  ILE  44          1HD1      ILE  44  -6.906   5.981  -6.873
  362   2HD1  ILE  44          2HD1      ILE  44  -5.431   6.811  -6.374
  363   3HD1  ILE  44          3HD1      ILE  44  -5.339   5.426  -7.462
  364    H    VAL  45           H        VAL  45  -7.907   4.014  -2.705
  365    HA   VAL  45           HA       VAL  45  -6.836   1.293  -3.084
  366    HB   VAL  45           HB       VAL  45  -9.334   1.826  -1.511
  367   1HG1  VAL  45          1HG1      VAL  45  -9.063  -0.446  -2.087
  368   2HG1  VAL  45          2HG1      VAL  45  -7.343  -0.421  -1.693
  369   3HG1  VAL  45          3HG1      VAL  45  -8.545  -0.315  -0.407
  370   1HG2  VAL  45          1HG2      VAL  45  -8.064   3.014  -0.074
  371   2HG2  VAL  45          2HG2      VAL  45  -7.519   1.419   0.443
  372   3HG2  VAL  45          3HG2      VAL  45  -6.551   2.354  -0.696
  373    H    GLY  46           H        GLY  46  -8.184  -0.213  -4.176
  374   1HA   GLY  46          1HA       GLY  46 -10.594   0.806  -5.465
  375   2HA   GLY  46          2HA       GLY  46  -9.259   0.383  -6.526
  376    H    GLU  47           H        GLU  47 -12.090  -0.729  -5.580
  377    HA   GLU  47           HA       GLU  47 -11.333  -3.476  -5.005
  378   1HB   GLU  47          1HB       GLU  47 -13.214  -2.585  -3.779
  379   2HB   GLU  47          2HB       GLU  47 -14.025  -2.133  -5.271
  380   1HG   GLU  47          1HG       GLU  47 -15.026  -4.097  -5.327
  381   2HG   GLU  47          2HG       GLU  47 -13.459  -4.900  -5.413
  382    H    GLU  48           H        GLU  48 -11.363  -5.124  -6.421
  383    HA   GLU  48           HA       GLU  48 -12.295  -4.541  -9.156
  384   1HB   GLU  48          1HB       GLU  48  -9.897  -4.757  -9.150
  385   2HB   GLU  48          2HB       GLU  48  -9.986  -6.251  -8.228
  386   1HG   GLU  48          1HG       GLU  48  -9.495  -6.719 -10.543
  387   2HG   GLU  48          2HG       GLU  48 -11.085  -7.349 -10.116
  388    H    GLY  49           H        GLY  49 -14.213  -5.511  -9.396
  389   1HA   GLY  49          1HA       GLY  49 -14.493  -8.273  -9.573
  390   2HA   GLY  49          2HA       GLY  49 -15.032  -7.816  -7.964
  391    H    ASN  50           H        ASN  50 -15.397  -5.835 -10.847
  392    HA   ASN  50           HA       ASN  50 -18.297  -5.927 -10.461
  393   1HB   ASN  50          1HB       ASN  50 -16.638  -3.798 -10.832
  394   2HB   ASN  50          2HB       ASN  50 -17.190  -4.083 -12.480
  395   1HD2  ASN  50          1HD2      ASN  50 -18.304  -3.570  -9.177
  396   2HD2  ASN  50          2HD2      ASN  50 -19.803  -2.826  -9.607
  397    H    GLU  51           H        GLU  51 -17.101  -8.197 -11.620
  398    HA   GLU  51           HA       GLU  51 -18.393  -8.139 -14.247
  399   1HB   GLU  51          1HB       GLU  51 -15.642  -8.110 -13.999
  400   2HB   GLU  51          2HB       GLU  51 -16.001  -9.819 -14.208
  401   1HG   GLU  51          1HG       GLU  51 -17.091  -9.413 -16.287
  402   2HG   GLU  51          2HG       GLU  51 -17.014  -7.668 -16.048
  403    H    GLU  52           H        GLU  52 -19.863  -9.692 -14.334
  404    HA   GLU  52           HA       GLU  52 -20.327 -11.591 -12.382
  405   1HB   GLU  52          1HB       GLU  52 -21.521 -10.839 -14.795
  406   2HB   GLU  52          2HB       GLU  52 -21.178 -12.554 -14.979
  407   1HG   GLU  52          1HG       GLU  52 -22.474 -13.110 -13.078
  408   2HG   GLU  52          2HG       GLU  52 -22.613 -11.420 -12.597
  409    H    GLY  53           H        GLY  53 -19.859 -13.761 -12.124
  410   1HA   GLY  53          1HA       GLY  53 -18.890 -15.830 -12.688
  411   2HA   GLY  53          2HA       GLY  53 -18.097 -15.061 -14.055
  412    H    ARG  54           H        ARG  54 -17.297 -12.863 -12.045
  413    HA   ARG  54           HA       ARG  54 -14.961 -14.311 -10.989
  414   1HB   ARG  54          1HB       ARG  54 -14.596 -12.536 -12.769
  415   2HB   ARG  54          2HB       ARG  54 -15.109 -11.356 -11.571
  416   1HG   ARG  54          1HG       ARG  54 -13.205 -11.571 -10.334
  417   2HG   ARG  54          2HG       ARG  54 -12.933 -13.239 -10.841
  418   1HD   ARG  54          1HD       ARG  54 -12.709 -10.965 -12.782
  419   2HD   ARG  54          2HD       ARG  54 -11.360 -11.408 -11.738
  420    HE   ARG  54           HE       ARG  54 -12.341 -12.861 -14.023
  421   1HH1  ARG  54          1HH1      ARG  54 -10.533 -13.040 -11.054
  422   2HH1  ARG  54          2HH1      ARG  54  -9.631 -14.439 -11.535
  423   1HH2  ARG  54          1HH2      ARG  54 -11.160 -14.703 -14.668
  424   2HH2  ARG  54          2HH2      ARG  54  -9.988 -15.383 -13.591
  425    H    THR  55           H        THR  55 -14.039 -13.487  -8.977
  426    HA   THR  55           HA       THR  55 -16.162 -12.641  -7.137
  427    HB   THR  55           HB       THR  55 -13.991 -13.307  -5.565
  428    HG1  THR  55           1HG      THR  55 -14.173 -15.274  -7.611
  429   1HG2  THR  55          1HG2      THR  55 -15.373 -15.641  -5.645
  430   2HG2  THR  55          2HG2      THR  55 -16.552 -14.531  -6.344
  431   3HG2  THR  55          3HG2      THR  55 -15.886 -14.217  -4.742
  432    HA   PRO  56           HA       PRO  56 -14.372  -8.722  -6.305
  433   1HB   PRO  56          1HB       PRO  56 -14.793  -8.461  -3.635
  434   2HB   PRO  56          2HB       PRO  56 -16.095  -8.363  -4.827
  435   1HG   PRO  56          1HG       PRO  56 -15.272 -10.669  -3.105
  436   2HG   PRO  56          2HG       PRO  56 -16.902 -10.082  -3.485
  437   1HD   PRO  56          1HD       PRO  56 -15.799 -12.223  -4.723
  438   2HD   PRO  56          2HD       PRO  56 -16.937 -11.130  -5.538
  439    H    HIS  57           H        HIS  57 -12.411  -7.867  -5.870
  440    HA   HIS  57           HA       HIS  57 -10.662  -9.197  -3.936
  441   1HB   HIS  57          1HB       HIS  57 -10.015 -10.215  -6.016
  442   2HB   HIS  57          2HB       HIS  57  -9.963  -8.652  -6.825
  443    HD1  HIS  57           1HD      HIS  57  -7.940 -10.966  -4.791
  444    HD2  HIS  57           2HD      HIS  57  -7.719  -7.026  -6.090
  445    HE1  HIS  57           1HE      HIS  57  -5.554 -10.267  -4.414
  446    H    LEU  58           H        LEU  58  -9.281  -7.848  -2.868
  447    HA   LEU  58           HA       LEU  58  -9.703  -4.992  -3.297
  448   1HB   LEU  58          1HB       LEU  58  -9.539  -6.549  -1.030
  449   2HB   LEU  58          2HB       LEU  58  -7.966  -5.756  -1.087
  450    HG   LEU  58           HG       LEU  58 -10.675  -4.444  -0.932
  451   1HD1  LEU  58          1HD1      LEU  58  -9.940  -5.231   1.195
  452   2HD1  LEU  58          2HD1      LEU  58  -9.675  -3.489   1.149
  453   3HD1  LEU  58          3HD1      LEU  58  -8.317  -4.593   0.936
  454   1HD2  LEU  58          1HD2      LEU  58  -7.959  -3.174  -1.268
  455   2HD2  LEU  58          2HD2      LEU  58  -9.461  -2.314  -0.929
  456   3HD2  LEU  58          3HD2      LEU  58  -9.264  -3.177  -2.455
  457    H    GLN  59           H        GLN  59  -8.177  -3.621  -4.013
  458    HA   GLN  59           HA       GLN  59  -5.376  -4.347  -3.985
  459   1HB   GLN  59          1HB       GLN  59  -5.912  -5.415  -6.029
  460   2HB   GLN  59          2HB       GLN  59  -6.954  -4.092  -6.537
  461   1HG   GLN  59          1HG       GLN  59  -4.915  -4.046  -7.803
  462   2HG   GLN  59          2HG       GLN  59  -4.979  -2.643  -6.738
  463   1HE2  GLN  59          1HE2      GLN  59  -3.565  -2.505  -5.005
  464   2HE2  GLN  59          2HE2      GLN  59  -2.169  -3.513  -4.869
  465    H    GLY  60           H        GLY  60  -4.506  -2.574  -3.137
  466   1HA   GLY  60          1HA       GLY  60  -4.943  -0.018  -4.457
  467   2HA   GLY  60          2HA       GLY  60  -5.438  -0.101  -2.773
  468    H    PHE  61           H        PHE  61  -3.623   1.744  -3.304
  469    HA   PHE  61           HA       PHE  61  -1.142   0.601  -2.215
  470   1HB   PHE  61          1HB       PHE  61  -0.534   1.052  -4.448
  471   2HB   PHE  61          2HB       PHE  61  -1.450   2.555  -4.484
  472    HD1  PHE  61           2HD      PHE  61   1.248   1.111  -2.341
  473    HD2  PHE  61           1HD      PHE  61  -0.142   4.421  -4.628
  474    HE1  PHE  61           2HE      PHE  61   3.287   2.362  -1.765
  475    HE2  PHE  61           1HE      PHE  61   1.895   5.677  -4.055
  476    HZ   PHE  61           HZ       PHE  61   3.613   4.648  -2.621
  477    H    ALA  62           H        ALA  62  -0.157   1.758  -0.613
  478    HA   ALA  62           HA       ALA  62  -1.302   4.370   0.095
  479   1HB   ALA  62          1HB       ALA  62  -0.716   3.164   2.533
  480   2HB   ALA  62          2HB       ALA  62  -2.316   3.478   1.861
  481   3HB   ALA  62          3HB       ALA  62  -1.541   1.916   1.597
  482    H    ASN  63           H        ASN  63   0.211   5.862   0.418
  483    HA   ASN  63           HA       ASN  63   2.997   5.021   0.624
  484   1HB   ASN  63          1HB       ASN  63   2.296   6.734  -1.061
  485   2HB   ASN  63          2HB       ASN  63   1.885   7.812   0.270
  486   1HD2  ASN  63          1HD2      ASN  63   4.152   7.223  -1.947
  487   2HD2  ASN  63          2HD2      ASN  63   5.555   7.812  -1.130
  488    H    PHE  64           H        PHE  64   3.827   4.759   2.581
  489    HA   PHE  64           HA       PHE  64   2.648   5.831   4.936
  490   1HB   PHE  64          1HB       PHE  64   4.780   3.985   4.270
  491   2HB   PHE  64          2HB       PHE  64   5.257   5.054   5.585
  492    HD1  PHE  64           2HD      PHE  64   3.634   5.262   7.565
  493    HD2  PHE  64           1HD      PHE  64   3.461   2.129   4.689
  494    HE1  PHE  64           2HE      PHE  64   2.352   3.884   9.149
  495    HE2  PHE  64           1HE      PHE  64   2.178   0.746   6.269
  496    HZ   PHE  64           HZ       PHE  64   1.623   1.622   8.503
  497    H    VAL  65           H        VAL  65   3.001   7.700   5.950
  498    HA   VAL  65           HA       VAL  65   4.462   9.786   4.778
  499    HB   VAL  65           HB       VAL  65   3.461   9.493   7.612
  500   1HG1  VAL  65          1HG1      VAL  65   4.859  11.218   8.001
  501   2HG1  VAL  65          2HG1      VAL  65   5.009  11.621   6.289
  502   3HG1  VAL  65          3HG1      VAL  65   3.598  12.157   7.204
  503   1HG2  VAL  65          1HG2      VAL  65   1.807   9.480   5.694
  504   2HG2  VAL  65          2HG2      VAL  65   1.561  10.719   6.925
  505   3HG2  VAL  65          3HG2      VAL  65   2.300  11.144   5.381
  506    H    LYS  66           H        LYS  66   5.420   7.262   6.926
  507    HA   LYS  66           HA       LYS  66   8.098   8.470   7.112
  508   1HB   LYS  66          1HB       LYS  66   6.439   7.177   9.242
  509   2HB   LYS  66          2HB       LYS  66   8.191   7.046   9.318
  510   1HG   LYS  66          1HG       LYS  66   7.860   8.916  10.579
  511   2HG   LYS  66          2HG       LYS  66   8.081   9.648   8.988
  512   1HD   LYS  66          1HD       LYS  66   6.188  10.716   9.857
  513   2HD   LYS  66          2HD       LYS  66   5.532   9.489   8.771
  514   1HE   LYS  66          1HE       LYS  66   4.323   8.714  10.466
  515   2HE   LYS  66          2HE       LYS  66   5.821   8.241  11.267
  516   1HZ   LYS  66          1HZ       LYS  66   5.347   9.714  12.832
  517   2HZ   LYS  66          2HZ       LYS  66   3.997  10.276  11.982
  518   3HZ   LYS  66          3HZ       LYS  66   5.518  10.959  11.700
  519    H    LYS  67           H        LYS  67   9.593   6.517   8.073
  520    HA   LYS  67           HA       LYS  67   9.543   4.545   5.948
  521   1HB   LYS  67          1HB       LYS  67  11.537   5.010   8.174
  522   2HB   LYS  67          2HB       LYS  67  11.744   3.865   6.855
  523   1HG   LYS  67          1HG       LYS  67  11.141   6.497   5.848
  524   2HG   LYS  67          2HG       LYS  67  12.544   6.527   6.919
  525   1HD   LYS  67          1HD       LYS  67  12.215   4.574   4.647
  526   2HD   LYS  67          2HD       LYS  67  13.063   6.115   4.497
  527   1HE   LYS  67          1HE       LYS  67  13.789   4.086   6.591
  528   2HE   LYS  67          2HE       LYS  67  14.471   4.038   4.967
  529   1HZ   LYS  67          1HZ       LYS  67  15.425   5.485   7.075
  530   2HZ   LYS  67          2HZ       LYS  67  14.634   6.643   6.129
  531   3HZ   LYS  67          3HZ       LYS  67  15.856   5.689   5.452
  532    H    GLN  68           H        GLN  68   8.706   2.579   6.139
  533    HA   GLN  68           HA       GLN  68   8.561   1.340   8.796
  534   1HB   GLN  68          1HB       GLN  68   6.304   1.406   6.786
  535   2HB   GLN  68          2HB       GLN  68   6.296   0.512   8.300
  536   1HG   GLN  68          1HG       GLN  68   6.923   3.132   9.008
  537   2HG   GLN  68          2HG       GLN  68   5.655   3.268   7.791
  538   1HE2  GLN  68          1HE2      GLN  68   5.451   3.932  10.559
  539   2HE2  GLN  68          2HE2      GLN  68   4.238   2.911  11.245
  540    H    THR  69           H        THR  69   8.514  -0.953   8.796
  541    HA   THR  69           HA       THR  69   9.795  -2.102   6.435
  542    HB   THR  69           HB       THR  69  10.529  -3.891   7.811
  543    HG1  THR  69           1HG      THR  69   9.533  -4.476   9.625
  544   1HG2  THR  69          1HG2      THR  69  10.614  -1.323   9.399
  545   2HG2  THR  69          2HG2      THR  69  11.781  -1.854   8.188
  546   3HG2  THR  69          3HG2      THR  69  11.626  -2.732   9.709
  547    H    PHE  70           H        PHE  70   9.208  -4.470   6.004
  548    HA   PHE  70           HA       PHE  70   6.545  -4.596   5.131
  549   1HB   PHE  70          1HB       PHE  70   7.994  -5.954   3.919
  550   2HB   PHE  70          2HB       PHE  70   8.764  -6.597   5.366
  551    HD1  PHE  70           1HD      PHE  70   5.672  -6.707   3.340
  552    HD2  PHE  70           2HD      PHE  70   8.020  -8.592   6.348
  553    HE1  PHE  70           1HE      PHE  70   4.229  -8.696   3.215
  554    HE2  PHE  70           2HE      PHE  70   6.581 -10.584   6.228
  555    HZ   PHE  70           HZ       PHE  70   4.683 -10.638   4.660
  556    H    ASN  71           H        ASN  71   8.135  -6.422   7.751
  557    HA   ASN  71           HA       ASN  71   5.805  -7.660   8.707
  558   1HB   ASN  71          1HB       ASN  71   8.557  -7.221   9.719
  559   2HB   ASN  71          2HB       ASN  71   7.331  -7.584  10.930
  560   1HD2  ASN  71          1HD2      ASN  71   9.551  -9.213  10.235
  561   2HD2  ASN  71          2HD2      ASN  71   8.930 -10.700   9.612
  562    H    LYS  72           H        LYS  72   7.350  -4.602   9.553
  563    HA   LYS  72           HA       LYS  72   5.715  -3.981  11.766
  564   1HB   LYS  72          1HB       LYS  72   7.770  -2.794  11.493
  565   2HB   LYS  72          2HB       LYS  72   7.315  -2.250   9.883
  566   1HG   LYS  72          1HG       LYS  72   7.161  -0.470  11.566
  567   2HG   LYS  72          2HG       LYS  72   5.607  -0.817  10.803
  568   1HD   LYS  72          1HD       LYS  72   4.948  -2.157  12.733
  569   2HD   LYS  72          2HD       LYS  72   6.513  -1.852  13.491
  570   1HE   LYS  72          1HE       LYS  72   4.971   0.523  12.643
  571   2HE   LYS  72          2HE       LYS  72   4.311  -0.398  13.993
  572   1HZ   LYS  72          1HZ       LYS  72   6.164   0.015  15.289
  573   2HZ   LYS  72          2HZ       LYS  72   5.961   1.485  14.477
  574   3HZ   LYS  72          3HZ       LYS  72   7.151   0.395  13.968
  575    H    VAL  73           H        VAL  73   5.514  -2.997   8.353
  576    HA   VAL  73           HA       VAL  73   3.269  -1.380   8.499
  577    HB   VAL  73           HB       VAL  73   4.244  -3.168   6.278
  578   1HG1  VAL  73          1HG1      VAL  73   1.902  -2.961   5.894
  579   2HG1  VAL  73          2HG1      VAL  73   1.932  -1.237   6.273
  580   3HG1  VAL  73          3HG1      VAL  73   2.714  -1.834   4.808
  581   1HG2  VAL  73          1HG2      VAL  73   5.312  -1.318   5.435
  582   2HG2  VAL  73          2HG2      VAL  73   4.201  -0.188   6.207
  583   3HG2  VAL  73          3HG2      VAL  73   5.436  -1.003   7.166
  584    H    LYS  74           H        LYS  74   3.519  -4.833   8.682
  585    HA   LYS  74           HA       LYS  74   0.875  -5.520   7.992
  586   1HB   LYS  74          1HB       LYS  74   2.751  -6.939   9.893
  587   2HB   LYS  74          2HB       LYS  74   1.322  -7.637   9.141
  588   1HG   LYS  74          1HG       LYS  74   2.694  -6.775   6.964
  589   2HG   LYS  74          2HG       LYS  74   4.010  -7.211   8.057
  590   1HD   LYS  74          1HD       LYS  74   3.701  -9.340   7.492
  591   2HD   LYS  74          2HD       LYS  74   2.114  -9.272   8.263
  592   1HE   LYS  74          1HE       LYS  74   1.061  -8.672   6.211
  593   2HE   LYS  74          2HE       LYS  74   2.615  -8.419   5.418
  594   1HZ   LYS  74          1HZ       LYS  74   2.573 -11.026   6.416
  595   2HZ   LYS  74          2HZ       LYS  74   2.589 -10.529   4.799
  596   3HZ   LYS  74          3HZ       LYS  74   1.116 -10.781   5.591
  597    H    TRP  75           H        TRP  75   2.074  -3.808  10.630
  598    HA   TRP  75           HA       TRP  75   0.276  -4.668  12.654
  599   1HB   TRP  75          1HB       TRP  75   1.099  -2.884  13.946
  600   2HB   TRP  75          2HB       TRP  75   2.457  -3.333  12.919
  601    HD1  TRP  75           HD       TRP  75   1.645  -1.754  10.288
  602    HE1  TRP  75           1HE      TRP  75   1.774   0.817  10.259
  603    HE3  TRP  75           3HE      TRP  75   1.454  -0.875  15.321
  604    HZ2  TRP  75           2HZ      TRP  75   1.793   2.936  12.123
  605    HZ3  TRP  75           3HZ      TRP  75   1.534   1.452  16.115
  606    HH2  TRP  75           HH       TRP  75   1.700   3.317  14.548
  607    H    TYR  76           H        TYR  76  -0.071  -2.662   9.900
  608    HA   TYR  76           HA       TYR  76  -2.635  -1.635  10.923
  609   1HB   TYR  76          1HB       TYR  76  -0.500  -0.409   9.343
  610   2HB   TYR  76          2HB       TYR  76  -2.096  -0.186   8.637
  611    HD1  TYR  76           2HD      TYR  76  -3.744  -0.004  11.112
  612    HD2  TYR  76           1HD      TYR  76   0.024   1.724  10.153
  613    HE1  TYR  76           2HE      TYR  76  -4.189   1.828  12.691
  614    HE2  TYR  76           1HE      TYR  76  -0.410   3.561  11.730
  615    HH   TYR  76           HH       TYR  76  -3.214   3.543  13.843
  616    H    LEU  77           H        LEU  77  -1.047  -2.791   7.954
  617    HA   LEU  77           HA       LEU  77  -3.490  -3.173   6.542
  618   1HB   LEU  77          1HB       LEU  77  -0.702  -4.208   6.069
  619   2HB   LEU  77          2HB       LEU  77  -2.047  -4.484   4.964
  620    HG   LEU  77           HG       LEU  77  -0.966  -1.766   5.706
  621   1HD1  LEU  77          1HD1      LEU  77   0.610  -3.245   4.413
  622   2HD1  LEU  77          2HD1      LEU  77   0.164  -1.731   3.626
  623   3HD1  LEU  77          3HD1      LEU  77  -0.583  -3.244   3.114
  624   1HD2  LEU  77          1HD2      LEU  77  -3.339  -1.817   5.043
  625   2HD2  LEU  77          2HD2      LEU  77  -2.883  -2.609   3.534
  626   3HD2  LEU  77          3HD2      LEU  77  -2.329  -0.968   3.872
  627    H    GLY  78           H        GLY  78  -1.336  -5.307   8.368
  628   1HA   GLY  78          1HA       GLY  78  -2.113  -7.173   9.605
  629   2HA   GLY  78          2HA       GLY  78  -3.537  -7.229   8.578
  630    H    ALA  79           H        ALA  79  -1.798  -9.418   9.301
  631    HA   ALA  79           HA       ALA  79  -0.126 -10.038   7.060
  632   1HB   ALA  79          1HB       ALA  79  -0.932 -11.387   9.566
  633   2HB   ALA  79          2HB       ALA  79  -0.414 -12.420   8.233
  634   3HB   ALA  79          3HB       ALA  79   0.667 -11.173   8.853
  635    H    ARG  80           H        ARG  80  -3.460 -10.538   7.885
  636    HA   ARG  80           HA       ARG  80  -4.146 -12.721   6.338
  637   1HB   ARG  80          1HB       ARG  80  -5.800 -10.214   6.687
  638   2HB   ARG  80          2HB       ARG  80  -6.400 -11.816   6.279
  639   1HG   ARG  80          1HG       ARG  80  -5.006 -12.227   8.624
  640   2HG   ARG  80          2HG       ARG  80  -5.786 -10.663   8.865
  641   1HD   ARG  80          1HD       ARG  80  -7.198 -12.513   9.633
  642   2HD   ARG  80          2HD       ARG  80  -7.943 -11.629   8.302
  643    HE   ARG  80           HE       ARG  80  -6.533 -13.765   7.207
  644   1HH1  ARG  80          1HH1      ARG  80  -9.266 -13.231   9.297
  645   2HH1  ARG  80          2HH1      ARG  80 -10.074 -14.691   8.830
  646   1HH2  ARG  80          1HH2      ARG  80  -7.587 -15.689   6.584
  647   2HH2  ARG  80          2HH2      ARG  80  -9.117 -16.089   7.287
  648    H    CYS  81           H        CYS  81  -3.632  -9.377   5.357
  649    HA   CYS  81           HA       CYS  81  -4.197 -10.098   2.572
  650   1HB   CYS  81          1HB       CYS  81  -4.264  -7.707   2.126
  651   2HB   CYS  81          2HB       CYS  81  -5.319  -8.092   3.480
  652    HG   CYS  81           HG       CYS  81  -2.156  -6.866   3.900
  653    H    HIS  82           H        HIS  82  -2.658 -10.112   1.021
  654    HA   HIS  82           HA       HIS  82   0.081 -10.206   1.834
  655   1HB   HIS  82          1HB       HIS  82  -1.079 -11.551  -0.040
  656   2HB   HIS  82          2HB       HIS  82  -0.850 -10.109  -1.026
  657    HD1  HIS  82           1HD      HIS  82   0.918 -13.054   0.310
  658    HD2  HIS  82           2HD      HIS  82   1.896  -9.466  -1.543
  659    HE1  HIS  82           1HE      HIS  82   3.302 -13.316  -0.447
  660    H    ILE  83           H        ILE  83   1.526  -8.616   1.882
  661    HA   ILE  83           HA       ILE  83   0.896  -6.118   0.449
  662    HB   ILE  83           HB       ILE  83   2.139  -4.905   2.176
  663   1HG1  ILE  83          1HG1      ILE  83   2.253  -7.542   3.654
  664   2HG1  ILE  83          2HG1      ILE  83   3.620  -6.820   2.811
  665   1HG2  ILE  83          1HG2      ILE  83   0.513  -5.194   4.017
  666   2HG2  ILE  83          2HG2      ILE  83  -0.250  -5.094   2.431
  667   3HG2  ILE  83          3HG2      ILE  83  -0.076  -6.657   3.229
  668   1HD1  ILE  83          1HD1      ILE  83   3.675  -6.423   5.228
  669   2HD1  ILE  83          2HD1      ILE  83   3.577  -4.924   4.304
  670   3HD1  ILE  83          3HD1      ILE  83   2.143  -5.559   5.109
  671    H    GLU  84           H        GLU  84   2.507  -5.105  -0.694
  672    HA   GLU  84           HA       GLU  84   5.216  -6.154  -0.612
  673   1HB   GLU  84          1HB       GLU  84   3.333  -6.933  -2.636
  674   2HB   GLU  84          2HB       GLU  84   4.614  -5.977  -3.368
  675   1HG   GLU  84          1HG       GLU  84   5.927  -7.738  -1.662
  676   2HG   GLU  84          2HG       GLU  84   4.657  -8.696  -2.421
  677    H    LYS  85           H        LYS  85   6.693  -4.869  -2.021
  678    HA   LYS  85           HA       LYS  85   6.188  -2.078  -1.633
  679   1HB   LYS  85          1HB       LYS  85   8.423  -1.761  -2.603
  680   2HB   LYS  85          2HB       LYS  85   8.432  -2.989  -1.344
  681   1HG   LYS  85          1HG       LYS  85   8.229  -4.692  -3.218
  682   2HG   LYS  85          2HG       LYS  85   8.616  -3.365  -4.316
  683   1HD   LYS  85          1HD       LYS  85  10.487  -3.290  -2.190
  684   2HD   LYS  85          2HD       LYS  85  10.382  -4.962  -2.746
  685   1HE   LYS  85          1HE       LYS  85  10.567  -2.809  -4.788
  686   2HE   LYS  85          2HE       LYS  85  12.019  -3.212  -3.873
  687   1HZ   LYS  85          1HZ       LYS  85  12.287  -5.057  -5.049
  688   2HZ   LYS  85          2HZ       LYS  85  11.064  -4.520  -6.086
  689   3HZ   LYS  85          3HZ       LYS  85  10.689  -5.552  -4.799
  690    H    ALA  86           H        ALA  86   5.502  -0.589  -3.052
  691    HA   ALA  86           HA       ALA  86   4.514  -1.475  -5.613
  692   1HB   ALA  86          1HB       ALA  86   3.033   0.135  -5.256
  693   2HB   ALA  86          2HB       ALA  86   3.904   0.615  -3.799
  694   3HB   ALA  86          3HB       ALA  86   4.312   1.346  -5.351
  695    H    LYS  87           H        LYS  87   5.302  -0.998  -7.603
  696    HA   LYS  87           HA       LYS  87   7.892   0.398  -7.691
  697   1HB   LYS  87          1HB       LYS  87   8.356  -0.890  -9.725
  698   2HB   LYS  87          2HB       LYS  87   8.016  -1.948  -8.362
  699   1HG   LYS  87          1HG       LYS  87   6.619  -2.997  -9.740
  700   2HG   LYS  87          2HG       LYS  87   5.541  -1.621  -9.491
  701   1HD   LYS  87          1HD       LYS  87   6.602  -0.511 -11.446
  702   2HD   LYS  87          2HD       LYS  87   7.539  -1.981 -11.724
  703   1HE   LYS  87          1HE       LYS  87   4.527  -1.845 -11.676
  704   2HE   LYS  87          2HE       LYS  87   5.507  -1.810 -13.140
  705   1HZ   LYS  87          1HZ       LYS  87   4.678  -4.031 -12.677
  706   2HZ   LYS  87          2HZ       LYS  87   5.436  -4.027 -11.165
  707   3HZ   LYS  87          3HZ       LYS  87   6.367  -3.994 -12.577
  708    H    GLY  88           H        GLY  88   8.260   1.999  -9.196
  709   1HA   GLY  88          1HA       GLY  88   7.609   3.114 -11.270
  710   2HA   GLY  88          2HA       GLY  88   5.936   2.802 -10.833
  711    H    THR  89           H        THR  89   6.126   5.246 -11.428
  712    HA   THR  89           HA       THR  89   7.071   6.905  -9.247
  713    HB   THR  89           HB       THR  89   6.544   8.789 -10.598
  714    HG1  THR  89           1HG      THR  89   5.419   8.209 -12.727
  715   1HG2  THR  89          1HG2      THR  89   8.396   7.101 -11.355
  716   2HG2  THR  89          2HG2      THR  89   7.952   8.452 -12.399
  717   3HG2  THR  89          3HG2      THR  89   7.319   6.838 -12.726
  718    H    ASP  90           H        ASP  90   5.557   8.696  -8.489
  719    HA   ASP  90           HA       ASP  90   3.456   7.614  -7.035
  720   1HB   ASP  90          1HB       ASP  90   3.540  10.508  -7.871
  721   2HB   ASP  90          2HB       ASP  90   2.924   9.822  -6.370
  722    H    GLN  91           H        GLN  91   3.423   9.234 -10.172
  723    HA   GLN  91           HA       GLN  91   0.601   9.313 -10.440
  724   1HB   GLN  91          1HB       GLN  91   2.447  10.603 -11.746
  725   2HB   GLN  91          2HB       GLN  91   2.465   9.186 -12.788
  726   1HG   GLN  91          1HG       GLN  91   1.019  10.717 -13.817
  727   2HG   GLN  91          2HG       GLN  91  -0.023   9.512 -13.061
  728   1HE2  GLN  91          1HE2      GLN  91  -1.492  10.150 -11.604
  729   2HE2  GLN  91          2HE2      GLN  91  -1.676  11.770 -11.032
  730    H    GLN  92           H        GLN  92   3.058   6.952 -11.297
  731    HA   GLN  92           HA       GLN  92   1.417   5.299 -12.900
  732   1HB   GLN  92          1HB       GLN  92   4.083   5.157 -11.695
  733   2HB   GLN  92          2HB       GLN  92   3.286   3.594 -11.817
  734   1HG   GLN  92          1HG       GLN  92   2.823   4.705 -14.282
  735   2HG   GLN  92          2HG       GLN  92   4.446   5.270 -13.890
  736   1HE2  GLN  92          1HE2      GLN  92   6.115   3.809 -13.734
  737   2HE2  GLN  92          2HE2      GLN  92   5.976   2.168 -14.253
  738    H    ASN  93           H        ASN  93   2.069   5.416  -9.444
  739    HA   ASN  93           HA       ASN  93   0.791   2.975  -8.784
  740   1HB   ASN  93          1HB       ASN  93   0.979   5.320  -6.909
  741   2HB   ASN  93          2HB       ASN  93   1.065   3.602  -6.534
  742   1HD2  ASN  93          1HD2      ASN  93   2.893   2.758  -8.412
  743   2HD2  ASN  93          2HD2      ASN  93   4.431   3.465  -8.067
  744    H    LYS  94           H        LYS  94  -0.318   6.336  -8.878
  745    HA   LYS  94           HA       LYS  94  -2.884   5.908  -7.820
  746   1HB   LYS  94          1HB       LYS  94  -1.868   8.137  -8.065
  747   2HB   LYS  94          2HB       LYS  94  -1.984   7.997  -9.814
  748   1HG   LYS  94          1HG       LYS  94  -4.296   8.211  -9.806
  749   2HG   LYS  94          2HG       LYS  94  -4.425   7.783  -8.098
  750   1HD   LYS  94          1HD       LYS  94  -3.995   9.890  -7.405
  751   2HD   LYS  94          2HD       LYS  94  -2.822  10.184  -8.691
  752   1HE   LYS  94          1HE       LYS  94  -4.357  11.127 -10.023
  753   2HE   LYS  94          2HE       LYS  94  -5.562   9.894  -9.656
  754   1HZ   LYS  94          1HZ       LYS  94  -5.502  11.243  -7.360
  755   2HZ   LYS  94          2HZ       LYS  94  -6.570  11.596  -8.623
  756   3HZ   LYS  94          3HZ       LYS  94  -5.148  12.494  -8.443
  757    H    GLU  95           H        GLU  95  -1.743   5.965 -11.186
  758    HA   GLU  95           HA       GLU  95  -4.297   5.406 -12.307
  759   1HB   GLU  95          1HB       GLU  95  -1.497   5.523 -13.311
  760   2HB   GLU  95          2HB       GLU  95  -2.671   4.642 -14.279
  761   1HG   GLU  95          1HG       GLU  95  -3.077   7.473 -13.358
  762   2HG   GLU  95          2HG       GLU  95  -2.340   7.043 -14.901
  763    H    TYR  96           H        TYR  96  -1.585   3.433 -11.265
  764    HA   TYR  96           HA       TYR  96  -2.266   1.005 -12.435
  765   1HB   TYR  96          1HB       TYR  96  -0.142   1.285 -11.326
  766   2HB   TYR  96          2HB       TYR  96  -0.934   1.571  -9.780
  767    HD1  TYR  96           1HD      TYR  96  -2.014  -0.295  -8.577
  768    HD2  TYR  96           2HD      TYR  96   0.193  -0.937 -12.158
  769    HE1  TYR  96           1HE      TYR  96  -1.897  -2.698  -8.067
  770    HE2  TYR  96           2HE      TYR  96   0.315  -3.342 -11.658
  771    HH   TYR  96           HH       TYR  96   0.005  -4.905 -10.046
  772    H    CYS  97           H        CYS  97  -3.253   2.328  -9.287
  773    HA   CYS  97           HA       CYS  97  -4.873   0.114  -8.572
  774   1HB   CYS  97          1HB       CYS  97  -4.017   1.647  -6.884
  775   2HB   CYS  97          2HB       CYS  97  -4.922   2.976  -7.597
  776    HG   CYS  97           HG       CYS  97  -7.329   2.317  -6.685
  777    H    SER  98           H        SER  98  -5.477   3.105 -10.306
  778    HA   SER  98           HA       SER  98  -8.329   2.790 -10.338
  779   1HB   SER  98          1HB       SER  98  -8.388   4.768 -11.623
  780   2HB   SER  98          2HB       SER  98  -7.000   4.983 -10.556
  781    HG   SER  98           HG       SER  98  -6.841   5.369 -12.997
  782    H    LYS  99           H        LYS  99  -5.788   1.363 -12.025
  783    HA   LYS  99           HA       LYS  99  -6.797   1.068 -14.610
  784   1HB   LYS  99          1HB       LYS  99  -4.510   0.448 -13.984
  785   2HB   LYS  99          2HB       LYS  99  -5.127  -0.875 -13.002
  786   1HG   LYS  99          1HG       LYS  99  -6.074  -1.895 -15.047
  787   2HG   LYS  99          2HG       LYS  99  -5.323  -0.610 -15.995
  788   1HD   LYS  99          1HD       LYS  99  -3.928  -2.590 -16.035
  789   2HD   LYS  99          2HD       LYS  99  -3.117  -1.304 -15.139
  790   1HE   LYS  99          1HE       LYS  99  -3.131  -2.477 -13.229
  791   2HE   LYS  99          2HE       LYS  99  -4.791  -3.019 -13.469
  792   1HZ   LYS  99          1HZ       LYS  99  -4.075  -4.974 -14.190
  793   2HZ   LYS  99          2HZ       LYS  99  -2.510  -4.530 -13.728
  794   3HZ   LYS  99          3HZ       LYS  99  -3.029  -4.267 -15.317
  795    H    GLU 100           H        GLU 100  -7.843  -0.315 -11.647
  796    HA   GLU 100           HA       GLU 100  -9.111  -2.633 -12.724
  797   1HB   GLU 100          1HB       GLU 100  -9.530  -1.154 -10.122
  798   2HB   GLU 100          2HB       GLU 100 -10.296  -2.685 -10.522
  799   1HG   GLU 100          1HG       GLU 100  -8.358  -3.876 -10.306
  800   2HG   GLU 100          2HG       GLU 100  -7.336  -2.494 -10.695
  801    H    GLY 101           H        GLY 101  -9.920   0.698 -12.596
  802   1HA   GLY 101          1HA       GLY 101 -11.672   1.759 -13.698
  803   2HA   GLY 101          2HA       GLY 101 -12.387   0.186 -14.018
  804    H    ASN 102           H        ASN 102 -11.735   0.074 -10.846
  805    HA   ASN 102           HA       ASN 102 -14.265   1.361 -10.065
  806   1HB   ASN 102          1HB       ASN 102 -13.529  -1.446  -9.921
  807   2HB   ASN 102          2HB       ASN 102 -13.944  -0.805  -8.335
  808   1HD2  ASN 102          1HD2      ASN 102 -15.921  -1.524  -7.945
  809   2HD2  ASN 102          2HD2      ASN 102 -17.282  -1.340  -8.994
  810    H    LEU 103           H        LEU 103 -14.029   2.779  -8.474
  811    HA   LEU 103           HA       LEU 103 -11.565   2.718  -6.886
  812   1HB   LEU 103          1HB       LEU 103 -13.084   4.787  -8.103
  813   2HB   LEU 103          2HB       LEU 103 -13.119   5.038  -6.359
  814    HG   LEU 103           HG       LEU 103 -11.312   6.273  -7.554
  815   1HD1  LEU 103          1HD1      LEU 103 -10.783   6.148  -5.350
  816   2HD1  LEU 103          2HD1      LEU 103  -9.462   5.174  -5.994
  817   3HD1  LEU 103          3HD1      LEU 103 -10.883   4.388  -5.308
  818   1HD2  LEU 103          1HD2      LEU 103  -9.517   4.022  -7.757
  819   2HD2  LEU 103          2HD2      LEU 103  -9.901   5.267  -8.946
  820   3HD2  LEU 103          3HD2      LEU 103 -10.911   3.826  -8.820
  821    H    LEU 104           H        LEU 104 -11.571   2.329  -4.755
  822    HA   LEU 104           HA       LEU 104 -14.177   1.916  -3.460
  823   1HB   LEU 104          1HB       LEU 104 -12.153   0.165  -3.686
  824   2HB   LEU 104          2HB       LEU 104 -11.703   0.942  -2.170
  825    HG   LEU 104           HG       LEU 104 -12.970  -1.117  -1.802
  826   1HD1  LEU 104          1HD1      LEU 104 -13.122   0.762  -0.208
  827   2HD1  LEU 104          2HD1      LEU 104 -14.575  -0.236  -0.236
  828   3HD1  LEU 104          3HD1      LEU 104 -14.565   1.328  -1.051
  829   1HD2  LEU 104          1HD2      LEU 104 -14.447  -0.325  -3.987
  830   2HD2  LEU 104          2HD2      LEU 104 -15.549  -0.057  -2.636
  831   3HD2  LEU 104          3HD2      LEU 104 -14.841  -1.652  -2.894
  832    H    MET 105           H        MET 105 -11.047   3.482  -3.113
  833    HA   MET 105           HA       MET 105 -12.210   5.343  -1.209
  834   1HB   MET 105          1HB       MET 105 -11.389   3.905   0.422
  835   2HB   MET 105          2HB       MET 105  -9.999   3.435  -0.546
  836   1HG   MET 105          1HG       MET 105  -8.743   5.156   0.170
  837   2HG   MET 105          2HG       MET 105 -10.109   6.268   0.230
  838   1HE   MET 105          1HE       MET 105  -7.760   4.113   1.668
  839   2HE   MET 105          2HE       MET 105  -7.731   4.755   3.310
  840   3HE   MET 105          3HE       MET 105  -8.536   3.221   2.977
  841    H    GLU 106           H        GLU 106 -11.395   7.362  -1.407
  842    HA   GLU 106           HA       GLU 106  -8.924   7.712  -2.960
  843   1HB   GLU 106          1HB       GLU 106 -11.134   8.062  -4.269
  844   2HB   GLU 106          2HB       GLU 106 -11.271   9.548  -3.339
  845   1HG   GLU 106          1HG       GLU 106  -8.947  10.115  -4.185
  846   2HG   GLU 106          2HG       GLU 106  -9.156   8.785  -5.323
  847    H    CYS 107           H        CYS 107  -7.575   8.523  -1.476
  848    HA   CYS 107           HA       CYS 107  -8.230  11.078  -0.271
  849   1HB   CYS 107          1HB       CYS 107  -7.841   8.562   1.303
  850   2HB   CYS 107          2HB       CYS 107  -7.273  10.088   1.970
  851    HG   CYS 107           HG       CYS 107 -10.377   8.898   1.722
  852    H    GLY 108           H        GLY 108  -6.221  11.742   1.180
  853   1HA   GLY 108          1HA       GLY 108  -3.940  12.094   1.341
  854   2HA   GLY 108          2HA       GLY 108  -3.689  10.696   0.307
  855    H    ALA 109           H        ALA 109  -2.023  12.674  -0.155
  856    HA   ALA 109           HA       ALA 109  -3.120  14.143  -2.462
  857   1HB   ALA 109          1HB       ALA 109  -1.577  15.029  -0.250
  858   2HB   ALA 109          2HB       ALA 109  -0.596  15.195  -1.707
  859   3HB   ALA 109          3HB       ALA 109  -2.180  15.965  -1.618
  860    HA   PRO 110           HA       PRO 110  -0.447  12.054  -5.245
  861   1HB   PRO 110          1HB       PRO 110   0.287  14.043  -6.941
  862   2HB   PRO 110          2HB       PRO 110  -1.339  13.351  -6.919
  863   1HG   PRO 110          1HG       PRO 110  -0.341  15.882  -5.670
  864   2HG   PRO 110          2HG       PRO 110  -1.848  15.591  -6.559
  865   1HD   PRO 110          1HD       PRO 110  -1.747  15.684  -3.855
  866   2HD   PRO 110          2HD       PRO 110  -2.891  14.649  -4.733
  867    H    ARG 111           H        ARG 111   1.489  11.312  -4.646
  868    HA   ARG 111           HA       ARG 111   3.472  12.922  -3.394
  869   1HB   ARG 111          1HB       ARG 111   3.390  10.097  -4.406
  870   2HB   ARG 111          2HB       ARG 111   4.904  10.803  -3.859
  871   1HG   ARG 111          1HG       ARG 111   2.692  11.183  -1.993
  872   2HG   ARG 111          2HG       ARG 111   3.105   9.492  -2.284
  873   1HD   ARG 111          1HD       ARG 111   4.323  10.613  -0.379
  874   2HD   ARG 111          2HD       ARG 111   5.338   9.818  -1.581
  875    HE   ARG 111           HE       ARG 111   6.253  11.849  -2.077
  876   1HH1  ARG 111          1HH1      ARG 111   3.223  12.357  -0.439
  877   2HH1  ARG 111          2HH1      ARG 111   3.421  14.075  -0.329
  878   1HH2  ARG 111          1HH2      ARG 111   6.525  14.109  -1.938
  879   2HH2  ARG 111          2HH2      ARG 111   5.299  15.070  -1.183
  880    H    SER 112           H        SER 112   5.607  13.370  -4.167
  881    HA   SER 112           HA       SER 112   6.054  13.204  -7.041
  882   1HB   SER 112          1HB       SER 112   6.610  15.630  -7.176
  883   2HB   SER 112          2HB       SER 112   4.905  15.332  -6.839
  884    HG   SER 112           HG       SER 112   6.903  16.365  -5.175
  885    H    GLN 113           H        GLN 113   8.282  14.432  -7.476
  886    HA   GLN 113           HA       GLN 113  10.152  13.954  -5.282
  887   1HB   GLN 113          1HB       GLN 113   9.955  11.868  -6.695
  888   2HB   GLN 113          2HB       GLN 113  10.625  12.798  -8.029
  889   1HG   GLN 113          1HG       GLN 113  12.324  13.161  -5.798
  890   2HG   GLN 113          2HG       GLN 113  11.984  11.437  -5.943
  891   1HE2  GLN 113          1HE2      GLN 113  12.771  14.211  -8.013
  892   2HE2  GLN 113          2HE2      GLN 113  13.886  13.360  -9.021
  893    H    GLY 114           H        GLY 114  10.081  14.787  -8.756
  894   1HA   GLY 114          1HA       GLY 114  10.557  17.323  -8.990
  895   2HA   GLY 114          2HA       GLY 114  12.070  16.882  -8.213
  896    H    GLN 115           H        GLN 115  12.130  18.104 -10.646
  897    HA   GLN 115           HA       GLN 115  12.979  15.913 -12.420
  898   1HB   GLN 115          1HB       GLN 115  11.880  18.548 -13.391
  899   2HB   GLN 115          2HB       GLN 115  12.210  17.104 -14.339
  900   1HG   GLN 115          1HG       GLN 115  10.437  15.965 -12.906
  901   2HG   GLN 115          2HG       GLN 115   9.989  17.590 -12.388
  902   1HE2  GLN 115          1HE2      GLN 115   8.150  18.048 -13.376
  903   2HE2  GLN 115          2HE2      GLN 115   7.842  17.878 -15.067
  904    H    ARG 116           H        ARG 116  15.133  15.934 -12.374
  905    HA   ARG 116           HA       ARG 116  16.532  18.514 -12.327
  906   1HB   ARG 116          1HB       ARG 116  18.512  17.222 -11.656
  907   2HB   ARG 116          2HB       ARG 116  17.162  16.957 -10.560
  908   1HG   ARG 116          1HG       ARG 116  16.921  14.964 -12.488
  909   2HG   ARG 116          2HG       ARG 116  18.648  15.063 -12.137
  910   1HD   ARG 116          1HD       ARG 116  17.651  15.179  -9.639
  911   2HD   ARG 116          2HD       ARG 116  16.402  14.211 -10.422
  912    HE   ARG 116           HE       ARG 116  19.103  13.413  -9.829
  913   1HH1  ARG 116          1HH1      ARG 116  16.308  12.838 -11.824
  914   2HH1  ARG 116          2HH1      ARG 116  16.735  11.196 -12.176
  915   1HH2  ARG 116          1HH2      ARG 116  19.675  11.252 -10.285
  916   2HH2  ARG 116          2HH2      ARG 116  18.650  10.295 -11.299
  Start of MODEL   15
    1    HA   PRO   2           HA       PRO   2  34.882   1.319  15.848
    2   1HB   PRO   2          1HB       PRO   2  33.580  -0.464  14.269
    3   2HB   PRO   2          2HB       PRO   2  34.951   0.497  13.704
    4   1HG   PRO   2          1HG       PRO   2  34.890  -2.342  14.650
    5   2HG   PRO   2          2HG       PRO   2  35.747  -1.643  13.265
    6   1HD   PRO   2          1HD       PRO   2  36.979  -2.195  15.612
    7   2HD   PRO   2          2HD       PRO   2  37.467  -0.841  14.573
    8    H    SER   3           H        SER   3  34.705  -2.027  16.955
    9    HA   SER   3           HA       SER   3  33.293  -3.095  18.385
   10   1HB   SER   3          1HB       SER   3  31.958  -0.606  19.296
   11   2HB   SER   3          2HB       SER   3  32.640  -1.931  20.239
   12    HG   SER   3           HG       SER   3  34.299  -0.689  20.514
   13    H    LYS   4           H        LYS   4  30.767  -2.938  19.120
   14    HA   LYS   4           HA       LYS   4  28.612  -3.225  18.451
   15   1HB   LYS   4          1HB       LYS   4  29.193  -1.306  16.199
   16   2HB   LYS   4          2HB       LYS   4  27.643  -1.639  16.960
   17   1HG   LYS   4          1HG       LYS   4  28.412  -0.592  19.019
   18   2HG   LYS   4          2HG       LYS   4  29.985  -0.282  18.281
   19   1HD   LYS   4          1HD       LYS   4  28.856   1.094  16.557
   20   2HD   LYS   4          2HD       LYS   4  27.327   0.848  17.405
   21   1HE   LYS   4          1HE       LYS   4  28.458   1.832  19.445
   22   2HE   LYS   4          2HE       LYS   4  29.776   2.304  18.374
   23   1HZ   LYS   4          1HZ       LYS   4  28.526   4.170  18.255
   24   2HZ   LYS   4          2HZ       LYS   4  27.069   3.372  18.570
   25   3HZ   LYS   4          3HZ       LYS   4  27.753   3.303  17.025
   26    H    LYS   5           H        LYS   5  27.251  -3.725  16.339
   27    HA   LYS   5           HA       LYS   5  28.840  -5.212  14.392
   28   1HB   LYS   5          1HB       LYS   5  26.761  -6.421  16.208
   29   2HB   LYS   5          2HB       LYS   5  27.204  -7.161  14.674
   30   1HG   LYS   5          1HG       LYS   5  29.295  -6.492  16.706
   31   2HG   LYS   5          2HG       LYS   5  28.347  -7.976  16.831
   32   1HD   LYS   5          1HD       LYS   5  29.225  -8.852  14.872
   33   2HD   LYS   5          2HD       LYS   5  29.695  -7.266  14.255
   34   1HE   LYS   5          1HE       LYS   5  31.391  -7.153  16.091
   35   2HE   LYS   5          2HE       LYS   5  30.995  -8.826  16.483
   36   1HZ   LYS   5          1HZ       LYS   5  31.489  -9.152  13.950
   37   2HZ   LYS   5          2HZ       LYS   5  32.748  -9.123  15.079
   38   3HZ   LYS   5          3HZ       LYS   5  32.410  -7.747  14.154
   39    H    ASN   6           H        ASN   6  28.077  -4.937  12.396
   40    HA   ASN   6           HA       ASN   6  25.632  -3.461  12.002
   41   1HB   ASN   6          1HB       ASN   6  28.025  -4.042  10.474
   42   2HB   ASN   6          2HB       ASN   6  26.579  -4.286   9.499
   43   1HD2  ASN   6          1HD2      ASN   6  28.267  -1.976  11.544
   44   2HD2  ASN   6          2HD2      ASN   6  27.603  -0.561  10.808
   45    H    GLY   7           H        GLY   7  23.911  -4.141  10.580
   46   1HA   GLY   7          1HA       GLY   7  23.672  -7.059  10.263
   47   2HA   GLY   7          2HA       GLY   7  22.393  -6.162  11.069
   48    H    ARG   8           H        ARG   8  22.981  -7.644   8.316
   49    HA   ARG   8           HA       ARG   8  21.097  -6.013   6.846
   50   1HB   ARG   8          1HB       ARG   8  23.970  -6.085   6.204
   51   2HB   ARG   8          2HB       ARG   8  22.906  -6.403   4.841
   52   1HG   ARG   8          1HG       ARG   8  21.724  -4.298   5.290
   53   2HG   ARG   8          2HG       ARG   8  22.838  -3.976   6.621
   54   1HD   ARG   8          1HD       ARG   8  23.785  -2.771   4.891
   55   2HD   ARG   8          2HD       ARG   8  24.677  -4.290   4.818
   56    HE   ARG   8           HE       ARG   8  22.561  -4.636   3.117
   57   1HH1  ARG   8          1HH1      ARG   8  25.168  -2.346   3.406
   58   2HH1  ARG   8          2HH1      ARG   8  25.253  -2.031   1.704
   59   1HH2  ARG   8          1HH2      ARG   8  22.663  -4.229   0.875
   60   2HH2  ARG   8          2HH2      ARG   8  23.827  -3.101   0.266
   61    H    SER   9           H        SER   9  20.028  -7.139   5.214
   62    HA   SER   9           HA       SER   9  20.686 -10.004   5.013
   63   1HB   SER   9          1HB       SER   9  18.730 -10.124   6.239
   64   2HB   SER   9          2HB       SER   9  18.074  -8.647   5.535
   65    HG   SER   9           HG       SER   9  18.056 -11.262   4.540
   66    H    GLY  10           H        GLY  10  18.303  -7.903   3.408
   67   1HA   GLY  10          1HA       GLY  10  19.735  -7.907   0.919
   68   2HA   GLY  10          2HA       GLY  10  18.377  -9.023   0.915
   69    HA   PRO  11           HA       PRO  11  15.540  -5.814   0.007
   70   1HB   PRO  11          1HB       PRO  11  13.450  -6.281   1.675
   71   2HB   PRO  11          2HB       PRO  11  13.828  -7.318   0.295
   72   1HG   PRO  11          1HG       PRO  11  14.479  -7.706   3.191
   73   2HG   PRO  11          2HG       PRO  11  13.885  -8.888   2.010
   74   1HD   PRO  11          1HD       PRO  11  16.491  -8.729   2.726
   75   2HD   PRO  11          2HD       PRO  11  15.976  -9.218   1.099
   76    H    GLN  12           H        GLN  12  14.928  -3.749   0.568
   77    HA   GLN  12           HA       GLN  12  15.558  -2.892   3.315
   78   1HB   GLN  12          1HB       GLN  12  15.872  -1.092   0.929
   79   2HB   GLN  12          2HB       GLN  12  16.565  -0.918   2.536
   80   1HG   GLN  12          1HG       GLN  12  18.427  -1.683   1.569
   81   2HG   GLN  12          2HG       GLN  12  17.667  -3.263   1.759
   82   1HE2  GLN  12          1HE2      GLN  12  19.466  -1.769  -0.299
   83   2HE2  GLN  12          2HE2      GLN  12  18.781  -2.247  -1.811
   84    HA   PRO  13           HA       PRO  13  11.538  -1.149   3.564
   85   1HB   PRO  13          1HB       PRO  13  11.994   0.991   5.171
   86   2HB   PRO  13          2HB       PRO  13  12.012  -0.674   5.762
   87   1HG   PRO  13          1HG       PRO  13  14.308   1.098   5.021
   88   2HG   PRO  13          2HG       PRO  13  14.138   0.009   6.410
   89   1HD   PRO  13          1HD       PRO  13  15.557  -0.657   4.202
   90   2HD   PRO  13          2HD       PRO  13  14.682  -1.858   5.173
   91    H    HIS  14           H        HIS  14  10.227   0.418   2.670
   92    HA   HIS  14           HA       HIS  14  11.514   2.713   1.374
   93   1HB   HIS  14          1HB       HIS  14   9.622   0.780   0.020
   94   2HB   HIS  14          2HB       HIS  14  10.133   2.320  -0.663
   95    HD1  HIS  14           1HD      HIS  14  11.293  -1.161  -0.043
   96    HD2  HIS  14           2HD      HIS  14  12.791   2.387  -1.603
   97    HE1  HIS  14           1HE      HIS  14  13.429  -1.789  -1.211
   98    H    LYS  15           H        LYS  15   9.617   4.092   0.318
   99    HA   LYS  15           HA       LYS  15   7.665   4.496   2.476
  100   1HB   LYS  15          1HB       LYS  15   7.411   6.784   1.416
  101   2HB   LYS  15          2HB       LYS  15   8.968   6.452   2.164
  102   1HG   LYS  15          1HG       LYS  15   9.005   5.689  -0.606
  103   2HG   LYS  15          2HG       LYS  15   8.485   7.366  -0.427
  104   1HD   LYS  15          1HD       LYS  15  10.496   7.598   1.161
  105   2HD   LYS  15          2HD       LYS  15  11.056   6.085   0.445
  106   1HE   LYS  15          1HE       LYS  15  11.510   7.046  -1.563
  107   2HE   LYS  15          2HE       LYS  15  10.199   8.217  -1.422
  108   1HZ   LYS  15          1HZ       LYS  15  11.687   9.209   0.424
  109   2HZ   LYS  15          2HZ       LYS  15  12.059   9.525  -1.195
  110   3HZ   LYS  15          3HZ       LYS  15  12.932   8.356  -0.340
  111    H    ARG  16           H        ARG  16   7.581   2.660   0.015
  112    HA   ARG  16           HA       ARG  16   4.852   3.396  -0.752
  113   1HB   ARG  16          1HB       ARG  16   6.976   2.546  -2.729
  114   2HB   ARG  16          2HB       ARG  16   5.289   2.874  -3.099
  115   1HG   ARG  16          1HG       ARG  16   5.549   5.188  -2.649
  116   2HG   ARG  16          2HG       ARG  16   7.147   4.935  -1.946
  117   1HD   ARG  16          1HD       ARG  16   8.059   4.338  -4.079
  118   2HD   ARG  16          2HD       ARG  16   6.458   4.341  -4.818
  119    HE   ARG  16           HE       ARG  16   8.126   6.623  -4.274
  120   1HH1  ARG  16          1HH1      ARG  16   4.876   5.504  -4.829
  121   2HH1  ARG  16          2HH1      ARG  16   4.301   7.043  -5.378
  122   1HH2  ARG  16          1HH2      ARG  16   7.380   8.654  -4.995
  123   2HH2  ARG  16          2HH2      ARG  16   5.726   8.834  -5.473
  124    H    TRP  17           H        TRP  17   3.521   1.741  -0.460
  125    HA   TRP  17           HA       TRP  17   4.417  -0.977  -0.992
  126   1HB   TRP  17          1HB       TRP  17   3.492  -0.011   1.710
  127   2HB   TRP  17          2HB       TRP  17   3.390  -1.705   1.237
  128    HD1  TRP  17           HD       TRP  17   5.828   0.907   2.448
  129    HE1  TRP  17           1HE      TRP  17   8.133  -0.179   2.812
  130    HE3  TRP  17           3HE      TRP  17   4.943  -3.629   0.261
  131    HZ2  TRP  17           2HZ      TRP  17   9.408  -2.633   2.246
  132    HZ3  TRP  17           3HZ      TRP  17   6.758  -5.289   0.213
  133    HH2  TRP  17           HH       TRP  17   8.944  -4.800   1.185
  134    H    VAL  18           H        VAL  18   2.831  -2.245  -1.793
  135    HA   VAL  18           HA       VAL  18   0.122  -1.092  -1.880
  136    HB   VAL  18           HB       VAL  18  -0.249  -2.379  -3.916
  137   1HG1  VAL  18          1HG1      VAL  18   2.193  -0.629  -3.856
  138   2HG1  VAL  18          2HG1      VAL  18   1.511  -1.251  -5.360
  139   3HG1  VAL  18          3HG1      VAL  18   0.547  -0.201  -4.321
  140   1HG2  VAL  18          1HG2      VAL  18   2.478  -3.139  -4.466
  141   2HG2  VAL  18          2HG2      VAL  18   1.885  -3.926  -3.004
  142   3HG2  VAL  18          3HG2      VAL  18   1.009  -4.112  -4.523
  143    H    PHE  19           H        PHE  19  -1.674  -2.644  -1.934
  144    HA   PHE  19           HA       PHE  19  -1.085  -5.176  -0.568
  145   1HB   PHE  19          1HB       PHE  19  -3.154  -4.775   0.836
  146   2HB   PHE  19          2HB       PHE  19  -1.769  -3.759   1.220
  147    HD1  PHE  19           1HD      PHE  19  -1.738  -1.391   0.483
  148    HD2  PHE  19           2HD      PHE  19  -5.191  -3.847   0.079
  149    HE1  PHE  19           1HE      PHE  19  -3.129   0.618   0.195
  150    HE2  PHE  19           2HE      PHE  19  -6.587  -1.842  -0.210
  151    HZ   PHE  19           HZ       PHE  19  -5.557   0.394  -0.153
  152    H    THR  20           H        THR  20  -2.466  -6.873  -1.032
  153    HA   THR  20           HA       THR  20  -4.761  -6.414  -2.761
  154    HB   THR  20           HB       THR  20  -3.845  -8.357  -4.254
  155    HG1  THR  20           1HG      THR  20  -1.584  -8.342  -4.410
  156   1HG2  THR  20          1HG2      THR  20  -3.877  -5.559  -4.470
  157   2HG2  THR  20          2HG2      THR  20  -3.775  -6.734  -5.782
  158   3HG2  THR  20          3HG2      THR  20  -2.302  -6.070  -5.075
  159    H    LEU  21           H        LEU  21  -6.374  -7.740  -2.230
  160    HA   LEU  21           HA       LEU  21  -5.770 -10.367  -1.089
  161   1HB   LEU  21          1HB       LEU  21  -6.076  -8.810   0.788
  162   2HB   LEU  21          2HB       LEU  21  -7.667  -8.384   0.161
  163    HG   LEU  21           HG       LEU  21  -7.882 -11.092   0.425
  164   1HD1  LEU  21          1HD1      LEU  21  -6.348 -10.151   2.837
  165   2HD1  LEU  21          2HD1      LEU  21  -5.631 -11.094   1.531
  166   3HD1  LEU  21          3HD1      LEU  21  -6.940 -11.777   2.496
  167   1HD2  LEU  21          1HD2      LEU  21  -9.512 -10.582   1.923
  168   2HD2  LEU  21          2HD2      LEU  21  -9.227  -8.963   1.283
  169   3HD2  LEU  21          3HD2      LEU  21  -8.496  -9.448   2.814
  170    H    ASN  22           H        ASN  22  -7.166 -11.943  -1.684
  171    HA   ASN  22           HA       ASN  22  -9.144 -11.268  -3.688
  172   1HB   ASN  22          1HB       ASN  22  -9.337 -13.690  -4.013
  173   2HB   ASN  22          2HB       ASN  22  -7.649 -13.188  -4.039
  174   1HD2  ASN  22          1HD2      ASN  22 -10.062 -15.019  -2.416
  175   2HD2  ASN  22          2HD2      ASN  22  -9.025 -15.764  -1.252
  176    H    ASN  23           H        ASN  23 -11.302 -11.274  -3.441
  177    HA   ASN  23           HA       ASN  23 -13.312 -11.173  -2.374
  178   1HB   ASN  23          1HB       ASN  23 -13.173 -13.591  -2.652
  179   2HB   ASN  23          2HB       ASN  23 -12.252 -13.733  -1.158
  180   1HD2  ASN  23          1HD2      ASN  23 -15.128 -11.823  -1.929
  181   2HD2  ASN  23          2HD2      ASN  23 -16.137 -12.536  -0.721
  182    HA   PRO  24           HA       PRO  24 -11.333  -9.411   1.475
  183   1HB   PRO  24          1HB       PRO  24 -12.108  -6.851   1.011
  184   2HB   PRO  24          2HB       PRO  24 -10.600  -7.527   0.383
  185   1HG   PRO  24          1HG       PRO  24 -13.228  -7.148  -1.001
  186   2HG   PRO  24          2HG       PRO  24 -11.590  -6.830  -1.602
  187   1HD   PRO  24          1HD       PRO  24 -12.978  -9.059  -2.263
  188   2HD   PRO  24          2HD       PRO  24 -11.209  -9.046  -2.106
  189    H    SER  25           H        SER  25 -12.412  -8.932   3.356
  190    HA   SER  25           HA       SER  25 -15.308  -9.256   3.275
  191   1HB   SER  25          1HB       SER  25 -13.202  -9.894   5.158
  192   2HB   SER  25          2HB       SER  25 -14.499  -8.997   5.947
  193    HG   SER  25           HG       SER  25 -15.944 -10.553   5.332
  194    H    GLU  26           H        GLU  26 -16.658  -7.901   4.711
  195    HA   GLU  26           HA       GLU  26 -16.372  -5.175   4.098
  196   1HB   GLU  26          1HB       GLU  26 -18.297  -6.854   5.416
  197   2HB   GLU  26          2HB       GLU  26 -18.064  -5.382   6.348
  198   1HG   GLU  26          1HG       GLU  26 -18.303  -4.281   3.948
  199   2HG   GLU  26          2HG       GLU  26 -19.213  -5.760   3.647
  200    H    ASP  27           H        ASP  27 -15.332  -7.073   6.827
  201    HA   ASP  27           HA       ASP  27 -14.772  -4.824   8.522
  202   1HB   ASP  27          1HB       ASP  27 -14.877  -7.646   8.811
  203   2HB   ASP  27          2HB       ASP  27 -13.260  -7.132   9.285
  204    H    GLU  28           H        GLU  28 -12.869  -6.971   6.446
  205    HA   GLU  28           HA       GLU  28 -10.336  -5.945   7.093
  206   1HB   GLU  28          1HB       GLU  28 -11.393  -7.867   5.313
  207   2HB   GLU  28          2HB       GLU  28 -10.438  -6.758   4.339
  208   1HG   GLU  28          1HG       GLU  28  -8.519  -7.561   5.119
  209   2HG   GLU  28          2HG       GLU  28  -9.085  -7.526   6.788
  210    H    ARG  29           H        ARG  29 -12.551  -5.125   4.433
  211    HA   ARG  29           HA       ARG  29 -10.914  -3.115   3.312
  212   1HB   ARG  29          1HB       ARG  29 -13.900  -3.553   3.147
  213   2HB   ARG  29          2HB       ARG  29 -13.020  -2.377   2.180
  214   1HG   ARG  29          1HG       ARG  29 -12.115  -3.955   0.827
  215   2HG   ARG  29          2HG       ARG  29 -12.061  -5.175   2.101
  216   1HD   ARG  29          1HD       ARG  29 -13.691  -5.695   0.308
  217   2HD   ARG  29          2HD       ARG  29 -14.425  -5.560   1.905
  218    HE   ARG  29           HE       ARG  29 -14.617  -3.062   0.723
  219   1HH1  ARG  29          1HH1      ARG  29 -15.773  -6.292   0.130
  220   2HH1  ARG  29          2HH1      ARG  29 -17.223  -5.768  -0.661
  221   1HH2  ARG  29          1HH2      ARG  29 -16.523  -2.360  -0.317
  222   2HH2  ARG  29          2HH2      ARG  29 -17.648  -3.532  -0.915
  223    H    LYS  30           H        LYS  30 -13.256  -3.116   5.902
  224    HA   LYS  30           HA       LYS  30 -13.602  -0.300   6.066
  225   1HB   LYS  30          1HB       LYS  30 -14.331  -2.659   7.681
  226   2HB   LYS  30          2HB       LYS  30 -14.138  -1.165   8.590
  227   1HG   LYS  30          1HG       LYS  30 -15.718  -0.088   6.966
  228   2HG   LYS  30          2HG       LYS  30 -16.025  -1.698   6.311
  229   1HD   LYS  30          1HD       LYS  30 -16.261  -1.332   9.249
  230   2HD   LYS  30          2HD       LYS  30 -17.527  -0.641   8.231
  231   1HE   LYS  30          1HE       LYS  30 -17.597  -2.955   7.113
  232   2HE   LYS  30          2HE       LYS  30 -16.699  -3.511   8.524
  233   1HZ   LYS  30          1HZ       LYS  30 -19.463  -2.565   8.334
  234   2HZ   LYS  30          2HZ       LYS  30 -18.620  -2.260   9.767
  235   3HZ   LYS  30          3HZ       LYS  30 -18.822  -3.850   9.228
  236    H    LYS  31           H        LYS  31 -11.451  -2.595   7.685
  237    HA   LYS  31           HA       LYS  31 -10.290  -0.790   9.500
  238   1HB   LYS  31          1HB       LYS  31  -9.987  -3.134   9.851
  239   2HB   LYS  31          2HB       LYS  31  -9.261  -3.342   8.262
  240   1HG   LYS  31          1HG       LYS  31  -7.770  -1.419   9.785
  241   2HG   LYS  31          2HG       LYS  31  -7.955  -2.920  10.696
  242   1HD   LYS  31          1HD       LYS  31  -7.291  -3.315   7.873
  243   2HD   LYS  31          2HD       LYS  31  -6.052  -2.451   8.787
  244   1HE   LYS  31          1HE       LYS  31  -5.769  -4.930   8.757
  245   2HE   LYS  31          2HE       LYS  31  -5.883  -4.232  10.372
  246   1HZ   LYS  31          1HZ       LYS  31  -7.909  -5.170  10.737
  247   2HZ   LYS  31          2HZ       LYS  31  -7.262  -6.339   9.700
  248   3HZ   LYS  31          3HZ       LYS  31  -8.344  -5.184   9.102
  249    H    ILE  32           H        ILE  32  -9.136  -1.901   6.318
  250    HA   ILE  32           HA       ILE  32  -6.864  -0.235   6.242
  251    HB   ILE  32           HB       ILE  32  -8.424  -1.677   4.125
  252   1HG1  ILE  32          1HG1      ILE  32  -5.547  -1.906   5.029
  253   2HG1  ILE  32          2HG1      ILE  32  -6.863  -2.898   5.646
  254   1HG2  ILE  32          1HG2      ILE  32  -6.219   0.320   3.730
  255   2HG2  ILE  32          2HG2      ILE  32  -6.518  -0.976   2.573
  256   3HG2  ILE  32          3HG2      ILE  32  -7.775   0.215   2.907
  257   1HD1  ILE  32          1HD1      ILE  32  -6.725  -4.280   3.922
  258   2HD1  ILE  32          2HD1      ILE  32  -6.762  -2.951   2.763
  259   3HD1  ILE  32          3HD1      ILE  32  -5.232  -3.451   3.482
  260    H    ARG  33           H        ARG  33 -10.169   0.201   5.064
  261    HA   ARG  33           HA       ARG  33  -9.666   2.697   3.787
  262   1HB   ARG  33          1HB       ARG  33 -11.553   1.422   3.059
  263   2HB   ARG  33          2HB       ARG  33 -12.205   1.342   4.690
  264   1HG   ARG  33          1HG       ARG  33 -12.910   3.559   4.651
  265   2HG   ARG  33          2HG       ARG  33 -11.847   3.969   3.303
  266   1HD   ARG  33          1HD       ARG  33 -13.913   3.855   2.275
  267   2HD   ARG  33          2HD       ARG  33 -13.269   2.238   1.993
  268    HE   ARG  33           HE       ARG  33 -14.922   1.382   3.328
  269   1HH1  ARG  33          1HH1      ARG  33 -14.725   4.825   3.809
  270   2HH1  ARG  33          2HH1      ARG  33 -16.163   4.904   4.772
  271   1HH2  ARG  33          1HH2      ARG  33 -16.817   1.474   4.595
  272   2HH2  ARG  33          2HH2      ARG  33 -17.351   2.997   5.219
  273    H    ASP  34           H        ASP  34 -10.216   1.745   7.040
  274    HA   ASP  34           HA       ASP  34 -10.907   4.470   7.858
  275   1HB   ASP  34          1HB       ASP  34 -12.206   2.535   8.765
  276   2HB   ASP  34          2HB       ASP  34 -10.736   1.976   9.560
  277    H    LEU  35           H        LEU  35  -8.176   3.068   7.070
  278    HA   LEU  35           HA       LEU  35  -6.501   3.319   9.328
  279   1HB   LEU  35          1HB       LEU  35  -6.065   3.175   6.380
  280   2HB   LEU  35          2HB       LEU  35  -4.719   3.609   7.431
  281    HG   LEU  35           HG       LEU  35  -6.314   1.059   7.661
  282   1HD1  LEU  35          1HD1      LEU  35  -3.655   1.605   6.356
  283   2HD1  LEU  35          2HD1      LEU  35  -5.127   1.023   5.579
  284   3HD1  LEU  35          3HD1      LEU  35  -4.274  -0.004   6.731
  285   1HD2  LEU  35          1HD2      LEU  35  -3.730   1.937   8.946
  286   2HD2  LEU  35          2HD2      LEU  35  -4.484   0.352   9.118
  287   3HD2  LEU  35          3HD2      LEU  35  -5.291   1.787   9.753
  288    HA   PRO  36           HA       PRO  36  -5.693   7.617   9.677
  289   1HB   PRO  36          1HB       PRO  36  -3.031   7.672  10.209
  290   2HB   PRO  36          2HB       PRO  36  -4.232   7.110  11.377
  291   1HG   PRO  36          1HG       PRO  36  -2.466   5.516   9.559
  292   2HG   PRO  36          2HG       PRO  36  -2.866   5.231  11.263
  293   1HD   PRO  36          1HD       PRO  36  -4.060   3.883   9.241
  294   2HD   PRO  36          2HD       PRO  36  -4.900   4.274  10.756
  295    H    ILE  37           H        ILE  37  -5.769   8.963   7.994
  296    HA   ILE  37           HA       ILE  37  -4.371   8.536   5.562
  297    HB   ILE  37           HB       ILE  37  -5.156  10.849   4.983
  298   1HG1  ILE  37          1HG1      ILE  37  -6.489  10.679   7.695
  299   2HG1  ILE  37          2HG1      ILE  37  -5.141  11.739   7.296
  300   1HG2  ILE  37          1HG2      ILE  37  -6.592   8.464   5.275
  301   2HG2  ILE  37          2HG2      ILE  37  -7.659   9.742   5.854
  302   3HG2  ILE  37          3HG2      ILE  37  -6.979   9.830   4.229
  303   1HD1  ILE  37          1HD1      ILE  37  -6.790  13.227   6.970
  304   2HD1  ILE  37          2HD1      ILE  37  -6.877  12.462   5.383
  305   3HD1  ILE  37          3HD1      ILE  37  -8.000  11.983   6.656
  306    H    SER  38           H        SER  38  -3.758  10.491   8.409
  307    HA   SER  38           HA       SER  38  -1.696  12.089   7.315
  308   1HB   SER  38          1HB       SER  38  -3.016  11.865   9.794
  309   2HB   SER  38          2HB       SER  38  -1.303  11.614  10.132
  310    HG   SER  38           HG       SER  38  -0.869  13.616   9.522
  311    H    LEU  39           H        LEU  39  -1.804   8.825   8.381
  312    HA   LEU  39           HA       LEU  39   0.971   8.525   8.980
  313   1HB   LEU  39          1HB       LEU  39  -1.215   7.031   9.467
  314   2HB   LEU  39          2HB       LEU  39  -0.566   6.174   8.071
  315    HG   LEU  39           HG       LEU  39   1.339   6.760  10.257
  316   1HD1  LEU  39          1HD1      LEU  39  -0.683   6.123  11.495
  317   2HD1  LEU  39          2HD1      LEU  39   0.581   4.899  11.613
  318   3HD1  LEU  39          3HD1      LEU  39  -0.793   4.646  10.537
  319   1HD2  LEU  39          1HD2      LEU  39   1.337   4.065   9.481
  320   2HD2  LEU  39          2HD2      LEU  39   2.481   5.323   9.010
  321   3HD2  LEU  39          3HD2      LEU  39   1.065   4.998   8.009
  322    H    PHE  40           H        PHE  40  -0.960   8.367   6.090
  323    HA   PHE  40           HA       PHE  40   1.470   7.714   4.557
  324   1HB   PHE  40          1HB       PHE  40  -1.292   7.032   3.583
  325   2HB   PHE  40          2HB       PHE  40   0.255   6.379   3.053
  326    HD1  PHE  40           2HD      PHE  40  -2.326   6.267   5.653
  327    HD2  PHE  40           1HD      PHE  40   1.323   4.591   4.240
  328    HE1  PHE  40           2HE      PHE  40  -2.609   4.365   7.187
  329    HE2  PHE  40           1HE      PHE  40   1.044   2.685   5.771
  330    HZ   PHE  40           HZ       PHE  40  -0.923   2.571   7.249
  331    H    ASP  41           H        ASP  41   2.121   9.407   3.423
  332    HA   ASP  41           HA       ASP  41   0.767  11.783   3.064
  333   1HB   ASP  41          1HB       ASP  41   2.376  12.090   1.073
  334   2HB   ASP  41          2HB       ASP  41   3.078  11.850   2.671
  335    H    TYR  42           H        TYR  42   0.553   8.839   1.224
  336    HA   TYR  42           HA       TYR  42  -1.631  10.009  -0.330
  337   1HB   TYR  42          1HB       TYR  42   0.330  10.181  -1.780
  338   2HB   TYR  42          2HB       TYR  42   0.672   8.471  -1.549
  339    HD1  TYR  42           1HD      TYR  42  -2.657  10.004  -2.118
  340    HD2  TYR  42           2HD      TYR  42   0.503   7.675  -3.760
  341    HE1  TYR  42           1HE      TYR  42  -4.070   9.466  -4.058
  342    HE2  TYR  42           2HE      TYR  42  -0.901   7.131  -5.705
  343    HH   TYR  42           HH       TYR  42  -4.167   8.479  -6.049
  344    H    PHE  43           H        PHE  43  -3.359   8.743  -0.257
  345    HA   PHE  43           HA       PHE  43  -2.992   5.843   0.034
  346   1HB   PHE  43          1HB       PHE  43  -3.724   7.329   2.155
  347   2HB   PHE  43          2HB       PHE  43  -5.308   7.053   1.438
  348    HD1  PHE  43           1HD      PHE  43  -4.294   4.269   0.288
  349    HD2  PHE  43           2HD      PHE  43  -4.410   6.074   4.141
  350    HE1  PHE  43           1HE      PHE  43  -4.375   2.040   1.326
  351    HE2  PHE  43           2HE      PHE  43  -4.490   3.848   5.185
  352    HZ   PHE  43           HZ       PHE  43  -4.472   1.827   3.778
  353    H    ILE  44           H        ILE  44  -3.875   4.902  -1.675
  354    HA   ILE  44           HA       ILE  44  -6.502   5.824  -2.600
  355    HB   ILE  44           HB       ILE  44  -5.126   6.831  -4.218
  356   1HG1  ILE  44          1HG1      ILE  44  -5.478   4.329  -5.753
  357   2HG1  ILE  44          2HG1      ILE  44  -6.917   4.920  -4.928
  358   1HG2  ILE  44          1HG2      ILE  44  -3.377   5.387  -5.441
  359   2HG2  ILE  44          2HG2      ILE  44  -2.990   5.998  -3.834
  360   3HG2  ILE  44          3HG2      ILE  44  -3.500   4.323  -4.040
  361   1HD1  ILE  44          1HD1      ILE  44  -5.926   5.734  -7.395
  362   2HD1  ILE  44          2HD1      ILE  44  -7.231   6.475  -6.468
  363   3HD1  ILE  44          3HD1      ILE  44  -5.578   7.065  -6.293
  364    H    VAL  45           H        VAL  45  -7.860   4.175  -2.477
  365    HA   VAL  45           HA       VAL  45  -6.844   1.464  -3.038
  366    HB   VAL  45           HB       VAL  45  -9.232   1.941  -1.289
  367   1HG1  VAL  45          1HG1      VAL  45  -7.769  -0.221  -0.377
  368   2HG1  VAL  45          2HG1      VAL  45  -9.206  -0.286  -1.399
  369   3HG1  VAL  45          3HG1      VAL  45  -7.601  -0.307  -2.131
  370   1HG2  VAL  45          1HG2      VAL  45  -6.343   2.190  -0.531
  371   2HG2  VAL  45          2HG2      VAL  45  -7.698   3.236  -0.106
  372   3HG2  VAL  45          3HG2      VAL  45  -7.546   1.644   0.638
  373    H    GLY  46           H        GLY  46  -8.025   0.160  -4.376
  374   1HA   GLY  46          1HA       GLY  46 -10.593   1.193  -5.376
  375   2HA   GLY  46          2HA       GLY  46  -9.321   0.791  -6.520
  376    H    GLU  47           H        GLU  47 -12.118  -0.315  -5.529
  377    HA   GLU  47           HA       GLU  47 -11.387  -3.088  -5.052
  378   1HB   GLU  47          1HB       GLU  47 -13.235  -2.131  -3.771
  379   2HB   GLU  47          2HB       GLU  47 -14.093  -1.756  -5.259
  380   1HG   GLU  47          1HG       GLU  47 -14.504  -4.020  -5.722
  381   2HG   GLU  47          2HG       GLU  47 -13.325  -4.560  -4.528
  382    H    GLU  48           H        GLU  48 -11.483  -4.696  -6.513
  383    HA   GLU  48           HA       GLU  48 -12.415  -4.000  -9.220
  384   1HB   GLU  48          1HB       GLU  48 -10.009  -4.396  -9.135
  385   2HB   GLU  48          2HB       GLU  48 -10.274  -5.960  -8.376
  386   1HG   GLU  48          1HG       GLU  48  -9.743  -6.039 -10.812
  387   2HG   GLU  48          2HG       GLU  48 -11.234  -6.855 -10.347
  388    H    GLY  49           H        GLY  49 -14.380  -4.840  -9.519
  389   1HA   GLY  49          1HA       GLY  49 -14.739  -7.692  -9.368
  390   2HA   GLY  49          2HA       GLY  49 -15.668  -6.818  -8.158
  391    H    ASN  50           H        ASN  50 -14.993  -6.737 -11.657
  392    HA   ASN  50           HA       ASN  50 -17.826  -6.039 -12.073
  393   1HB   ASN  50          1HB       ASN  50 -15.595  -4.597 -12.867
  394   2HB   ASN  50          2HB       ASN  50 -16.061  -5.467 -14.326
  395   1HD2  ASN  50          1HD2      ASN  50 -17.651  -3.732 -11.666
  396   2HD2  ASN  50          2HD2      ASN  50 -18.734  -2.839 -12.673
  397    H    GLU  51           H        GLU  51 -16.729  -8.710 -11.812
  398    HA   GLU  51           HA       GLU  51 -17.442  -9.732 -14.477
  399   1HB   GLU  51          1HB       GLU  51 -15.174 -10.601 -12.697
  400   2HB   GLU  51          2HB       GLU  51 -15.834 -11.656 -13.939
  401   1HG   GLU  51          1HG       GLU  51 -15.332  -9.900 -15.619
  402   2HG   GLU  51          2HG       GLU  51 -14.540  -8.972 -14.347
  403    H    GLU  52           H        GLU  52 -19.450 -10.477 -14.106
  404    HA   GLU  52           HA       GLU  52 -20.460 -11.484 -11.720
  405   1HB   GLU  52          1HB       GLU  52 -21.641 -10.827 -13.965
  406   2HB   GLU  52          2HB       GLU  52 -21.446 -12.531 -14.348
  407   1HG   GLU  52          1HG       GLU  52 -22.893 -13.211 -12.692
  408   2HG   GLU  52          2HG       GLU  52 -22.674 -11.737 -11.750
  409    H    GLY  53           H        GLY  53 -20.752 -13.546 -10.889
  410   1HA   GLY  53          1HA       GLY  53 -20.537 -15.890 -10.843
  411   2HA   GLY  53          2HA       GLY  53 -19.554 -15.806 -12.297
  412    H    ARG  54           H        ARG  54 -18.028 -13.547 -10.869
  413    HA   ARG  54           HA       ARG  54 -16.308 -15.339  -9.286
  414   1HB   ARG  54          1HB       ARG  54 -15.385 -14.370 -11.443
  415   2HB   ARG  54          2HB       ARG  54 -15.442 -12.797 -10.659
  416   1HG   ARG  54          1HG       ARG  54 -13.861 -13.487  -9.006
  417   2HG   ARG  54          2HG       ARG  54 -13.917 -15.155  -9.580
  418   1HD   ARG  54          1HD       ARG  54 -12.009 -14.441 -10.617
  419   2HD   ARG  54          2HD       ARG  54 -13.199 -14.041 -11.855
  420    HE   ARG  54           HE       ARG  54 -12.774 -11.817 -11.500
  421   1HH1  ARG  54          1HH1      ARG  54 -11.429 -13.678  -8.884
  422   2HH1  ARG  54          2HH1      ARG  54 -10.581 -12.335  -8.191
  423   1HH2  ARG  54          1HH2      ARG  54 -11.663 -10.041 -10.598
  424   2HH2  ARG  54          2HH2      ARG  54 -10.716 -10.266  -9.166
  425    H    THR  55           H        THR  55 -15.046 -14.259  -7.558
  426    HA   THR  55           HA       THR  55 -16.802 -12.518  -6.026
  427    HB   THR  55           HB       THR  55 -14.582 -12.917  -4.451
  428    HG1  THR  55           1HG      THR  55 -15.070 -15.403  -5.727
  429   1HG2  THR  55          1HG2      THR  55 -17.232 -13.420  -4.290
  430   2HG2  THR  55          2HG2      THR  55 -16.057 -13.967  -3.093
  431   3HG2  THR  55          3HG2      THR  55 -16.603 -15.065  -4.360
  432    HA   PRO  56           HA       PRO  56 -14.581  -8.772  -6.565
  433   1HB   PRO  56          1HB       PRO  56 -14.682  -7.680  -4.081
  434   2HB   PRO  56          2HB       PRO  56 -16.092  -7.786  -5.142
  435   1HG   PRO  56          1HG       PRO  56 -15.299  -9.558  -2.862
  436   2HG   PRO  56          2HG       PRO  56 -16.900  -8.919  -3.279
  437   1HD   PRO  56          1HD       PRO  56 -16.138 -11.447  -3.879
  438   2HD   PRO  56          2HD       PRO  56 -17.255 -10.518  -4.900
  439    H    HIS  57           H        HIS  57 -12.655  -7.582  -5.998
  440    HA   HIS  57           HA       HIS  57 -10.756  -8.974  -4.258
  441   1HB   HIS  57          1HB       HIS  57 -10.262  -9.853  -6.456
  442   2HB   HIS  57          2HB       HIS  57 -10.233  -8.231  -7.142
  443    HD1  HIS  57           1HD      HIS  57  -8.138  -6.774  -6.650
  444    HD2  HIS  57           2HD      HIS  57  -7.933 -10.642  -5.148
  445    HE1  HIS  57           1HE      HIS  57  -5.727  -7.126  -6.027
  446    H    LEU  58           H        LEU  58  -9.368  -7.649  -3.182
  447    HA   LEU  58           HA       LEU  58  -9.813  -4.776  -3.512
  448   1HB   LEU  58          1HB       LEU  58  -9.668  -6.403  -1.283
  449   2HB   LEU  58          2HB       LEU  58  -8.106  -5.586  -1.301
  450    HG   LEU  58           HG       LEU  58 -10.835  -4.314  -1.152
  451   1HD1  LEU  58          1HD1      LEU  58  -8.540  -4.621   0.756
  452   2HD1  LEU  58          2HD1      LEU  58 -10.231  -5.069   0.980
  453   3HD1  LEU  58          3HD1      LEU  58  -9.765  -3.368   0.959
  454   1HD2  LEU  58          1HD2      LEU  58  -9.780  -2.731  -2.412
  455   2HD2  LEU  58          2HD2      LEU  58  -8.173  -3.192  -1.851
  456   3HD2  LEU  58          3HD2      LEU  58  -9.232  -2.241  -0.809
  457    H    GLN  59           H        GLN  59  -8.291  -3.422  -4.242
  458    HA   GLN  59           HA       GLN  59  -5.487  -4.165  -4.183
  459   1HB   GLN  59          1HB       GLN  59  -5.981  -5.157  -6.261
  460   2HB   GLN  59          2HB       GLN  59  -7.058  -3.848  -6.727
  461   1HG   GLN  59          1HG       GLN  59  -4.983  -3.768  -7.981
  462   2HG   GLN  59          2HG       GLN  59  -5.160  -2.346  -6.955
  463   1HE2  GLN  59          1HE2      GLN  59  -3.003  -4.515  -8.033
  464   2HE2  GLN  59          2HE2      GLN  59  -1.864  -4.491  -6.735
  465    H    GLY  60           H        GLY  60  -4.603  -2.429  -3.275
  466   1HA   GLY  60          1HA       GLY  60  -5.098   0.187  -4.487
  467   2HA   GLY  60          2HA       GLY  60  -5.445   0.019  -2.772
  468    H    PHE  61           H        PHE  61  -3.649   1.887  -3.506
  469    HA   PHE  61           HA       PHE  61  -1.097   0.706  -2.634
  470   1HB   PHE  61          1HB       PHE  61  -0.724   1.233  -4.914
  471   2HB   PHE  61          2HB       PHE  61  -1.581   2.765  -4.781
  472    HD1  PHE  61           2HD      PHE  61   1.218   1.162  -2.899
  473    HD2  PHE  61           1HD      PHE  61  -0.179   4.549  -5.065
  474    HE1  PHE  61           2HE      PHE  61   3.351   2.311  -2.471
  475    HE2  PHE  61           1HE      PHE  61   1.953   5.703  -4.641
  476    HZ   PHE  61           HZ       PHE  61   3.721   4.585  -3.342
  477    H    ALA  62           H        ALA  62   0.029   1.804  -1.087
  478    HA   ALA  62           HA       ALA  62  -1.016   4.403  -0.206
  479   1HB   ALA  62          1HB       ALA  62  -0.245   3.034   2.124
  480   2HB   ALA  62          2HB       ALA  62  -1.870   3.528   1.646
  481   3HB   ALA  62          3HB       ALA  62  -1.271   1.928   1.210
  482    H    ASN  63           H        ASN  63   0.548   5.856   0.041
  483    HA   ASN  63           HA       ASN  63   3.321   4.974  -0.024
  484   1HB   ASN  63          1HB       ASN  63   2.459   6.822  -1.505
  485   2HB   ASN  63          2HB       ASN  63   2.268   7.807  -0.057
  486   1HD2  ASN  63          1HD2      ASN  63   4.274   7.090  -2.562
  487   2HD2  ASN  63          2HD2      ASN  63   5.769   7.648  -1.900
  488    H    PHE  64           H        PHE  64   4.308   4.558   1.833
  489    HA   PHE  64           HA       PHE  64   3.364   5.498   4.348
  490   1HB   PHE  64          1HB       PHE  64   5.336   3.620   3.387
  491   2HB   PHE  64          2HB       PHE  64   6.005   4.602   4.686
  492    HD1  PHE  64           2HD      PHE  64   4.557   4.812   6.823
  493    HD2  PHE  64           1HD      PHE  64   4.052   1.771   3.889
  494    HE1  PHE  64           2HE      PHE  64   3.394   3.412   8.479
  495    HE2  PHE  64           1HE      PHE  64   2.888   0.366   5.540
  496    HZ   PHE  64           HZ       PHE  64   2.559   1.186   7.839
  497    H    VAL  65           H        VAL  65   3.804   7.333   5.374
  498    HA   VAL  65           HA       VAL  65   5.288   9.411   4.224
  499    HB   VAL  65           HB       VAL  65   4.448   9.040   7.102
  500   1HG1  VAL  65          1HG1      VAL  65   4.598  11.711   6.763
  501   2HG1  VAL  65          2HG1      VAL  65   5.903  10.732   7.435
  502   3HG1  VAL  65          3HG1      VAL  65   5.928  11.188   5.731
  503   1HG2  VAL  65          1HG2      VAL  65   3.163  10.793   5.028
  504   2HG2  VAL  65          2HG2      VAL  65   2.681   9.113   5.265
  505   3HG2  VAL  65          3HG2      VAL  65   2.514  10.272   6.583
  506    H    LYS  66           H        LYS  66   6.275   6.735   6.139
  507    HA   LYS  66           HA       LYS  66   8.981   7.884   6.331
  508   1HB   LYS  66          1HB       LYS  66   7.390   6.357   8.359
  509   2HB   LYS  66          2HB       LYS  66   9.144   6.224   8.355
  510   1HG   LYS  66          1HG       LYS  66   8.805   7.927   9.856
  511   2HG   LYS  66          2HG       LYS  66   9.073   8.824   8.360
  512   1HD   LYS  66          1HD       LYS  66   7.195   9.841   9.319
  513   2HD   LYS  66          2HD       LYS  66   6.527   8.766   8.088
  514   1HE   LYS  66          1HE       LYS  66   5.206   8.002   9.723
  515   2HE   LYS  66          2HE       LYS  66   6.636   7.145  10.294
  516   1HZ   LYS  66          1HZ       LYS  66   5.491   9.680  11.281
  517   2HZ   LYS  66          2HZ       LYS  66   7.111   9.290  11.573
  518   3HZ   LYS  66          3HZ       LYS  66   5.881   8.283  12.152
  519    H    LYS  67           H        LYS  67  10.486   5.821   7.005
  520    HA   LYS  67           HA       LYS  67  10.197   4.010   4.727
  521   1HB   LYS  67          1HB       LYS  67  12.429   5.177   6.182
  522   2HB   LYS  67          2HB       LYS  67  12.613   3.439   5.986
  523   1HG   LYS  67          1HG       LYS  67  13.679   4.413   4.134
  524   2HG   LYS  67          2HG       LYS  67  12.140   3.797   3.528
  525   1HD   LYS  67          1HD       LYS  67  11.888   5.843   2.646
  526   2HD   LYS  67          2HD       LYS  67  11.480   6.339   4.291
  527   1HE   LYS  67          1HE       LYS  67  14.141   6.513   4.445
  528   2HE   LYS  67          2HE       LYS  67  13.949   6.796   2.716
  529   1HZ   LYS  67          1HZ       LYS  67  12.174   8.480   3.479
  530   2HZ   LYS  67          2HZ       LYS  67  13.806   8.905   3.598
  531   3HZ   LYS  67          3HZ       LYS  67  12.960   8.405   4.975
  532    H    GLN  68           H        GLN  68   9.156   2.170   5.098
  533    HA   GLN  68           HA       GLN  68   9.670   0.763   7.634
  534   1HB   GLN  68          1HB       GLN  68   7.094   1.189   6.154
  535   2HB   GLN  68          2HB       GLN  68   7.301  -0.217   7.190
  536   1HG   GLN  68          1HG       GLN  68   6.178   1.643   8.327
  537   2HG   GLN  68          2HG       GLN  68   7.696   1.191   9.102
  538   1HE2  GLN  68          1HE2      GLN  68   8.737   2.892   9.820
  539   2HE2  GLN  68          2HE2      GLN  68   8.845   4.431   9.043
  540    H    THR  69           H        THR  69   9.427  -1.584   7.522
  541    HA   THR  69           HA       THR  69  10.437  -2.595   4.970
  542    HB   THR  69           HB       THR  69  11.320  -4.445   6.126
  543    HG1  THR  69           1HG      THR  69  10.542  -5.175   8.026
  544   1HG2  THR  69          1HG2      THR  69  12.548  -2.399   6.611
  545   2HG2  THR  69          2HG2      THR  69  12.572  -3.470   8.012
  546   3HG2  THR  69          3HG2      THR  69  11.496  -2.073   7.988
  547    H    PHE  70           H        PHE  70   9.749  -4.940   4.491
  548    HA   PHE  70           HA       PHE  70   7.009  -4.953   3.887
  549   1HB   PHE  70          1HB       PHE  70   8.365  -6.262   2.485
  550   2HB   PHE  70          2HB       PHE  70   9.141  -7.074   3.842
  551    HD1  PHE  70           1HD      PHE  70   5.765  -6.662   2.312
  552    HD2  PHE  70           2HD      PHE  70   8.494  -9.219   4.344
  553    HE1  PHE  70           1HE      PHE  70   4.172  -8.525   2.100
  554    HE2  PHE  70           2HE      PHE  70   6.906 -11.086   4.135
  555    HZ   PHE  70           HZ       PHE  70   4.741 -10.741   3.012
  556    H    ASN  71           H        ASN  71   8.812  -6.891   6.276
  557    HA   ASN  71           HA       ASN  71   6.584  -8.176   7.389
  558   1HB   ASN  71          1HB       ASN  71   9.331  -8.241   7.782
  559   2HB   ASN  71          2HB       ASN  71   8.706  -7.657   9.321
  560   1HD2  ASN  71          1HD2      ASN  71   9.950 -10.220   8.549
  561   2HD2  ASN  71          2HD2      ASN  71   8.825 -11.438   9.033
  562    H    LYS  72           H        LYS  72   8.177  -5.135   8.224
  563    HA   LYS  72           HA       LYS  72   6.682  -4.602  10.560
  564   1HB   LYS  72          1HB       LYS  72   8.851  -3.472   9.485
  565   2HB   LYS  72          2HB       LYS  72   7.647  -2.338   8.888
  566   1HG   LYS  72          1HG       LYS  72   7.816  -3.085  11.788
  567   2HG   LYS  72          2HG       LYS  72   8.793  -1.790  11.092
  568   1HD   LYS  72          1HD       LYS  72   6.887  -0.521  10.525
  569   2HD   LYS  72          2HD       LYS  72   5.803  -1.891  10.777
  570   1HE   LYS  72          1HE       LYS  72   5.481  -0.593  12.680
  571   2HE   LYS  72          2HE       LYS  72   6.630  -1.818  13.215
  572   1HZ   LYS  72          1HZ       LYS  72   7.321   0.337  13.980
  573   2HZ   LYS  72          2HZ       LYS  72   7.274   0.967  12.411
  574   3HZ   LYS  72          3HZ       LYS  72   8.422  -0.208  12.816
  575    H    VAL  73           H        VAL  73   6.294  -3.461   7.211
  576    HA   VAL  73           HA       VAL  73   4.062  -1.856   7.562
  577    HB   VAL  73           HB       VAL  73   4.885  -3.536   5.196
  578   1HG1  VAL  73          1HG1      VAL  73   2.569  -1.661   5.525
  579   2HG1  VAL  73          2HG1      VAL  73   3.321  -1.919   3.950
  580   3HG1  VAL  73          3HG1      VAL  73   2.599  -3.275   4.816
  581   1HG2  VAL  73          1HG2      VAL  73   4.934  -0.556   5.303
  582   2HG2  VAL  73          2HG2      VAL  73   6.199  -1.466   6.130
  583   3HG2  VAL  73          3HG2      VAL  73   5.959  -1.668   4.395
  584    H    LYS  74           H        LYS  74   4.322  -5.304   7.600
  585    HA   LYS  74           HA       LYS  74   1.646  -5.970   7.000
  586   1HB   LYS  74          1HB       LYS  74   3.641  -7.457   8.719
  587   2HB   LYS  74          2HB       LYS  74   2.156  -8.131   8.063
  588   1HG   LYS  74          1HG       LYS  74   3.443  -7.124   5.840
  589   2HG   LYS  74          2HG       LYS  74   4.752  -7.788   6.820
  590   1HD   LYS  74          1HD       LYS  74   4.182  -9.709   5.775
  591   2HD   LYS  74          2HD       LYS  74   2.951  -9.777   7.038
  592   1HE   LYS  74          1HE       LYS  74   1.316  -8.803   5.561
  593   2HE   LYS  74          2HE       LYS  74   2.538  -8.545   4.316
  594   1HZ   LYS  74          1HZ       LYS  74   1.969 -11.255   5.335
  595   2HZ   LYS  74          2HZ       LYS  74   2.666 -10.800   3.863
  596   3HZ   LYS  74          3HZ       LYS  74   1.010 -10.570   4.121
  597    H    TRP  75           H        TRP  75   2.972  -4.369   9.645
  598    HA   TRP  75           HA       TRP  75   1.265  -5.325  11.710
  599   1HB   TRP  75          1HB       TRP  75   2.164  -3.612  13.051
  600   2HB   TRP  75          2HB       TRP  75   3.471  -4.032  11.948
  601    HD1  TRP  75           HD       TRP  75   2.533  -2.316   9.430
  602    HE1  TRP  75           1HE      TRP  75   2.718   0.250   9.516
  603    HE3  TRP  75           3HE      TRP  75   2.666  -1.680  14.501
  604    HZ2  TRP  75           2HZ      TRP  75   2.898   2.275  11.473
  605    HZ3  TRP  75           3HZ      TRP  75   2.846   0.604  15.399
  606    HH2  TRP  75           HH       TRP  75   2.960   2.539  13.915
  607    H    TYR  76           H        TYR  76   0.818  -3.178   9.080
  608    HA   TYR  76           HA       TYR  76  -1.685  -2.180  10.272
  609   1HB   TYR  76          1HB       TYR  76   0.390  -0.895   8.655
  610   2HB   TYR  76          2HB       TYR  76  -1.238  -0.614   8.048
  611    HD1  TYR  76           2HD      TYR  76  -2.750  -0.550  10.613
  612    HD2  TYR  76           1HD      TYR  76   0.987   1.184   9.549
  613    HE1  TYR  76           2HE      TYR  76  -3.084   1.198  12.311
  614    HE2  TYR  76           1HE      TYR  76   0.663   2.936  11.245
  615    HH   TYR  76           HH       TYR  76  -1.420   2.752  13.703
  616    H    LEU  77           H        LEU  77  -0.242  -3.204   7.183
  617    HA   LEU  77           HA       LEU  77  -2.764  -3.498   5.878
  618   1HB   LEU  77          1HB       LEU  77  -0.000  -4.471   5.187
  619   2HB   LEU  77          2HB       LEU  77  -1.403  -4.699   4.145
  620    HG   LEU  77           HG       LEU  77  -0.168  -2.064   4.941
  621   1HD1  LEU  77          1HD1      LEU  77  -0.149  -3.693   2.420
  622   2HD1  LEU  77          2HD1      LEU  77   1.218  -3.042   3.324
  623   3HD1  LEU  77          3HD1      LEU  77   0.163  -1.957   2.419
  624   1HD2  LEU  77          1HD2      LEU  77  -2.555  -1.803   4.761
  625   2HD2  LEU  77          2HD2      LEU  77  -2.574  -2.680   3.231
  626   3HD2  LEU  77          3HD2      LEU  77  -1.789  -1.104   3.335
  627    H    GLY  78           H        GLY  78  -1.127  -5.366   8.152
  628   1HA   GLY  78          1HA       GLY  78  -1.623  -7.411   9.077
  629   2HA   GLY  78          2HA       GLY  78  -3.088  -7.416   8.106
  630    H    ALA  79           H        ALA  79  -1.398  -9.664   8.683
  631    HA   ALA  79           HA       ALA  79   0.213 -10.244   6.389
  632   1HB   ALA  79          1HB       ALA  79  -0.547 -11.617   8.875
  633   2HB   ALA  79          2HB       ALA  79  -0.222 -12.672   7.499
  634   3HB   ALA  79          3HB       ALA  79   1.009 -11.536   8.049
  635    H    ARG  80           H        ARG  80  -3.123 -10.699   7.259
  636    HA   ARG  80           HA       ARG  80  -3.881 -12.772   5.589
  637   1HB   ARG  80          1HB       ARG  80  -5.504 -10.283   6.141
  638   2HB   ARG  80          2HB       ARG  80  -6.121 -11.864   5.681
  639   1HG   ARG  80          1HG       ARG  80  -4.571 -12.264   7.989
  640   2HG   ARG  80          2HG       ARG  80  -5.557 -10.830   8.283
  641   1HD   ARG  80          1HD       ARG  80  -6.823 -12.702   9.011
  642   2HD   ARG  80          2HD       ARG  80  -7.538 -12.156   7.494
  643    HE   ARG  80           HE       ARG  80  -5.668 -14.134   6.894
  644   1HH1  ARG  80          1HH1      ARG  80  -8.706 -13.809   8.563
  645   2HH1  ARG  80          2HH1      ARG  80  -9.205 -15.437   8.242
  646   1HH2  ARG  80          1HH2      ARG  80  -6.314 -16.280   6.465
  647   2HH2  ARG  80          2HH2      ARG  80  -7.844 -16.842   7.050
  648    H    CYS  81           H        CYS  81  -3.515  -9.331   4.842
  649    HA   CYS  81           HA       CYS  81  -4.194  -9.805   2.051
  650   1HB   CYS  81          1HB       CYS  81  -3.311  -7.202   3.299
  651   2HB   CYS  81          2HB       CYS  81  -4.190  -7.430   1.791
  652    HG   CYS  81           HG       CYS  81  -5.409  -7.883   4.954
  653    H    HIS  82           H        HIS  82  -2.772  -9.854   0.399
  654    HA   HIS  82           HA       HIS  82  -0.005 -10.241   0.992
  655   1HB   HIS  82          1HB       HIS  82  -0.993 -11.525  -0.789
  656   2HB   HIS  82          2HB       HIS  82  -1.505 -10.063  -1.626
  657    HD1  HIS  82           1HD      HIS  82   1.397 -12.314  -1.145
  658    HD2  HIS  82           2HD      HIS  82   0.583  -8.662  -2.953
  659    HE1  HIS  82           1HE      HIS  82   3.371 -11.844  -2.630
  660    H    ILE  83           H        ILE  83   1.649  -8.847   0.878
  661    HA   ILE  83           HA       ILE  83   1.070  -6.128  -0.096
  662    HB   ILE  83           HB       ILE  83   3.332  -6.756   1.768
  663   1HG1  ILE  83          1HG1      ILE  83   0.452  -6.237   2.536
  664   2HG1  ILE  83          2HG1      ILE  83   1.375  -7.701   2.854
  665   1HG2  ILE  83          1HG2      ILE  83   3.222  -4.562   0.655
  666   2HG2  ILE  83          2HG2      ILE  83   1.641  -4.290   1.386
  667   3HG2  ILE  83          3HG2      ILE  83   3.071  -4.435   2.408
  668   1HD1  ILE  83          1HD1      ILE  83   2.951  -6.152   4.172
  669   2HD1  ILE  83          2HD1      ILE  83   1.604  -5.014   4.135
  670   3HD1  ILE  83          3HD1      ILE  83   1.400  -6.598   4.883
  671    H    GLU  84           H        GLU  84   2.527  -5.091  -1.431
  672    HA   GLU  84           HA       GLU  84   4.979  -6.449  -2.204
  673   1HB   GLU  84          1HB       GLU  84   2.775  -7.020  -3.669
  674   2HB   GLU  84          2HB       GLU  84   3.343  -5.585  -4.511
  675   1HG   GLU  84          1HG       GLU  84   5.601  -6.715  -4.637
  676   2HG   GLU  84          2HG       GLU  84   4.787  -8.183  -4.097
  677    H    LYS  85           H        LYS  85   6.287  -5.103  -3.714
  678    HA   LYS  85           HA       LYS  85   6.226  -2.355  -2.828
  679   1HB   LYS  85          1HB       LYS  85   8.126  -3.677  -4.772
  680   2HB   LYS  85          2HB       LYS  85   8.364  -2.140  -3.951
  681   1HG   LYS  85          1HG       LYS  85   8.167  -3.542  -1.785
  682   2HG   LYS  85          2HG       LYS  85   8.503  -4.912  -2.847
  683   1HD   LYS  85          1HD       LYS  85  10.442  -3.249  -3.655
  684   2HD   LYS  85          2HD       LYS  85  10.261  -2.689  -1.990
  685   1HE   LYS  85          1HE       LYS  85  10.246  -5.475  -1.834
  686   2HE   LYS  85          2HE       LYS  85  11.507  -5.088  -3.004
  687   1HZ   LYS  85          1HZ       LYS  85  12.826  -4.521  -1.339
  688   2HZ   LYS  85          2HZ       LYS  85  11.616  -4.891  -0.217
  689   3HZ   LYS  85          3HZ       LYS  85  11.737  -3.324  -0.843
  690    H    ALA  86           H        ALA  86   5.570  -0.620  -3.954
  691    HA   ALA  86           HA       ALA  86   4.289  -1.070  -6.525
  692   1HB   ALA  86          1HB       ALA  86   3.812   0.635  -4.328
  693   2HB   ALA  86          2HB       ALA  86   4.168   1.663  -5.717
  694   3HB   ALA  86          3HB       ALA  86   2.868   0.475  -5.809
  695    H    LYS  87           H        LYS  87   4.646   0.376  -8.337
  696    HA   LYS  87           HA       LYS  87   7.257   1.706  -8.378
  697   1HB   LYS  87          1HB       LYS  87   7.971   0.623 -10.368
  698   2HB   LYS  87          2HB       LYS  87   7.448  -0.651  -9.274
  699   1HG   LYS  87          1HG       LYS  87   5.156  -0.269 -10.581
  700   2HG   LYS  87          2HG       LYS  87   6.283   0.252 -11.836
  701   1HD   LYS  87          1HD       LYS  87   7.532  -1.921 -11.399
  702   2HD   LYS  87          2HD       LYS  87   6.118  -2.423 -10.468
  703   1HE   LYS  87          1HE       LYS  87   5.286  -3.171 -12.398
  704   2HE   LYS  87          2HE       LYS  87   5.036  -1.478 -12.824
  705   1HZ   LYS  87          1HZ       LYS  87   6.619  -3.292 -14.147
  706   2HZ   LYS  87          2HZ       LYS  87   7.712  -2.284 -13.340
  707   3HZ   LYS  87          3HZ       LYS  87   6.572  -1.619 -14.398
  708    H    GLY  88           H        GLY  88   7.390   3.469  -9.733
  709   1HA   GLY  88          1HA       GLY  88   6.573   4.704 -11.664
  710   2HA   GLY  88          2HA       GLY  88   4.962   4.117 -11.281
  711    H    THR  89           H        THR  89   4.473   6.455 -11.485
  712    HA   THR  89           HA       THR  89   5.222   7.995  -9.099
  713    HB   THR  89           HB       THR  89   4.637   9.980 -10.259
  714    HG1  THR  89           1HG      THR  89   3.449   8.250 -12.186
  715   1HG2  THR  89          1HG2      THR  89   5.844   8.331 -12.460
  716   2HG2  THR  89          2HG2      THR  89   6.744   8.688 -10.986
  717   3HG2  THR  89          3HG2      THR  89   6.182  10.004 -12.016
  718    H    ASP  90           H        ASP  90   3.389   9.590  -8.438
  719    HA   ASP  90           HA       ASP  90   1.330   8.138  -7.276
  720   1HB   ASP  90          1HB       ASP  90   0.465  10.182  -6.518
  721   2HB   ASP  90          2HB       ASP  90   2.182  10.512  -6.733
  722    H    GLN  91           H        GLN  91   1.434   9.826 -10.360
  723    HA   GLN  91           HA       GLN  91  -1.337   9.606 -10.934
  724   1HB   GLN  91          1HB       GLN  91   0.275  11.204 -12.023
  725   2HB   GLN  91          2HB       GLN  91   0.920   9.840 -12.927
  726   1HG   GLN  91          1HG       GLN  91  -0.736  11.234 -14.161
  727   2HG   GLN  91          2HG       GLN  91  -1.129   9.518 -14.073
  728   1HE2  GLN  91          1HE2      GLN  91  -1.541  12.089 -11.682
  729   2HE2  GLN  91          2HE2      GLN  91  -3.256  11.930 -11.546
  730    H    GLN  92           H        GLN  92   1.450   7.553 -11.539
  731    HA   GLN  92           HA       GLN  92   0.158   5.760 -13.316
  732   1HB   GLN  92          1HB       GLN  92   2.692   5.788 -11.767
  733   2HB   GLN  92          2HB       GLN  92   2.100   4.219 -12.298
  734   1HG   GLN  92          1HG       GLN  92   1.857   5.698 -14.571
  735   2HG   GLN  92          2HG       GLN  92   3.295   6.401 -13.832
  736   1HE2  GLN  92          1HE2      GLN  92   5.166   5.273 -13.821
  737   2HE2  GLN  92          2HE2      GLN  92   5.364   3.716 -14.544
  738    H    ASN  93           H        ASN  93   0.607   5.810  -9.815
  739    HA   ASN  93           HA       ASN  93  -0.643   3.247  -9.435
  740   1HB   ASN  93          1HB       ASN  93   0.302   5.412  -7.566
  741   2HB   ASN  93          2HB       ASN  93  -0.593   4.015  -6.977
  742   1HD2  ASN  93          1HD2      ASN  93   2.040   4.574  -9.294
  743   2HD2  ASN  93          2HD2      ASN  93   3.086   3.355  -8.655
  744    H    LYS  94           H        LYS  94  -1.601   6.623  -9.228
  745    HA   LYS  94           HA       LYS  94  -4.086   6.270  -7.968
  746   1HB   LYS  94          1HB       LYS  94  -2.937   8.456  -8.286
  747   2HB   LYS  94          2HB       LYS  94  -3.337   8.383  -9.998
  748   1HG   LYS  94          1HG       LYS  94  -5.597   8.720  -9.617
  749   2HG   LYS  94          2HG       LYS  94  -5.490   8.210  -7.930
  750   1HD   LYS  94          1HD       LYS  94  -4.884  10.260  -7.220
  751   2HD   LYS  94          2HD       LYS  94  -3.852  10.550  -8.623
  752   1HE   LYS  94          1HE       LYS  94  -5.980  10.867  -9.954
  753   2HE   LYS  94          2HE       LYS  94  -6.837  10.878  -8.414
  754   1HZ   LYS  94          1HZ       LYS  94  -4.942  12.851  -9.494
  755   2HZ   LYS  94          2HZ       LYS  94  -5.114  12.695  -7.819
  756   3HZ   LYS  94          3HZ       LYS  94  -6.452  13.099  -8.772
  757    H    GLU  95           H        GLU  95  -3.231   6.394 -11.416
  758    HA   GLU  95           HA       GLU  95  -5.897   5.965 -12.323
  759   1HB   GLU  95          1HB       GLU  95  -3.211   5.743 -13.677
  760   2HB   GLU  95          2HB       GLU  95  -4.723   5.426 -14.516
  761   1HG   GLU  95          1HG       GLU  95  -4.548   7.985 -13.062
  762   2HG   GLU  95          2HG       GLU  95  -3.520   7.813 -14.484
  763    H    TYR  96           H        TYR  96  -3.164   3.873 -11.616
  764    HA   TYR  96           HA       TYR  96  -4.101   1.514 -12.796
  765   1HB   TYR  96          1HB       TYR  96  -1.795   1.865 -11.914
  766   2HB   TYR  96          2HB       TYR  96  -2.438   1.750 -10.279
  767    HD1  TYR  96           2HD      TYR  96  -1.750  -0.120 -13.374
  768    HD2  TYR  96           1HD      TYR  96  -3.021  -0.371  -9.321
  769    HE1  TYR  96           2HE      TYR  96  -1.481  -2.564 -13.447
  770    HE2  TYR  96           1HE      TYR  96  -2.754  -2.815  -9.382
  771    HH   TYR  96           HH       TYR  96  -1.355  -4.480 -10.755
  772    H    CYS  97           H        CYS  97  -4.377   2.582  -9.404
  773    HA   CYS  97           HA       CYS  97  -5.971   0.454  -8.528
  774   1HB   CYS  97          1HB       CYS  97  -5.888   3.293  -7.484
  775   2HB   CYS  97          2HB       CYS  97  -6.545   1.905  -6.625
  776    HG   CYS  97           HG       CYS  97  -3.558   1.017  -7.405
  777    H    SER  98           H        SER  98  -6.798   3.490 -10.081
  778    HA   SER  98           HA       SER  98  -9.631   3.161  -9.678
  779   1HB   SER  98          1HB       SER  98  -8.799   5.413  -9.811
  780   2HB   SER  98          2HB       SER  98  -8.019   5.091 -11.359
  781    HG   SER  98           HG       SER  98 -10.096   6.211 -11.450
  782    H    LYS  99           H        LYS  99  -7.354   1.900 -11.822
  783    HA   LYS  99           HA       LYS  99  -8.766   1.752 -14.232
  784   1HB   LYS  99          1HB       LYS  99  -6.340   1.164 -13.843
  785   2HB   LYS  99          2HB       LYS  99  -6.892  -0.362 -13.167
  786   1HG   LYS  99          1HG       LYS  99  -8.117   0.064 -15.721
  787   2HG   LYS  99          2HG       LYS  99  -6.366   0.242 -15.852
  788   1HD   LYS  99          1HD       LYS  99  -7.707  -2.094 -14.501
  789   2HD   LYS  99          2HD       LYS  99  -7.235  -2.091 -16.201
  790   1HE   LYS  99          1HE       LYS  99  -4.919  -1.320 -15.144
  791   2HE   LYS  99          2HE       LYS  99  -5.558  -2.196 -13.754
  792   1HZ   LYS  99          1HZ       LYS  99  -5.391  -4.171 -14.806
  793   2HZ   LYS  99          2HZ       LYS  99  -4.183  -3.369 -15.678
  794   3HZ   LYS  99          3HZ       LYS  99  -5.733  -3.534 -16.336
  795    H    GLU 100           H        GLU 100  -9.259   0.132 -11.247
  796    HA   GLU 100           HA       GLU 100 -10.612  -2.163 -12.269
  797   1HB   GLU 100          1HB       GLU 100 -10.981  -0.985  -9.520
  798   2HB   GLU 100          2HB       GLU 100 -11.160  -2.662 -10.014
  799   1HG   GLU 100          1HG       GLU 100  -8.647  -1.083  -9.626
  800   2HG   GLU 100          2HG       GLU 100  -9.138  -2.591  -8.857
  801    H    GLY 101           H        GLY 101 -11.483   1.110 -11.837
  802   1HA   GLY 101          1HA       GLY 101 -13.437   2.128 -12.608
  803   2HA   GLY 101          2HA       GLY 101 -14.173   0.541 -12.767
  804    H    ASN 102           H        ASN 102 -12.874   0.493  -9.790
  805    HA   ASN 102           HA       ASN 102 -15.165   1.805  -8.500
  806   1HB   ASN 102          1HB       ASN 102 -14.897  -0.964  -8.764
  807   2HB   ASN 102          2HB       ASN 102 -14.387  -0.623  -7.113
  808   1HD2  ASN 102          1HD2      ASN 102 -16.117  -1.433  -6.056
  809   2HD2  ASN 102          2HD2      ASN 102 -17.719  -0.803  -6.195
  810    H    LEU 103           H        LEU 103 -14.538   3.138  -6.942
  811    HA   LEU 103           HA       LEU 103 -11.820   2.881  -5.876
  812   1HB   LEU 103          1HB       LEU 103 -13.464   5.079  -6.660
  813   2HB   LEU 103          2HB       LEU 103 -13.065   5.247  -4.951
  814    HG   LEU 103           HG       LEU 103 -11.527   6.436  -6.529
  815   1HD1  LEU 103          1HD1      LEU 103  -9.502   4.902  -5.413
  816   2HD1  LEU 103          2HD1      LEU 103 -10.867   4.698  -4.316
  817   3HD1  LEU 103          3HD1      LEU 103 -10.277   6.315  -4.696
  818   1HD2  LEU 103          1HD2      LEU 103 -11.583   4.048  -7.918
  819   2HD2  LEU 103          2HD2      LEU 103  -9.991   4.054  -7.158
  820   3HD2  LEU 103          3HD2      LEU 103 -10.478   5.394  -8.197
  821    H    LEU 104           H        LEU 104 -11.524   2.067  -3.918
  822    HA   LEU 104           HA       LEU 104 -13.798   1.694  -2.147
  823   1HB   LEU 104          1HB       LEU 104 -12.043  -0.070  -2.659
  824   2HB   LEU 104          2HB       LEU 104 -10.951   0.868  -1.643
  825    HG   LEU 104           HG       LEU 104 -12.406   0.505   0.279
  826   1HD1  LEU 104          1HD1      LEU 104 -14.275  -0.290  -1.763
  827   2HD1  LEU 104          2HD1      LEU 104 -14.558   0.087  -0.064
  828   3HD1  LEU 104          3HD1      LEU 104 -14.104  -1.549  -0.539
  829   1HD2  LEU 104          1HD2      LEU 104 -10.680  -1.102   0.008
  830   2HD2  LEU 104          2HD2      LEU 104 -11.579  -1.955  -1.248
  831   3HD2  LEU 104          3HD2      LEU 104 -12.145  -1.993   0.423
  832    H    MET 105           H        MET 105 -10.989   3.702  -2.441
  833    HA   MET 105           HA       MET 105 -11.896   5.443  -0.374
  834   1HB   MET 105          1HB       MET 105 -10.931   4.103   1.245
  835   2HB   MET 105          2HB       MET 105  -9.644   3.559   0.177
  836   1HG   MET 105          1HG       MET 105  -8.314   5.329   0.642
  837   2HG   MET 105          2HG       MET 105  -9.671   6.427   0.884
  838   1HE   MET 105          1HE       MET 105  -7.951   3.179   2.877
  839   2HE   MET 105          2HE       MET 105  -6.982   4.477   2.179
  840   3HE   MET 105          3HE       MET 105  -7.177   4.365   3.929
  841    H    GLU 106           H        GLU 106 -11.123   7.469  -0.674
  842    HA   GLU 106           HA       GLU 106  -8.796   7.811  -2.436
  843   1HB   GLU 106          1HB       GLU 106 -11.347   8.236  -3.306
  844   2HB   GLU 106          2HB       GLU 106 -10.913   9.837  -2.723
  845   1HG   GLU 106          1HG       GLU 106  -8.920   9.802  -4.155
  846   2HG   GLU 106          2HG       GLU 106  -9.403   8.220  -4.764
  847    H    CYS 107           H        CYS 107  -7.330   8.652  -1.085
  848    HA   CYS 107           HA       CYS 107  -7.871  11.234   0.103
  849   1HB   CYS 107          1HB       CYS 107  -7.580   8.752   1.705
  850   2HB   CYS 107          2HB       CYS 107  -6.711  10.168   2.283
  851    HG   CYS 107           HG       CYS 107  -9.208  11.714   2.123
  852    H    GLY 108           H        GLY 108  -5.763  11.898   1.411
  853   1HA   GLY 108          1HA       GLY 108  -3.446  12.111   1.461
  854   2HA   GLY 108          2HA       GLY 108  -3.326  10.790   0.307
  855    H    ALA 109           H        ALA 109  -1.628  12.679  -0.211
  856    HA   ALA 109           HA       ALA 109  -2.870  14.424  -2.234
  857   1HB   ALA 109          1HB       ALA 109  -1.789  16.022  -1.106
  858   2HB   ALA 109          2HB       ALA 109  -0.758  14.862  -0.267
  859   3HB   ALA 109          3HB       ALA 109  -0.336  15.403  -1.892
  860    HA   PRO 110           HA       PRO 110  -0.737  12.422  -5.504
  861   1HB   PRO 110          1HB       PRO 110  -0.045  14.504  -7.103
  862   2HB   PRO 110          2HB       PRO 110  -1.710  13.935  -6.934
  863   1HG   PRO 110          1HG       PRO 110  -0.357  16.254  -5.609
  864   2HG   PRO 110          2HG       PRO 110  -1.978  16.162  -6.321
  865   1HD   PRO 110          1HD       PRO 110  -1.546  15.988  -3.654
  866   2HD   PRO 110          2HD       PRO 110  -2.872  15.130  -4.464
  867    H    ARG 111           H        ARG 111   1.161  11.483  -4.999
  868    HA   ARG 111           HA       ARG 111   3.424  12.906  -4.026
  869   1HB   ARG 111          1HB       ARG 111   2.849  10.092  -4.826
  870   2HB   ARG 111          2HB       ARG 111   4.531  10.592  -4.719
  871   1HG   ARG 111          1HG       ARG 111   2.660  11.131  -2.454
  872   2HG   ARG 111          2HG       ARG 111   3.379   9.532  -2.662
  873   1HD   ARG 111          1HD       ARG 111   5.032  12.041  -2.623
  874   2HD   ARG 111          2HD       ARG 111   4.601  11.180  -1.146
  875    HE   ARG 111           HE       ARG 111   5.695   9.301  -2.849
  876   1HH1  ARG 111          1HH1      ARG 111   6.714  12.249  -1.304
  877   2HH1  ARG 111          2HH1      ARG 111   8.378  11.777  -1.208
  878   1HH2  ARG 111          1HH2      ARG 111   7.883   8.667  -2.728
  879   2HH2  ARG 111          2HH2      ARG 111   9.042   9.740  -2.019
  880    H    SER 112           H        SER 112   5.484  13.132  -5.050
  881    HA   SER 112           HA       SER 112   5.501  12.951  -7.973
  882   1HB   SER 112          1HB       SER 112   6.540  15.444  -6.656
  883   2HB   SER 112          2HB       SER 112   6.066  15.192  -8.336
  884    HG   SER 112           HG       SER 112   4.070  15.639  -7.834
  885    H    GLN 113           H        GLN 113   7.770  13.523  -8.814
  886    HA   GLN 113           HA       GLN 113   9.844  12.690  -6.912
  887   1HB   GLN 113          1HB       GLN 113   9.097  11.383  -9.494
  888   2HB   GLN 113          2HB       GLN 113  10.787  11.399  -9.009
  889   1HG   GLN 113          1HG       GLN 113   9.876  10.472  -6.761
  890   2HG   GLN 113          2HG       GLN 113   8.462  10.045  -7.723
  891   1HE2  GLN 113          1HE2      GLN 113   9.955   8.116  -6.483
  892   2HE2  GLN 113          2HE2      GLN 113  10.793   7.178  -7.667
  893    H    GLY 114           H        GLY 114  10.516  14.877  -6.878
  894   1HA   GLY 114          1HA       GLY 114  11.393  16.083  -9.381
  895   2HA   GLY 114          2HA       GLY 114  11.389  16.850  -7.800
  896    H    GLN 115           H        GLN 115  12.871  13.841  -8.992
  897    HA   GLN 115           HA       GLN 115  15.480  14.918  -8.148
  898   1HB   GLN 115          1HB       GLN 115  14.676  13.172  -6.606
  899   2HB   GLN 115          2HB       GLN 115  14.536  12.052  -7.955
  900   1HG   GLN 115          1HG       GLN 115  16.923  12.115  -8.306
  901   2HG   GLN 115          2HG       GLN 115  17.102  13.328  -7.040
  902   1HE2  GLN 115          1HE2      GLN 115  17.434  12.662  -5.026
  903   2HE2  GLN 115          2HE2      GLN 115  17.290  11.032  -4.473
  904    H    ARG 116           H        ARG 116  16.967  15.014  -9.693
  905    HA   ARG 116           HA       ARG 116  16.402  13.977 -12.314
  906   1HB   ARG 116          1HB       ARG 116  17.853  16.107 -11.361
  907   2HB   ARG 116          2HB       ARG 116  19.115  14.978 -11.833
  908   1HG   ARG 116          1HG       ARG 116  18.682  15.201 -14.033
  909   2HG   ARG 116          2HG       ARG 116  16.943  15.369 -13.784
  910   1HD   ARG 116          1HD       ARG 116  18.048  17.424 -14.653
  911   2HD   ARG 116          2HD       ARG 116  17.193  17.657 -13.129
  912    HE   ARG 116           HE       ARG 116  19.910  17.050 -12.643
  913   1HH1  ARG 116          1HH1      ARG 116  17.842  19.610 -13.779
  914   2HH1  ARG 116          2HH1      ARG 116  18.912  20.875 -13.274
  915   1HH2  ARG 116          1HH2      ARG 116  21.328  18.707 -11.974
  916   2HH2  ARG 116          2HH2      ARG 116  20.895  20.361 -12.249
  Start of MODEL   16
    1    HA   PRO   2           HA       PRO   2  29.230  12.444  14.895
    2   1HB   PRO   2          1HB       PRO   2  27.515  11.165  13.223
    3   2HB   PRO   2          2HB       PRO   2  27.023  12.511  14.259
    4   1HG   PRO   2          1HG       PRO   2  27.726  12.519  11.349
    5   2HG   PRO   2          2HG       PRO   2  26.398  13.349  12.182
    6   1HD   PRO   2          1HD       PRO   2  28.682  14.613  11.461
    7   2HD   PRO   2          2HD       PRO   2  27.757  15.063  12.909
    8    H    SER   3           H        SER   3  29.081   9.964  14.268
    9    HA   SER   3           HA       SER   3  30.758   9.178  12.061
   10   1HB   SER   3          1HB       SER   3  32.444   8.043  13.540
   11   2HB   SER   3          2HB       SER   3  32.517   9.804  13.583
   12    HG   SER   3           HG       SER   3  32.547   9.204  15.679
   13    H    LYS   4           H        LYS   4  28.843   8.010  11.569
   14    HA   LYS   4           HA       LYS   4  28.787   5.391  12.792
   15   1HB   LYS   4          1HB       LYS   4  26.749   7.417  13.360
   16   2HB   LYS   4          2HB       LYS   4  26.082   5.909  12.750
   17   1HG   LYS   4          1HG       LYS   4  28.026   6.006  15.036
   18   2HG   LYS   4          2HG       LYS   4  26.280   6.130  15.259
   19   1HD   LYS   4          1HD       LYS   4  26.570   3.937  13.604
   20   2HD   LYS   4          2HD       LYS   4  27.931   3.797  14.718
   21   1HE   LYS   4          1HE       LYS   4  26.031   4.379  16.486
   22   2HE   LYS   4          2HE       LYS   4  25.013   3.655  15.242
   23   1HZ   LYS   4          1HZ       LYS   4  25.674   1.651  15.864
   24   2HZ   LYS   4          2HZ       LYS   4  26.537   2.342  17.144
   25   3HZ   LYS   4          3HZ       LYS   4  27.304   2.058  15.663
   26    H    LYS   5           H        LYS   5  28.210   3.841  11.364
   27    HA   LYS   5           HA       LYS   5  26.549   4.350   9.093
   28   1HB   LYS   5          1HB       LYS   5  29.124   5.130   8.699
   29   2HB   LYS   5          2HB       LYS   5  29.206   3.454   8.173
   30   1HG   LYS   5          1HG       LYS   5  27.207   3.961   6.704
   31   2HG   LYS   5          2HG       LYS   5  27.496   5.663   7.074
   32   1HD   LYS   5          1HD       LYS   5  29.963   5.011   6.347
   33   2HD   LYS   5          2HD       LYS   5  29.099   3.768   5.439
   34   1HE   LYS   5          1HE       LYS   5  27.693   5.538   4.435
   35   2HE   LYS   5          2HE       LYS   5  28.657   6.748   5.281
   36   1HZ   LYS   5          1HZ       LYS   5  29.505   6.583   3.098
   37   2HZ   LYS   5          2HZ       LYS   5  29.554   4.894   3.150
   38   3HZ   LYS   5          3HZ       LYS   5  30.626   5.799   4.094
   39    H    ASN   6           H        ASN   6  26.411   2.396   7.661
   40    HA   ASN   6           HA       ASN   6  27.489  -0.088   8.422
   41   1HB   ASN   6          1HB       ASN   6  25.478   0.749  10.161
   42   2HB   ASN   6          2HB       ASN   6  24.671  -0.379   9.076
   43   1HD2  ASN   6          1HD2      ASN   6  24.637  -2.359   9.822
   44   2HD2  ASN   6          2HD2      ASN   6  25.862  -3.117  10.776
   45    H    GLY   7           H        GLY   7  26.315  -1.938   7.341
   46   1HA   GLY   7          1HA       GLY   7  24.651  -1.071   5.085
   47   2HA   GLY   7          2HA       GLY   7  26.155  -1.909   4.736
   48    H    ARG   8           H        ARG   8  24.399  -3.278   3.644
   49    HA   ARG   8           HA       ARG   8  24.176  -5.706   5.053
   50   1HB   ARG   8          1HB       ARG   8  22.122  -3.863   5.649
   51   2HB   ARG   8          2HB       ARG   8  21.411  -5.073   4.590
   52   1HG   ARG   8          1HG       ARG   8  21.852  -6.812   6.085
   53   2HG   ARG   8          2HG       ARG   8  23.025  -5.854   6.990
   54   1HD   ARG   8          1HD       ARG   8  21.238  -4.409   7.800
   55   2HD   ARG   8          2HD       ARG   8  20.058  -5.325   6.863
   56    HE   ARG   8           HE       ARG   8  21.142  -6.025   9.405
   57   1HH1  ARG   8          1HH1      ARG   8  19.920  -7.341   6.423
   58   2HH1  ARG   8          2HH1      ARG   8  19.422  -8.840   7.136
   59   1HH2  ARG   8          1HH2      ARG   8  20.491  -7.994  10.356
   60   2HH2  ARG   8          2HH2      ARG   8  19.746  -9.209   9.374
   61    H    SER   9           H        SER   9  22.241  -7.054   3.827
   62    HA   SER   9           HA       SER   9  22.387  -6.454   0.964
   63   1HB   SER   9          1HB       SER   9  22.729  -9.306   1.522
   64   2HB   SER   9          2HB       SER   9  23.610  -8.264   0.405
   65    HG   SER   9           HG       SER   9  24.780  -7.487   2.259
   66    H    GLY  10           H        GLY  10  21.109  -8.453  -0.169
   67   1HA   GLY  10          1HA       GLY  10  19.077  -9.486  -0.475
   68   2HA   GLY  10          2HA       GLY  10  18.900  -9.508   1.273
   69    HA   PRO  11           HA       PRO  11  15.691  -6.657  -0.482
   70   1HB   PRO  11          1HB       PRO  11  13.647  -7.667   0.992
   71   2HB   PRO  11          2HB       PRO  11  14.131  -8.341  -0.569
   72   1HG   PRO  11          1HG       PRO  11  14.803  -9.284   2.191
   73   2HG   PRO  11          2HG       PRO  11  14.332 -10.232   0.769
   74   1HD   PRO  11          1HD       PRO  11  16.907  -9.990   1.570
   75   2HD   PRO  11          2HD       PRO  11  16.450 -10.161  -0.137
   76    H    GLN  12           H        GLN  12  15.281  -4.730   0.425
   77    HA   GLN  12           HA       GLN  12  15.550  -4.494   3.349
   78   1HB   GLN  12          1HB       GLN  12  16.760  -2.972   1.152
   79   2HB   GLN  12          2HB       GLN  12  16.033  -1.966   2.398
   80   1HG   GLN  12          1HG       GLN  12  17.376  -3.100   4.096
   81   2HG   GLN  12          2HG       GLN  12  18.110  -4.098   2.842
   82   1HE2  GLN  12          1HE2      GLN  12  18.740  -2.461   0.881
   83   2HE2  GLN  12          2HE2      GLN  12  19.817  -1.214   1.400
   84    HA   PRO  13           HA       PRO  13  11.569  -2.674   3.604
   85   1HB   PRO  13          1HB       PRO  13  11.930  -0.722   5.455
   86   2HB   PRO  13          2HB       PRO  13  11.921  -2.442   5.862
   87   1HG   PRO  13          1HG       PRO  13  14.249  -0.607   5.444
   88   2HG   PRO  13          2HG       PRO  13  14.007  -1.840   6.695
   89   1HD   PRO  13          1HD       PRO  13  15.545  -2.267   4.509
   90   2HD   PRO  13          2HD       PRO  13  14.621  -3.564   5.294
   91    H    HIS  14           H        HIS  14  10.304  -1.014   2.816
   92    HA   HIS  14           HA       HIS  14  11.693   1.356   1.767
   93   1HB   HIS  14          1HB       HIS  14   9.489  -0.027   0.246
   94   2HB   HIS  14          2HB       HIS  14  10.598   1.215  -0.329
   95    HD1  HIS  14           1HD      HIS  14  10.048  -2.284  -0.560
   96    HD2  HIS  14           2HD      HIS  14  13.425   0.117  -0.259
   97    HE1  HIS  14           1HE      HIS  14  11.957  -3.702  -1.381
   98    H    LYS  15           H        LYS  15   9.864   2.935   0.888
   99    HA   LYS  15           HA       LYS  15   7.969   3.241   3.114
  100   1HB   LYS  15          1HB       LYS  15   7.854   5.640   2.290
  101   2HB   LYS  15          2HB       LYS  15   9.383   5.135   2.998
  102   1HG   LYS  15          1HG       LYS  15   9.362   4.666   0.155
  103   2HG   LYS  15          2HG       LYS  15   8.988   6.351   0.528
  104   1HD   LYS  15          1HD       LYS  15  11.190   5.246   2.106
  105   2HD   LYS  15          2HD       LYS  15  11.504   5.281   0.369
  106   1HE   LYS  15          1HE       LYS  15  11.171   7.618   0.261
  107   2HE   LYS  15          2HE       LYS  15  10.453   7.666   1.870
  108   1HZ   LYS  15          1HZ       LYS  15  12.856   6.658   2.418
  109   2HZ   LYS  15          2HZ       LYS  15  12.508   8.313   2.452
  110   3HZ   LYS  15          3HZ       LYS  15  13.245   7.631   1.090
  111    H    ARG  16           H        ARG  16   7.743   1.679   0.483
  112    HA   ARG  16           HA       ARG  16   5.060   2.659  -0.160
  113   1HB   ARG  16          1HB       ARG  16   7.097   1.900  -2.262
  114   2HB   ARG  16          2HB       ARG  16   5.435   2.395  -2.554
  115   1HG   ARG  16          1HG       ARG  16   5.886   4.614  -1.810
  116   2HG   ARG  16          2HG       ARG  16   7.490   4.152  -1.238
  117   1HD   ARG  16          1HD       ARG  16   7.868   3.444  -3.714
  118   2HD   ARG  16          2HD       ARG  16   6.502   4.511  -4.037
  119    HE   ARG  16           HE       ARG  16   7.876   6.300  -3.682
  120   1HH1  ARG  16          1HH1      ARG  16   9.345   3.463  -2.300
  121   2HH1  ARG  16          2HH1      ARG  16  10.833   4.262  -1.914
  122   1HH2  ARG  16          1HH2      ARG  16   9.830   7.364  -3.179
  123   2HH2  ARG  16          2HH2      ARG  16  11.108   6.481  -2.414
  124    H    TRP  17           H        TRP  17   3.637   1.062  -0.025
  125    HA   TRP  17           HA       TRP  17   4.374  -1.631  -0.858
  126   1HB   TRP  17          1HB       TRP  17   3.492  -0.902   1.931
  127   2HB   TRP  17          2HB       TRP  17   3.292  -2.528   1.283
  128    HD1  TRP  17           HD       TRP  17   5.889  -0.190   2.724
  129    HE1  TRP  17           1HE      TRP  17   8.118  -1.450   2.982
  130    HE3  TRP  17           3HE      TRP  17   4.714  -4.452   0.156
  131    HZ2  TRP  17           2HZ      TRP  17   9.231  -3.924   2.201
  132    HZ3  TRP  17           3HZ      TRP  17   6.418  -6.216  -0.043
  133    HH2  TRP  17           HH       TRP  17   8.629  -5.956   0.959
  134    H    VAL  18           H        VAL  18   2.721  -2.714  -1.787
  135    HA   VAL  18           HA       VAL  18   0.095  -1.385  -1.783
  136    HB   VAL  18           HB       VAL  18  -0.337  -2.582  -3.899
  137   1HG1  VAL  18          1HG1      VAL  18   1.196  -1.269  -5.297
  138   2HG1  VAL  18          2HG1      VAL  18   0.544  -0.316  -3.962
  139   3HG1  VAL  18          3HG1      VAL  18   2.193  -0.938  -3.881
  140   1HG2  VAL  18          1HG2      VAL  18   2.440  -3.269  -4.426
  141   2HG2  VAL  18          2HG2      VAL  18   1.742  -4.214  -3.111
  142   3HG2  VAL  18          3HG2      VAL  18   0.972  -4.207  -4.698
  143    H    PHE  19           H        PHE  19  -1.806  -2.798  -1.958
  144    HA   PHE  19           HA       PHE  19  -1.419  -5.464  -0.797
  145   1HB   PHE  19          1HB       PHE  19  -3.412  -5.028   0.684
  146   2HB   PHE  19          2HB       PHE  19  -1.963  -4.122   1.107
  147    HD1  PHE  19           1HD      PHE  19  -1.805  -1.711   0.485
  148    HD2  PHE  19           2HD      PHE  19  -5.412  -3.937   0.093
  149    HE1  PHE  19           1HE      PHE  19  -3.083   0.388   0.371
  150    HE2  PHE  19           2HE      PHE  19  -6.696  -1.842  -0.023
  151    HZ   PHE  19           HZ       PHE  19  -5.532   0.324   0.115
  152    H    THR  20           H        THR  20  -2.936  -6.997  -1.382
  153    HA   THR  20           HA       THR  20  -5.204  -6.209  -3.026
  154    HB   THR  20           HB       THR  20  -4.638  -7.632  -4.896
  155    HG1  THR  20           1HG      THR  20  -2.718  -8.788  -4.948
  156   1HG2  THR  20          1HG2      THR  20  -2.909  -6.342  -5.890
  157   2HG2  THR  20          2HG2      THR  20  -2.198  -5.959  -4.321
  158   3HG2  THR  20          3HG2      THR  20  -3.753  -5.264  -4.779
  159    H    LEU  21           H        LEU  21  -6.913  -7.447  -2.588
  160    HA   LEU  21           HA       LEU  21  -6.507 -10.200  -1.681
  161   1HB   LEU  21          1HB       LEU  21  -6.685  -8.768   0.319
  162   2HB   LEU  21          2HB       LEU  21  -8.254  -8.203  -0.250
  163    HG   LEU  21           HG       LEU  21  -8.722 -10.849  -0.192
  164   1HD1  LEU  21          1HD1      LEU  21  -6.951 -10.440   2.197
  165   2HD1  LEU  21          2HD1      LEU  21  -6.360 -11.160   0.700
  166   3HD1  LEU  21          3HD1      LEU  21  -7.665 -11.937   1.597
  167   1HD2  LEU  21          1HD2      LEU  21 -10.169 -10.336   1.465
  168   2HD2  LEU  21          2HD2      LEU  21  -9.679  -8.687   1.076
  169   3HD2  LEU  21          3HD2      LEU  21  -8.940  -9.529   2.439
  170    H    ASN  22           H        ASN  22  -8.023 -11.610  -2.390
  171    HA   ASN  22           HA       ASN  22  -9.968 -10.609  -4.293
  172   1HB   ASN  22          1HB       ASN  22  -8.432 -12.924  -4.119
  173   2HB   ASN  22          2HB       ASN  22 -10.072 -13.472  -3.785
  174   1HD2  ASN  22          1HD2      ASN  22  -7.854 -12.623  -6.157
  175   2HD2  ASN  22          2HD2      ASN  22  -8.928 -12.593  -7.510
  176    H    ASN  23           H        ASN  23 -12.099 -10.435  -3.968
  177    HA   ASN  23           HA       ASN  23 -14.077 -10.301  -2.843
  178   1HB   ASN  23          1HB       ASN  23 -14.141 -12.669  -3.451
  179   2HB   ASN  23          2HB       ASN  23 -13.245 -13.084  -1.993
  180   1HD2  ASN  23          1HD2      ASN  23 -15.924 -10.827  -2.472
  181   2HD2  ASN  23          2HD2      ASN  23 -17.004 -11.604  -1.370
  182    HA   PRO  24           HA       PRO  24 -11.892  -9.266   1.156
  183   1HB   PRO  24          1HB       PRO  24 -12.432  -6.607   1.062
  184   2HB   PRO  24          2HB       PRO  24 -11.002  -7.324   0.310
  185   1HG   PRO  24          1HG       PRO  24 -13.600  -6.524  -0.942
  186   2HG   PRO  24          2HG       PRO  24 -11.948  -6.276  -1.537
  187   1HD   PRO  24          1HD       PRO  24 -13.545  -8.260  -2.457
  188   2HD   PRO  24          2HD       PRO  24 -11.781  -8.428  -2.345
  189    H    SER  25           H        SER  25 -12.903  -8.987   3.107
  190    HA   SER  25           HA       SER  25 -15.807  -9.070   3.071
  191   1HB   SER  25          1HB       SER  25 -13.676  -9.809   4.989
  192   2HB   SER  25          2HB       SER  25 -15.183  -9.232   5.700
  193    HG   SER  25           HG       SER  25 -16.101 -10.833   4.035
  194    H    GLU  26           H        GLU  26 -17.072  -7.762   4.580
  195    HA   GLU  26           HA       GLU  26 -16.567  -5.015   4.276
  196   1HB   GLU  26          1HB       GLU  26 -18.649  -6.675   5.362
  197   2HB   GLU  26          2HB       GLU  26 -18.337  -5.330   6.451
  198   1HG   GLU  26          1HG       GLU  26 -18.405  -4.013   4.116
  199   2HG   GLU  26          2HG       GLU  26 -19.491  -5.349   3.741
  200    H    ASP  27           H        ASP  27 -15.749  -7.274   6.798
  201    HA   ASP  27           HA       ASP  27 -15.092  -5.287   8.758
  202   1HB   ASP  27          1HB       ASP  27 -15.377  -8.105   8.704
  203   2HB   ASP  27          2HB       ASP  27 -13.733  -7.767   9.238
  204    H    GLU  28           H        GLU  28 -13.241  -7.311   6.510
  205    HA   GLU  28           HA       GLU  28 -10.698  -6.336   7.326
  206   1HB   GLU  28          1HB       GLU  28 -11.641  -8.355   5.639
  207   2HB   GLU  28          2HB       GLU  28 -10.760  -7.262   4.580
  208   1HG   GLU  28          1HG       GLU  28  -9.098  -8.693   5.219
  209   2HG   GLU  28          2HG       GLU  28  -8.920  -7.415   6.419
  210    H    ARG  29           H        ARG  29 -12.786  -5.602   4.542
  211    HA   ARG  29           HA       ARG  29 -11.124  -3.690   3.351
  212   1HB   ARG  29          1HB       ARG  29 -13.018  -4.666   2.173
  213   2HB   ARG  29          2HB       ARG  29 -14.138  -3.919   3.305
  214   1HG   ARG  29          1HG       ARG  29 -12.645  -1.798   2.329
  215   2HG   ARG  29          2HG       ARG  29 -12.915  -2.833   0.925
  216   1HD   ARG  29          1HD       ARG  29 -15.249  -2.383   2.673
  217   2HD   ARG  29          2HD       ARG  29 -14.668  -0.975   1.784
  218    HE   ARG  29           HE       ARG  29 -15.000  -3.337   0.169
  219   1HH1  ARG  29          1HH1      ARG  29 -16.538  -0.496   1.466
  220   2HH1  ARG  29          2HH1      ARG  29 -17.760  -0.438   0.239
  221   1HH2  ARG  29          1HH2      ARG  29 -16.603  -3.271  -1.452
  222   2HH2  ARG  29          2HH2      ARG  29 -17.797  -2.018  -1.419
  223    H    LYS  30           H        LYS  30 -13.499  -3.424   5.927
  224    HA   LYS  30           HA       LYS  30 -13.542  -0.582   6.020
  225   1HB   LYS  30          1HB       LYS  30 -15.384  -1.783   6.968
  226   2HB   LYS  30          2HB       LYS  30 -14.320  -2.695   8.030
  227   1HG   LYS  30          1HG       LYS  30 -14.489  -1.154   9.608
  228   2HG   LYS  30          2HG       LYS  30 -13.980   0.113   8.490
  229   1HD   LYS  30          1HD       LYS  30 -16.103   0.797   9.177
  230   2HD   LYS  30          2HD       LYS  30 -16.396   0.027   7.615
  231   1HE   LYS  30          1HE       LYS  30 -18.025  -1.015   8.798
  232   2HE   LYS  30          2HE       LYS  30 -16.696  -2.104   9.195
  233   1HZ   LYS  30          1HZ       LYS  30 -16.657  -1.420  11.319
  234   2HZ   LYS  30          2HZ       LYS  30 -18.249  -0.938  11.016
  235   3HZ   LYS  30          3HZ       LYS  30 -16.994   0.194  10.939
  236    H    LYS  31           H        LYS  31 -11.602  -3.059   7.580
  237    HA   LYS  31           HA       LYS  31 -10.377  -1.459   9.537
  238   1HB   LYS  31          1HB       LYS  31 -10.178  -3.828   9.714
  239   2HB   LYS  31          2HB       LYS  31  -9.467  -3.957   8.111
  240   1HG   LYS  31          1HG       LYS  31  -7.468  -2.796   8.904
  241   2HG   LYS  31          2HG       LYS  31  -8.181  -2.674  10.514
  242   1HD   LYS  31          1HD       LYS  31  -7.125  -4.607  10.926
  243   2HD   LYS  31          2HD       LYS  31  -8.413  -5.349   9.974
  244   1HE   LYS  31          1HE       LYS  31  -5.681  -4.502   9.028
  245   2HE   LYS  31          2HE       LYS  31  -6.320  -6.142   9.134
  246   1HZ   LYS  31          1HZ       LYS  31  -7.945  -5.569   7.431
  247   2HZ   LYS  31          2HZ       LYS  31  -6.368  -5.343   6.866
  248   3HZ   LYS  31          3HZ       LYS  31  -7.303  -4.008   7.317
  249    H    ILE  32           H        ILE  32  -9.237  -2.367   6.286
  250    HA   ILE  32           HA       ILE  32  -6.879  -0.839   6.349
  251    HB   ILE  32           HB       ILE  32  -8.536  -1.954   4.111
  252   1HG1  ILE  32          1HG1      ILE  32  -5.684  -2.459   4.984
  253   2HG1  ILE  32          2HG1      ILE  32  -7.067  -3.434   5.468
  254   1HG2  ILE  32          1HG2      ILE  32  -7.755   0.045   3.129
  255   2HG2  ILE  32          2HG2      ILE  32  -6.169  -0.116   3.882
  256   3HG2  ILE  32          3HG2      ILE  32  -6.648  -1.219   2.592
  257   1HD1  ILE  32          1HD1      ILE  32  -6.929  -4.634   3.618
  258   2HD1  ILE  32          2HD1      ILE  32  -6.976  -3.186   2.613
  259   3HD1  ILE  32          3HD1      ILE  32  -5.436  -3.778   3.235
  260    H    ARG  33           H        ARG  33 -10.144  -0.072   5.218
  261    HA   ARG  33           HA       ARG  33  -9.465   2.512   4.226
  262   1HB   ARG  33          1HB       ARG  33 -11.423   1.329   3.393
  263   2HB   ARG  33          2HB       ARG  33 -12.137   1.331   5.000
  264   1HG   ARG  33          1HG       ARG  33 -12.344   3.740   4.944
  265   2HG   ARG  33          2HG       ARG  33 -11.536   3.793   3.375
  266   1HD   ARG  33          1HD       ARG  33 -13.802   3.938   2.842
  267   2HD   ARG  33          2HD       ARG  33 -13.413   2.239   2.577
  268    HE   ARG  33           HE       ARG  33 -14.307   2.439   5.185
  269   1HH1  ARG  33          1HH1      ARG  33 -15.564   3.036   1.993
  270   2HH1  ARG  33          2HH1      ARG  33 -17.203   2.685   2.431
  271   1HH2  ARG  33          1HH2      ARG  33 -16.461   1.975   5.774
  272   2HH2  ARG  33          2HH2      ARG  33 -17.712   2.083   4.582
  273    H    ASP  34           H        ASP  34 -10.131   1.245   7.345
  274    HA   ASP  34           HA       ASP  34 -10.680   3.899   8.451
  275   1HB   ASP  34          1HB       ASP  34 -12.099   1.946   9.120
  276   2HB   ASP  34          2HB       ASP  34 -10.678   1.233   9.877
  277    H    LEU  35           H        LEU  35  -8.019   2.443   7.543
  278    HA   LEU  35           HA       LEU  35  -6.380   2.365   9.849
  279   1HB   LEU  35          1HB       LEU  35  -5.893   2.446   6.906
  280   2HB   LEU  35          2HB       LEU  35  -4.543   2.699   8.011
  281    HG   LEU  35           HG       LEU  35  -6.304   0.249   7.996
  282   1HD1  LEU  35          1HD1      LEU  35  -5.044   0.385   5.927
  283   2HD1  LEU  35          2HD1      LEU  35  -4.385  -0.877   6.966
  284   3HD1  LEU  35          3HD1      LEU  35  -3.556   0.673   6.829
  285   1HD2  LEU  35          1HD2      LEU  35  -4.553  -0.698   9.412
  286   2HD2  LEU  35          2HD2      LEU  35  -5.279   0.726  10.157
  287   3HD2  LEU  35          3HD2      LEU  35  -3.695   0.842   9.389
  288    HA   PRO  36           HA       PRO  36  -5.307   6.556  10.583
  289   1HB   PRO  36          1HB       PRO  36  -2.659   6.390  11.161
  290   2HB   PRO  36          2HB       PRO  36  -3.920   5.809  12.256
  291   1HG   PRO  36          1HG       PRO  36  -2.220   4.264  10.337
  292   2HG   PRO  36          2HG       PRO  36  -2.675   3.862  12.003
  293   1HD   PRO  36          1HD       PRO  36  -3.908   2.773   9.852
  294   2HD   PRO  36          2HD       PRO  36  -4.755   3.087  11.380
  295    H    ILE  37           H        ILE  37  -5.247   8.053   9.034
  296    HA   ILE  37           HA       ILE  37  -3.840   7.743   6.589
  297    HB   ILE  37           HB       ILE  37  -4.450  10.138   6.199
  298   1HG1  ILE  37          1HG1      ILE  37  -5.752   9.863   8.917
  299   2HG1  ILE  37          2HG1      ILE  37  -4.370  10.886   8.540
  300   1HG2  ILE  37          1HG2      ILE  37  -6.284   9.239   5.337
  301   2HG2  ILE  37          2HG2      ILE  37  -6.126   7.860   6.423
  302   3HG2  ILE  37          3HG2      ILE  37  -7.052   9.275   6.924
  303   1HD1  ILE  37          1HD1      ILE  37  -7.236  11.282   7.978
  304   2HD1  ILE  37          2HD1      ILE  37  -5.980  12.452   8.386
  305   3HD1  ILE  37          3HD1      ILE  37  -6.103  11.827   6.741
  306    H    SER  38           H        SER  38  -3.148   9.416   9.599
  307    HA   SER  38           HA       SER  38  -0.960  10.947   8.692
  308   1HB   SER  38          1HB       SER  38  -2.215  11.249  10.870
  309   2HB   SER  38          2HB       SER  38  -1.320   9.864  11.492
  310    HG   SER  38           HG       SER  38  -0.126  12.213  10.437
  311    H    LEU  39           H        LEU  39  -1.299   7.603   9.411
  312    HA   LEU  39           HA       LEU  39   1.450   7.060   9.965
  313   1HB   LEU  39          1HB       LEU  39  -0.860   5.677  10.284
  314   2HB   LEU  39          2HB       LEU  39  -0.199   4.894   8.850
  315    HG   LEU  39           HG       LEU  39   1.656   5.210  11.127
  316   1HD1  LEU  39          1HD1      LEU  39  -0.412   4.629  12.290
  317   2HD1  LEU  39          2HD1      LEU  39   0.740   3.294  12.320
  318   3HD1  LEU  39          3HD1      LEU  39  -0.633   3.249  11.214
  319   1HD2  LEU  39          1HD2      LEU  39   1.339   3.614   8.763
  320   2HD2  LEU  39          2HD2      LEU  39   1.508   2.574  10.178
  321   3HD2  LEU  39          3HD2      LEU  39   2.742   3.783   9.819
  322    H    PHE  40           H        PHE  40  -0.492   7.311   7.091
  323    HA   PHE  40           HA       PHE  40   1.886   6.653   5.482
  324   1HB   PHE  40          1HB       PHE  40  -0.915   6.226   4.474
  325   2HB   PHE  40          2HB       PHE  40   0.589   5.536   3.872
  326    HD1  PHE  40           2HD      PHE  40  -1.974   5.343   6.488
  327    HD2  PHE  40           1HD      PHE  40   1.544   3.579   4.865
  328    HE1  PHE  40           2HE      PHE  40  -2.364   3.327   7.843
  329    HE2  PHE  40           1HE      PHE  40   1.159   1.560   6.217
  330    HZ   PHE  40           HZ       PHE  40  -0.796   1.432   7.709
  331    H    ASP  41           H        ASP  41   2.636   8.430   4.555
  332    HA   ASP  41           HA       ASP  41   1.380  10.886   4.400
  333   1HB   ASP  41          1HB       ASP  41   3.680   9.648   2.946
  334   2HB   ASP  41          2HB       ASP  41   3.061  11.200   2.388
  335    H    TYR  42           H        TYR  42   1.113   8.140   2.286
  336    HA   TYR  42           HA       TYR  42  -0.932   9.571   0.750
  337   1HB   TYR  42          1HB       TYR  42   1.093   9.663  -0.611
  338   2HB   TYR  42          2HB       TYR  42   1.291   7.920  -0.468
  339    HD1  TYR  42           1HD      TYR  42  -1.972   9.550  -0.983
  340    HD2  TYR  42           2HD      TYR  42   1.248   7.460  -2.819
  341    HE1  TYR  42           1HE      TYR  42  -3.337   9.234  -3.005
  342    HE2  TYR  42           2HE      TYR  42  -0.108   7.139  -4.846
  343    HH   TYR  42           HH       TYR  42  -2.114   7.388  -5.777
  344    H    PHE  43           H        PHE  43  -2.761   8.456   0.683
  345    HA   PHE  43           HA       PHE  43  -2.648   5.522   0.800
  346   1HB   PHE  43          1HB       PHE  43  -3.332   6.930   2.990
  347   2HB   PHE  43          2HB       PHE  43  -4.906   6.836   2.206
  348    HD1  PHE  43           1HD      PHE  43  -4.043   4.049   0.912
  349    HD2  PHE  43           2HD      PHE  43  -4.235   5.621   4.863
  350    HE1  PHE  43           1HE      PHE  43  -4.348   1.774   1.799
  351    HE2  PHE  43           2HE      PHE  43  -4.538   3.349   5.756
  352    HZ   PHE  43           HZ       PHE  43  -4.595   1.422   4.224
  353    H    ILE  44           H        ILE  44  -3.530   4.782  -1.006
  354    HA   ILE  44           HA       ILE  44  -6.053   5.951  -1.934
  355    HB   ILE  44           HB       ILE  44  -4.460   6.993  -3.375
  356   1HG1  ILE  44          1HG1      ILE  44  -5.114   4.888  -5.291
  357   2HG1  ILE  44          2HG1      ILE  44  -6.487   5.340  -4.286
  358   1HG2  ILE  44          1HG2      ILE  44  -2.770   5.795  -4.617
  359   2HG2  ILE  44          2HG2      ILE  44  -2.587   5.461  -2.896
  360   3HG2  ILE  44          3HG2      ILE  44  -3.328   4.260  -3.953
  361   1HD1  ILE  44          1HD1      ILE  44  -4.832   7.402  -5.690
  362   2HD1  ILE  44          2HD1      ILE  44  -6.163   6.569  -6.493
  363   3HD1  ILE  44          3HD1      ILE  44  -6.471   7.539  -5.054
  364    H    VAL  45           H        VAL  45  -7.526   4.407  -2.098
  365    HA   VAL  45           HA       VAL  45  -6.647   1.686  -2.819
  366    HB   VAL  45           HB       VAL  45  -9.082   2.159  -1.138
  367   1HG1  VAL  45          1HG1      VAL  45  -7.382  -0.115  -1.945
  368   2HG1  VAL  45          2HG1      VAL  45  -7.994  -0.145  -0.290
  369   3HG1  VAL  45          3HG1      VAL  45  -9.118  -0.044  -1.646
  370   1HG2  VAL  45          1HG2      VAL  45  -7.530   3.265   0.208
  371   2HG2  VAL  45          2HG2      VAL  45  -7.522   1.616   0.834
  372   3HG2  VAL  45          3HG2      VAL  45  -6.224   2.162  -0.228
  373    H    GLY  46           H        GLY  46  -8.057   0.446  -4.105
  374   1HA   GLY  46          1HA       GLY  46 -10.335   1.894  -5.283
  375   2HA   GLY  46          2HA       GLY  46  -9.109   1.200  -6.332
  376    H    GLU  47           H        GLU  47 -11.965   0.607  -6.187
  377    HA   GLU  47           HA       GLU  47 -11.862  -2.210  -5.338
  378   1HB   GLU  47          1HB       GLU  47 -13.668  -0.322  -4.576
  379   2HB   GLU  47          2HB       GLU  47 -14.490  -1.029  -5.959
  380   1HG   GLU  47          1HG       GLU  47 -13.513  -2.479  -3.512
  381   2HG   GLU  47          2HG       GLU  47 -15.187  -2.135  -3.943
  382    H    GLU  48           H        GLU  48 -12.187  -3.796  -6.792
  383    HA   GLU  48           HA       GLU  48 -13.062  -3.035  -9.496
  384   1HB   GLU  48          1HB       GLU  48 -11.430  -4.714 -10.384
  385   2HB   GLU  48          2HB       GLU  48 -10.688  -3.299  -9.650
  386   1HG   GLU  48          1HG       GLU  48  -9.823  -4.476  -7.911
  387   2HG   GLU  48          2HG       GLU  48 -11.123  -5.667  -7.924
  388    H    GLY  49           H        GLY  49 -14.056  -4.726 -10.730
  389   1HA   GLY  49          1HA       GLY  49 -14.594  -7.248 -10.464
  390   2HA   GLY  49          2HA       GLY  49 -15.382  -6.695  -8.994
  391    H    ASN  50           H        ASN  50 -15.361  -6.272 -12.514
  392    HA   ASN  50           HA       ASN  50 -18.229  -5.613 -12.354
  393   1HB   ASN  50          1HB       ASN  50 -16.203  -4.067 -13.453
  394   2HB   ASN  50          2HB       ASN  50 -16.927  -4.855 -14.852
  395   1HD2  ASN  50          1HD2      ASN  50 -18.104  -3.444 -11.812
  396   2HD2  ASN  50          2HD2      ASN  50 -19.331  -2.472 -12.543
  397    H    GLU  51           H        GLU  51 -17.080  -8.265 -12.469
  398    HA   GLU  51           HA       GLU  51 -17.999  -9.119 -15.136
  399   1HB   GLU  51          1HB       GLU  51 -15.561  -9.623 -13.968
  400   2HB   GLU  51          2HB       GLU  51 -16.470 -11.078 -13.582
  401   1HG   GLU  51          1HG       GLU  51 -16.742 -10.214 -16.358
  402   2HG   GLU  51          2HG       GLU  51 -15.096 -10.637 -15.891
  403    H    GLU  52           H        GLU  52 -20.027  -9.822 -15.011
  404    HA   GLU  52           HA       GLU  52 -21.419 -10.578 -12.752
  405   1HB   GLU  52          1HB       GLU  52 -22.269 -10.107 -15.142
  406   2HB   GLU  52          2HB       GLU  52 -21.979 -11.816 -15.434
  407   1HG   GLU  52          1HG       GLU  52 -23.511 -11.286 -13.009
  408   2HG   GLU  52          2HG       GLU  52 -24.298 -10.735 -14.487
  409    H    GLY  53           H        GLY  53 -21.685 -12.413 -11.593
  410   1HA   GLY  53          1HA       GLY  53 -21.582 -14.702 -11.116
  411   2HA   GLY  53          2HA       GLY  53 -20.695 -14.952 -12.612
  412    H    ARG  54           H        ARG  54 -19.054 -12.497 -11.463
  413    HA   ARG  54           HA       ARG  54 -17.219 -14.213  -9.929
  414   1HB   ARG  54          1HB       ARG  54 -16.462 -13.208 -12.146
  415   2HB   ARG  54          2HB       ARG  54 -16.493 -11.648 -11.336
  416   1HG   ARG  54          1HG       ARG  54 -14.708 -12.175  -9.966
  417   2HG   ARG  54          2HG       ARG  54 -14.938 -13.913 -10.167
  418   1HD   ARG  54          1HD       ARG  54 -14.372 -13.443 -12.654
  419   2HD   ARG  54          2HD       ARG  54 -13.693 -11.937 -12.038
  420    HE   ARG  54           HE       ARG  54 -12.663 -14.033 -10.511
  421   1HH1  ARG  54          1HH1      ARG  54 -12.535 -12.847 -13.782
  422   2HH1  ARG  54          2HH1      ARG  54 -10.944 -13.465 -14.082
  423   1HH2  ARG  54          1HH2      ARG  54 -10.569 -14.851 -10.894
  424   2HH2  ARG  54          2HH2      ARG  54  -9.827 -14.605 -12.439
  425    H    THR  55           H        THR  55 -15.881 -13.065  -8.291
  426    HA   THR  55           HA       THR  55 -17.586 -11.237  -6.760
  427    HB   THR  55           HB       THR  55 -15.468 -11.865  -5.113
  428    HG1  THR  55           1HG      THR  55 -14.922 -13.948  -5.446
  429   1HG2  THR  55          1HG2      THR  55 -17.094 -12.717  -3.789
  430   2HG2  THR  55          2HG2      THR  55 -17.729 -13.761  -5.062
  431   3HG2  THR  55          3HG2      THR  55 -18.161 -12.052  -5.025
  432    HA   PRO  56           HA       PRO  56 -14.959  -7.753  -7.233
  433   1HB   PRO  56          1HB       PRO  56 -15.035  -6.637  -4.759
  434   2HB   PRO  56          2HB       PRO  56 -16.408  -6.600  -5.872
  435   1HG   PRO  56          1HG       PRO  56 -15.894  -8.427  -3.557
  436   2HG   PRO  56          2HG       PRO  56 -17.401  -7.625  -4.036
  437   1HD   PRO  56          1HD       PRO  56 -16.893 -10.225  -4.596
  438   2HD   PRO  56          2HD       PRO  56 -17.864  -9.191  -5.663
  439    H    HIS  57           H        HIS  57 -12.963  -6.718  -6.505
  440    HA   HIS  57           HA       HIS  57 -11.277  -8.348  -4.753
  441   1HB   HIS  57          1HB       HIS  57 -10.743  -9.188  -6.945
  442   2HB   HIS  57          2HB       HIS  57 -10.582  -7.555  -7.585
  443    HD1  HIS  57           1HD      HIS  57  -8.738 -10.187  -5.742
  444    HD2  HIS  57           2HD      HIS  57  -8.190  -6.216  -6.833
  445    HE1  HIS  57           1HE      HIS  57  -6.296  -9.718  -5.367
  446    H    LEU  58           H        LEU  58  -9.773  -7.209  -3.600
  447    HA   LEU  58           HA       LEU  58 -10.019  -4.303  -3.722
  448   1HB   LEU  58          1HB       LEU  58  -9.818  -6.148  -1.639
  449   2HB   LEU  58          2HB       LEU  58  -8.272  -5.302  -1.652
  450    HG   LEU  58           HG       LEU  58 -11.012  -4.096  -1.299
  451   1HD1  LEU  58          1HD1      LEU  58  -8.643  -4.523   0.493
  452   2HD1  LEU  58          2HD1      LEU  58 -10.321  -5.005   0.743
  453   3HD1  LEU  58          3HD1      LEU  58  -9.868  -3.303   0.840
  454   1HD2  LEU  58          1HD2      LEU  58  -9.416  -2.033  -0.843
  455   2HD2  LEU  58          2HD2      LEU  58 -10.036  -2.392  -2.455
  456   3HD2  LEU  58          3HD2      LEU  58  -8.399  -2.877  -2.012
  457    H    GLN  59           H        GLN  59  -8.408  -2.953  -4.298
  458    HA   GLN  59           HA       GLN  59  -5.670  -3.871  -4.461
  459   1HB   GLN  59          1HB       GLN  59  -6.375  -4.641  -6.598
  460   2HB   GLN  59          2HB       GLN  59  -7.276  -3.164  -6.912
  461   1HG   GLN  59          1HG       GLN  59  -5.269  -3.167  -8.222
  462   2HG   GLN  59          2HG       GLN  59  -5.154  -1.917  -6.984
  463   1HE2  GLN  59          1HE2      GLN  59  -3.767  -2.243  -5.214
  464   2HE2  GLN  59          2HE2      GLN  59  -2.466  -3.377  -5.288
  465    H    GLY  60           H        GLY  60  -4.607  -2.280  -3.488
  466   1HA   GLY  60          1HA       GLY  60  -4.936   0.448  -4.448
  467   2HA   GLY  60          2HA       GLY  60  -5.336   0.181  -2.758
  468    H    PHE  61           H        PHE  61  -3.433   1.958  -3.154
  469    HA   PHE  61           HA       PHE  61  -0.976   0.528  -2.404
  470   1HB   PHE  61          1HB       PHE  61  -0.498   1.251  -4.604
  471   2HB   PHE  61          2HB       PHE  61  -1.273   2.810  -4.347
  472    HD1  PHE  61           2HD      PHE  61   1.395   0.865  -2.600
  473    HD2  PHE  61           1HD      PHE  61   0.213   4.546  -4.381
  474    HE1  PHE  61           2HE      PHE  61   3.573   1.846  -2.011
  475    HE2  PHE  61           1HE      PHE  61   2.390   5.532  -3.796
  476    HZ   PHE  61           HZ       PHE  61   4.073   4.182  -2.608
  477    H    ALA  62           H        ALA  62   0.183   1.391  -0.735
  478    HA   ALA  62           HA       ALA  62  -0.739   3.942   0.398
  479   1HB   ALA  62          1HB       ALA  62  -0.854   1.281   1.637
  480   2HB   ALA  62          2HB       ALA  62  -0.171   2.551   2.653
  481   3HB   ALA  62          3HB       ALA  62  -1.789   2.737   1.978
  482    H    ASN  63           H        ASN  63   0.889   5.288   0.791
  483    HA   ASN  63           HA       ASN  63   3.620   4.291   0.648
  484   1HB   ASN  63          1HB       ASN  63   2.924   6.297  -0.657
  485   2HB   ASN  63          2HB       ASN  63   2.634   7.144   0.859
  486   1HD2  ASN  63          1HD2      ASN  63   4.634   7.265  -1.505
  487   2HD2  ASN  63          2HD2      ASN  63   6.149   7.503  -0.708
  488    H    PHE  64           H        PHE  64   4.582   3.648   2.451
  489    HA   PHE  64           HA       PHE  64   3.659   4.377   5.048
  490   1HB   PHE  64          1HB       PHE  64   5.512   2.482   3.911
  491   2HB   PHE  64          2HB       PHE  64   6.244   3.293   5.292
  492    HD1  PHE  64           2HD      PHE  64   4.789   3.409   7.443
  493    HD2  PHE  64           1HD      PHE  64   4.138   0.664   4.256
  494    HE1  PHE  64           2HE      PHE  64   3.541   1.938   8.969
  495    HE2  PHE  64           1HE      PHE  64   2.888  -0.811   5.777
  496    HZ   PHE  64           HZ       PHE  64   2.590  -0.176   8.138
  497    H    VAL  65           H        VAL  65   4.203   6.067   6.257
  498    HA   VAL  65           HA       VAL  65   5.818   8.157   5.324
  499    HB   VAL  65           HB       VAL  65   4.943   7.556   8.153
  500   1HG1  VAL  65          1HG1      VAL  65   6.535   9.111   8.595
  501   2HG1  VAL  65          2HG1      VAL  65   6.485   9.788   6.966
  502   3HG1  VAL  65          3HG1      VAL  65   5.234  10.208   8.137
  503   1HG2  VAL  65          1HG2      VAL  65   3.757   9.562   6.257
  504   2HG2  VAL  65          2HG2      VAL  65   3.187   7.895   6.335
  505   3HG2  VAL  65          3HG2      VAL  65   3.078   8.932   7.757
  506    H    LYS  66           H        LYS  66   6.626   5.247   6.961
  507    HA   LYS  66           HA       LYS  66   9.395   6.202   7.271
  508   1HB   LYS  66          1HB       LYS  66   7.698   4.591   9.141
  509   2HB   LYS  66          2HB       LYS  66   9.441   4.351   9.127
  510   1HG   LYS  66          1HG       LYS  66   9.220   5.923  10.775
  511   2HG   LYS  66          2HG       LYS  66   9.511   6.949   9.368
  512   1HD   LYS  66          1HD       LYS  66   7.698   7.955  10.455
  513   2HD   LYS  66          2HD       LYS  66   6.961   7.037   9.139
  514   1HE   LYS  66          1HE       LYS  66   5.791   5.794  10.568
  515   2HE   LYS  66          2HE       LYS  66   7.232   5.416  11.511
  516   1HZ   LYS  66          1HZ       LYS  66   5.136   7.252  12.087
  517   2HZ   LYS  66          2HZ       LYS  66   6.639   8.025  12.120
  518   3HZ   LYS  66          3HZ       LYS  66   6.362   6.675  13.099
  519    H    LYS  67           H        LYS  67  10.764   3.995   7.746
  520    HA   LYS  67           HA       LYS  67  10.376   2.428   5.307
  521   1HB   LYS  67          1HB       LYS  67  12.742   2.511   7.188
  522   2HB   LYS  67          2HB       LYS  67  12.683   1.690   5.634
  523   1HG   LYS  67          1HG       LYS  67  11.952   4.397   5.215
  524   2HG   LYS  67          2HG       LYS  67  13.417   4.368   6.199
  525   1HD   LYS  67          1HD       LYS  67  13.324   2.527   3.882
  526   2HD   LYS  67          2HD       LYS  67  13.455   4.251   3.526
  527   1HE   LYS  67          1HE       LYS  67  15.248   2.998   5.564
  528   2HE   LYS  67          2HE       LYS  67  15.609   2.824   3.848
  529   1HZ   LYS  67          1HZ       LYS  67  15.910   5.099   3.601
  530   2HZ   LYS  67          2HZ       LYS  67  16.634   4.780   5.096
  531   3HZ   LYS  67          3HZ       LYS  67  15.094   5.478   5.034
  532    H    GLN  68           H        GLN  68   9.242   0.617   5.497
  533    HA   GLN  68           HA       GLN  68   9.659  -1.048   7.890
  534   1HB   GLN  68          1HB       GLN  68   7.115  -0.327   6.471
  535   2HB   GLN  68          2HB       GLN  68   7.235  -1.837   7.366
  536   1HG   GLN  68          1HG       GLN  68   6.227  -0.037   8.685
  537   2HG   GLN  68          2HG       GLN  68   7.719  -0.644   9.402
  538   1HE2  GLN  68          1HE2      GLN  68   8.822   0.934  10.292
  539   2HE2  GLN  68          2HE2      GLN  68   9.026   2.527   9.656
  540    H    THR  69           H        THR  69   9.260  -3.356   7.556
  541    HA   THR  69           HA       THR  69  10.215  -4.179   4.916
  542    HB   THR  69           HB       THR  69  10.976  -6.185   5.887
  543    HG1  THR  69           1HG      THR  69  10.343  -6.553   8.222
  544   1HG2  THR  69          1HG2      THR  69  12.332  -4.271   6.550
  545   2HG2  THR  69          2HG2      THR  69  12.294  -5.472   7.841
  546   3HG2  THR  69          3HG2      THR  69  11.308  -4.015   7.962
  547    H    PHE  70           H        PHE  70   9.386  -6.434   4.234
  548    HA   PHE  70           HA       PHE  70   6.656  -6.219   3.628
  549   1HB   PHE  70          1HB       PHE  70   7.949  -7.486   2.124
  550   2HB   PHE  70          2HB       PHE  70   8.638  -8.471   3.410
  551    HD1  PHE  70           1HD      PHE  70   5.315  -7.664   1.920
  552    HD2  PHE  70           2HD      PHE  70   7.843 -10.607   3.672
  553    HE1  PHE  70           1HE      PHE  70   3.593  -9.376   1.522
  554    HE2  PHE  70           2HE      PHE  70   6.125 -12.323   3.275
  555    HZ   PHE  70           HZ       PHE  70   3.997 -11.709   2.198
  556    H    ASN  71           H        ASN  71   8.313  -8.470   5.841
  557    HA   ASN  71           HA       ASN  71   5.995  -9.694   6.837
  558   1HB   ASN  71          1HB       ASN  71   8.777  -9.871   7.290
  559   2HB   ASN  71          2HB       ASN  71   8.037  -9.578   8.861
  560   1HD2  ASN  71          1HD2      ASN  71   9.192 -11.953   7.156
  561   2HD2  ASN  71          2HD2      ASN  71   8.093 -13.231   7.534
  562    H    LYS  72           H        LYS  72   7.787  -6.852   7.928
  563    HA   LYS  72           HA       LYS  72   6.330  -6.426  10.309
  564   1HB   LYS  72          1HB       LYS  72   8.570  -5.355   9.333
  565   2HB   LYS  72          2HB       LYS  72   7.449  -4.098   8.828
  566   1HG   LYS  72          1HG       LYS  72   7.925  -5.067  11.638
  567   2HG   LYS  72          2HG       LYS  72   8.407  -3.514  10.951
  568   1HD   LYS  72          1HD       LYS  72   6.008  -2.996  10.573
  569   2HD   LYS  72          2HD       LYS  72   5.590  -4.501  11.396
  570   1HE   LYS  72          1HE       LYS  72   6.993  -2.099  12.551
  571   2HE   LYS  72          2HE       LYS  72   5.398  -2.718  12.976
  572   1HZ   LYS  72          1HZ       LYS  72   6.934  -3.387  14.647
  573   2HZ   LYS  72          2HZ       LYS  72   8.015  -4.011  13.506
  574   3HZ   LYS  72          3HZ       LYS  72   6.523  -4.768  13.759
  575    H    VAL  73           H        VAL  73   6.022  -4.969   7.075
  576    HA   VAL  73           HA       VAL  73   3.898  -3.261   7.578
  577    HB   VAL  73           HB       VAL  73   4.610  -4.773   5.067
  578   1HG1  VAL  73          1HG1      VAL  73   3.165  -2.931   3.988
  579   2HG1  VAL  73          2HG1      VAL  73   2.355  -4.324   4.708
  580   3HG1  VAL  73          3HG1      VAL  73   2.422  -2.792   5.581
  581   1HG2  VAL  73          1HG2      VAL  73   5.808  -2.918   4.430
  582   2HG2  VAL  73          2HG2      VAL  73   4.866  -1.825   5.443
  583   3HG2  VAL  73          3HG2      VAL  73   6.064  -2.892   6.175
  584    H    LYS  74           H        LYS  74   3.934  -6.708   7.306
  585    HA   LYS  74           HA       LYS  74   1.221  -7.142   6.661
  586   1HB   LYS  74          1HB       LYS  74   3.112  -8.904   8.231
  587   2HB   LYS  74          2HB       LYS  74   1.587  -9.419   7.522
  588   1HG   LYS  74          1HG       LYS  74   2.946  -8.298   5.396
  589   2HG   LYS  74          2HG       LYS  74   4.202  -9.140   6.306
  590   1HD   LYS  74          1HD       LYS  74   3.507 -10.920   5.106
  591   2HD   LYS  74          2HD       LYS  74   2.248 -11.003   6.341
  592   1HE   LYS  74          1HE       LYS  74   0.716  -9.799   4.936
  593   2HE   LYS  74          2HE       LYS  74   1.978  -9.497   3.743
  594   1HZ   LYS  74          1HZ       LYS  74   0.248 -11.486   3.539
  595   2HZ   LYS  74          2HZ       LYS  74   1.461 -12.283   4.406
  596   3HZ   LYS  74          3HZ       LYS  74   1.816 -11.573   2.912
  597    H    TRP  75           H        TRP  75   2.644  -5.874   9.433
  598    HA   TRP  75           HA       TRP  75   0.874  -6.899  11.410
  599   1HB   TRP  75          1HB       TRP  75   1.884  -5.381  12.897
  600   2HB   TRP  75          2HB       TRP  75   3.162  -5.779  11.752
  601    HD1  TRP  75           HD       TRP  75   2.353  -3.783   9.410
  602    HE1  TRP  75           1HE      TRP  75   2.695  -1.252   9.731
  603    HE3  TRP  75           3HE      TRP  75   2.483  -3.624  14.518
  604    HZ2  TRP  75           2HZ      TRP  75   2.982   0.570  11.868
  605    HZ3  TRP  75           3HZ      TRP  75   2.795  -1.448  15.623
  606    HH2  TRP  75           HH       TRP  75   3.040   0.605  14.323
  607    H    TYR  76           H        TYR  76   0.574  -4.500   8.986
  608    HA   TYR  76           HA       TYR  76  -1.859  -3.450  10.274
  609   1HB   TYR  76          1HB       TYR  76   0.299  -2.165   8.771
  610   2HB   TYR  76          2HB       TYR  76  -1.304  -1.727   8.193
  611    HD1  TYR  76           2HD      TYR  76  -2.819  -1.789  10.756
  612    HD2  TYR  76           1HD      TYR  76   1.026  -0.215   9.843
  613    HE1  TYR  76           2HE      TYR  76  -3.047  -0.179  12.601
  614    HE2  TYR  76           1HE      TYR  76   0.810   1.399  11.686
  615    HH   TYR  76           HH       TYR  76  -0.406   1.720  13.719
  616    H    LEU  77           H        LEU  77  -0.485  -4.285   7.098
  617    HA   LEU  77           HA       LEU  77  -3.024  -4.301   5.791
  618   1HB   LEU  77          1HB       LEU  77  -0.321  -5.357   4.993
  619   2HB   LEU  77          2HB       LEU  77  -1.738  -5.424   3.946
  620    HG   LEU  77           HG       LEU  77  -0.372  -2.931   4.958
  621   1HD1  LEU  77          1HD1      LEU  77  -0.075  -2.642   2.425
  622   2HD1  LEU  77          2HD1      LEU  77  -0.401  -4.372   2.331
  623   3HD1  LEU  77          3HD1      LEU  77   0.976  -3.785   3.262
  624   1HD2  LEU  77          1HD2      LEU  77  -2.742  -2.536   4.810
  625   2HD2  LEU  77          2HD2      LEU  77  -2.806  -3.283   3.213
  626   3HD2  LEU  77          3HD2      LEU  77  -1.943  -1.761   3.442
  627    H    GLY  78           H        GLY  78  -1.496  -6.465   7.869
  628   1HA   GLY  78          1HA       GLY  78  -2.112  -8.555   8.604
  629   2HA   GLY  78          2HA       GLY  78  -3.576  -8.383   7.647
  630    H    ALA  79           H        ALA  79  -2.042 -10.776   7.996
  631    HA   ALA  79           HA       ALA  79  -0.463 -11.234   5.652
  632   1HB   ALA  79          1HB       ALA  79   0.252 -12.738   7.158
  633   2HB   ALA  79          2HB       ALA  79  -1.292 -12.773   8.009
  634   3HB   ALA  79          3HB       ALA  79  -1.073 -13.725   6.541
  635    H    ARG  80           H        ARG  80  -3.822 -11.559   6.489
  636    HA   ARG  80           HA       ARG  80  -4.707 -13.414   4.635
  637   1HB   ARG  80          1HB       ARG  80  -6.127 -10.890   5.508
  638   2HB   ARG  80          2HB       ARG  80  -6.886 -12.295   4.770
  639   1HG   ARG  80          1HG       ARG  80  -5.323 -12.634   7.285
  640   2HG   ARG  80          2HG       ARG  80  -6.950 -11.955   7.353
  641   1HD   ARG  80          1HD       ARG  80  -6.329 -14.528   5.927
  642   2HD   ARG  80          2HD       ARG  80  -6.738 -14.473   7.641
  643    HE   ARG  80           HE       ARG  80  -8.691 -13.087   6.160
  644   1HH1  ARG  80          1HH1      ARG  80  -7.548 -16.318   6.771
  645   2HH1  ARG  80          2HH1      ARG  80  -9.088 -17.058   6.483
  646   1HH2  ARG  80          1HH2      ARG  80 -10.724 -14.049   5.778
  647   2HH2  ARG  80          2HH2      ARG  80 -10.893 -15.766   5.916
  648    H    CYS  81           H        CYS  81  -4.088  -9.957   4.209
  649    HA   CYS  81           HA       CYS  81  -4.798 -10.123   1.388
  650   1HB   CYS  81          1HB       CYS  81  -3.759  -7.708   2.872
  651   2HB   CYS  81          2HB       CYS  81  -4.639  -7.738   1.349
  652    HG   CYS  81           HG       CYS  81  -6.293  -6.688   3.357
  653    H    HIS  82           H        HIS  82  -3.374 -10.108  -0.264
  654    HA   HIS  82           HA       HIS  82  -0.638 -10.721   0.288
  655   1HB   HIS  82          1HB       HIS  82  -2.032 -11.604  -1.651
  656   2HB   HIS  82          2HB       HIS  82  -1.797 -10.034  -2.412
  657    HD1  HIS  82           1HD      HIS  82   0.690 -12.314  -0.646
  658    HD2  HIS  82           2HD      HIS  82   0.086 -10.440  -4.305
  659    HE1  HIS  82           1HE      HIS  82   2.736 -12.834  -2.013
  660    H    ILE  83           H        ILE  83   1.096  -9.426   0.311
  661    HA   ILE  83           HA       ILE  83   0.695  -6.601  -0.423
  662    HB   ILE  83           HB       ILE  83   2.896  -7.521   1.392
  663   1HG1  ILE  83          1HG1      ILE  83   0.043  -6.912   2.193
  664   2HG1  ILE  83          2HG1      ILE  83   0.875  -8.452   2.374
  665   1HG2  ILE  83          1HG2      ILE  83   2.901  -5.230   0.473
  666   2HG2  ILE  83          2HG2      ILE  83   1.342  -4.942   1.242
  667   3HG2  ILE  83          3HG2      ILE  83   2.767  -5.260   2.231
  668   1HD1  ILE  83          1HD1      ILE  83   2.528  -7.130   3.837
  669   2HD1  ILE  83          2HD1      ILE  83   1.250  -5.916   3.904
  670   3HD1  ILE  83          3HD1      ILE  83   0.948  -7.549   4.498
  671    H    GLU  84           H        GLU  84   2.258  -5.530  -1.619
  672    HA   GLU  84           HA       GLU  84   4.613  -6.983  -2.511
  673   1HB   GLU  84          1HB       GLU  84   2.246  -6.866  -4.089
  674   2HB   GLU  84          2HB       GLU  84   3.457  -5.848  -4.857
  675   1HG   GLU  84          1HG       GLU  84   4.947  -8.019  -4.316
  676   2HG   GLU  84          2HG       GLU  84   3.367  -8.770  -4.530
  677    H    LYS  85           H        LYS  85   6.037  -5.592  -3.871
  678    HA   LYS  85           HA       LYS  85   6.145  -2.940  -2.719
  679   1HB   LYS  85          1HB       LYS  85   8.321  -2.778  -3.842
  680   2HB   LYS  85          2HB       LYS  85   8.194  -4.256  -2.897
  681   1HG   LYS  85          1HG       LYS  85   7.613  -5.461  -5.006
  682   2HG   LYS  85          2HG       LYS  85   7.982  -3.975  -5.884
  683   1HD   LYS  85          1HD       LYS  85  10.166  -4.401  -5.806
  684   2HD   LYS  85          2HD       LYS  85  10.110  -4.625  -4.056
  685   1HE   LYS  85          1HE       LYS  85   9.446  -6.934  -4.341
  686   2HE   LYS  85          2HE       LYS  85   9.367  -6.726  -6.089
  687   1HZ   LYS  85          1HZ       LYS  85  11.680  -7.070  -4.364
  688   2HZ   LYS  85          2HZ       LYS  85  11.863  -5.956  -5.624
  689   3HZ   LYS  85          3HZ       LYS  85  11.441  -7.558  -5.966
  690    H    ALA  86           H        ALA  86   5.641  -1.071  -3.696
  691    HA   ALA  86           HA       ALA  86   4.416  -1.193  -6.328
  692   1HB   ALA  86          1HB       ALA  86   4.361   1.451  -5.450
  693   2HB   ALA  86          2HB       ALA  86   3.055   0.268  -5.352
  694   3HB   ALA  86          3HB       ALA  86   4.158   0.478  -3.993
  695    H    LYS  87           H        LYS  87   4.934   0.375  -7.995
  696    HA   LYS  87           HA       LYS  87   7.535   1.660  -7.854
  697   1HB   LYS  87          1HB       LYS  87   8.482   0.549  -9.741
  698   2HB   LYS  87          2HB       LYS  87   7.936  -0.699  -8.629
  699   1HG   LYS  87          1HG       LYS  87   5.972  -1.097  -9.975
  700   2HG   LYS  87          2HG       LYS  87   6.411   0.230 -11.053
  701   1HD   LYS  87          1HD       LYS  87   7.886  -1.028 -12.179
  702   2HD   LYS  87          2HD       LYS  87   8.536  -1.745 -10.703
  703   1HE   LYS  87          1HE       LYS  87   7.288  -3.584 -10.931
  704   2HE   LYS  87          2HE       LYS  87   5.837  -2.650 -11.295
  705   1HZ   LYS  87          1HZ       LYS  87   6.384  -4.007 -13.169
  706   2HZ   LYS  87          2HZ       LYS  87   7.972  -3.427 -13.205
  707   3HZ   LYS  87          3HZ       LYS  87   6.687  -2.395 -13.584
  708    H    GLY  88           H        GLY  88   7.752   3.381  -9.253
  709   1HA   GLY  88          1HA       GLY  88   7.033   4.395 -11.402
  710   2HA   GLY  88          2HA       GLY  88   5.396   3.946 -10.947
  711    H    THR  89           H        THR  89   5.411   6.409 -11.540
  712    HA   THR  89           HA       THR  89   6.220   8.114  -9.337
  713    HB   THR  89           HB       THR  89   5.571   9.969 -10.681
  714    HG1  THR  89           1HG      THR  89   4.288   9.746 -12.506
  715   1HG2  THR  89          1HG2      THR  89   6.568   8.033 -12.747
  716   2HG2  THR  89          2HG2      THR  89   7.587   8.525 -11.394
  717   3HG2  THR  89          3HG2      THR  89   6.982   9.733 -12.527
  718    H    ASP  90           H        ASP  90   4.508   9.863  -8.729
  719    HA   ASP  90           HA       ASP  90   2.528   8.665  -7.202
  720   1HB   ASP  90          1HB       ASP  90   1.663  10.879  -6.805
  721   2HB   ASP  90          2HB       ASP  90   3.419  10.979  -6.886
  722    H    GLN  91           H        GLN  91   2.339  10.029 -10.453
  723    HA   GLN  91           HA       GLN  91  -0.475   9.757 -10.721
  724   1HB   GLN  91          1HB       GLN  91   1.582  10.892 -12.214
  725   2HB   GLN  91          2HB       GLN  91   0.976   9.594 -13.233
  726   1HG   GLN  91          1HG       GLN  91  -0.227  11.530 -13.823
  727   2HG   GLN  91          2HG       GLN  91  -1.326  10.527 -12.877
  728   1HE2  GLN  91          1HE2      GLN  91  -2.633  12.001 -11.989
  729   2HE2  GLN  91          2HE2      GLN  91  -2.115  13.301 -10.976
  730    H    GLN  92           H        GLN  92   2.259   7.664 -11.426
  731    HA   GLN  92           HA       GLN  92   0.856   5.724 -12.923
  732   1HB   GLN  92          1HB       GLN  92   3.488   5.948 -11.631
  733   2HB   GLN  92          2HB       GLN  92   2.874   4.305 -11.749
  734   1HG   GLN  92          1HG       GLN  92   2.387   5.300 -14.252
  735   2HG   GLN  92          2HG       GLN  92   3.910   6.074 -13.816
  736   1HE2  GLN  92          1HE2      GLN  92   5.746   4.879 -13.713
  737   2HE2  GLN  92          2HE2      GLN  92   5.833   3.207 -14.138
  738    H    ASN  93           H        ASN  93   1.524   6.053  -9.468
  739    HA   ASN  93           HA       ASN  93   0.286   3.554  -8.790
  740   1HB   ASN  93          1HB       ASN  93   1.341   5.879  -7.200
  741   2HB   ASN  93          2HB       ASN  93   0.434   4.587  -6.419
  742   1HD2  ASN  93          1HD2      ASN  93   2.769   4.471  -9.071
  743   2HD2  ASN  93          2HD2      ASN  93   3.887   3.424  -8.272
  744    H    LYS  94           H        LYS  94  -0.631   6.972  -8.561
  745    HA   LYS  94           HA       LYS  94  -3.116   6.590  -7.311
  746   1HB   LYS  94          1HB       LYS  94  -1.981   8.776  -7.485
  747   2HB   LYS  94          2HB       LYS  94  -2.291   8.789  -9.216
  748   1HG   LYS  94          1HG       LYS  94  -4.720   8.745  -8.733
  749   2HG   LYS  94          2HG       LYS  94  -4.341   8.876  -7.014
  750   1HD   LYS  94          1HD       LYS  94  -2.965  10.961  -7.762
  751   2HD   LYS  94          2HD       LYS  94  -3.994  10.893  -9.195
  752   1HE   LYS  94          1HE       LYS  94  -5.216  10.781  -6.469
  753   2HE   LYS  94          2HE       LYS  94  -4.710  12.330  -7.142
  754   1HZ   LYS  94          1HZ       LYS  94  -6.577  12.386  -8.301
  755   2HZ   LYS  94          2HZ       LYS  94  -7.051  10.889  -7.675
  756   3HZ   LYS  94          3HZ       LYS  94  -6.151  10.960  -9.106
  757    H    GLU  95           H        GLU  95  -2.207   6.700 -10.729
  758    HA   GLU  95           HA       GLU  95  -4.870   6.483 -11.711
  759   1HB   GLU  95          1HB       GLU  95  -2.172   6.039 -12.978
  760   2HB   GLU  95          2HB       GLU  95  -3.674   5.816 -13.862
  761   1HG   GLU  95          1HG       GLU  95  -4.248   8.103 -13.644
  762   2HG   GLU  95          2HG       GLU  95  -2.958   8.381 -12.475
  763    H    TYR  96           H        TYR  96  -2.342   4.177 -10.912
  764    HA   TYR  96           HA       TYR  96  -3.380   1.889 -12.107
  765   1HB   TYR  96          1HB       TYR  96  -1.139   2.051 -11.046
  766   2HB   TYR  96          2HB       TYR  96  -1.913   2.043  -9.466
  767    HD1  TYR  96           2HD      TYR  96  -1.381   0.020 -12.527
  768    HD2  TYR  96           1HD      TYR  96  -2.528   0.017  -8.430
  769    HE1  TYR  96           2HE      TYR  96  -1.324  -2.439 -12.519
  770    HE2  TYR  96           1HE      TYR  96  -2.473  -2.442  -8.410
  771    HH   TYR  96           HH       TYR  96  -2.591  -4.305 -10.981
  772    H    CYS  97           H        CYS  97  -3.966   3.172  -8.843
  773    HA   CYS  97           HA       CYS  97  -5.786   1.135  -8.089
  774   1HB   CYS  97          1HB       CYS  97  -5.582   3.942  -6.982
  775   2HB   CYS  97          2HB       CYS  97  -6.309   2.550  -6.187
  776    HG   CYS  97           HG       CYS  97  -2.982   2.805  -6.950
  777    H    SER  98           H        SER  98  -6.147   4.246  -9.667
  778    HA   SER  98           HA       SER  98  -9.006   4.295  -9.474
  779   1HB   SER  98          1HB       SER  98  -8.910   6.293 -10.746
  780   2HB   SER  98          2HB       SER  98  -7.456   6.313  -9.748
  781    HG   SER  98           HG       SER  98  -7.685   6.291 -12.441
  782    H    LYS  99           H        LYS  99  -6.789   2.662 -11.443
  783    HA   LYS  99           HA       LYS  99  -8.121   2.558 -13.904
  784   1HB   LYS  99          1HB       LYS  99  -5.818   1.765 -13.577
  785   2HB   LYS  99          2HB       LYS  99  -6.412   0.436 -12.590
  786   1HG   LYS  99          1HG       LYS  99  -7.664  -0.402 -14.555
  787   2HG   LYS  99          2HG       LYS  99  -6.927   0.876 -15.524
  788   1HD   LYS  99          1HD       LYS  99  -5.700  -1.190 -15.819
  789   2HD   LYS  99          2HD       LYS  99  -4.698  -0.021 -14.956
  790   1HE   LYS  99          1HE       LYS  99  -4.537  -1.348 -13.172
  791   2HE   LYS  99          2HE       LYS  99  -6.276  -1.638 -13.143
  792   1HZ   LYS  99          1HZ       LYS  99  -5.791  -3.697 -13.773
  793   2HZ   LYS  99          2HZ       LYS  99  -4.180  -3.312 -14.116
  794   3HZ   LYS  99          3HZ       LYS  99  -5.375  -3.071 -15.289
  795    H    GLU 100           H        GLU 100  -8.900   1.154 -10.877
  796    HA   GLU 100           HA       GLU 100 -10.434  -1.049 -11.841
  797   1HB   GLU 100          1HB       GLU 100 -10.811   0.325  -9.186
  798   2HB   GLU 100          2HB       GLU 100 -11.137  -1.353  -9.594
  799   1HG   GLU 100          1HG       GLU 100  -8.418  -0.072  -9.441
  800   2HG   GLU 100          2HG       GLU 100  -9.135  -1.137  -8.232
  801    H    GLY 101           H        GLY 101 -10.942   2.254 -11.949
  802   1HA   GLY 101          1HA       GLY 101 -12.811   3.210 -13.053
  803   2HA   GLY 101          2HA       GLY 101 -13.776   1.826 -12.563
  804    H    ASN 102           H        ASN 102 -12.991   1.879  -9.797
  805    HA   ASN 102           HA       ASN 102 -14.087   4.451  -8.894
  806   1HB   ASN 102          1HB       ASN 102 -15.794   3.509  -7.661
  807   2HB   ASN 102          2HB       ASN 102 -15.752   2.409  -9.036
  808   1HD2  ASN 102          1HD2      ASN 102 -14.896   2.844  -5.684
  809   2HD2  ASN 102          2HD2      ASN 102 -14.672   1.170  -5.320
  810    H    LEU 103           H        LEU 103 -13.620   4.971  -6.677
  811    HA   LEU 103           HA       LEU 103 -11.181   3.635  -5.716
  812   1HB   LEU 103          1HB       LEU 103 -12.150   6.390  -4.989
  813   2HB   LEU 103          2HB       LEU 103 -10.567   5.687  -4.665
  814    HG   LEU 103           HG       LEU 103 -11.657   6.490  -7.362
  815   1HD1  LEU 103          1HD1      LEU 103 -10.830   8.232  -5.625
  816   2HD1  LEU 103          2HD1      LEU 103 -10.254   8.321  -7.289
  817   3HD1  LEU 103          3HD1      LEU 103  -9.229   7.620  -6.037
  818   1HD2  LEU 103          1HD2      LEU 103  -9.375   5.945  -8.162
  819   2HD2  LEU 103          2HD2      LEU 103 -10.283   4.533  -7.621
  820   3HD2  LEU 103          3HD2      LEU 103  -9.031   5.226  -6.589
  821    H    LEU 104           H        LEU 104 -11.115   2.747  -3.731
  822    HA   LEU 104           HA       LEU 104 -13.600   2.580  -2.245
  823   1HB   LEU 104          1HB       LEU 104 -12.231   0.577  -2.683
  824   2HB   LEU 104          2HB       LEU 104 -10.931   1.279  -1.721
  825    HG   LEU 104           HG       LEU 104 -12.605   1.276   0.214
  826   1HD1  LEU 104          1HD1      LEU 104 -14.010  -1.003  -0.908
  827   2HD1  LEU 104          2HD1      LEU 104 -14.363   0.499  -1.762
  828   3HD1  LEU 104          3HD1      LEU 104 -14.633   0.390  -0.022
  829   1HD2  LEU 104          1HD2      LEU 104 -12.048  -1.522  -0.597
  830   2HD2  LEU 104          2HD2      LEU 104 -11.734  -0.699   0.931
  831   3HD2  LEU 104          3HD2      LEU 104 -10.676  -0.423  -0.453
  832    H    MET 105           H        MET 105 -10.651   4.320  -2.119
  833    HA   MET 105           HA       MET 105 -11.535   5.866   0.106
  834   1HB   MET 105          1HB       MET 105 -10.738   4.269   1.581
  835   2HB   MET 105          2HB       MET 105  -9.432   3.779   0.511
  836   1HG   MET 105          1HG       MET 105  -8.025   5.377   1.265
  837   2HG   MET 105          2HG       MET 105  -9.319   6.536   1.556
  838   1HE   MET 105          1HE       MET 105  -7.788   3.052   3.283
  839   2HE   MET 105          2HE       MET 105  -6.788   4.419   2.789
  840   3HE   MET 105          3HE       MET 105  -7.092   4.120   4.501
  841    H    GLU 106           H        GLU 106 -10.624   7.854   0.071
  842    HA   GLU 106           HA       GLU 106  -8.224   8.231  -1.591
  843   1HB   GLU 106          1HB       GLU 106 -10.513   8.921  -2.620
  844   2HB   GLU 106          2HB       GLU 106 -10.414  10.281  -1.510
  845   1HG   GLU 106          1HG       GLU 106  -7.976  10.423  -2.621
  846   2HG   GLU 106          2HG       GLU 106  -8.880   9.715  -3.958
  847    H    CYS 107           H        CYS 107  -6.697   8.734  -0.147
  848    HA   CYS 107           HA       CYS 107  -7.048  11.130   1.451
  849   1HB   CYS 107          1HB       CYS 107  -6.691   8.395   2.623
  850   2HB   CYS 107          2HB       CYS 107  -5.989   9.787   3.439
  851    HG   CYS 107           HG       CYS 107  -8.419  11.098   3.811
  852    H    GLY 108           H        GLY 108  -4.883  11.484   2.757
  853   1HA   GLY 108          1HA       GLY 108  -2.599  11.777   2.711
  854   2HA   GLY 108          2HA       GLY 108  -2.500  10.387   1.640
  855    H    ALA 109           H        ALA 109  -0.737  12.046   0.917
  856    HA   ALA 109           HA       ALA 109  -1.900  13.839  -1.109
  857   1HB   ALA 109          1HB       ALA 109  -0.596  15.303   0.003
  858   2HB   ALA 109          2HB       ALA 109   0.460  14.043   0.644
  859   3HB   ALA 109          3HB       ALA 109   0.675  14.617  -1.010
  860    HA   PRO 110           HA       PRO 110  -0.220  11.499  -4.419
  861   1HB   PRO 110          1HB       PRO 110   0.605  13.434  -6.135
  862   2HB   PRO 110          2HB       PRO 110  -1.100  13.070  -5.847
  863   1HG   PRO 110          1HG       PRO 110   0.591  15.255  -4.696
  864   2HG   PRO 110          2HG       PRO 110  -1.072  15.331  -5.307
  865   1HD   PRO 110          1HD       PRO 110  -0.496  15.193  -2.665
  866   2HD   PRO 110          2HD       PRO 110  -1.960  14.471  -3.362
  867    H    ARG 111           H        ARG 111   1.561  10.749  -2.978
  868    HA   ARG 111           HA       ARG 111   4.087  12.060  -3.014
  869   1HB   ARG 111          1HB       ARG 111   3.112   9.362  -2.154
  870   2HB   ARG 111          2HB       ARG 111   4.840   9.658  -2.281
  871   1HG   ARG 111          1HG       ARG 111   2.925  11.261  -0.599
  872   2HG   ARG 111          2HG       ARG 111   3.991   9.987  -0.005
  873   1HD   ARG 111          1HD       ARG 111   5.374  11.720   0.412
  874   2HD   ARG 111          2HD       ARG 111   5.780  11.526  -1.293
  875    HE   ARG 111           HE       ARG 111   3.588  13.269  -1.055
  876   1HH1  ARG 111          1HH1      ARG 111   7.004  13.138  -0.398
  877   2HH1  ARG 111          2HH1      ARG 111   7.237  14.845  -0.577
  878   1HH2  ARG 111          1HH2      ARG 111   3.881  15.519  -1.293
  879   2HH2  ARG 111          2HH2      ARG 111   5.459  16.199  -1.085
  880    H    SER 112           H        SER 112   5.572  12.087  -4.562
  881    HA   SER 112           HA       SER 112   5.391  10.077  -6.707
  882   1HB   SER 112          1HB       SER 112   6.934  12.516  -7.276
  883   2HB   SER 112          2HB       SER 112   5.717  11.696  -8.254
  884    HG   SER 112           HG       SER 112   5.410  13.919  -6.940
  885    H    GLN 113           H        GLN 113   7.687  10.132  -7.940
  886    HA   GLN 113           HA       GLN 113   9.809   9.893  -5.923
  887   1HB   GLN 113          1HB       GLN 113   8.545   7.707  -7.034
  888   2HB   GLN 113          2HB       GLN 113   9.972   7.888  -8.045
  889   1HG   GLN 113          1HG       GLN 113  11.181   8.093  -5.717
  890   2HG   GLN 113          2HG       GLN 113   9.759   7.210  -5.163
  891   1HE2  GLN 113          1HE2      GLN 113  11.990   5.923  -4.793
  892   2HE2  GLN 113          2HE2      GLN 113  12.239   4.673  -5.958
  893    H    GLY 114           H        GLY 114  11.977   9.993  -6.786
  894   1HA   GLY 114          1HA       GLY 114  12.893  10.288  -9.295
  895   2HA   GLY 114          2HA       GLY 114  12.130  11.845  -9.013
  896    H    GLN 115           H        GLN 115  14.801   9.773  -8.239
  897    HA   GLN 115           HA       GLN 115  15.914  11.642  -6.317
  898   1HB   GLN 115          1HB       GLN 115  16.090   9.079  -6.203
  899   2HB   GLN 115          2HB       GLN 115  17.319   9.236  -7.451
  900   1HG   GLN 115          1HG       GLN 115  18.860   9.991  -6.018
  901   2HG   GLN 115          2HG       GLN 115  17.705  11.001  -5.150
  902   1HE2  GLN 115          1HE2      GLN 115  19.258   7.925  -5.325
  903   2HE2  GLN 115          2HE2      GLN 115  18.681   7.308  -3.819
  904    H    ARG 116           H        ARG 116  16.929  10.254  -9.442
  905    HA   ARG 116           HA       ARG 116  17.962  12.784 -10.321
  906   1HB   ARG 116          1HB       ARG 116  19.714  11.392  -8.789
  907   2HB   ARG 116          2HB       ARG 116  20.090  10.737 -10.377
  908   1HG   ARG 116          1HG       ARG 116  21.559  12.523 -10.135
  909   2HG   ARG 116          2HG       ARG 116  20.260  13.173 -11.138
  910   1HD   ARG 116          1HD       ARG 116  20.064  13.458  -8.180
  911   2HD   ARG 116          2HD       ARG 116  21.186  14.499  -9.055
  912    HE   ARG 116           HE       ARG 116  18.351  14.719  -8.995
  913   1HH1  ARG 116          1HH1      ARG 116  21.135  15.182 -11.034
  914   2HH1  ARG 116          2HH1      ARG 116  20.384  16.406 -12.003
  915   1HH2  ARG 116          1HH2      ARG 116  17.352  16.330 -10.264
  916   2HH2  ARG 116          2HH2      ARG 116  18.232  17.059 -11.564
  Start of MODEL   17
    1    HA   PRO   2           HA       PRO   2  33.999   5.689   7.514
    2   1HB   PRO   2          1HB       PRO   2  35.634   3.563   7.933
    3   2HB   PRO   2          2HB       PRO   2  35.794   4.638   6.539
    4   1HG   PRO   2          1HG       PRO   2  37.341   4.617   9.103
    5   2HG   PRO   2          2HG       PRO   2  37.929   4.825   7.443
    6   1HD   PRO   2          1HD       PRO   2  37.562   6.910   9.130
    7   2HD   PRO   2          2HD       PRO   2  37.330   7.050   7.375
    8    H    SER   3           H        SER   3  32.609   6.105   9.365
    9    HA   SER   3           HA       SER   3  33.032   5.109  11.938
   10   1HB   SER   3          1HB       SER   3  30.478   5.142  12.070
   11   2HB   SER   3          2HB       SER   3  31.264   6.664  11.652
   12    HG   SER   3           HG       SER   3  29.632   6.399  10.200
   13    H    LYS   4           H        LYS   4  31.263   3.426  12.817
   14    HA   LYS   4           HA       LYS   4  31.843   0.940  11.377
   15   1HB   LYS   4          1HB       LYS   4  31.440   1.673  14.211
   16   2HB   LYS   4          2HB       LYS   4  30.759   0.125  13.727
   17   1HG   LYS   4          1HG       LYS   4  32.808  -0.803  13.303
   18   2HG   LYS   4          2HG       LYS   4  33.566   0.755  12.963
   19   1HD   LYS   4          1HD       LYS   4  33.097   1.225  15.482
   20   2HD   LYS   4          2HD       LYS   4  32.970  -0.532  15.598
   21   1HE   LYS   4          1HE       LYS   4  35.191  -0.858  15.033
   22   2HE   LYS   4          2HE       LYS   4  35.321   0.705  14.228
   23   1HZ   LYS   4          1HZ       LYS   4  35.343   0.122  17.124
   24   2HZ   LYS   4          2HZ       LYS   4  34.987   1.671  16.546
   25   3HZ   LYS   4          3HZ       LYS   4  36.488   0.967  16.208
   26    H    LYS   5           H        LYS   5  30.206   1.208   9.784
   27    HA   LYS   5           HA       LYS   5  27.594   0.310  10.713
   28   1HB   LYS   5          1HB       LYS   5  26.421   1.974   9.303
   29   2HB   LYS   5          2HB       LYS   5  27.310   2.713  10.628
   30   1HG   LYS   5          1HG       LYS   5  28.912   3.616   9.224
   31   2HG   LYS   5          2HG       LYS   5  28.560   2.474   7.924
   32   1HD   LYS   5          1HD       LYS   5  26.410   4.343   8.791
   33   2HD   LYS   5          2HD       LYS   5  27.738   4.983   7.819
   34   1HE   LYS   5          1HE       LYS   5  26.706   2.474   6.779
   35   2HE   LYS   5          2HE       LYS   5  25.464   3.722   6.874
   36   1HZ   LYS   5          1HZ       LYS   5  26.558   5.055   5.387
   37   2HZ   LYS   5          2HZ       LYS   5  26.957   3.528   4.778
   38   3HZ   LYS   5          3HZ       LYS   5  28.078   4.387   5.710
   39    H    ASN   6           H        ASN   6  26.314  -0.679   9.063
   40    HA   ASN   6           HA       ASN   6  27.109  -0.921   6.378
   41   1HB   ASN   6          1HB       ASN   6  28.719  -2.437   8.073
   42   2HB   ASN   6          2HB       ASN   6  27.561  -3.595   7.427
   43   1HD2  ASN   6          1HD2      ASN   6  30.171  -1.441   6.704
   44   2HD2  ASN   6          2HD2      ASN   6  30.454  -1.992   5.091
   45    H    GLY   7           H        GLY   7  25.451  -1.715   5.207
   46   1HA   GLY   7          1HA       GLY   7  22.958  -2.186   6.369
   47   2HA   GLY   7          2HA       GLY   7  23.393  -2.604   4.718
   48    H    ARG   8           H        ARG   8  21.631  -4.212   5.912
   49    HA   ARG   8           HA       ARG   8  23.062  -6.714   6.033
   50   1HB   ARG   8          1HB       ARG   8  22.028  -7.391   8.201
   51   2HB   ARG   8          2HB       ARG   8  23.232  -6.118   8.354
   52   1HG   ARG   8          1HG       ARG   8  21.592  -4.469   8.721
   53   2HG   ARG   8          2HG       ARG   8  20.292  -5.538   8.190
   54   1HD   ARG   8          1HD       ARG   8  21.976  -6.335  10.519
   55   2HD   ARG   8          2HD       ARG   8  20.728  -5.109  10.742
   56    HE   ARG   8           HE       ARG   8  20.337  -7.919  10.397
   57   1HH1  ARG   8          1HH1      ARG   8  18.916  -4.787   9.857
   58   2HH1  ARG   8          2HH1      ARG   8  17.289  -5.380   9.856
   59   1HH2  ARG   8          1HH2      ARG   8  18.198  -8.713  10.398
   60   2HH2  ARG   8          2HH2      ARG   8  16.881  -7.614  10.165
   61    H    SER   9           H        SER   9  21.559  -8.581   6.127
   62    HA   SER   9           HA       SER   9  19.752  -9.727   5.354
   63   1HB   SER   9          1HB       SER   9  18.704  -7.775   6.992
   64   2HB   SER   9          2HB       SER   9  17.813  -7.532   5.490
   65    HG   SER   9           HG       SER   9  16.764  -9.309   5.860
   66    H    GLY  10           H        GLY  10  18.121  -9.792   3.571
   67   1HA   GLY  10          1HA       GLY  10  19.255  -8.527   1.231
   68   2HA   GLY  10          2HA       GLY  10  17.958  -9.712   1.254
   69    HA   PRO  11           HA       PRO  11  14.910  -6.626   0.657
   70   1HB   PRO  11          1HB       PRO  11  12.959  -7.252   2.437
   71   2HB   PRO  11          2HB       PRO  11  13.295  -8.223   0.999
   72   1HG   PRO  11          1HG       PRO  11  14.154  -8.673   3.831
   73   2HG   PRO  11          2HG       PRO  11  13.541  -9.844   2.649
   74   1HD   PRO  11          1HD       PRO  11  16.178  -9.577   3.202
   75   2HD   PRO  11          2HD       PRO  11  15.581 -10.038   1.594
   76    H    GLN  12           H        GLN  12  14.548  -4.557   1.234
   77    HA   GLN  12           HA       GLN  12  15.085  -3.797   4.030
   78   1HB   GLN  12          1HB       GLN  12  15.553  -1.952   1.705
   79   2HB   GLN  12          2HB       GLN  12  16.195  -1.846   3.339
   80   1HG   GLN  12          1HG       GLN  12  17.556  -3.860   2.891
   81   2HG   GLN  12          2HG       GLN  12  16.972  -3.843   1.228
   82   1HE2  GLN  12          1HE2      GLN  12  18.335  -2.979  -0.146
   83   2HE2  GLN  12          2HE2      GLN  12  19.460  -1.711   0.186
   84    HA   PRO  13           HA       PRO  13  11.128  -1.907   4.185
   85   1HB   PRO  13          1HB       PRO  13  11.606   0.174   5.862
   86   2HB   PRO  13          2HB       PRO  13  11.540  -1.506   6.409
   87   1HG   PRO  13          1HG       PRO  13  13.927   0.194   5.796
   88   2HG   PRO  13          2HG       PRO  13  13.666  -0.922   7.149
   89   1HD   PRO  13          1HD       PRO  13  15.137  -1.588   4.975
   90   2HD   PRO  13          2HD       PRO  13  14.182  -2.778   5.883
   91    H    HIS  14           H        HIS  14   9.916  -0.296   3.250
   92    HA   HIS  14           HA       HIS  14  11.322   2.001   2.091
   93   1HB   HIS  14          1HB       HIS  14   9.485   0.128   0.588
   94   2HB   HIS  14          2HB       HIS  14  10.014   1.693  -0.023
   95    HD1  HIS  14           1HD      HIS  14  11.173  -1.800   0.538
   96    HD2  HIS  14           2HD      HIS  14  12.708   1.805  -0.846
   97    HE1  HIS  14           1HE      HIS  14  13.362  -2.377  -0.557
   98    H    LYS  15           H        LYS  15   9.525   3.461   0.981
   99    HA   LYS  15           HA       LYS  15   7.476   3.862   3.045
  100   1HB   LYS  15          1HB       LYS  15   7.318   6.171   2.045
  101   2HB   LYS  15          2HB       LYS  15   8.857   5.787   2.804
  102   1HG   LYS  15          1HG       LYS  15   8.967   5.069   0.042
  103   2HG   LYS  15          2HG       LYS  15   8.390   6.730   0.197
  104   1HD   LYS  15          1HD       LYS  15  10.375   7.478   0.955
  105   2HD   LYS  15          2HD       LYS  15  10.656   6.038   1.936
  106   1HE   LYS  15          1HE       LYS  15  11.400   4.806   0.017
  107   2HE   LYS  15          2HE       LYS  15  10.938   6.119  -1.064
  108   1HZ   LYS  15          1HZ       LYS  15  13.407   5.771  -0.155
  109   2HZ   LYS  15          2HZ       LYS  15  12.815   6.807   1.043
  110   3HZ   LYS  15          3HZ       LYS  15  12.784   7.286  -0.579
  111    H    ARG  16           H        ARG  16   7.555   2.154   0.424
  112    HA   ARG  16           HA       ARG  16   4.850   2.934  -0.417
  113   1HB   ARG  16          1HB       ARG  16   6.940   1.940  -2.352
  114   2HB   ARG  16          2HB       ARG  16   5.351   2.593  -2.724
  115   1HG   ARG  16          1HG       ARG  16   6.495   4.663  -1.373
  116   2HG   ARG  16          2HG       ARG  16   7.879   3.966  -2.217
  117   1HD   ARG  16          1HD       ARG  16   5.379   4.334  -3.766
  118   2HD   ARG  16          2HD       ARG  16   6.279   5.786  -3.329
  119    HE   ARG  16           HE       ARG  16   6.973   3.904  -5.331
  120   1HH1  ARG  16          1HH1      ARG  16   8.356   5.968  -2.893
  121   2HH1  ARG  16          2HH1      ARG  16   9.870   6.146  -3.716
  122   1HH2  ARG  16          1HH2      ARG  16   8.962   4.130  -6.425
  123   2HH2  ARG  16          2HH2      ARG  16  10.213   5.101  -5.726
  124    H    TRP  17           H        TRP  17   3.461   1.312  -0.223
  125    HA   TRP  17           HA       TRP  17   4.308  -1.422  -0.750
  126   1HB   TRP  17          1HB       TRP  17   3.260  -0.481   1.918
  127   2HB   TRP  17          2HB       TRP  17   3.173  -2.166   1.411
  128    HD1  TRP  17           HD       TRP  17   5.566   0.417   2.777
  129    HE1  TRP  17           1HE      TRP  17   7.839  -0.694   3.254
  130    HE3  TRP  17           3HE      TRP  17   4.754  -4.095   0.515
  131    HZ2  TRP  17           2HZ      TRP  17   9.118  -3.157   2.739
  132    HZ3  TRP  17           3HZ      TRP  17   6.554  -5.773   0.551
  133    HH2  TRP  17           HH       TRP  17   8.690  -5.312   1.640
  134    H    VAL  18           H        VAL  18   2.726  -2.635  -1.642
  135    HA   VAL  18           HA       VAL  18   0.059  -1.402  -1.843
  136    HB   VAL  18           HB       VAL  18  -0.246  -2.703  -3.903
  137   1HG1  VAL  18          1HG1      VAL  18   0.587  -0.462  -4.131
  138   2HG1  VAL  18          2HG1      VAL  18   2.239  -0.998  -3.816
  139   3HG1  VAL  18          3HG1      VAL  18   1.418  -1.492  -5.297
  140   1HG2  VAL  18          1HG2      VAL  18   1.833  -4.251  -2.925
  141   2HG2  VAL  18          2HG2      VAL  18   1.084  -4.385  -4.516
  142   3HG2  VAL  18          3HG2      VAL  18   2.537  -3.408  -4.304
  143    H    PHE  19           H        PHE  19  -1.786  -2.861  -1.940
  144    HA   PHE  19           HA       PHE  19  -1.338  -5.447  -0.621
  145   1HB   PHE  19          1HB       PHE  19  -3.441  -4.983   0.722
  146   2HB   PHE  19          2HB       PHE  19  -2.018  -4.052   1.181
  147    HD1  PHE  19           1HD      PHE  19  -1.833  -1.672   0.475
  148    HD2  PHE  19           2HD      PHE  19  -5.405  -3.928  -0.040
  149    HE1  PHE  19           1HE      PHE  19  -3.107   0.415   0.197
  150    HE2  PHE  19           2HE      PHE  19  -6.684  -1.846  -0.320
  151    HZ   PHE  19           HZ       PHE  19  -5.536   0.330  -0.202
  152    H    THR  20           H        THR  20  -2.764  -7.078  -1.165
  153    HA   THR  20           HA       THR  20  -4.990  -6.493  -2.947
  154    HB   THR  20           HB       THR  20  -4.242  -8.203  -4.604
  155    HG1  THR  20           1HG      THR  20  -1.797  -7.991  -3.150
  156   1HG2  THR  20          1HG2      THR  20  -3.776  -5.607  -4.653
  157   2HG2  THR  20          2HG2      THR  20  -3.096  -6.675  -5.881
  158   3HG2  THR  20          3HG2      THR  20  -2.098  -6.133  -4.532
  159    H    LEU  21           H        LEU  21  -6.669  -7.753  -2.469
  160    HA   LEU  21           HA       LEU  21  -6.207 -10.435  -1.395
  161   1HB   LEU  21          1HB       LEU  21  -6.471  -8.873   0.510
  162   2HB   LEU  21          2HB       LEU  21  -8.061  -8.435  -0.111
  163    HG   LEU  21           HG       LEU  21  -8.190 -11.188   0.126
  164   1HD1  LEU  21          1HD1      LEU  21  -6.497 -10.018   2.304
  165   2HD1  LEU  21          2HD1      LEU  21  -6.253 -11.500   1.381
  166   3HD1  LEU  21          3HD1      LEU  21  -7.530 -11.417   2.593
  167   1HD2  LEU  21          1HD2      LEU  21  -9.841 -10.757   1.726
  168   2HD2  LEU  21          2HD2      LEU  21  -9.825  -9.312   0.716
  169   3HD2  LEU  21          3HD2      LEU  21  -9.038  -9.294   2.295
  170    H    ASN  22           H        ASN  22  -7.674 -11.924  -2.049
  171    HA   ASN  22           HA       ASN  22  -9.607 -11.080  -4.039
  172   1HB   ASN  22          1HB       ASN  22  -9.850 -13.441  -4.542
  173   2HB   ASN  22          2HB       ASN  22  -8.138 -13.046  -4.427
  174   1HD2  ASN  22          1HD2      ASN  22  -9.716 -15.564  -4.041
  175   2HD2  ASN  22          2HD2      ASN  22  -9.208 -16.161  -2.501
  176    H    ASN  23           H        ASN  23 -11.772 -11.062  -3.812
  177    HA   ASN  23           HA       ASN  23 -13.785 -10.954  -2.749
  178   1HB   ASN  23          1HB       ASN  23 -13.638 -13.383  -3.104
  179   2HB   ASN  23          2HB       ASN  23 -12.812 -13.561  -1.559
  180   1HD2  ASN  23          1HD2      ASN  23 -15.611 -11.607  -2.492
  181   2HD2  ASN  23          2HD2      ASN  23 -16.701 -12.312  -1.352
  182    HA   PRO  24           HA       PRO  24 -11.788  -9.355   1.160
  183   1HB   PRO  24          1HB       PRO  24 -12.519  -6.768   0.779
  184   2HB   PRO  24          2HB       PRO  24 -11.022  -7.449   0.131
  185   1HG   PRO  24          1HG       PRO  24 -13.640  -6.980  -1.243
  186   2HG   PRO  24          2HG       PRO  24 -11.996  -6.671  -1.832
  187   1HD   PRO  24          1HD       PRO  24 -13.419  -8.854  -2.566
  188   2HD   PRO  24          2HD       PRO  24 -11.651  -8.876  -2.407
  189    H    SER  25           H        SER  25 -12.866  -8.969   3.053
  190    HA   SER  25           HA       SER  25 -15.770  -9.200   2.948
  191   1HB   SER  25          1HB       SER  25 -13.688  -9.992   4.807
  192   2HB   SER  25          2HB       SER  25 -14.981  -9.121   5.631
  193    HG   SER  25           HG       SER  25 -15.533 -11.205   3.807
  194    H    GLU  26           H        GLU  26 -16.997  -7.929   4.665
  195    HA   GLU  26           HA       GLU  26 -16.653  -5.161   4.142
  196   1HB   GLU  26          1HB       GLU  26 -18.625  -6.861   5.397
  197   2HB   GLU  26          2HB       GLU  26 -18.363  -5.407   6.351
  198   1HG   GLU  26          1HG       GLU  26 -18.570  -4.275   3.956
  199   2HG   GLU  26          2HG       GLU  26 -19.524  -5.725   3.650
  200    H    ASP  27           H        ASP  27 -15.689  -7.271   6.741
  201    HA   ASP  27           HA       ASP  27 -15.068  -5.173   8.594
  202   1HB   ASP  27          1HB       ASP  27 -15.392  -7.909   8.786
  203   2HB   ASP  27          2HB       ASP  27 -13.656  -7.702   8.998
  204    H    GLU  28           H        GLU  28 -13.185  -7.231   6.402
  205    HA   GLU  28           HA       GLU  28 -10.646  -6.259   7.106
  206   1HB   GLU  28          1HB       GLU  28 -11.688  -8.115   5.277
  207   2HB   GLU  28          2HB       GLU  28 -10.794  -6.953   4.306
  208   1HG   GLU  28          1HG       GLU  28  -9.699  -8.457   6.672
  209   2HG   GLU  28          2HG       GLU  28  -9.419  -8.859   4.979
  210    H    ARG  29           H        ARG  29 -12.841  -5.296   4.479
  211    HA   ARG  29           HA       ARG  29 -11.188  -3.265   3.436
  212   1HB   ARG  29          1HB       ARG  29 -14.177  -3.677   3.297
  213   2HB   ARG  29          2HB       ARG  29 -13.330  -2.414   2.412
  214   1HG   ARG  29          1HG       ARG  29 -12.329  -3.900   0.975
  215   2HG   ARG  29          2HG       ARG  29 -12.447  -5.244   2.114
  216   1HD   ARG  29          1HD       ARG  29 -13.990  -5.526   0.241
  217   2HD   ARG  29          2HD       ARG  29 -14.857  -5.341   1.765
  218    HE   ARG  29           HE       ARG  29 -14.557  -2.840   0.465
  219   1HH1  ARG  29          1HH1      ARG  29 -16.367  -5.811   0.344
  220   2HH1  ARG  29          2HH1      ARG  29 -17.753  -5.089  -0.403
  221   1HH2  ARG  29          1HH2      ARG  29 -16.377  -1.877  -0.519
  222   2HH2  ARG  29          2HH2      ARG  29 -17.757  -2.851  -0.894
  223    H    LYS  30           H        LYS  30 -13.739  -3.233   5.880
  224    HA   LYS  30           HA       LYS  30 -13.916  -0.455   6.228
  225   1HB   LYS  30          1HB       LYS  30 -14.627  -2.846   7.854
  226   2HB   LYS  30          2HB       LYS  30 -14.566  -1.292   8.676
  227   1HG   LYS  30          1HG       LYS  30 -16.231  -0.382   7.224
  228   2HG   LYS  30          2HG       LYS  30 -16.190  -1.817   6.197
  229   1HD   LYS  30          1HD       LYS  30 -17.642  -2.886   7.508
  230   2HD   LYS  30          2HD       LYS  30 -16.702  -2.514   8.955
  231   1HE   LYS  30          1HE       LYS  30 -18.350  -0.368   7.703
  232   2HE   LYS  30          2HE       LYS  30 -19.152  -1.611   8.663
  233   1HZ   LYS  30          1HZ       LYS  30 -16.825  -0.519   9.941
  234   2HZ   LYS  30          2HZ       LYS  30 -18.389  -0.733  10.547
  235   3HZ   LYS  30          3HZ       LYS  30 -18.015   0.646   9.642
  236    H    LYS  31           H        LYS  31 -11.802  -2.865   7.709
  237    HA   LYS  31           HA       LYS  31 -10.617  -1.193   9.634
  238   1HB   LYS  31          1HB       LYS  31 -10.331  -3.553   9.839
  239   2HB   LYS  31          2HB       LYS  31  -9.630  -3.675   8.231
  240   1HG   LYS  31          1HG       LYS  31  -7.654  -2.483   8.971
  241   2HG   LYS  31          2HG       LYS  31  -8.363  -2.266  10.573
  242   1HD   LYS  31          1HD       LYS  31  -7.850  -4.360  11.210
  243   2HD   LYS  31          2HD       LYS  31  -8.305  -5.047   9.649
  244   1HE   LYS  31          1HE       LYS  31  -5.999  -5.434   9.827
  245   2HE   LYS  31          2HE       LYS  31  -6.140  -4.036   8.762
  246   1HZ   LYS  31          1HZ       LYS  31  -5.086  -2.737  10.217
  247   2HZ   LYS  31          2HZ       LYS  31  -4.571  -4.169  10.955
  248   3HZ   LYS  31          3HZ       LYS  31  -5.928  -3.352  11.549
  249    H    ILE  32           H        ILE  32  -9.481  -2.110   6.383
  250    HA   ILE  32           HA       ILE  32  -7.197  -0.453   6.413
  251    HB   ILE  32           HB       ILE  32  -8.753  -1.771   4.213
  252   1HG1  ILE  32          1HG1      ILE  32  -5.886  -2.056   5.136
  253   2HG1  ILE  32          2HG1      ILE  32  -7.212  -3.094   5.651
  254   1HG2  ILE  32          1HG2      ILE  32  -6.897  -0.990   2.679
  255   2HG2  ILE  32          2HG2      ILE  32  -8.086   0.225   3.147
  256   3HG2  ILE  32          3HG2      ILE  32  -6.501   0.198   3.921
  257   1HD1  ILE  32          1HD1      ILE  32  -6.970  -4.367   3.861
  258   2HD1  ILE  32          2HD1      ILE  32  -7.105  -2.972   2.789
  259   3HD1  ILE  32          3HD1      ILE  32  -5.535  -3.430   3.447
  260    H    ARG  33           H        ARG  33 -10.505   0.063   5.285
  261    HA   ARG  33           HA       ARG  33  -9.993   2.620   4.134
  262   1HB   ARG  33          1HB       ARG  33 -12.504   1.160   4.927
  263   2HB   ARG  33          2HB       ARG  33 -12.551   2.807   4.312
  264   1HG   ARG  33          1HG       ARG  33 -11.168   1.827   2.341
  265   2HG   ARG  33          2HG       ARG  33 -11.810   0.283   2.907
  266   1HD   ARG  33          1HD       ARG  33 -13.865   2.319   2.757
  267   2HD   ARG  33          2HD       ARG  33 -13.061   2.087   1.206
  268    HE   ARG  33           HE       ARG  33 -13.988  -0.015   1.064
  269   1HH1  ARG  33          1HH1      ARG  33 -14.461   1.272   4.264
  270   2HH1  ARG  33          2HH1      ARG  33 -15.565   0.026   4.743
  271   1HH2  ARG  33          1HH2      ARG  33 -15.440  -1.661   1.683
  272   2HH2  ARG  33          2HH2      ARG  33 -16.121  -1.643   3.274
  273    H    ASP  34           H        ASP  34 -10.520   1.498   7.333
  274    HA   ASP  34           HA       ASP  34 -11.194   4.180   8.299
  275   1HB   ASP  34          1HB       ASP  34 -12.503   2.196   9.097
  276   2HB   ASP  34          2HB       ASP  34 -11.038   1.605   9.876
  277    H    LEU  35           H        LEU  35  -8.478   2.793   7.432
  278    HA   LEU  35           HA       LEU  35  -6.811   2.949   9.719
  279   1HB   LEU  35          1HB       LEU  35  -6.362   2.819   6.772
  280   2HB   LEU  35          2HB       LEU  35  -5.011   3.214   7.833
  281    HG   LEU  35           HG       LEU  35  -6.665   0.698   8.030
  282   1HD1  LEU  35          1HD1      LEU  35  -3.985   1.203   6.750
  283   2HD1  LEU  35          2HD1      LEU  35  -5.460   0.645   5.961
  284   3HD1  LEU  35          3HD1      LEU  35  -4.630  -0.398   7.115
  285   1HD2  LEU  35          1HD2      LEU  35  -4.076   1.508   9.349
  286   2HD2  LEU  35          2HD2      LEU  35  -4.867  -0.061   9.500
  287   3HD2  LEU  35          3HD2      LEU  35  -5.648   1.386  10.138
  288    HA   PRO  36           HA       PRO  36  -5.906   7.224  10.112
  289   1HB   PRO  36          1HB       PRO  36  -3.249   7.211  10.666
  290   2HB   PRO  36          2HB       PRO  36  -4.473   6.667  11.819
  291   1HG   PRO  36          1HG       PRO  36  -2.729   5.047  10.004
  292   2HG   PRO  36          2HG       PRO  36  -3.151   4.758  11.702
  293   1HD   PRO  36          1HD       PRO  36  -4.359   3.455   9.658
  294   2HD   PRO  36          2HD       PRO  36  -5.203   3.853  11.169
  295    H    ILE  37           H        ILE  37  -5.948   8.572   8.428
  296    HA   ILE  37           HA       ILE  37  -4.517   8.133   6.014
  297    HB   ILE  37           HB       ILE  37  -5.271  10.461   5.434
  298   1HG1  ILE  37          1HG1      ILE  37  -6.701  10.278   8.094
  299   2HG1  ILE  37          2HG1      ILE  37  -5.304  11.301   7.780
  300   1HG2  ILE  37          1HG2      ILE  37  -6.979   9.329   4.586
  301   2HG2  ILE  37          2HG2      ILE  37  -6.796   8.082   5.818
  302   3HG2  ILE  37          3HG2      ILE  37  -7.824   9.481   6.127
  303   1HD1  ILE  37          1HD1      ILE  37  -6.947  12.093   5.796
  304   2HD1  ILE  37          2HD1      ILE  37  -8.118  11.664   7.043
  305   3HD1  ILE  37          3HD1      ILE  37  -6.864  12.856   7.384
  306    H    SER  38           H        SER  38  -3.915  10.036   8.890
  307    HA   SER  38           HA       SER  38  -1.820  11.625   7.822
  308   1HB   SER  38          1HB       SER  38  -1.965  10.896  10.730
  309   2HB   SER  38          2HB       SER  38  -1.518  12.433   9.988
  310    HG   SER  38           HG       SER  38  -3.909  11.648  10.864
  311    H    LEU  39           H        LEU  39  -1.998   8.369   8.885
  312    HA   LEU  39           HA       LEU  39   0.749   8.029   9.577
  313   1HB   LEU  39          1HB       LEU  39  -1.458   6.562   9.991
  314   2HB   LEU  39          2HB       LEU  39  -0.805   5.714   8.592
  315    HG   LEU  39           HG       LEU  39   1.078   6.223  10.815
  316   1HD1  LEU  39          1HD1      LEU  39  -0.973   5.617  12.017
  317   2HD1  LEU  39          2HD1      LEU  39   0.258   4.359  12.131
  318   3HD1  LEU  39          3HD1      LEU  39  -1.108   4.159  11.034
  319   1HD2  LEU  39          1HD2      LEU  39   1.730   3.898  10.232
  320   2HD2  LEU  39          2HD2      LEU  39   1.826   5.022   8.876
  321   3HD2  LEU  39          3HD2      LEU  39   0.472   3.898   8.995
  322    H    PHE  40           H        PHE  40  -1.081   7.897   6.617
  323    HA   PHE  40           HA       PHE  40   1.385   7.178   5.172
  324   1HB   PHE  40          1HB       PHE  40  -1.375   6.693   4.077
  325   2HB   PHE  40          2HB       PHE  40   0.149   5.969   3.575
  326    HD1  PHE  40           2HD      PHE  40  -2.531   5.915   6.069
  327    HD2  PHE  40           1HD      PHE  40   1.087   4.098   4.755
  328    HE1  PHE  40           2HE      PHE  40  -2.972   3.986   7.531
  329    HE2  PHE  40           1HE      PHE  40   0.651   2.166   6.214
  330    HZ   PHE  40           HZ       PHE  40  -1.380   2.109   7.606
  331    H    ASP  41           H        ASP  41   2.174   8.762   3.969
  332    HA   ASP  41           HA       ASP  41   0.972  11.258   3.647
  333   1HB   ASP  41          1HB       ASP  41   3.346  11.076   3.428
  334   2HB   ASP  41          2HB       ASP  41   3.198   9.916   2.111
  335    H    TYR  42           H        TYR  42   0.522   8.337   1.901
  336    HA   TYR  42           HA       TYR  42  -1.436   9.643   0.195
  337   1HB   TYR  42          1HB       TYR  42   0.609   9.747  -1.148
  338   2HB   TYR  42          2HB       TYR  42   0.844   8.014  -0.947
  339    HD1  TYR  42           1HD      TYR  42  -2.355   9.761  -1.641
  340    HD2  TYR  42           2HD      TYR  42   0.734   7.272  -3.178
  341    HE1  TYR  42           1HE      TYR  42  -3.699   9.351  -3.660
  342    HE2  TYR  42           2HE      TYR  42  -0.600   6.856  -5.202
  343    HH   TYR  42           HH       TYR  42  -3.804   8.336  -5.627
  344    H    PHE  43           H        PHE  43  -3.222   8.458   0.169
  345    HA   PHE  43           HA       PHE  43  -3.002   5.538   0.399
  346   1HB   PHE  43          1HB       PHE  43  -3.738   7.001   2.536
  347   2HB   PHE  43          2HB       PHE  43  -5.306   6.820   1.758
  348    HD1  PHE  43           1HD      PHE  43  -4.399   4.024   0.563
  349    HD2  PHE  43           2HD      PHE  43  -4.536   5.726   4.462
  350    HE1  PHE  43           1HE      PHE  43  -4.620   1.774   1.534
  351    HE2  PHE  43           2HE      PHE  43  -4.757   3.479   5.439
  352    HZ   PHE  43           HZ       PHE  43  -4.798   1.499   3.975
  353    H    ILE  44           H        ILE  44  -3.864   4.690  -1.367
  354    HA   ILE  44           HA       ILE  44  -6.415   5.753  -2.349
  355    HB   ILE  44           HB       ILE  44  -4.949   6.756  -3.887
  356   1HG1  ILE  44          1HG1      ILE  44  -5.343   4.316  -5.511
  357   2HG1  ILE  44          2HG1      ILE  44  -6.785   4.944  -4.721
  358   1HG2  ILE  44          1HG2      ILE  44  -3.426   4.181  -3.742
  359   2HG2  ILE  44          2HG2      ILE  44  -3.212   5.289  -5.096
  360   3HG2  ILE  44          3HG2      ILE  44  -2.860   5.827  -3.454
  361   1HD1  ILE  44          1HD1      ILE  44  -5.672   5.784  -7.126
  362   2HD1  ILE  44          2HD1      ILE  44  -6.976   6.556  -6.223
  363   3HD1  ILE  44          3HD1      ILE  44  -5.307   7.067  -5.974
  364    H    VAL  45           H        VAL  45  -7.840   4.156  -2.316
  365    HA   VAL  45           HA       VAL  45  -6.922   1.432  -2.974
  366    HB   VAL  45           HB       VAL  45  -9.295   1.916  -1.209
  367   1HG1  VAL  45          1HG1      VAL  45  -8.675  -0.313  -0.357
  368   2HG1  VAL  45          2HG1      VAL  45  -8.987  -0.317  -2.094
  369   3HG1  VAL  45          3HG1      VAL  45  -7.328  -0.353  -1.494
  370   1HG2  VAL  45          1HG2      VAL  45  -7.566   1.432   0.683
  371   2HG2  VAL  45          2HG2      VAL  45  -6.409   2.110  -0.463
  372   3HG2  VAL  45          3HG2      VAL  45  -7.778   3.078   0.085
  373    H    GLY  46           H        GLY  46  -8.054   0.320  -4.476
  374   1HA   GLY  46          1HA       GLY  46 -10.570   1.526  -5.445
  375   2HA   GLY  46          2HA       GLY  46  -9.324   0.984  -6.559
  376    H    GLU  47           H        GLU  47 -12.211   0.167  -5.929
  377    HA   GLU  47           HA       GLU  47 -11.792  -2.659  -5.293
  378   1HB   GLU  47          1HB       GLU  47 -13.580  -1.647  -4.059
  379   2HB   GLU  47          2HB       GLU  47 -14.285  -0.974  -5.522
  380   1HG   GLU  47          1HG       GLU  47 -15.400  -2.846  -5.984
  381   2HG   GLU  47          2HG       GLU  47 -14.017  -3.872  -5.608
  382    H    GLU  48           H        GLU  48 -11.992  -4.259  -6.751
  383    HA   GLU  48           HA       GLU  48 -12.893  -3.532  -9.461
  384   1HB   GLU  48          1HB       GLU  48 -10.373  -3.952  -9.102
  385   2HB   GLU  48          2HB       GLU  48 -10.820  -5.643  -8.922
  386   1HG   GLU  48          1HG       GLU  48 -12.104  -4.956 -11.231
  387   2HG   GLU  48          2HG       GLU  48 -10.629  -3.995 -11.320
  388    H    GLY  49           H        GLY  49 -14.843  -4.437  -9.687
  389   1HA   GLY  49          1HA       GLY  49 -15.054  -7.330  -9.321
  390   2HA   GLY  49          2HA       GLY  49 -16.184  -6.326  -8.425
  391    H    ASN  50           H        ASN  50 -15.188  -5.169 -11.502
  392    HA   ASN  50           HA       ASN  50 -17.875  -5.339 -12.499
  393   1HB   ASN  50          1HB       ASN  50 -16.046  -3.499 -12.904
  394   2HB   ASN  50          2HB       ASN  50 -15.547  -4.560 -14.218
  395   1HD2  ASN  50          1HD2      ASN  50 -18.629  -3.414 -12.873
  396   2HD2  ASN  50          2HD2      ASN  50 -19.305  -2.937 -14.389
  397    H    GLU  51           H        GLU  51 -17.988  -7.713 -12.411
  398    HA   GLU  51           HA       GLU  51 -17.782  -8.864 -14.955
  399   1HB   GLU  51          1HB       GLU  51 -15.340  -8.924 -13.531
  400   2HB   GLU  51          2HB       GLU  51 -15.984 -10.559 -13.491
  401   1HG   GLU  51          1HG       GLU  51 -15.622 -10.895 -15.674
  402   2HG   GLU  51          2HG       GLU  51 -16.115  -9.261 -16.114
  403    H    GLU  52           H        GLU  52 -19.588 -10.018 -14.873
  404    HA   GLU  52           HA       GLU  52 -20.667 -11.079 -12.469
  405   1HB   GLU  52          1HB       GLU  52 -22.342 -12.141 -13.971
  406   2HB   GLU  52          2HB       GLU  52 -22.154 -10.414 -14.242
  407   1HG   GLU  52          1HG       GLU  52 -21.030 -10.729 -16.258
  408   2HG   GLU  52          2HG       GLU  52 -20.662 -12.414 -15.894
  409    H    GLY  53           H        GLY  53 -20.847 -13.206 -11.770
  410   1HA   GLY  53          1HA       GLY  53 -20.473 -15.529 -11.855
  411   2HA   GLY  53          2HA       GLY  53 -19.454 -15.291 -13.267
  412    H    ARG  54           H        ARG  54 -18.126 -13.028 -11.667
  413    HA   ARG  54           HA       ARG  54 -16.362 -14.788 -10.093
  414   1HB   ARG  54          1HB       ARG  54 -15.389 -13.756 -12.180
  415   2HB   ARG  54          2HB       ARG  54 -15.586 -12.186 -11.413
  416   1HG   ARG  54          1HG       ARG  54 -14.052 -12.783  -9.667
  417   2HG   ARG  54          2HG       ARG  54 -13.949 -14.438 -10.271
  418   1HD   ARG  54          1HD       ARG  54 -12.233 -13.813 -11.535
  419   2HD   ARG  54          2HD       ARG  54 -13.335 -12.784 -12.448
  420    HE   ARG  54           HE       ARG  54 -12.446 -10.951 -11.397
  421   1HH1  ARG  54          1HH1      ARG  54 -11.474 -13.834  -9.705
  422   2HH1  ARG  54          2HH1      ARG  54 -10.351 -13.009  -8.677
  423   1HH2  ARG  54          1HH2      ARG  54 -10.970  -9.853 -10.049
  424   2HH2  ARG  54          2HH2      ARG  54 -10.066 -10.744  -8.872
  425    H    THR  55           H        THR  55 -15.262 -13.761  -8.263
  426    HA   THR  55           HA       THR  55 -17.112 -12.030  -6.819
  427    HB   THR  55           HB       THR  55 -15.041 -12.566  -5.078
  428    HG1  THR  55           1HG      THR  55 -14.000 -14.122  -6.148
  429   1HG2  THR  55          1HG2      THR  55 -16.673 -13.560  -3.868
  430   2HG2  THR  55          2HG2      THR  55 -17.164 -14.610  -5.198
  431   3HG2  THR  55          3HG2      THR  55 -17.718 -12.937  -5.144
  432    HA   PRO  56           HA       PRO  56 -14.719  -8.357  -7.043
  433   1HB   PRO  56          1HB       PRO  56 -15.014  -7.329  -4.548
  434   2HB   PRO  56          2HB       PRO  56 -16.321  -7.353  -5.737
  435   1HG   PRO  56          1HG       PRO  56 -15.808  -9.213  -3.448
  436   2HG   PRO  56          2HG       PRO  56 -17.340  -8.504  -3.992
  437   1HD   PRO  56          1HD       PRO  56 -16.615 -11.042  -4.594
  438   2HD   PRO  56          2HD       PRO  56 -17.597 -10.045  -5.686
  439    H    HIS  57           H        HIS  57 -12.814  -7.258  -6.266
  440    HA   HIS  57           HA       HIS  57 -11.137  -8.765  -4.399
  441   1HB   HIS  57          1HB       HIS  57 -10.420  -9.630  -6.510
  442   2HB   HIS  57          2HB       HIS  57 -10.377  -8.022  -7.226
  443    HD1  HIS  57           1HD      HIS  57  -8.429  -6.421  -6.333
  444    HD2  HIS  57           2HD      HIS  57  -8.088 -10.437  -5.326
  445    HE1  HIS  57           1HE      HIS  57  -6.038  -6.734  -5.618
  446    H    LEU  58           H        LEU  58  -9.759  -7.527  -3.194
  447    HA   LEU  58           HA       LEU  58 -10.141  -4.640  -3.395
  448   1HB   LEU  58          1HB       LEU  58 -10.114  -6.333  -1.259
  449   2HB   LEU  58          2HB       LEU  58  -8.475  -5.689  -1.222
  450    HG   LEU  58           HG       LEU  58 -11.055  -4.146  -1.009
  451   1HD1  LEU  58          1HD1      LEU  58 -10.469  -5.151   1.063
  452   2HD1  LEU  58          2HD1      LEU  58 -10.004  -3.453   1.160
  453   3HD1  LEU  58          3HD1      LEU  58  -8.777  -4.688   0.882
  454   1HD2  LEU  58          1HD2      LEU  58  -9.054  -2.362  -0.512
  455   2HD2  LEU  58          2HD2      LEU  58  -9.939  -2.494  -2.031
  456   3HD2  LEU  58          3HD2      LEU  58  -8.380  -3.299  -1.846
  457    H    GLN  59           H        GLN  59  -8.730  -3.506  -4.541
  458    HA   GLN  59           HA       GLN  59  -5.883  -4.218  -4.369
  459   1HB   GLN  59          1HB       GLN  59  -6.517  -5.014  -6.513
  460   2HB   GLN  59          2HB       GLN  59  -7.480  -3.580  -6.843
  461   1HG   GLN  59          1HG       GLN  59  -5.472  -3.477  -8.133
  462   2HG   GLN  59          2HG       GLN  59  -5.403  -2.242  -6.876
  463   1HE2  GLN  59          1HE2      GLN  59  -4.010  -2.545  -5.107
  464   2HE2  GLN  59          2HE2      GLN  59  -2.670  -3.632  -5.194
  465    H    GLY  60           H        GLY  60  -4.861  -2.594  -3.411
  466   1HA   GLY  60          1HA       GLY  60  -5.278   0.123  -4.369
  467   2HA   GLY  60          2HA       GLY  60  -5.661  -0.159  -2.677
  468    H    PHE  61           H        PHE  61  -3.774   1.681  -3.257
  469    HA   PHE  61           HA       PHE  61  -1.304   0.342  -2.386
  470   1HB   PHE  61          1HB       PHE  61  -0.781   0.896  -4.609
  471   2HB   PHE  61          2HB       PHE  61  -1.645   2.428  -4.525
  472    HD1  PHE  61           2HD      PHE  61   1.139   0.772  -2.664
  473    HD2  PHE  61           1HD      PHE  61  -0.312   4.281  -4.587
  474    HE1  PHE  61           2HE      PHE  61   3.247   1.927  -2.138
  475    HE2  PHE  61           1HE      PHE  61   1.794   5.441  -4.065
  476    HZ   PHE  61           HZ       PHE  61   3.577   4.265  -2.839
  477    H    ALA  62           H        ALA  62  -0.155   1.348  -0.790
  478    HA   ALA  62           HA       ALA  62  -1.104   3.967   0.143
  479   1HB   ALA  62          1HB       ALA  62  -2.062   3.038   1.919
  480   2HB   ALA  62          2HB       ALA  62  -1.422   1.447   1.505
  481   3HB   ALA  62          3HB       ALA  62  -0.452   2.565   2.463
  482    H    ASN  63           H        ASN  63   0.504   5.348   0.527
  483    HA   ASN  63           HA       ASN  63   3.244   4.327   0.526
  484   1HB   ASN  63          1HB       ASN  63   2.673   6.107  -1.082
  485   2HB   ASN  63          2HB       ASN  63   2.228   7.165   0.254
  486   1HD2  ASN  63          1HD2      ASN  63   4.625   6.383  -1.855
  487   2HD2  ASN  63          2HD2      ASN  63   5.981   7.030  -1.001
  488    H    PHE  64           H        PHE  64   4.166   3.965   2.424
  489    HA   PHE  64           HA       PHE  64   3.154   4.989   4.873
  490   1HB   PHE  64          1HB       PHE  64   5.201   3.109   4.026
  491   2HB   PHE  64          2HB       PHE  64   5.746   4.093   5.381
  492    HD1  PHE  64           2HD      PHE  64   4.272   4.196   7.447
  493    HD2  PHE  64           1HD      PHE  64   3.760   1.312   4.359
  494    HE1  PHE  64           2HE      PHE  64   3.000   2.770   8.996
  495    HE2  PHE  64           1HE      PHE  64   2.486  -0.119   5.903
  496    HZ   PHE  64           HZ       PHE  64   2.105   0.609   8.225
  497    H    VAL  65           H        VAL  65   3.665   6.774   5.980
  498    HA   VAL  65           HA       VAL  65   5.103   8.876   4.810
  499    HB   VAL  65           HB       VAL  65   4.302   8.444   7.689
  500   1HG1  VAL  65          1HG1      VAL  65   5.784  10.648   6.369
  501   2HG1  VAL  65          2HG1      VAL  65   4.547  11.088   7.549
  502   3HG1  VAL  65          3HG1      VAL  65   5.887  10.042   8.022
  503   1HG2  VAL  65          1HG2      VAL  65   3.079  10.298   5.661
  504   2HG2  VAL  65          2HG2      VAL  65   2.524   8.640   5.892
  505   3HG2  VAL  65          3HG2      VAL  65   2.423   9.797   7.220
  506    H    LYS  66           H        LYS  66   6.132   6.216   6.762
  507    HA   LYS  66           HA       LYS  66   8.864   7.315   6.768
  508   1HB   LYS  66          1HB       LYS  66   9.192   5.988   8.912
  509   2HB   LYS  66          2HB       LYS  66   8.206   7.440   9.035
  510   1HG   LYS  66          1HG       LYS  66   6.769   4.920   8.490
  511   2HG   LYS  66          2HG       LYS  66   7.501   5.087  10.088
  512   1HD   LYS  66          1HD       LYS  66   5.947   7.390   9.042
  513   2HD   LYS  66          2HD       LYS  66   5.044   5.959   9.545
  514   1HE   LYS  66          1HE       LYS  66   7.088   6.647  11.469
  515   2HE   LYS  66          2HE       LYS  66   6.004   8.006  11.176
  516   1HZ   LYS  66          1HZ       LYS  66   4.209   6.869  11.983
  517   2HZ   LYS  66          2HZ       LYS  66   5.428   6.219  12.958
  518   3HZ   LYS  66          3HZ       LYS  66   4.852   5.345  11.630
  519    H    LYS  67           H        LYS  67  10.330   5.246   7.563
  520    HA   LYS  67           HA       LYS  67  10.042   3.375   5.365
  521   1HB   LYS  67          1HB       LYS  67  12.207   4.370   7.008
  522   2HB   LYS  67          2HB       LYS  67  12.241   2.614   6.923
  523   1HG   LYS  67          1HG       LYS  67  13.496   3.092   5.096
  524   2HG   LYS  67          2HG       LYS  67  11.899   3.097   4.344
  525   1HD   LYS  67          1HD       LYS  67  11.836   5.402   4.185
  526   2HD   LYS  67          2HD       LYS  67  13.000   5.626   5.494
  527   1HE   LYS  67          1HE       LYS  67  14.272   4.162   3.419
  528   2HE   LYS  67          2HE       LYS  67  13.466   5.550   2.690
  529   1HZ   LYS  67          1HZ       LYS  67  14.957   6.929   3.555
  530   2HZ   LYS  67          2HZ       LYS  67  15.888   5.571   3.944
  531   3HZ   LYS  67          3HZ       LYS  67  14.845   6.239   5.096
  532    H    GLN  68           H        GLN  68   9.141   1.435   5.536
  533    HA   GLN  68           HA       GLN  68   9.121   0.095   8.147
  534   1HB   GLN  68          1HB       GLN  68   6.734   0.303   6.304
  535   2HB   GLN  68          2HB       GLN  68   6.797  -0.600   7.812
  536   1HG   GLN  68          1HG       GLN  68   7.581   1.986   8.485
  537   2HG   GLN  68          2HG       GLN  68   6.239   2.186   7.359
  538   1HE2  GLN  68          1HE2      GLN  68   6.237   2.850  10.125
  539   2HE2  GLN  68          2HE2      GLN  68   5.039   1.872  10.893
  540    H    THR  69           H        THR  69   9.000  -2.187   8.065
  541    HA   THR  69           HA       THR  69  10.095  -3.291   5.603
  542    HB   THR  69           HB       THR  69  10.730  -5.208   6.866
  543    HG1  THR  69           1HG      THR  69   9.639  -5.841   8.572
  544   1HG2  THR  69          1HG2      THR  69  12.038  -4.242   8.696
  545   2HG2  THR  69          2HG2      THR  69  11.070  -2.770   8.617
  546   3HG2  THR  69          3HG2      THR  69  12.105  -3.219   7.262
  547    H    PHE  70           H        PHE  70   9.347  -5.556   5.012
  548    HA   PHE  70           HA       PHE  70   6.645  -5.475   4.258
  549   1HB   PHE  70          1HB       PHE  70   8.040  -6.778   2.890
  550   2HB   PHE  70          2HB       PHE  70   8.722  -7.648   4.260
  551    HD1  PHE  70           1HD      PHE  70   5.427  -7.096   2.602
  552    HD2  PHE  70           2HD      PHE  70   8.015  -9.799   4.629
  553    HE1  PHE  70           1HE      PHE  70   3.802  -8.911   2.250
  554    HE2  PHE  70           2HE      PHE  70   6.396 -11.618   4.280
  555    HZ   PHE  70           HZ       PHE  70   4.286 -11.175   3.088
  556    H    ASN  71           H        ASN  71   8.258  -7.559   6.661
  557    HA   ASN  71           HA       ASN  71   5.921  -8.784   7.617
  558   1HB   ASN  71          1HB       ASN  71   8.570  -9.158   8.053
  559   2HB   ASN  71          2HB       ASN  71   8.111  -8.375   9.563
  560   1HD2  ASN  71          1HD2      ASN  71   8.479 -11.270   8.100
  561   2HD2  ASN  71          2HD2      ASN  71   7.414 -12.229   9.065
  562    H    LYS  72           H        LYS  72   7.615  -5.857   8.633
  563    HA   LYS  72           HA       LYS  72   6.068  -5.347  10.939
  564   1HB   LYS  72          1HB       LYS  72   8.164  -4.229  10.703
  565   2HB   LYS  72          2HB       LYS  72   7.699  -3.545   9.152
  566   1HG   LYS  72          1HG       LYS  72   7.661  -1.892  10.963
  567   2HG   LYS  72          2HG       LYS  72   6.074  -2.116  10.223
  568   1HD   LYS  72          1HD       LYS  72   5.453  -3.622  12.073
  569   2HD   LYS  72          2HD       LYS  72   7.024  -3.324  12.822
  570   1HE   LYS  72          1HE       LYS  72   5.264  -1.017  12.117
  571   2HE   LYS  72          2HE       LYS  72   4.916  -1.961  13.564
  572   1HZ   LYS  72          1HZ       LYS  72   6.858  -1.310  14.566
  573   2HZ   LYS  72          2HZ       LYS  72   6.470   0.090  13.701
  574   3HZ   LYS  72          3HZ       LYS  72   7.647  -0.972  13.108
  575    H    VAL  73           H        VAL  73   5.831  -4.069   7.625
  576    HA   VAL  73           HA       VAL  73   3.656  -2.387   7.970
  577    HB   VAL  73           HB       VAL  73   4.496  -4.008   5.572
  578   1HG1  VAL  73          1HG1      VAL  73   2.244  -3.674   5.105
  579   2HG1  VAL  73          2HG1      VAL  73   2.211  -2.099   5.902
  580   3HG1  VAL  73          3HG1      VAL  73   3.019  -2.284   4.345
  581   1HG2  VAL  73          1HG2      VAL  73   4.621  -1.038   5.774
  582   2HG2  VAL  73          2HG2      VAL  73   5.827  -2.002   6.626
  583   3HG2  VAL  73          3HG2      VAL  73   5.654  -2.151   4.877
  584    H    LYS  74           H        LYS  74   3.775  -5.845   7.862
  585    HA   LYS  74           HA       LYS  74   1.096  -6.378   7.165
  586   1HB   LYS  74          1HB       LYS  74   2.974  -8.004   8.889
  587   2HB   LYS  74          2HB       LYS  74   1.483  -8.594   8.167
  588   1HG   LYS  74          1HG       LYS  74   2.837  -7.593   6.005
  589   2HG   LYS  74          2HG       LYS  74   4.130  -8.267   6.999
  590   1HD   LYS  74          1HD       LYS  74   3.595 -10.211   6.013
  591   2HD   LYS  74          2HD       LYS  74   2.238 -10.227   7.142
  592   1HE   LYS  74          1HE       LYS  74   0.772  -9.296   5.508
  593   2HE   LYS  74          2HE       LYS  74   2.111  -8.969   4.409
  594   1HZ   LYS  74          1HZ       LYS  74   0.770 -10.964   3.841
  595   2HZ   LYS  74          2HZ       LYS  74   1.317 -11.696   5.264
  596   3HZ   LYS  74          3HZ       LYS  74   2.419 -11.283   4.048
  597    H    TRP  75           H        TRP  75   2.402  -4.937   9.915
  598    HA   TRP  75           HA       TRP  75   0.598  -5.893  11.890
  599   1HB   TRP  75          1HB       TRP  75   1.508  -4.253  13.312
  600   2HB   TRP  75          2HB       TRP  75   2.834  -4.678  12.234
  601    HD1  TRP  75           HD       TRP  75   2.051  -2.857   9.748
  602    HE1  TRP  75           1HE      TRP  75   2.302  -0.301   9.922
  603    HE3  TRP  75           3HE      TRP  75   1.990  -2.380  14.838
  604    HZ2  TRP  75           2HZ      TRP  75   2.456   1.657  11.949
  605    HZ3  TRP  75           3HZ      TRP  75   2.195  -0.131  15.814
  606    HH2  TRP  75           HH       TRP  75   2.423   1.845  14.398
  607    H    TYR  76           H        TYR  76   0.296  -3.651   9.319
  608    HA   TYR  76           HA       TYR  76  -2.208  -2.610  10.470
  609   1HB   TYR  76          1HB       TYR  76  -0.048  -1.345   8.954
  610   2HB   TYR  76          2HB       TYR  76  -1.646  -0.996   8.306
  611    HD1  TYR  76           2HD      TYR  76  -3.240  -0.952  10.817
  612    HD2  TYR  76           1HD      TYR  76   0.587   0.683   9.935
  613    HE1  TYR  76           2HE      TYR  76  -3.576   0.756  12.555
  614    HE2  TYR  76           1HE      TYR  76   0.263   2.395  11.670
  615    HH   TYR  76           HH       TYR  76  -2.018   2.206  14.034
  616    H    LEU  77           H        LEU  77  -0.710  -3.587   7.392
  617    HA   LEU  77           HA       LEU  77  -3.160  -3.722   5.965
  618   1HB   LEU  77          1HB       LEU  77  -0.428  -4.870   5.455
  619   2HB   LEU  77          2HB       LEU  77  -1.777  -5.099   4.344
  620    HG   LEU  77           HG       LEU  77  -0.494  -2.474   5.096
  621   1HD1  LEU  77          1HD1      LEU  77  -0.084  -2.519   2.554
  622   2HD1  LEU  77          2HD1      LEU  77  -0.360  -4.255   2.693
  623   3HD1  LEU  77          3HD1      LEU  77   0.952  -3.496   3.595
  624   1HD2  LEU  77          1HD2      LEU  77  -1.992  -1.563   3.316
  625   2HD2  LEU  77          2HD2      LEU  77  -2.828  -2.085   4.778
  626   3HD2  LEU  77          3HD2      LEU  77  -2.857  -3.099   3.335
  627    H    GLY  78           H        GLY  78  -1.265  -6.066   7.786
  628   1HA   GLY  78          1HA       GLY  78  -2.173  -7.955   8.860
  629   2HA   GLY  78          2HA       GLY  78  -3.583  -7.841   7.818
  630    H    ALA  79           H        ALA  79  -1.976 -10.181   8.448
  631    HA   ALA  79           HA       ALA  79  -0.362 -10.803   6.166
  632   1HB   ALA  79          1HB       ALA  79   0.298 -11.959   8.060
  633   2HB   ALA  79          2HB       ALA  79  -1.358 -12.352   8.523
  634   3HB   ALA  79          3HB       ALA  79  -0.603 -13.182   7.163
  635    H    ARG  80           H        ARG  80  -3.717 -11.126   6.995
  636    HA   ARG  80           HA       ARG  80  -4.547 -13.189   5.354
  637   1HB   ARG  80          1HB       ARG  80  -5.991 -10.597   5.939
  638   2HB   ARG  80          2HB       ARG  80  -6.739 -12.051   5.291
  639   1HG   ARG  80          1HG       ARG  80  -5.242 -12.314   7.832
  640   2HG   ARG  80          2HG       ARG  80  -6.780 -11.449   7.874
  641   1HD   ARG  80          1HD       ARG  80  -6.619 -14.081   6.479
  642   2HD   ARG  80          2HD       ARG  80  -6.691 -14.043   8.240
  643    HE   ARG  80           HE       ARG  80  -8.823 -13.469   6.409
  644   1HH1  ARG  80          1HH1      ARG  80  -7.573 -12.876   9.604
  645   2HH1  ARG  80          2HH1      ARG  80  -9.122 -12.500  10.282
  646   1HH2  ARG  80          1HH2      ARG  80 -10.869 -12.976   7.291
  647   2HH2  ARG  80          2HH2      ARG  80 -10.996 -12.559   8.966
  648    H    CYS  81           H        CYS  81  -3.805  -9.849   4.526
  649    HA   CYS  81           HA       CYS  81  -4.441 -10.396   1.715
  650   1HB   CYS  81          1HB       CYS  81  -4.475  -8.032   1.370
  651   2HB   CYS  81          2HB       CYS  81  -5.376  -8.347   2.848
  652    HG   CYS  81           HG       CYS  81  -3.460  -7.436   4.575
  653    H    HIS  82           H        HIS  82  -2.928 -10.234   0.099
  654    HA   HIS  82           HA       HIS  82  -0.195 -10.646   0.878
  655   1HB   HIS  82          1HB       HIS  82  -1.361 -11.798  -1.054
  656   2HB   HIS  82          2HB       HIS  82  -1.248 -10.273  -1.927
  657    HD1  HIS  82           1HD      HIS  82   1.353 -12.166   0.115
  658    HD2  HIS  82           2HD      HIS  82   0.774 -10.590  -3.686
  659    HE1  HIS  82           1HE      HIS  82   3.512 -12.560  -1.113
  660    H    ILE  83           H        ILE  83   1.441  -9.227   0.889
  661    HA   ILE  83           HA       ILE  83   0.884  -6.503  -0.086
  662    HB   ILE  83           HB       ILE  83   3.033  -7.112   1.912
  663   1HG1  ILE  83          1HG1      ILE  83   0.098  -6.679   2.508
  664   2HG1  ILE  83          2HG1      ILE  83   1.036  -8.128   2.855
  665   1HG2  ILE  83          1HG2      ILE  83   2.953  -4.904   0.848
  666   2HG2  ILE  83          2HG2      ILE  83   1.306  -4.687   1.437
  667   3HG2  ILE  83          3HG2      ILE  83   2.642  -4.807   2.581
  668   1HD1  ILE  83          1HD1      ILE  83   1.025  -5.498   4.237
  669   2HD1  ILE  83          2HD1      ILE  83   1.000  -7.130   4.906
  670   3HD1  ILE  83          3HD1      ILE  83   2.498  -6.467   4.252
  671    H    GLU  84           H        GLU  84   2.265  -5.541  -1.483
  672    HA   GLU  84           HA       GLU  84   4.813  -6.857  -2.082
  673   1HB   GLU  84          1HB       GLU  84   2.490  -6.679  -3.848
  674   2HB   GLU  84          2HB       GLU  84   3.955  -6.032  -4.571
  675   1HG   GLU  84          1HG       GLU  84   4.517  -8.527  -3.275
  676   2HG   GLU  84          2HG       GLU  84   3.167  -8.708  -4.393
  677    H    LYS  85           H        LYS  85   6.232  -5.474  -3.455
  678    HA   LYS  85           HA       LYS  85   6.182  -2.769  -2.441
  679   1HB   LYS  85          1HB       LYS  85   8.152  -4.233  -4.204
  680   2HB   LYS  85          2HB       LYS  85   8.369  -2.578  -3.649
  681   1HG   LYS  85          1HG       LYS  85   8.561  -3.262  -1.393
  682   2HG   LYS  85          2HG       LYS  85   8.007  -4.895  -1.770
  683   1HD   LYS  85          1HD       LYS  85  10.198  -4.518  -3.430
  684   2HD   LYS  85          2HD       LYS  85  10.673  -3.761  -1.908
  685   1HE   LYS  85          1HE       LYS  85  11.347  -5.961  -1.620
  686   2HE   LYS  85          2HE       LYS  85   9.776  -5.927  -0.821
  687   1HZ   LYS  85          1HZ       LYS  85  10.563  -7.225  -3.322
  688   2HZ   LYS  85          2HZ       LYS  85   8.984  -6.631  -3.209
  689   3HZ   LYS  85          3HZ       LYS  85   9.537  -7.777  -2.095
  690    H    ALA  86           H        ALA  86   5.628  -0.970  -3.519
  691    HA   ALA  86           HA       ALA  86   4.478  -1.268  -6.170
  692   1HB   ALA  86          1HB       ALA  86   3.056   0.245  -5.394
  693   2HB   ALA  86          2HB       ALA  86   4.016   0.426  -3.925
  694   3HB   ALA  86          3HB       ALA  86   4.364   1.427  -5.335
  695    H    LYS  87           H        LYS  87   4.977   0.235  -7.901
  696    HA   LYS  87           HA       LYS  87   7.559   1.578  -7.760
  697   1HB   LYS  87          1HB       LYS  87   8.526   0.446  -9.609
  698   2HB   LYS  87          2HB       LYS  87   7.933  -0.805  -8.524
  699   1HG   LYS  87          1HG       LYS  87   5.979  -1.130  -9.922
  700   2HG   LYS  87          2HG       LYS  87   6.506   0.174 -10.989
  701   1HD   LYS  87          1HD       LYS  87   8.413  -1.068 -11.694
  702   2HD   LYS  87          2HD       LYS  87   8.152  -2.292 -10.449
  703   1HE   LYS  87          1HE       LYS  87   6.071  -2.960 -11.533
  704   2HE   LYS  87          2HE       LYS  87   6.300  -1.716 -12.762
  705   1HZ   LYS  87          1HZ       LYS  87   8.594  -3.374 -12.565
  706   2HZ   LYS  87          2HZ       LYS  87   7.614  -3.063 -13.907
  707   3HZ   LYS  87          3HZ       LYS  87   7.214  -4.314 -12.840
  708    H    GLY  88           H        GLY  88   7.769   3.285  -9.178
  709   1HA   GLY  88          1HA       GLY  88   7.044   4.288 -11.326
  710   2HA   GLY  88          2HA       GLY  88   5.410   3.825 -10.875
  711    H    THR  89           H        THR  89   4.747   6.006 -11.118
  712    HA   THR  89           HA       THR  89   5.680   7.791  -8.965
  713    HB   THR  89           HB       THR  89   5.142   9.687 -10.310
  714    HG1  THR  89           1HG      THR  89   3.572   9.501 -11.705
  715   1HG2  THR  89          1HG2      THR  89   6.495   7.652 -12.086
  716   2HG2  THR  89          2HG2      THR  89   7.289   8.588 -10.820
  717   3HG2  THR  89          3HG2      THR  89   6.612   9.405 -12.228
  718    H    ASP  90           H        ASP  90   3.906   9.521  -8.481
  719    HA   ASP  90           HA       ASP  90   1.792   8.276  -7.191
  720   1HB   ASP  90          1HB       ASP  90   2.284  10.426  -6.425
  721   2HB   ASP  90          2HB       ASP  90   2.282  11.110  -8.048
  722    H    GLN  91           H        GLN  91   1.930   9.695 -10.417
  723    HA   GLN  91           HA       GLN  91  -0.843   9.444 -10.972
  724   1HB   GLN  91          1HB       GLN  91   1.011  10.854 -12.165
  725   2HB   GLN  91          2HB       GLN  91   1.243   9.397 -13.123
  726   1HG   GLN  91          1HG       GLN  91  -0.231  10.727 -14.359
  727   2HG   GLN  91          2HG       GLN  91  -1.237   9.488 -13.611
  728   1HE2  GLN  91          1HE2      GLN  91  -3.127  10.587 -13.554
  729   2HE2  GLN  91          2HE2      GLN  91  -3.383  12.024 -12.630
  730    H    GLN  92           H        GLN  92   1.934   7.339 -11.415
  731    HA   GLN  92           HA       GLN  92   0.612   5.418 -13.041
  732   1HB   GLN  92          1HB       GLN  92   3.043   5.085 -11.274
  733   2HB   GLN  92          2HB       GLN  92   2.530   3.972 -12.536
  734   1HG   GLN  92          1HG       GLN  92   2.699   6.173 -14.009
  735   2HG   GLN  92          2HG       GLN  92   3.853   6.610 -12.750
  736   1HE2  GLN  92          1HE2      GLN  92   5.865   6.039 -13.116
  737   2HE2  GLN  92          2HE2      GLN  92   6.391   4.738 -14.123
  738    H    ASN  93           H        ASN  93   1.176   5.712  -9.564
  739    HA   ASN  93           HA       ASN  93  -0.040   3.189  -8.948
  740   1HB   ASN  93          1HB       ASN  93   0.912   5.521  -7.303
  741   2HB   ASN  93          2HB       ASN  93   0.010   4.200  -6.565
  742   1HD2  ASN  93          1HD2      ASN  93   2.430   4.162  -9.142
  743   2HD2  ASN  93          2HD2      ASN  93   3.547   3.134  -8.317
  744    H    LYS  94           H        LYS  94  -1.038   6.582  -8.786
  745    HA   LYS  94           HA       LYS  94  -3.543   6.173  -7.585
  746   1HB   LYS  94          1HB       LYS  94  -2.364   8.376  -7.875
  747   2HB   LYS  94          2HB       LYS  94  -2.842   8.343  -9.567
  748   1HG   LYS  94          1HG       LYS  94  -5.164   7.887  -8.014
  749   2HG   LYS  94          2HG       LYS  94  -4.309   9.267  -7.320
  750   1HD   LYS  94          1HD       LYS  94  -5.083   8.949 -10.221
  751   2HD   LYS  94          2HD       LYS  94  -5.912   9.965  -9.039
  752   1HE   LYS  94          1HE       LYS  94  -3.376  10.857  -8.769
  753   2HE   LYS  94          2HE       LYS  94  -3.372  10.397 -10.471
  754   1HZ   LYS  94          1HZ       LYS  94  -4.057  12.751  -9.933
  755   2HZ   LYS  94          2HZ       LYS  94  -5.490  12.105  -9.308
  756   3HZ   LYS  94          3HZ       LYS  94  -5.104  11.882 -10.939
  757    H    GLU  95           H        GLU  95  -2.620   6.378 -11.011
  758    HA   GLU  95           HA       GLU  95  -5.252   5.980 -12.001
  759   1HB   GLU  95          1HB       GLU  95  -2.535   5.685 -13.279
  760   2HB   GLU  95          2HB       GLU  95  -4.037   5.444 -14.160
  761   1HG   GLU  95          1HG       GLU  95  -3.914   7.962 -12.683
  762   2HG   GLU  95          2HG       GLU  95  -2.696   7.802 -13.947
  763    H    TYR  96           H        TYR  96  -2.588   3.832 -11.210
  764    HA   TYR  96           HA       TYR  96  -3.475   1.495 -12.436
  765   1HB   TYR  96          1HB       TYR  96  -1.262   1.632 -11.469
  766   2HB   TYR  96          2HB       TYR  96  -1.935   1.861  -9.859
  767    HD1  TYR  96           1HD      TYR  96  -2.927  -0.016  -8.646
  768    HD2  TYR  96           2HD      TYR  96  -1.178  -0.557 -12.487
  769    HE1  TYR  96           1HE      TYR  96  -2.886  -2.448  -8.278
  770    HE2  TYR  96           2HE      TYR  96  -1.134  -2.990 -12.130
  771    HH   TYR  96           HH       TYR  96  -1.082  -4.546 -10.065
  772    H    CYS  97           H        CYS  97  -4.180   2.742  -9.185
  773    HA   CYS  97           HA       CYS  97  -5.843   0.576  -8.425
  774   1HB   CYS  97          1HB       CYS  97  -5.699   3.408  -7.370
  775   2HB   CYS  97          2HB       CYS  97  -6.590   2.099  -6.603
  776    HG   CYS  97           HG       CYS  97  -3.862   0.677  -6.739
  777    H    SER  98           H        SER  98  -6.432   3.638 -10.034
  778    HA   SER  98           HA       SER  98  -9.295   3.417  -9.889
  779   1HB   SER  98          1HB       SER  98  -7.945   5.586 -10.066
  780   2HB   SER  98          2HB       SER  98  -7.751   5.197 -11.775
  781    HG   SER  98           HG       SER  98  -9.634   6.561 -11.036
  782    H    LYS  99           H        LYS  99  -6.906   2.002 -11.791
  783    HA   LYS  99           HA       LYS  99  -8.056   1.872 -14.326
  784   1HB   LYS  99          1HB       LYS  99  -5.771   1.129 -13.853
  785   2HB   LYS  99          2HB       LYS  99  -6.392  -0.213 -12.901
  786   1HG   LYS  99          1HG       LYS  99  -7.484  -1.097 -14.936
  787   2HG   LYS  99          2HG       LYS  99  -6.731   0.202 -15.864
  788   1HD   LYS  99          1HD       LYS  99  -5.423  -1.828 -16.070
  789   2HD   LYS  99          2HD       LYS  99  -4.514  -0.617 -15.163
  790   1HE   LYS  99          1HE       LYS  99  -4.434  -1.904 -13.339
  791   2HE   LYS  99          2HE       LYS  99  -6.149  -2.299 -13.447
  792   1HZ   LYS  99          1HZ       LYS  99  -5.721  -4.224 -14.476
  793   2HZ   LYS  99          2HZ       LYS  99  -4.161  -4.051 -13.847
  794   3HZ   LYS  99          3HZ       LYS  99  -4.489  -3.577 -15.437
  795    H    GLU 100           H        GLU 100  -8.996   0.364 -11.382
  796    HA   GLU 100           HA       GLU 100 -10.424  -1.831 -12.513
  797   1HB   GLU 100          1HB       GLU 100 -10.987  -0.567  -9.836
  798   2HB   GLU 100          2HB       GLU 100 -11.243  -2.237 -10.324
  799   1HG   GLU 100          1HG       GLU 100  -8.618  -0.861  -9.829
  800   2HG   GLU 100          2HG       GLU 100  -9.348  -2.158  -8.885
  801    H    GLY 101           H        GLY 101 -11.051   1.509 -12.250
  802   1HA   GLY 101          1HA       GLY 101 -12.822   2.660 -13.245
  803   2HA   GLY 101          2HA       GLY 101 -13.676   1.135 -13.432
  804    H    ASN 102           H        ASN 102 -12.780   0.947 -10.367
  805    HA   ASN 102           HA       ASN 102 -14.966   2.603  -9.316
  806   1HB   ASN 102          1HB       ASN 102 -14.937  -0.263  -9.493
  807   2HB   ASN 102          2HB       ASN 102 -14.917   0.214  -7.798
  808   1HD2  ASN 102          1HD2      ASN 102 -16.860   0.284  -6.962
  809   2HD2  ASN 102          2HD2      ASN 102 -18.304   0.788  -7.766
  810    H    LEU 103           H        LEU 103 -14.316   3.808  -7.666
  811    HA   LEU 103           HA       LEU 103 -11.771   3.207  -6.378
  812   1HB   LEU 103          1HB       LEU 103 -13.185   5.573  -7.076
  813   2HB   LEU 103          2HB       LEU 103 -12.963   5.560  -5.328
  814    HG   LEU 103           HG       LEU 103 -11.195   6.779  -6.601
  815   1HD1  LEU 103          1HD1      LEU 103 -10.989   5.339  -4.347
  816   2HD1  LEU 103          2HD1      LEU 103  -9.657   6.270  -5.032
  817   3HD1  LEU 103          3HD1      LEU 103  -9.765   4.535  -5.330
  818   1HD2  LEU 103          1HD2      LEU 103 -10.117   5.853  -8.308
  819   2HD2  LEU 103          2HD2      LEU 103 -11.240   4.497  -8.207
  820   3HD2  LEU 103          3HD2      LEU 103  -9.701   4.433  -7.349
  821    H    LEU 104           H        LEU 104 -11.521   2.723  -4.248
  822    HA   LEU 104           HA       LEU 104 -13.986   2.171  -2.747
  823   1HB   LEU 104          1HB       LEU 104 -12.322   0.326  -3.272
  824   2HB   LEU 104          2HB       LEU 104 -11.236   1.120  -2.134
  825    HG   LEU 104           HG       LEU 104 -12.884   0.764  -0.341
  826   1HD1  LEU 104          1HD1      LEU 104 -14.533  -1.220  -1.401
  827   2HD1  LEU 104          2HD1      LEU 104 -14.574   0.097  -2.573
  828   3HD1  LEU 104          3HD1      LEU 104 -15.002   0.402  -0.890
  829   1HD2  LEU 104          1HD2      LEU 104 -12.643  -1.709  -0.224
  830   2HD2  LEU 104          2HD2      LEU 104 -11.140  -0.863  -0.591
  831   3HD2  LEU 104          3HD2      LEU 104 -12.027  -1.685  -1.876
  832    H    MET 105           H        MET 105 -10.937   3.875  -2.651
  833    HA   MET 105           HA       MET 105 -11.897   5.556  -0.523
  834   1HB   MET 105          1HB       MET 105 -11.061   3.985   0.979
  835   2HB   MET 105          2HB       MET 105  -9.713   3.555  -0.066
  836   1HG   MET 105          1HG       MET 105  -8.400   5.202   0.719
  837   2HG   MET 105          2HG       MET 105  -9.740   6.332   0.899
  838   1HE   MET 105          1HE       MET 105  -7.341   4.082   2.199
  839   2HE   MET 105          2HE       MET 105  -7.516   4.130   3.953
  840   3HE   MET 105          3HE       MET 105  -8.352   2.891   3.017
  841    H    GLU 106           H        GLU 106 -11.019   7.557  -0.631
  842    HA   GLU 106           HA       GLU 106  -8.611   7.921  -2.279
  843   1HB   GLU 106          1HB       GLU 106 -10.881   8.447  -3.429
  844   2HB   GLU 106          2HB       GLU 106 -10.886   9.876  -2.405
  845   1HG   GLU 106          1HG       GLU 106  -8.367   9.911  -3.501
  846   2HG   GLU 106          2HG       GLU 106  -9.372   9.311  -4.819
  847    H    CYS 107           H        CYS 107  -7.155   8.577  -0.820
  848    HA   CYS 107           HA       CYS 107  -7.629  11.070   0.577
  849   1HB   CYS 107          1HB       CYS 107  -7.354   8.442   1.970
  850   2HB   CYS 107          2HB       CYS 107  -6.617   9.861   2.702
  851    HG   CYS 107           HG       CYS 107  -9.938   9.562   1.930
  852    H    GLY 108           H        GLY 108  -5.532  11.541   1.977
  853   1HA   GLY 108          1HA       GLY 108  -3.235  11.780   2.058
  854   2HA   GLY 108          2HA       GLY 108  -3.095  10.420   0.953
  855    H    ALA 109           H        ALA 109  -1.335  12.277   0.473
  856    HA   ALA 109           HA       ALA 109  -2.443  13.965  -1.672
  857   1HB   ALA 109          1HB       ALA 109  -1.383  15.600  -0.589
  858   2HB   ALA 109          2HB       ALA 109  -0.474  14.463   0.407
  859   3HB   ALA 109          3HB       ALA 109   0.111  14.890  -1.201
  860    HA   PRO 110           HA       PRO 110  -0.170  11.826  -4.756
  861   1HB   PRO 110          1HB       PRO 110   0.636  13.844  -6.384
  862   2HB   PRO 110          2HB       PRO 110  -1.044  13.302  -6.285
  863   1HG   PRO 110          1HG       PRO 110   0.271  15.647  -4.968
  864   2HG   PRO 110          2HG       PRO 110  -1.312  15.552  -5.762
  865   1HD   PRO 110          1HD       PRO 110  -1.023  15.464  -3.071
  866   2HD   PRO 110          2HD       PRO 110  -2.317  14.595  -3.922
  867    H    ARG 111           H        ARG 111   1.718  10.874  -4.314
  868    HA   ARG 111           HA       ARG 111   3.927  12.231  -3.141
  869   1HB   ARG 111          1HB       ARG 111   3.503   9.472  -4.250
  870   2HB   ARG 111          2HB       ARG 111   5.110  10.007  -3.777
  871   1HG   ARG 111          1HG       ARG 111   3.042  10.495  -1.766
  872   2HG   ARG 111          2HG       ARG 111   3.322   8.792  -2.135
  873   1HD   ARG 111          1HD       ARG 111   4.728   9.623  -0.281
  874   2HD   ARG 111          2HD       ARG 111   5.670   9.026  -1.646
  875    HE   ARG 111           HE       ARG 111   5.512  11.658  -2.164
  876   1HH1  ARG 111          1HH1      ARG 111   6.394   9.879   0.695
  877   2HH1  ARG 111          2HH1      ARG 111   7.489  11.092   1.271
  878   1HH2  ARG 111          1HH2      ARG 111   6.951  13.263  -1.417
  879   2HH2  ARG 111          2HH2      ARG 111   7.804  13.016   0.069
  880    H    SER 112           H        SER 112   6.035  12.518  -4.044
  881    HA   SER 112           HA       SER 112   6.202  12.513  -6.967
  882   1HB   SER 112          1HB       SER 112   5.779  14.860  -5.448
  883   2HB   SER 112          2HB       SER 112   7.462  14.899  -5.972
  884    HG   SER 112           HG       SER 112   5.543  15.668  -7.407
  885    H    GLN 113           H        GLN 113   8.573  13.431  -7.507
  886    HA   GLN 113           HA       GLN 113  10.654  12.895  -5.687
  887   1HB   GLN 113          1HB       GLN 113   9.515  10.561  -6.545
  888   2HB   GLN 113          2HB       GLN 113  10.809  10.775  -7.718
  889   1HG   GLN 113          1HG       GLN 113  12.306  11.164  -5.655
  890   2HG   GLN 113          2HG       GLN 113  10.990  10.408  -4.758
  891   1HE2  GLN 113          1HE2      GLN 113  13.785   9.561  -5.374
  892   2HE2  GLN 113          2HE2      GLN 113  13.627   7.983  -6.058
  893    H    GLY 114           H        GLY 114  12.169  14.239  -6.388
  894   1HA   GLY 114          1HA       GLY 114  12.734  14.323  -9.281
  895   2HA   GLY 114          2HA       GLY 114  12.541  15.812  -8.367
  896    H    GLN 115           H        GLN 115  14.705  16.300  -9.157
  897    HA   GLN 115           HA       GLN 115  16.945  16.545  -8.850
  898   1HB   GLN 115          1HB       GLN 115  15.841  16.184  -6.295
  899   2HB   GLN 115          2HB       GLN 115  17.264  15.152  -6.340
  900   1HG   GLN 115          1HG       GLN 115  18.305  17.026  -5.680
  901   2HG   GLN 115          2HG       GLN 115  18.294  17.387  -7.406
  902   1HE2  GLN 115          1HE2      GLN 115  16.482  18.680  -8.203
  903   2HE2  GLN 115          2HE2      GLN 115  15.818  19.899  -7.174
  904    H    ARG 116           H        ARG 116  18.981  15.122  -7.981
  905    HA   ARG 116           HA       ARG 116  18.694  12.534  -9.356
  906   1HB   ARG 116          1HB       ARG 116  21.091  12.680  -9.837
  907   2HB   ARG 116          2HB       ARG 116  20.232  14.081 -10.463
  908   1HG   ARG 116          1HG       ARG 116  21.245  15.519  -9.031
  909   2HG   ARG 116          2HG       ARG 116  21.405  14.310  -7.755
  910   1HD   ARG 116          1HD       ARG 116  23.113  13.190  -9.309
  911   2HD   ARG 116          2HD       ARG 116  23.116  14.720 -10.186
  912    HE   ARG 116           HE       ARG 116  23.522  15.271  -7.478
  913   1HH1  ARG 116          1HH1      ARG 116  25.144  13.691 -10.123
  914   2HH1  ARG 116          2HH1      ARG 116  26.733  14.020  -9.516
  915   1HH2  ARG 116          1HH2      ARG 116  25.609  15.711  -6.669
  916   2HH2  ARG 116          2HH2      ARG 116  26.996  15.168  -7.551
  Start of MODEL   18
    1    HA   PRO   2           HA       PRO   2  29.267  -4.986  23.738
    2   1HB   PRO   2          1HB       PRO   2  27.636  -2.861  24.179
    3   2HB   PRO   2          2HB       PRO   2  28.159  -3.953  25.466
    4   1HG   PRO   2          1HG       PRO   2  29.230  -1.260  24.716
    5   2HG   PRO   2          2HG       PRO   2  28.905  -1.926  26.327
    6   1HD   PRO   2          1HD       PRO   2  31.393  -1.832  25.264
    7   2HD   PRO   2          2HD       PRO   2  30.875  -3.122  26.368
    8    H    SER   3           H        SER   3  28.892  -5.186  21.630
    9    HA   SER   3           HA       SER   3  28.857  -2.752  19.968
   10   1HB   SER   3          1HB       SER   3  30.599  -4.959  19.741
   11   2HB   SER   3          2HB       SER   3  29.450  -5.104  18.411
   12    HG   SER   3           HG       SER   3  30.677  -3.665  17.496
   13    H    LYS   4           H        LYS   4  27.735  -3.299  17.770
   14    HA   LYS   4           HA       LYS   4  25.134  -4.452  18.459
   15   1HB   LYS   4          1HB       LYS   4  25.966  -2.718  16.125
   16   2HB   LYS   4          2HB       LYS   4  24.330  -3.288  16.427
   17   1HG   LYS   4          1HG       LYS   4  25.628  -1.831  18.639
   18   2HG   LYS   4          2HG       LYS   4  25.230  -0.889  17.201
   19   1HD   LYS   4          1HD       LYS   4  23.196  -0.699  18.129
   20   2HD   LYS   4          2HD       LYS   4  22.953  -2.355  17.567
   21   1HE   LYS   4          1HE       LYS   4  24.328  -2.568  19.998
   22   2HE   LYS   4          2HE       LYS   4  23.095  -1.333  20.255
   23   1HZ   LYS   4          1HZ       LYS   4  21.397  -2.818  19.757
   24   2HZ   LYS   4          2HZ       LYS   4  22.467  -3.752  20.676
   25   3HZ   LYS   4          3HZ       LYS   4  22.429  -3.919  18.993
   26    H    LYS   5           H        LYS   5  24.201  -6.113  17.333
   27    HA   LYS   5           HA       LYS   5  25.986  -7.578  15.514
   28   1HB   LYS   5          1HB       LYS   5  23.896  -8.405  17.471
   29   2HB   LYS   5          2HB       LYS   5  24.137  -9.413  16.050
   30   1HG   LYS   5          1HG       LYS   5  26.355  -8.617  17.920
   31   2HG   LYS   5          2HG       LYS   5  25.421 -10.106  18.079
   32   1HD   LYS   5          1HD       LYS   5  26.118 -10.306  15.501
   33   2HD   LYS   5          2HD       LYS   5  27.482  -9.352  16.090
   34   1HE   LYS   5          1HE       LYS   5  26.790 -11.583  17.838
   35   2HE   LYS   5          2HE       LYS   5  27.249 -12.091  16.214
   36   1HZ   LYS   5          1HZ       LYS   5  29.368 -11.542  16.568
   37   2HZ   LYS   5          2HZ       LYS   5  28.973 -11.524  18.213
   38   3HZ   LYS   5          3HZ       LYS   5  28.980 -10.081  17.329
   39    H    ASN   6           H        ASN   6  25.540  -6.767  13.520
   40    HA   ASN   6           HA       ASN   6  22.754  -7.024  12.594
   41   1HB   ASN   6          1HB       ASN   6  24.709  -5.049  11.431
   42   2HB   ASN   6          2HB       ASN   6  22.955  -5.081  11.266
   43   1HD2  ASN   6          1HD2      ASN   6  25.625  -4.074  13.167
   44   2HD2  ASN   6          2HD2      ASN   6  24.731  -3.203  14.362
   45    H    GLY   7           H        GLY   7  22.435  -7.761  10.464
   46   1HA   GLY   7          1HA       GLY   7  24.777  -9.172   9.350
   47   2HA   GLY   7          2HA       GLY   7  23.117  -9.732   9.207
   48    H    ARG   8           H        ARG   8  22.936  -9.799   7.018
   49    HA   ARG   8           HA       ARG   8  23.292  -7.242   5.596
   50   1HB   ARG   8          1HB       ARG   8  24.487  -9.736   5.061
   51   2HB   ARG   8          2HB       ARG   8  23.267  -9.506   3.815
   52   1HG   ARG   8          1HG       ARG   8  25.197  -8.583   2.904
   53   2HG   ARG   8          2HG       ARG   8  24.294  -7.187   3.495
   54   1HD   ARG   8          1HD       ARG   8  25.714  -6.889   5.319
   55   2HD   ARG   8          2HD       ARG   8  26.345  -8.532   5.215
   56    HE   ARG   8           HE       ARG   8  27.012  -7.131   2.871
   57   1HH1  ARG   8          1HH1      ARG   8  27.794  -7.233   6.261
   58   2HH1  ARG   8          2HH1      ARG   8  29.408  -6.643   6.040
   59   1HH2  ARG   8          1HH2      ARG   8  29.134  -6.354   2.566
   60   2HH2  ARG   8          2HH2      ARG   8  30.169  -6.142   3.938
   61    H    SER   9           H        SER   9  21.740  -6.664   4.056
   62    HA   SER   9           HA       SER   9  19.340  -8.331   3.872
   63   1HB   SER   9          1HB       SER   9  19.540  -5.866   5.368
   64   2HB   SER   9          2HB       SER   9  18.377  -5.697   4.054
   65    HG   SER   9           HG       SER   9  18.157  -7.074   6.371
   66    H    GLY  10           H        GLY  10  18.519  -8.400   1.871
   67   1HA   GLY  10          1HA       GLY  10  19.850  -6.954  -0.233
   68   2HA   GLY  10          2HA       GLY  10  18.551  -8.123  -0.427
   69    HA   PRO  11           HA       PRO  11  15.596  -4.966  -1.114
   70   1HB   PRO  11          1HB       PRO  11  13.469  -5.691   0.409
   71   2HB   PRO  11          2HB       PRO  11  13.946  -6.564  -1.052
   72   1HG   PRO  11          1HG       PRO  11  14.507  -7.220   1.814
   73   2HG   PRO  11          2HG       PRO  11  14.013  -8.298   0.495
   74   1HD   PRO  11          1HD       PRO  11  16.581  -8.103   1.333
   75   2HD   PRO  11          2HD       PRO  11  16.150  -8.442  -0.355
   76    H    GLN  12           H        GLN  12  15.626  -2.919  -0.451
   77    HA   GLN  12           HA       GLN  12  15.863  -2.354   2.417
   78   1HB   GLN  12          1HB       GLN  12  16.697  -0.935  -0.065
   79   2HB   GLN  12          2HB       GLN  12  16.300   0.041   1.342
   80   1HG   GLN  12          1HG       GLN  12  17.999  -0.990   2.641
   81   2HG   GLN  12          2HG       GLN  12  18.280  -2.217   1.407
   82   1HE2  GLN  12          1HE2      GLN  12  20.465  -1.064   2.144
   83   2HE2  GLN  12          2HE2      GLN  12  21.011   0.136   1.028
   84    HA   PRO  13           HA       PRO  13  11.870  -0.578   2.781
   85   1HB   PRO  13          1HB       PRO  13  12.328   1.582   4.360
   86   2HB   PRO  13          2HB       PRO  13  12.393  -0.078   4.962
   87   1HG   PRO  13          1HG       PRO  13  14.635   1.730   4.147
   88   2HG   PRO  13          2HG       PRO  13  14.523   0.649   5.548
   89   1HD   PRO  13          1HD       PRO  13  15.894  -0.007   3.308
   90   2HD   PRO  13          2HD       PRO  13  15.068  -1.217   4.310
   91    H    HIS  14           H        HIS  14  10.501   1.024   1.991
   92    HA   HIS  14           HA       HIS  14  11.717   3.302   0.610
   93   1HB   HIS  14          1HB       HIS  14   9.844   1.294  -0.651
   94   2HB   HIS  14          2HB       HIS  14  10.196   2.871  -1.352
   95    HD1  HIS  14           1HD      HIS  14  11.758  -0.471  -0.678
   96    HD2  HIS  14           2HD      HIS  14  12.665   3.091  -2.615
   97    HE1  HIS  14           1HE      HIS  14  13.828  -0.945  -2.025
   98    H    LYS  15           H        LYS  15   9.776   4.664  -0.376
   99    HA   LYS  15           HA       LYS  15   7.906   5.066   1.853
  100   1HB   LYS  15          1HB       LYS  15   7.583   7.339   0.784
  101   2HB   LYS  15          2HB       LYS  15   9.176   7.031   1.462
  102   1HG   LYS  15          1HG       LYS  15   9.095   6.237  -1.298
  103   2HG   LYS  15          2HG       LYS  15   8.561   7.910  -1.115
  104   1HD   LYS  15          1HD       LYS  15  10.991   7.043   0.365
  105   2HD   LYS  15          2HD       LYS  15  11.121   7.281  -1.379
  106   1HE   LYS  15          1HE       LYS  15   9.707   9.422   0.042
  107   2HE   LYS  15          2HE       LYS  15  11.400   9.240   0.498
  108   1HZ   LYS  15          1HZ       LYS  15  12.114   9.729  -1.621
  109   2HZ   LYS  15          2HZ       LYS  15  10.778  10.756  -1.474
  110   3HZ   LYS  15          3HZ       LYS  15  10.643   9.313  -2.347
  111    H    ARG  16           H        ARG  16   7.726   3.189  -0.559
  112    HA   ARG  16           HA       ARG  16   4.954   3.860  -1.196
  113   1HB   ARG  16          1HB       ARG  16   7.032   3.177  -3.284
  114   2HB   ARG  16          2HB       ARG  16   5.306   3.335  -3.583
  115   1HG   ARG  16          1HG       ARG  16   5.430   5.694  -2.878
  116   2HG   ARG  16          2HG       ARG  16   7.174   5.516  -2.680
  117   1HD   ARG  16          1HD       ARG  16   5.647   5.102  -5.248
  118   2HD   ARG  16          2HD       ARG  16   6.584   6.537  -4.835
  119    HE   ARG  16           HE       ARG  16   8.279   4.345  -4.606
  120   1HH1  ARG  16          1HH1      ARG  16   6.478   6.000  -7.083
  121   2HH1  ARG  16          2HH1      ARG  16   7.586   5.585  -8.349
  122   1HH2  ARG  16          1HH2      ARG  16   9.745   3.792  -6.263
  123   2HH2  ARG  16          2HH2      ARG  16   9.444   4.328  -7.881
  124    H    TRP  17           H        TRP  17   3.685   2.149  -0.926
  125    HA   TRP  17           HA       TRP  17   4.652  -0.522  -1.541
  126   1HB   TRP  17          1HB       TRP  17   3.844   0.356   1.227
  127   2HB   TRP  17          2HB       TRP  17   3.769  -1.330   0.724
  128    HD1  TRP  17           HD       TRP  17   6.221   1.384   1.733
  129    HE1  TRP  17           1HE      TRP  17   8.562   0.347   1.996
  130    HE3  TRP  17           3HE      TRP  17   5.278  -3.252  -0.204
  131    HZ2  TRP  17           2HZ      TRP  17   9.840  -2.111   1.453
  132    HZ3  TRP  17           3HZ      TRP  17   7.114  -4.888  -0.297
  133    HH2  TRP  17           HH       TRP  17   9.347  -4.327   0.515
  134    H    VAL  18           H        VAL  18   3.070  -1.832  -2.281
  135    HA   VAL  18           HA       VAL  18   0.329  -0.761  -2.232
  136    HB   VAL  18           HB       VAL  18  -0.103  -2.087  -4.234
  137   1HG1  VAL  18          1HG1      VAL  18   0.678   0.157  -4.584
  138   2HG1  VAL  18          2HG1      VAL  18   2.358  -0.353  -4.402
  139   3HG1  VAL  18          3HG1      VAL  18   1.418  -0.891  -5.794
  140   1HG2  VAL  18          1HG2      VAL  18   2.129  -3.550  -3.405
  141   2HG2  VAL  18          2HG2      VAL  18   1.170  -3.799  -4.864
  142   3HG2  VAL  18          3HG2      VAL  18   2.607  -2.779  -4.918
  143    H    PHE  19           H        PHE  19  -1.428  -2.366  -2.200
  144    HA   PHE  19           HA       PHE  19  -0.721  -4.874  -0.854
  145   1HB   PHE  19          1HB       PHE  19  -2.676  -4.508   0.696
  146   2HB   PHE  19          2HB       PHE  19  -1.304  -3.440   0.968
  147    HD1  PHE  19           1HD      PHE  19  -1.409  -1.084   0.150
  148    HD2  PHE  19           2HD      PHE  19  -4.799  -3.659   0.140
  149    HE1  PHE  19           1HE      PHE  19  -2.890   0.870  -0.053
  150    HE2  PHE  19           2HE      PHE  19  -6.284  -1.709  -0.064
  151    HZ   PHE  19           HZ       PHE  19  -5.330   0.560  -0.162
  152    H    THR  20           H        THR  20  -2.097  -6.590  -1.239
  153    HA   THR  20           HA       THR  20  -4.517  -6.165  -2.796
  154    HB   THR  20           HB       THR  20  -3.900  -7.668  -4.591
  155    HG1  THR  20           1HG      THR  20  -1.461  -7.894  -3.147
  156   1HG2  THR  20          1HG2      THR  20  -1.685  -5.646  -4.254
  157   2HG2  THR  20          2HG2      THR  20  -3.323  -5.239  -4.767
  158   3HG2  THR  20          3HG2      THR  20  -2.323  -6.295  -5.765
  159    H    LEU  21           H        LEU  21  -6.058  -7.543  -2.180
  160    HA   LEU  21           HA       LEU  21  -5.308 -10.158  -1.101
  161   1HB   LEU  21          1HB       LEU  21  -5.552  -8.598   0.794
  162   2HB   LEU  21          2HB       LEU  21  -7.201  -8.257   0.274
  163    HG   LEU  21           HG       LEU  21  -7.147 -11.014   0.559
  164   1HD1  LEU  21          1HD1      LEU  21  -5.468  -9.689   2.667
  165   2HD1  LEU  21          2HD1      LEU  21  -5.097 -11.117   1.702
  166   3HD1  LEU  21          3HD1      LEU  21  -6.334 -11.198   2.957
  167   1HD2  LEU  21          1HD2      LEU  21  -8.347  -8.690   1.847
  168   2HD2  LEU  21          2HD2      LEU  21  -8.190 -10.080   2.921
  169   3HD2  LEU  21          3HD2      LEU  21  -9.066 -10.236   1.398
  170    H    ASN  22           H        ASN  22  -6.694 -11.774  -1.615
  171    HA   ASN  22           HA       ASN  22  -8.791 -11.161  -3.510
  172   1HB   ASN  22          1HB       ASN  22  -8.812 -13.453  -4.029
  173   2HB   ASN  22          2HB       ASN  22  -7.125 -13.122  -3.647
  174   1HD2  ASN  22          1HD2      ASN  22  -9.377 -15.358  -3.299
  175   2HD2  ASN  22          2HD2      ASN  22  -8.934 -16.043  -1.776
  176    H    ASN  23           H        ASN  23 -10.938 -11.231  -3.167
  177    HA   ASN  23           HA       ASN  23 -12.897 -11.149  -2.004
  178   1HB   ASN  23          1HB       ASN  23 -12.705 -13.570  -2.229
  179   2HB   ASN  23          2HB       ASN  23 -11.714 -13.648  -0.775
  180   1HD2  ASN  23          1HD2      ASN  23 -14.662 -11.817  -1.449
  181   2HD2  ASN  23          2HD2      ASN  23 -15.602 -12.528  -0.185
  182    HA   PRO  24           HA       PRO  24 -10.771  -9.249   1.701
  183   1HB   PRO  24          1HB       PRO  24 -11.601  -6.712   1.203
  184   2HB   PRO  24          2HB       PRO  24 -10.113  -7.386   0.529
  185   1HG   PRO  24          1HG       PRO  24 -12.802  -7.079  -0.750
  186   2HG   PRO  24          2HG       PRO  24 -11.196  -6.756  -1.430
  187   1HD   PRO  24          1HD       PRO  24 -12.579  -9.021  -1.970
  188   2HD   PRO  24          2HD       PRO  24 -10.806  -8.981  -1.890
  189    H    SER  25           H        SER  25 -11.787  -8.925   3.615
  190    HA   SER  25           HA       SER  25 -14.694  -9.139   3.629
  191   1HB   SER  25          1HB       SER  25 -12.722  -9.251   5.924
  192   2HB   SER  25          2HB       SER  25 -14.446  -9.605   6.027
  193    HG   SER  25           HG       SER  25 -12.788 -11.399   5.696
  194    H    GLU  26           H        GLU  26 -15.990  -7.783   5.038
  195    HA   GLU  26           HA       GLU  26 -15.597  -5.055   4.607
  196   1HB   GLU  26          1HB       GLU  26 -17.422  -4.728   6.263
  197   2HB   GLU  26          2HB       GLU  26 -17.803  -5.926   5.034
  198   1HG   GLU  26          1HG       GLU  26 -16.909  -7.616   6.801
  199   2HG   GLU  26          2HG       GLU  26 -17.229  -6.304   7.933
  200    H    ASP  27           H        ASP  27 -14.559  -7.124   7.211
  201    HA   ASP  27           HA       ASP  27 -13.916  -5.040   9.049
  202   1HB   ASP  27          1HB       ASP  27 -14.269  -7.182   9.995
  203   2HB   ASP  27          2HB       ASP  27 -13.156  -7.950   8.866
  204    H    GLU  28           H        GLU  28 -11.972  -7.033   6.835
  205    HA   GLU  28           HA       GLU  28  -9.501  -5.816   7.429
  206   1HB   GLU  28          1HB       GLU  28 -10.400  -7.897   5.786
  207   2HB   GLU  28          2HB       GLU  28  -9.654  -6.742   4.691
  208   1HG   GLU  28          1HG       GLU  28  -7.820  -7.954   5.207
  209   2HG   GLU  28          2HG       GLU  28  -7.752  -6.800   6.538
  210    H    ARG  29           H        ARG  29 -11.849  -5.219   4.831
  211    HA   ARG  29           HA       ARG  29 -10.403  -3.189   3.535
  212   1HB   ARG  29          1HB       ARG  29 -13.245  -4.080   3.567
  213   2HB   ARG  29          2HB       ARG  29 -12.892  -2.496   2.891
  214   1HG   ARG  29          1HG       ARG  29 -11.643  -3.372   1.150
  215   2HG   ARG  29          2HG       ARG  29 -11.354  -4.895   1.994
  216   1HD   ARG  29          1HD       ARG  29 -12.923  -5.347   0.272
  217   2HD   ARG  29          2HD       ARG  29 -13.816  -5.353   1.792
  218    HE   ARG  29           HE       ARG  29 -13.829  -2.813   0.441
  219   1HH1  ARG  29          1HH1      ARG  29 -15.385  -5.913   0.743
  220   2HH1  ARG  29          2HH1      ARG  29 -16.910  -5.352   0.141
  221   1HH2  ARG  29          1HH2      ARG  29 -15.831  -2.063  -0.354
  222   2HH2  ARG  29          2HH2      ARG  29 -17.162  -3.162  -0.483
  223    H    LYS  30           H        LYS  30 -12.588  -3.135   6.277
  224    HA   LYS  30           HA       LYS  30 -12.898  -0.310   6.387
  225   1HB   LYS  30          1HB       LYS  30 -13.512  -2.608   8.171
  226   2HB   LYS  30          2HB       LYS  30 -13.410  -1.018   8.917
  227   1HG   LYS  30          1HG       LYS  30 -15.083  -0.196   7.287
  228   2HG   LYS  30          2HG       LYS  30 -15.239  -1.844   6.672
  229   1HD   LYS  30          1HD       LYS  30 -15.506  -1.618   9.581
  230   2HD   LYS  30          2HD       LYS  30 -16.751  -0.758   8.673
  231   1HE   LYS  30          1HE       LYS  30 -17.785  -2.745   8.595
  232   2HE   LYS  30          2HE       LYS  30 -16.617  -3.130   7.332
  233   1HZ   LYS  30          1HZ       LYS  30 -16.834  -4.167  10.008
  234   2HZ   LYS  30          2HZ       LYS  30 -15.261  -3.707   9.592
  235   3HZ   LYS  30          3HZ       LYS  30 -16.089  -4.838   8.645
  236    H    LYS  31           H        LYS  31 -10.641  -2.591   7.839
  237    HA   LYS  31           HA       LYS  31  -9.411  -0.835   9.653
  238   1HB   LYS  31          1HB       LYS  31  -9.016  -3.174   9.888
  239   2HB   LYS  31          2HB       LYS  31  -8.414  -3.307   8.241
  240   1HG   LYS  31          1HG       LYS  31  -6.452  -1.993   8.838
  241   2HG   LYS  31          2HG       LYS  31  -7.059  -1.826  10.487
  242   1HD   LYS  31          1HD       LYS  31  -6.474  -3.936  11.054
  243   2HD   LYS  31          2HD       LYS  31  -6.873  -4.586   9.462
  244   1HE   LYS  31          1HE       LYS  31  -4.543  -4.811   9.647
  245   2HE   LYS  31          2HE       LYS  31  -4.786  -3.393   8.629
  246   1HZ   LYS  31          1HZ       LYS  31  -4.249  -3.298  11.548
  247   2HZ   LYS  31          2HZ       LYS  31  -4.361  -1.974  10.501
  248   3HZ   LYS  31          3HZ       LYS  31  -3.079  -3.067  10.348
  249    H    ILE  32           H        ILE  32  -8.431  -1.773   6.358
  250    HA   ILE  32           HA       ILE  32  -6.228  -0.002   6.233
  251    HB   ILE  32           HB       ILE  32  -7.797  -1.490   4.154
  252   1HG1  ILE  32          1HG1      ILE  32  -4.872  -1.577   4.915
  253   2HG1  ILE  32          2HG1      ILE  32  -6.101  -2.638   5.596
  254   1HG2  ILE  32          1HG2      ILE  32  -7.314   0.267   2.790
  255   2HG2  ILE  32          2HG2      ILE  32  -5.922   0.771   3.746
  256   3HG2  ILE  32          3HG2      ILE  32  -5.791  -0.611   2.659
  257   1HD1  ILE  32          1HD1      ILE  32  -6.018  -2.596   2.671
  258   2HD1  ILE  32          2HD1      ILE  32  -4.564  -3.224   3.448
  259   3HD1  ILE  32          3HD1      ILE  32  -6.133  -3.954   3.790
  260    H    ARG  33           H        ARG  33  -9.607   0.283   5.245
  261    HA   ARG  33           HA       ARG  33  -9.304   2.810   3.968
  262   1HB   ARG  33          1HB       ARG  33 -11.168   1.411   3.369
  263   2HB   ARG  33          2HB       ARG  33 -11.732   1.366   5.034
  264   1HG   ARG  33          1HG       ARG  33 -12.420   3.622   4.966
  265   2HG   ARG  33          2HG       ARG  33 -11.564   3.911   3.449
  266   1HD   ARG  33          1HD       ARG  33 -13.454   3.446   2.376
  267   2HD   ARG  33          2HD       ARG  33 -13.296   1.780   2.933
  268    HE   ARG  33           HE       ARG  33 -14.986   2.155   4.432
  269   1HH1  ARG  33          1HH1      ARG  33 -13.828   5.207   3.222
  270   2HH1  ARG  33          2HH1      ARG  33 -15.095   6.129   3.960
  271   1HH2  ARG  33          1HH2      ARG  33 -16.660   3.359   5.409
  272   2HH2  ARG  33          2HH2      ARG  33 -16.705   5.077   5.205
  273    H    ASP  34           H        ASP  34  -9.590   1.809   7.237
  274    HA   ASP  34           HA       ASP  34 -10.347   4.498   8.122
  275   1HB   ASP  34          1HB       ASP  34 -11.524   2.506   9.075
  276   2HB   ASP  34          2HB       ASP  34  -9.995   2.000   9.789
  277    H    LEU  35           H        LEU  35  -7.616   3.188   7.177
  278    HA   LEU  35           HA       LEU  35  -5.831   3.483   9.343
  279   1HB   LEU  35          1HB       LEU  35  -5.552   3.370   6.376
  280   2HB   LEU  35          2HB       LEU  35  -4.166   3.849   7.353
  281    HG   LEU  35           HG       LEU  35  -5.652   1.243   7.669
  282   1HD1  LEU  35          1HD1      LEU  35  -3.096   1.868   6.201
  283   2HD1  LEU  35          2HD1      LEU  35  -4.602   1.272   5.505
  284   3HD1  LEU  35          3HD1      LEU  35  -3.665   0.244   6.588
  285   1HD2  LEU  35          1HD2      LEU  35  -3.707   0.598   8.997
  286   2HD2  LEU  35          2HD2      LEU  35  -4.514   2.006   9.689
  287   3HD2  LEU  35          3HD2      LEU  35  -3.016   2.206   8.777
  288    HA   PRO  36           HA       PRO  36  -5.151   7.803   9.687
  289   1HB   PRO  36          1HB       PRO  36  -2.469   7.944  10.082
  290   2HB   PRO  36          2HB       PRO  36  -3.589   7.334  11.305
  291   1HG   PRO  36          1HG       PRO  36  -1.867   5.812   9.387
  292   2HG   PRO  36          2HG       PRO  36  -2.169   5.503  11.107
  293   1HD   PRO  36          1HD       PRO  36  -3.420   4.129   9.137
  294   2HD   PRO  36          2HD       PRO  36  -4.194   4.481  10.696
  295    H    ILE  37           H        ILE  37  -5.333   9.185   8.044
  296    HA   ILE  37           HA       ILE  37  -4.056   8.813   5.531
  297    HB   ILE  37           HB       ILE  37  -4.930  11.135   5.046
  298   1HG1  ILE  37          1HG1      ILE  37  -6.269  10.804   7.737
  299   2HG1  ILE  37          2HG1      ILE  37  -4.893  11.863   7.448
  300   1HG2  ILE  37          1HG2      ILE  37  -6.229   8.680   5.222
  301   2HG2  ILE  37          2HG2      ILE  37  -7.343   9.836   5.950
  302   3HG2  ILE  37          3HG2      ILE  37  -6.753  10.095   4.309
  303   1HD1  ILE  37          1HD1      ILE  37  -6.438  13.428   7.094
  304   2HD1  ILE  37          2HD1      ILE  37  -6.635  12.666   5.515
  305   3HD1  ILE  37          3HD1      ILE  37  -7.719  12.243   6.841
  306    H    SER  38           H        SER  38  -3.353  10.743   8.370
  307    HA   SER  38           HA       SER  38  -1.398  12.417   7.182
  308   1HB   SER  38          1HB       SER  38  -2.483  11.958   9.828
  309   2HB   SER  38          2HB       SER  38  -0.732  12.155   9.892
  310    HG   SER  38           HG       SER  38  -0.914  14.174   9.218
  311    H    LEU  39           H        LEU  39  -1.376   9.139   8.124
  312    HA   LEU  39           HA       LEU  39   1.440   8.926   8.634
  313   1HB   LEU  39          1HB       LEU  39  -0.678   7.371   9.233
  314   2HB   LEU  39          2HB       LEU  39  -0.067   6.526   7.813
  315    HG   LEU  39           HG       LEU  39   1.928   7.184   9.890
  316   1HD1  LEU  39          1HD1      LEU  39   1.286   5.349  11.328
  317   2HD1  LEU  39          2HD1      LEU  39  -0.128   5.023  10.327
  318   3HD1  LEU  39          3HD1      LEU  39  -0.023   6.528  11.239
  319   1HD2  LEU  39          1HD2      LEU  39   2.797   5.031   9.279
  320   2HD2  LEU  39          2HD2      LEU  39   2.409   5.919   7.806
  321   3HD2  LEU  39          3HD2      LEU  39   1.331   4.645   8.377
  322    H    PHE  40           H        PHE  40  -0.635   8.712   5.852
  323    HA   PHE  40           HA       PHE  40   1.727   8.134   4.191
  324   1HB   PHE  40          1HB       PHE  40  -1.052   7.332   3.373
  325   2HB   PHE  40          2HB       PHE  40   0.489   6.738   2.764
  326    HD1  PHE  40           2HD      PHE  40  -1.940   6.543   5.501
  327    HD2  PHE  40           1HD      PHE  40   1.691   5.004   3.901
  328    HE1  PHE  40           2HE      PHE  40  -2.063   4.643   7.059
  329    HE2  PHE  40           1HE      PHE  40   1.573   3.101   5.456
  330    HZ   PHE  40           HZ       PHE  40  -0.305   2.919   7.039
  331    H    ASP  41           H        ASP  41   2.248   9.891   3.083
  332    HA   ASP  41           HA       ASP  41   0.735  12.176   2.759
  333   1HB   ASP  41          1HB       ASP  41   3.042  11.042   1.202
  334   2HB   ASP  41          2HB       ASP  41   2.282  12.552   0.707
  335    H    TYR  42           H        TYR  42   0.709   9.238   0.886
  336    HA   TYR  42           HA       TYR  42  -1.548  10.300  -0.659
  337   1HB   TYR  42          1HB       TYR  42   0.386  10.450  -2.131
  338   2HB   TYR  42          2HB       TYR  42   0.793   8.767  -1.811
  339    HD1  TYR  42           1HD      TYR  42  -2.640  10.007  -2.367
  340    HD2  TYR  42           2HD      TYR  42   0.699   7.985  -4.060
  341    HE1  TYR  42           1HE      TYR  42  -4.034   9.313  -4.271
  342    HE2  TYR  42           2HE      TYR  42  -0.685   7.287  -5.970
  343    HH   TYR  42           HH       TYR  42  -2.764   7.182  -6.796
  344    H    PHE  43           H        PHE  43  -3.259   9.018  -0.519
  345    HA   PHE  43           HA       PHE  43  -2.854   6.134  -0.135
  346   1HB   PHE  43          1HB       PHE  43  -3.578   7.684   1.946
  347   2HB   PHE  43          2HB       PHE  43  -5.166   7.357   1.261
  348    HD1  PHE  43           1HD      PHE  43  -4.108   4.552   0.194
  349    HD2  PHE  43           2HD      PHE  43  -4.226   6.488   3.983
  350    HE1  PHE  43           1HE      PHE  43  -4.136   2.359   1.310
  351    HE2  PHE  43           2HE      PHE  43  -4.254   4.298   5.105
  352    HZ   PHE  43           HZ       PHE  43  -4.208   2.230   3.768
  353    H    ILE  44           H        ILE  44  -3.759   5.119  -1.788
  354    HA   ILE  44           HA       ILE  44  -6.401   5.994  -2.715
  355    HB   ILE  44           HB       ILE  44  -4.983   6.941  -4.365
  356   1HG1  ILE  44          1HG1      ILE  44  -5.508   4.467  -5.875
  357   2HG1  ILE  44          2HG1      ILE  44  -6.889   5.081  -4.973
  358   1HG2  ILE  44          1HG2      ILE  44  -3.586   4.277  -4.572
  359   2HG2  ILE  44          2HG2      ILE  44  -3.221   5.725  -5.508
  360   3HG2  ILE  44          3HG2      ILE  44  -2.944   5.709  -3.767
  361   1HD1  ILE  44          1HD1      ILE  44  -6.529   5.834  -7.411
  362   2HD1  ILE  44          2HD1      ILE  44  -6.981   7.034  -6.200
  363   3HD1  ILE  44          3HD1      ILE  44  -5.304   6.902  -6.728
  364    H    VAL  45           H        VAL  45  -7.752   4.347  -2.509
  365    HA   VAL  45           HA       VAL  45  -6.740   1.621  -3.000
  366    HB   VAL  45           HB       VAL  45  -9.048   2.179  -1.162
  367   1HG1  VAL  45          1HG1      VAL  45  -7.992  -0.136  -2.195
  368   2HG1  VAL  45          2HG1      VAL  45  -7.244  -0.041  -0.599
  369   3HG1  VAL  45          3HG1      VAL  45  -9.001  -0.018  -0.754
  370   1HG2  VAL  45          1HG2      VAL  45  -7.541   3.373   0.058
  371   2HG2  VAL  45          2HG2      VAL  45  -7.126   1.754   0.620
  372   3HG2  VAL  45          3HG2      VAL  45  -6.150   2.532  -0.626
  373    H    GLY  46           H        GLY  46  -7.989   0.251  -4.219
  374   1HA   GLY  46          1HA       GLY  46 -10.541   1.324  -5.236
  375   2HA   GLY  46          2HA       GLY  46  -9.327   0.706  -6.345
  376    H    GLU  47           H        GLU  47 -12.163  -0.114  -5.503
  377    HA   GLU  47           HA       GLU  47 -11.570  -2.903  -4.780
  378   1HB   GLU  47          1HB       GLU  47 -13.094  -1.923  -3.223
  379   2HB   GLU  47          2HB       GLU  47 -14.083  -1.256  -4.514
  380   1HG   GLU  47          1HG       GLU  47 -13.723  -4.206  -4.339
  381   2HG   GLU  47          2HG       GLU  47 -14.828  -3.401  -3.227
  382    H    GLU  48           H        GLU  48 -12.024  -4.530  -6.149
  383    HA   GLU  48           HA       GLU  48 -13.495  -3.876  -8.616
  384   1HB   GLU  48          1HB       GLU  48 -11.981  -5.146  -9.925
  385   2HB   GLU  48          2HB       GLU  48 -10.992  -4.113  -8.904
  386   1HG   GLU  48          1HG       GLU  48 -10.583  -5.977  -7.392
  387   2HG   GLU  48          2HG       GLU  48 -11.595  -7.017  -8.393
  388    H    GLY  49           H        GLY  49 -14.948  -5.368  -9.360
  389   1HA   GLY  49          1HA       GLY  49 -15.162  -8.035  -8.960
  390   2HA   GLY  49          2HA       GLY  49 -15.796  -7.374  -7.460
  391    H    ASN  50           H        ASN  50 -16.170  -7.127 -10.987
  392    HA   ASN  50           HA       ASN  50 -19.052  -6.700 -10.542
  393   1HB   ASN  50          1HB       ASN  50 -17.285  -4.966 -11.808
  394   2HB   ASN  50          2HB       ASN  50 -18.088  -5.795 -13.138
  395   1HD2  ASN  50          1HD2      ASN  50 -19.155  -4.690  -9.939
  396   2HD2  ASN  50          2HD2      ASN  50 -20.487  -3.755 -10.520
  397    H    GLU  51           H        GLU  51 -17.659  -9.227 -10.828
  398    HA   GLU  51           HA       GLU  51 -18.915 -10.161 -13.324
  399   1HB   GLU  51          1HB       GLU  51 -16.341 -11.120 -12.066
  400   2HB   GLU  51          2HB       GLU  51 -17.148 -11.926 -13.403
  401   1HG   GLU  51          1HG       GLU  51 -16.548  -9.052 -13.739
  402   2HG   GLU  51          2HG       GLU  51 -15.182 -10.167 -13.743
  403    H    GLU  52           H        GLU  52 -20.720 -11.169 -12.706
  404    HA   GLU  52           HA       GLU  52 -21.296 -12.268 -10.240
  405   1HB   GLU  52          1HB       GLU  52 -22.580 -12.070 -12.724
  406   2HB   GLU  52          2HB       GLU  52 -22.579 -13.786 -12.340
  407   1HG   GLU  52          1HG       GLU  52 -23.483 -13.096 -10.057
  408   2HG   GLU  52          2HG       GLU  52 -23.795 -11.526 -10.795
  409    H    GLY  53           H        GLY  53 -21.144 -14.286  -9.314
  410   1HA   GLY  53          1HA       GLY  53 -20.609 -16.573  -9.219
  411   2HA   GLY  53          2HA       GLY  53 -19.896 -16.451 -10.820
  412    H    ARG  54           H        ARG  54 -18.493 -13.928  -9.695
  413    HA   ARG  54           HA       ARG  54 -16.299 -15.410  -8.403
  414   1HB   ARG  54          1HB       ARG  54 -15.883 -14.410 -10.696
  415   2HB   ARG  54          2HB       ARG  54 -16.040 -12.829  -9.943
  416   1HG   ARG  54          1HG       ARG  54 -14.033 -12.969  -8.900
  417   2HG   ARG  54          2HG       ARG  54 -14.132 -14.721  -8.707
  418   1HD   ARG  54          1HD       ARG  54 -13.876 -13.619 -11.457
  419   2HD   ARG  54          2HD       ARG  54 -12.453 -13.595 -10.416
  420    HE   ARG  54           HE       ARG  54 -13.377 -16.143 -10.205
  421   1HH1  ARG  54          1HH1      ARG  54 -12.506 -14.083 -12.873
  422   2HH1  ARG  54          2HH1      ARG  54 -11.994 -15.392 -13.886
  423   1HH2  ARG  54          1HH2      ARG  54 -12.705 -17.875 -11.529
  424   2HH2  ARG  54          2HH2      ARG  54 -12.108 -17.548 -13.121
  425    H    THR  55           H        THR  55 -14.940 -14.111  -6.921
  426    HA   THR  55           HA       THR  55 -16.651 -12.417  -5.250
  427    HB   THR  55           HB       THR  55 -14.326 -12.797  -3.820
  428    HG1  THR  55           1HG      THR  55 -13.429 -14.358  -5.055
  429   1HG2  THR  55          1HG2      THR  55 -15.647 -14.047  -2.366
  430   2HG2  THR  55          2HG2      THR  55 -16.568 -14.783  -3.678
  431   3HG2  THR  55          3HG2      THR  55 -16.837 -13.093  -3.251
  432    HA   PRO  56           HA       PRO  56 -14.441  -8.708  -6.039
  433   1HB   PRO  56          1HB       PRO  56 -14.373  -7.546  -3.586
  434   2HB   PRO  56          2HB       PRO  56 -15.850  -7.669  -4.550
  435   1HG   PRO  56          1HG       PRO  56 -14.924  -9.383  -2.277
  436   2HG   PRO  56          2HG       PRO  56 -16.544  -8.741  -2.608
  437   1HD   PRO  56          1HD       PRO  56 -15.842 -11.292  -3.183
  438   2HD   PRO  56          2HD       PRO  56 -17.015 -10.382  -4.156
  439    H    HIS  57           H        HIS  57 -12.482  -7.499  -5.593
  440    HA   HIS  57           HA       HIS  57 -10.480  -8.882  -3.965
  441   1HB   HIS  57          1HB       HIS  57 -10.018  -9.813  -6.097
  442   2HB   HIS  57          2HB       HIS  57 -10.238  -8.264  -6.906
  443    HD1  HIS  57           1HD      HIS  57  -8.171  -6.954  -7.343
  444    HD2  HIS  57           2HD      HIS  57  -7.597  -9.857  -4.426
  445    HE1  HIS  57           1HE      HIS  57  -5.710  -6.910  -6.826
  446    H    LEU  58           H        LEU  58  -9.026  -7.552  -2.989
  447    HA   LEU  58           HA       LEU  58  -9.512  -4.687  -3.264
  448   1HB   LEU  58          1HB       LEU  58  -9.104  -6.325  -1.085
  449   2HB   LEU  58          2HB       LEU  58  -7.552  -5.511  -1.272
  450    HG   LEU  58           HG       LEU  58 -10.241  -4.233  -0.802
  451   1HD1  LEU  58          1HD1      LEU  58  -9.052  -3.356   1.214
  452   2HD1  LEU  58          2HD1      LEU  58  -7.721  -4.448   0.831
  453   3HD1  LEU  58          3HD1      LEU  58  -9.315  -5.101   1.213
  454   1HD2  LEU  58          1HD2      LEU  58  -7.572  -2.948  -1.368
  455   2HD2  LEU  58          2HD2      LEU  58  -9.009  -2.097  -0.800
  456   3HD2  LEU  58          3HD2      LEU  58  -9.012  -2.876  -2.383
  457    H    GLN  59           H        GLN  59  -8.074  -3.274  -4.076
  458    HA   GLN  59           HA       GLN  59  -5.280  -3.965  -4.357
  459   1HB   GLN  59          1HB       GLN  59  -6.034  -4.984  -6.366
  460   2HB   GLN  59          2HB       GLN  59  -7.097  -3.634  -6.738
  461   1HG   GLN  59          1HG       GLN  59  -5.193  -3.560  -8.186
  462   2HG   GLN  59          2HG       GLN  59  -5.116  -2.204  -7.062
  463   1HE2  GLN  59          1HE2      GLN  59  -3.588  -2.251  -5.381
  464   2HE2  GLN  59          2HE2      GLN  59  -2.191  -3.264  -5.463
  465    H    GLY  60           H        GLY  60  -4.345  -2.205  -3.553
  466   1HA   GLY  60          1HA       GLY  60  -4.961   0.385  -4.736
  467   2HA   GLY  60          2HA       GLY  60  -5.247   0.239  -3.008
  468    H    PHE  61           H        PHE  61  -3.539   2.131  -3.660
  469    HA   PHE  61           HA       PHE  61  -0.928   0.994  -2.930
  470   1HB   PHE  61          1HB       PHE  61  -0.618   1.529  -5.211
  471   2HB   PHE  61          2HB       PHE  61  -1.524   3.031  -5.066
  472    HD1  PHE  61           2HD      PHE  61   1.404   1.512  -3.313
  473    HD2  PHE  61           1HD      PHE  61  -0.223   4.891  -5.326
  474    HE1  PHE  61           2HE      PHE  61   3.505   2.739  -2.945
  475    HE2  PHE  61           1HE      PHE  61   1.876   6.123  -4.962
  476    HZ   PHE  61           HZ       PHE  61   3.743   5.048  -3.769
  477    H    ALA  62           H        ALA  62   0.230   2.117  -1.422
  478    HA   ALA  62           HA       ALA  62  -0.853   4.685  -0.492
  479   1HB   ALA  62          1HB       ALA  62   0.004   3.459   1.830
  480   2HB   ALA  62          2HB       ALA  62  -1.671   3.682   1.321
  481   3HB   ALA  62          3HB       ALA  62  -0.833   2.173   0.960
  482    H    ASN  63           H        ASN  63   0.673   6.187  -0.308
  483    HA   ASN  63           HA       ASN  63   3.469   5.393  -0.490
  484   1HB   ASN  63          1HB       ASN  63   2.577   7.182  -1.965
  485   2HB   ASN  63          2HB       ASN  63   2.250   8.163  -0.539
  486   1HD2  ASN  63          1HD2      ASN  63   4.245   8.001  -2.990
  487   2HD2  ASN  63          2HD2      ASN  63   5.723   8.530  -2.269
  488    H    PHE  64           H        PHE  64   4.552   5.024   1.322
  489    HA   PHE  64           HA       PHE  64   3.680   5.932   3.874
  490   1HB   PHE  64          1HB       PHE  64   5.669   4.123   2.833
  491   2HB   PHE  64          2HB       PHE  64   6.373   5.141   4.085
  492    HD1  PHE  64           2HD      PHE  64   5.028   5.330   6.294
  493    HD2  PHE  64           1HD      PHE  64   4.489   2.232   3.426
  494    HE1  PHE  64           2HE      PHE  64   4.008   3.910   8.025
  495    HE2  PHE  64           1HE      PHE  64   3.467   0.807   5.152
  496    HZ   PHE  64           HZ       PHE  64   3.227   1.645   7.455
  497    H    VAL  65           H        VAL  65   4.140   7.751   4.931
  498    HA   VAL  65           HA       VAL  65   5.451   9.908   3.712
  499    HB   VAL  65           HB       VAL  65   4.768   9.445   6.616
  500   1HG1  VAL  65          1HG1      VAL  65   4.912  12.094   6.478
  501   2HG1  VAL  65          2HG1      VAL  65   6.308  11.098   6.895
  502   3HG1  VAL  65          3HG1      VAL  65   6.117  11.707   5.251
  503   1HG2  VAL  65          1HG2      VAL  65   3.409  11.261   4.641
  504   2HG2  VAL  65          2HG2      VAL  65   2.926   9.581   4.875
  505   3HG2  VAL  65          3HG2      VAL  65   2.824  10.722   6.216
  506    H    LYS  66           H        LYS  66   6.647   7.296   5.638
  507    HA   LYS  66           HA       LYS  66   9.332   8.507   5.560
  508   1HB   LYS  66          1HB       LYS  66   9.778   7.144   7.667
  509   2HB   LYS  66          2HB       LYS  66   8.754   8.562   7.847
  510   1HG   LYS  66          1HG       LYS  66   7.387   6.000   7.306
  511   2HG   LYS  66          2HG       LYS  66   8.149   6.183   8.887
  512   1HD   LYS  66          1HD       LYS  66   6.488   8.434   7.895
  513   2HD   LYS  66          2HD       LYS  66   5.650   6.968   8.409
  514   1HE   LYS  66          1HE       LYS  66   6.406   7.154  10.596
  515   2HE   LYS  66          2HE       LYS  66   7.756   8.194  10.146
  516   1HZ   LYS  66          1HZ       LYS  66   4.895   8.906  10.378
  517   2HZ   LYS  66          2HZ       LYS  66   5.985   9.878   9.526
  518   3HZ   LYS  66          3HZ       LYS  66   6.218   9.595  11.177
  519    H    LYS  67           H        LYS  67  10.904   6.482   6.284
  520    HA   LYS  67           HA       LYS  67  10.600   4.621   4.069
  521   1HB   LYS  67          1HB       LYS  67  12.790   5.848   5.361
  522   2HB   LYS  67          2HB       LYS  67  12.933   4.123   5.675
  523   1HG   LYS  67          1HG       LYS  67  13.982   4.069   3.705
  524   2HG   LYS  67          2HG       LYS  67  12.356   4.133   3.021
  525   1HD   LYS  67          1HD       LYS  67  12.514   6.572   2.877
  526   2HD   LYS  67          2HD       LYS  67  14.137   6.509   3.567
  527   1HE   LYS  67          1HE       LYS  67  13.734   4.785   1.228
  528   2HE   LYS  67          2HE       LYS  67  13.570   6.509   0.903
  529   1HZ   LYS  67          1HZ       LYS  67  15.743   6.906   1.396
  530   2HZ   LYS  67          2HZ       LYS  67  15.888   5.328   0.806
  531   3HZ   LYS  67          3HZ       LYS  67  15.871   5.608   2.474
  532    H    GLN  68           H        GLN  68   9.799   2.645   4.295
  533    HA   GLN  68           HA       GLN  68  10.046   1.292   6.888
  534   1HB   GLN  68          1HB       GLN  68   7.519   1.413   5.232
  535   2HB   GLN  68          2HB       GLN  68   7.737   0.469   6.700
  536   1HG   GLN  68          1HG       GLN  68   8.448   3.065   7.406
  537   2HG   GLN  68          2HG       GLN  68   7.023   3.240   6.383
  538   1HE2  GLN  68          1HE2      GLN  68   7.214   3.795   9.179
  539   2HE2  GLN  68          2HE2      GLN  68   6.104   2.746   9.986
  540    H    THR  69           H        THR  69   9.998  -1.001   6.793
  541    HA   THR  69           HA       THR  69  10.933  -2.034   4.226
  542    HB   THR  69           HB       THR  69  11.899  -3.840   5.387
  543    HG1  THR  69           1HG      THR  69  11.309  -4.394   7.497
  544   1HG2  THR  69          1HG2      THR  69  13.084  -1.753   5.799
  545   2HG2  THR  69          2HG2      THR  69  13.179  -2.797   7.216
  546   3HG2  THR  69          3HG2      THR  69  12.066  -1.430   7.201
  547    H    PHE  70           H        PHE  70  10.298  -4.406   3.806
  548    HA   PHE  70           HA       PHE  70   7.542  -4.505   3.287
  549   1HB   PHE  70          1HB       PHE  70   8.816  -5.814   1.846
  550   2HB   PHE  70          2HB       PHE  70   9.767  -6.508   3.155
  551    HD1  PHE  70           1HD      PHE  70   6.418  -6.537   1.579
  552    HD2  PHE  70           2HD      PHE  70   9.169  -8.552   4.126
  553    HE1  PHE  70           1HE      PHE  70   4.963  -8.522   1.574
  554    HE2  PHE  70           2HE      PHE  70   7.720 -10.540   4.124
  555    HZ   PHE  70           HZ       PHE  70   5.614 -10.527   2.847
  556    H    ASN  71           H        ASN  71   9.471  -6.377   5.629
  557    HA   ASN  71           HA       ASN  71   7.304  -7.689   6.834
  558   1HB   ASN  71          1HB       ASN  71  10.093  -7.640   7.152
  559   2HB   ASN  71          2HB       ASN  71   9.436  -7.191   8.723
  560   1HD2  ASN  71          1HD2      ASN  71   8.562  -9.470   6.142
  561   2HD2  ASN  71          2HD2      ASN  71   8.376 -10.837   7.182
  562    H    LYS  72           H        LYS  72   8.908  -4.634   7.606
  563    HA   LYS  72           HA       LYS  72   7.505  -4.103   9.994
  564   1HB   LYS  72          1HB       LYS  72   9.619  -2.962   8.894
  565   2HB   LYS  72          2HB       LYS  72   8.411  -1.875   8.221
  566   1HG   LYS  72          1HG       LYS  72   8.427  -2.446  11.150
  567   2HG   LYS  72          2HG       LYS  72   9.573  -1.292  10.465
  568   1HD   LYS  72          1HD       LYS  72   7.936   0.208   9.901
  569   2HD   LYS  72          2HD       LYS  72   6.704  -1.042   9.716
  570   1HE   LYS  72          1HE       LYS  72   6.250   0.341  11.668
  571   2HE   LYS  72          2HE       LYS  72   6.618  -1.316  12.145
  572   1HZ   LYS  72          1HZ       LYS  72   8.878   0.504  12.044
  573   2HZ   LYS  72          2HZ       LYS  72   8.500  -0.692  13.179
  574   3HZ   LYS  72          3HZ       LYS  72   7.743   0.819  13.259
  575    H    VAL  73           H        VAL  73   6.947  -3.005   6.655
  576    HA   VAL  73           HA       VAL  73   4.723  -1.412   7.086
  577    HB   VAL  73           HB       VAL  73   5.476  -3.118   4.721
  578   1HG1  VAL  73          1HG1      VAL  73   3.106  -2.938   4.582
  579   2HG1  VAL  73          2HG1      VAL  73   3.149  -1.228   5.019
  580   3HG1  VAL  73          3HG1      VAL  73   3.784  -1.759   3.461
  581   1HG2  VAL  73          1HG2      VAL  73   5.389  -0.138   4.756
  582   2HG2  VAL  73          2HG2      VAL  73   6.731  -0.967   5.545
  583   3HG2  VAL  73          3HG2      VAL  73   6.423  -1.224   3.828
  584    H    LYS  74           H        LYS  74   5.005  -4.866   7.134
  585    HA   LYS  74           HA       LYS  74   2.301  -5.545   6.706
  586   1HB   LYS  74          1HB       LYS  74   4.376  -7.023   8.335
  587   2HB   LYS  74          2HB       LYS  74   2.876  -7.700   7.715
  588   1HG   LYS  74          1HG       LYS  74   4.060  -6.698   5.454
  589   2HG   LYS  74          2HG       LYS  74   5.434  -7.290   6.389
  590   1HD   LYS  74          1HD       LYS  74   4.946  -9.314   5.587
  591   2HD   LYS  74          2HD       LYS  74   3.540  -9.291   6.654
  592   1HE   LYS  74          1HE       LYS  74   2.133  -8.486   4.916
  593   2HE   LYS  74          2HE       LYS  74   3.511  -8.154   3.866
  594   1HZ   LYS  74          1HZ       LYS  74   3.364 -10.195   3.063
  595   2HZ   LYS  74          2HZ       LYS  74   2.007 -10.493   4.028
  596   3HZ   LYS  74          3HZ       LYS  74   3.553 -10.864   4.605
  597    H    TRP  75           H        TRP  75   3.774  -3.917   9.254
  598    HA   TRP  75           HA       TRP  75   2.201  -4.867  11.426
  599   1HB   TRP  75          1HB       TRP  75   3.174  -3.145  12.698
  600   2HB   TRP  75          2HB       TRP  75   4.411  -3.554  11.513
  601    HD1  TRP  75           HD       TRP  75   3.302  -1.855   9.057
  602    HE1  TRP  75           1HE      TRP  75   3.463   0.713   9.125
  603    HE3  TRP  75           3HE      TRP  75   3.738  -1.203  14.109
  604    HZ2  TRP  75           2HZ      TRP  75   3.738   2.746  11.064
  605    HZ3  TRP  75           3HZ      TRP  75   3.946   1.086  14.989
  606    HH2  TRP  75           HH       TRP  75   3.947   3.018  13.496
  607    H    TYR  76           H        TYR  76   1.585  -2.739   8.813
  608    HA   TYR  76           HA       TYR  76  -0.852  -1.754  10.145
  609   1HB   TYR  76          1HB       TYR  76   1.120  -0.456   8.415
  610   2HB   TYR  76          2HB       TYR  76  -0.540  -0.191   7.894
  611    HD1  TYR  76           2HD      TYR  76  -1.909  -0.139  10.543
  612    HD2  TYR  76           1HD      TYR  76   1.739   1.638   9.263
  613    HE1  TYR  76           2HE      TYR  76  -2.169   1.612  12.251
  614    HE2  TYR  76           1HE      TYR  76   1.490   3.393  10.969
  615    HH   TYR  76           HH       TYR  76  -1.336   3.473  13.122
  616    H    LEU  77           H        LEU  77   0.417  -2.758   6.973
  617    HA   LEU  77           HA       LEU  77  -2.151  -3.055   5.790
  618   1HB   LEU  77          1HB       LEU  77   0.567  -4.091   5.016
  619   2HB   LEU  77          2HB       LEU  77  -0.878  -4.331   4.036
  620    HG   LEU  77           HG       LEU  77   0.327  -1.655   4.742
  621   1HD1  LEU  77          1HD1      LEU  77   1.683  -3.073   3.193
  622   2HD1  LEU  77          2HD1      LEU  77   1.117  -1.555   2.497
  623   3HD1  LEU  77          3HD1      LEU  77   0.312  -3.068   2.083
  624   1HD2  LEU  77          1HD2      LEU  77  -2.088  -1.554   4.432
  625   2HD2  LEU  77          2HD2      LEU  77  -1.937  -2.393   2.889
  626   3HD2  LEU  77          3HD2      LEU  77  -1.249  -0.781   3.087
  627    H    GLY  78           H        GLY  78   0.041  -5.226   7.476
  628   1HA   GLY  78          1HA       GLY  78  -0.634  -7.150   8.649
  629   2HA   GLY  78          2HA       GLY  78  -2.138  -7.148   7.742
  630    H    ALA  79           H        ALA  79  -0.315  -9.362   8.259
  631    HA   ALA  79           HA       ALA  79   1.103  -9.928   5.834
  632   1HB   ALA  79          1HB       ALA  79   0.745 -12.343   7.146
  633   2HB   ALA  79          2HB       ALA  79   2.126 -11.256   7.299
  634   3HB   ALA  79          3HB       ALA  79   0.787 -11.147   8.442
  635    H    ARG  80           H        ARG  80  -2.116 -10.462   7.014
  636    HA   ARG  80           HA       ARG  80  -2.960 -12.628   5.525
  637   1HB   ARG  80          1HB       ARG  80  -4.556 -10.125   6.103
  638   2HB   ARG  80          2HB       ARG  80  -5.213 -11.706   5.699
  639   1HG   ARG  80          1HG       ARG  80  -3.652 -11.004   8.176
  640   2HG   ARG  80          2HG       ARG  80  -5.389 -11.297   8.074
  641   1HD   ARG  80          1HD       ARG  80  -3.194 -13.288   7.516
  642   2HD   ARG  80          2HD       ARG  80  -4.250 -13.261   8.928
  643    HE   ARG  80           HE       ARG  80  -4.888 -14.246   6.298
  644   1HH1  ARG  80          1HH1      ARG  80  -6.157 -13.034   9.304
  645   2HH1  ARG  80          2HH1      ARG  80  -7.704 -13.790   9.106
  646   1HH2  ARG  80          1HH2      ARG  80  -6.920 -15.246   6.026
  647   2HH2  ARG  80          2HH2      ARG  80  -8.136 -15.049   7.242
  648    H    CYS  81           H        CYS  81  -2.531  -9.281   4.526
  649    HA   CYS  81           HA       CYS  81  -3.398  -9.974   1.810
  650   1HB   CYS  81          1HB       CYS  81  -3.628  -7.627   1.397
  651   2HB   CYS  81          2HB       CYS  81  -4.380  -7.961   2.953
  652    HG   CYS  81           HG       CYS  81  -1.152  -6.931   2.940
  653    H    HIS  82           H        HIS  82  -2.056  -9.816   0.061
  654    HA   HIS  82           HA       HIS  82   0.766  -9.949   0.593
  655   1HB   HIS  82          1HB       HIS  82  -0.573 -11.283  -1.166
  656   2HB   HIS  82          2HB       HIS  82  -0.469  -9.826  -2.149
  657    HD1  HIS  82           1HD      HIS  82   1.618 -12.607  -0.767
  658    HD2  HIS  82           2HD      HIS  82   2.046  -9.297  -3.241
  659    HE1  HIS  82           1HE      HIS  82   3.870 -12.868  -1.855
  660    H    ILE  83           H        ILE  83   2.191  -8.343   0.507
  661    HA   ILE  83           HA       ILE  83   1.371  -5.823  -0.785
  662    HB   ILE  83           HB       ILE  83   2.791  -4.628   0.790
  663   1HG1  ILE  83          1HG1      ILE  83   3.288  -7.343   2.032
  664   2HG1  ILE  83          2HG1      ILE  83   4.473  -6.383   1.153
  665   1HG2  ILE  83          1HG2      ILE  83   0.474  -4.953   1.403
  666   2HG2  ILE  83          2HG2      ILE  83   0.856  -6.513   2.129
  667   3HG2  ILE  83          3HG2      ILE  83   1.487  -5.030   2.845
  668   1HD1  ILE  83          1HD1      ILE  83   3.157  -5.642   3.754
  669   2HD1  ILE  83          2HD1      ILE  83   4.820  -6.189   3.532
  670   3HD1  ILE  83          3HD1      ILE  83   4.304  -4.640   2.866
  671    H    GLU  84           H        GLU  84   2.875  -4.696  -2.017
  672    HA   GLU  84           HA       GLU  84   5.531  -5.819  -2.390
  673   1HB   GLU  84          1HB       GLU  84   3.564  -6.716  -4.047
  674   2HB   GLU  84          2HB       GLU  84   4.146  -5.321  -4.944
  675   1HG   GLU  84          1HG       GLU  84   6.203  -6.238  -5.318
  676   2HG   GLU  84          2HG       GLU  84   6.139  -7.246  -3.873
  677    H    LYS  85           H        LYS  85   6.866  -4.448  -3.850
  678    HA   LYS  85           HA       LYS  85   6.501  -1.688  -3.170
  679   1HB   LYS  85          1HB       LYS  85   8.569  -3.122  -4.838
  680   2HB   LYS  85          2HB       LYS  85   8.608  -1.390  -4.534
  681   1HG   LYS  85          1HG       LYS  85   8.739  -1.839  -2.119
  682   2HG   LYS  85          2HG       LYS  85   8.767  -3.570  -2.461
  683   1HD   LYS  85          1HD       LYS  85  10.786  -1.621  -3.560
  684   2HD   LYS  85          2HD       LYS  85  11.016  -2.521  -2.059
  685   1HE   LYS  85          1HE       LYS  85  11.802  -4.227  -3.242
  686   2HE   LYS  85          2HE       LYS  85  10.224  -4.390  -4.012
  687   1HZ   LYS  85          1HZ       LYS  85  12.400  -3.961  -5.399
  688   2HZ   LYS  85          2HZ       LYS  85  12.042  -2.346  -5.046
  689   3HZ   LYS  85          3HZ       LYS  85  10.913  -3.302  -5.867
  690    H    ALA  86           H        ALA  86   5.718  -0.066  -4.381
  691    HA   ALA  86           HA       ALA  86   4.482  -0.726  -6.917
  692   1HB   ALA  86          1HB       ALA  86   2.993   0.757  -6.211
  693   2HB   ALA  86          2HB       ALA  86   4.024   1.178  -4.842
  694   3HB   ALA  86          3HB       ALA  86   4.204   2.029  -6.376
  695    H    LYS  87           H        LYS  87   4.766   0.607  -8.827
  696    HA   LYS  87           HA       LYS  87   7.304   2.055  -8.990
  697   1HB   LYS  87          1HB       LYS  87   8.090   0.847 -10.876
  698   2HB   LYS  87          2HB       LYS  87   7.631  -0.358  -9.681
  699   1HG   LYS  87          1HG       LYS  87   5.330   0.029 -11.179
  700   2HG   LYS  87          2HG       LYS  87   6.640   0.060 -12.362
  701   1HD   LYS  87          1HD       LYS  87   7.403  -2.089 -11.703
  702   2HD   LYS  87          2HD       LYS  87   6.378  -2.086 -10.266
  703   1HE   LYS  87          1HE       LYS  87   4.761  -3.068 -11.427
  704   2HE   LYS  87          2HE       LYS  87   4.705  -1.683 -12.515
  705   1HZ   LYS  87          1HZ       LYS  87   6.857  -3.016 -13.412
  706   2HZ   LYS  87          2HZ       LYS  87   5.299  -3.175 -14.052
  707   3HZ   LYS  87          3HZ       LYS  87   5.865  -4.295 -12.917
  708    H    GLY  88           H        GLY  88   7.380   3.646 -10.579
  709   1HA   GLY  88          1HA       GLY  88   6.447   4.605 -12.625
  710   2HA   GLY  88          2HA       GLY  88   4.867   4.072 -12.071
  711    H    THR  89           H        THR  89   4.724   6.523 -12.737
  712    HA   THR  89           HA       THR  89   5.534   8.332 -10.622
  713    HB   THR  89           HB       THR  89   4.706  10.106 -11.976
  714    HG1  THR  89           1HG      THR  89   2.976   9.801 -13.143
  715   1HG2  THR  89          1HG2      THR  89   5.694   8.183 -14.056
  716   2HG2  THR  89          2HG2      THR  89   6.758   8.741 -12.765
  717   3HG2  THR  89          3HG2      THR  89   6.038   9.903 -13.878
  718    H    ASP  90           H        ASP  90   3.756   9.993  -9.962
  719    HA   ASP  90           HA       ASP  90   1.932   8.721  -8.305
  720   1HB   ASP  90          1HB       ASP  90   0.803  10.988  -8.191
  721   2HB   ASP  90          2HB       ASP  90   2.524  10.974  -7.819
  722    H    GLN  91           H        GLN  91   1.494   9.998 -11.567
  723    HA   GLN  91           HA       GLN  91  -1.309   9.562 -11.677
  724   1HB   GLN  91          1HB       GLN  91   0.826  10.104 -13.707
  725   2HB   GLN  91          2HB       GLN  91  -0.779   9.620 -14.241
  726   1HG   GLN  91          1HG       GLN  91  -0.099  12.022 -12.560
  727   2HG   GLN  91          2HG       GLN  91  -0.578  12.023 -14.257
  728   1HE2  GLN  91          1HE2      GLN  91  -2.659  10.280 -14.276
  729   2HE2  GLN  91          2HE2      GLN  91  -3.958  10.893 -13.317
  730    H    GLN  92           H        GLN  92   1.499   7.610 -12.487
  731    HA   GLN  92           HA       GLN  92   0.128   5.560 -13.865
  732   1HB   GLN  92          1HB       GLN  92   2.813   5.968 -12.740
  733   2HB   GLN  92          2HB       GLN  92   2.292   4.289 -12.780
  734   1HG   GLN  92          1HG       GLN  92   1.599   5.193 -15.273
  735   2HG   GLN  92          2HG       GLN  92   3.104   6.051 -14.947
  736   1HE2  GLN  92          1HE2      GLN  92   5.007   4.911 -14.774
  737   2HE2  GLN  92          2HE2      GLN  92   5.149   3.250 -15.226
  738    H    ASN  93           H        ASN  93   0.857   6.091 -10.464
  739    HA   ASN  93           HA       ASN  93  -0.085   3.513  -9.629
  740   1HB   ASN  93          1HB       ASN  93   0.704   6.028  -8.174
  741   2HB   ASN  93          2HB       ASN  93  -0.008   4.663  -7.319
  742   1HD2  ASN  93          1HD2      ASN  93   2.310   4.828  -9.992
  743   2HD2  ASN  93          2HD2      ASN  93   3.557   3.939  -9.192
  744    H    LYS  94           H        LYS  94  -1.376   6.815  -9.560
  745    HA   LYS  94           HA       LYS  94  -3.784   6.227  -8.241
  746   1HB   LYS  94          1HB       LYS  94  -2.957   8.512  -8.506
  747   2HB   LYS  94          2HB       LYS  94  -3.172   8.406 -10.248
  748   1HG   LYS  94          1HG       LYS  94  -5.426   8.669 -10.129
  749   2HG   LYS  94          2HG       LYS  94  -5.544   7.900  -8.544
  750   1HD   LYS  94          1HD       LYS  94  -5.964  10.096  -8.001
  751   2HD   LYS  94          2HD       LYS  94  -4.218  10.019  -7.756
  752   1HE   LYS  94          1HE       LYS  94  -4.329  11.908  -9.026
  753   2HE   LYS  94          2HE       LYS  94  -4.201  10.709 -10.312
  754   1HZ   LYS  94          1HZ       LYS  94  -6.301  11.076 -10.981
  755   2HZ   LYS  94          2HZ       LYS  94  -6.096  12.571 -10.218
  756   3HZ   LYS  94          3HZ       LYS  94  -6.894  11.314  -9.414
  757    H    GLU  95           H        GLU  95  -2.968   6.309 -11.690
  758    HA   GLU  95           HA       GLU  95  -5.604   5.703 -12.580
  759   1HB   GLU  95          1HB       GLU  95  -3.624   6.765 -13.882
  760   2HB   GLU  95          2HB       GLU  95  -3.130   5.103 -14.171
  761   1HG   GLU  95          1HG       GLU  95  -5.923   5.934 -14.793
  762   2HG   GLU  95          2HG       GLU  95  -4.616   6.355 -15.899
  763    H    TYR  96           H        TYR  96  -2.775   3.790 -11.767
  764    HA   TYR  96           HA       TYR  96  -3.500   1.343 -12.868
  765   1HB   TYR  96          1HB       TYR  96  -1.297   1.690 -11.929
  766   2HB   TYR  96          2HB       TYR  96  -1.975   1.933 -10.324
  767    HD1  TYR  96           1HD      TYR  96  -2.927   0.017  -9.079
  768    HD2  TYR  96           2HD      TYR  96  -0.942  -0.506 -12.806
  769    HE1  TYR  96           1HE      TYR  96  -2.700  -2.387  -8.614
  770    HE2  TYR  96           2HE      TYR  96  -0.711  -2.912 -12.352
  771    HH   TYR  96           HH       TYR  96  -1.781  -4.313  -9.279
  772    H    CYS  97           H        CYS  97  -4.174   2.584  -9.598
  773    HA   CYS  97           HA       CYS  97  -5.742   0.357  -8.814
  774   1HB   CYS  97          1HB       CYS  97  -5.882   3.153  -7.678
  775   2HB   CYS  97          2HB       CYS  97  -6.322   1.652  -6.873
  776    HG   CYS  97           HG       CYS  97  -3.482   3.205  -6.800
  777    H    SER  98           H        SER  98  -6.473   3.409 -10.374
  778    HA   SER  98           HA       SER  98  -9.295   3.263 -10.072
  779   1HB   SER  98          1HB       SER  98  -8.026   5.361 -10.579
  780   2HB   SER  98          2HB       SER  98  -7.738   4.742 -12.206
  781    HG   SER  98           HG       SER  98 -10.364   4.851 -11.225
  782    H    LYS  99           H        LYS  99  -7.139   1.500 -11.952
  783    HA   LYS  99           HA       LYS  99  -8.469   1.112 -14.361
  784   1HB   LYS  99          1HB       LYS  99  -7.084  -0.724 -14.693
  785   2HB   LYS  99          2HB       LYS  99  -6.167   0.234 -13.539
  786   1HG   LYS  99          1HG       LYS  99  -5.976  -1.761 -12.509
  787   2HG   LYS  99          2HG       LYS  99  -7.535  -1.291 -11.826
  788   1HD   LYS  99          1HD       LYS  99  -8.701  -2.783 -13.108
  789   2HD   LYS  99          2HD       LYS  99  -7.529  -2.731 -14.427
  790   1HE   LYS  99          1HE       LYS  99  -6.178  -3.792 -12.201
  791   2HE   LYS  99          2HE       LYS  99  -7.745  -4.597 -12.259
  792   1HZ   LYS  99          1HZ       LYS  99  -5.585  -4.602 -14.259
  793   2HZ   LYS  99          2HZ       LYS  99  -7.181  -4.872 -14.749
  794   3HZ   LYS  99          3HZ       LYS  99  -6.456  -5.906 -13.623
  795    H    GLU 100           H        GLU 100  -9.259   0.002 -11.187
  796    HA   GLU 100           HA       GLU 100 -10.948  -2.160 -11.972
  797   1HB   GLU 100          1HB       GLU 100 -11.148  -0.622  -9.389
  798   2HB   GLU 100          2HB       GLU 100 -11.587  -2.298  -9.690
  799   1HG   GLU 100          1HG       GLU 100  -8.801  -1.160  -9.657
  800   2HG   GLU 100          2HG       GLU 100  -9.538  -2.173  -8.417
  801    H    GLY 101           H        GLY 101 -11.334   1.268 -11.717
  802   1HA   GLY 101          1HA       GLY 101 -13.081   2.499 -12.680
  803   2HA   GLY 101          2HA       GLY 101 -14.040   1.029 -12.768
  804    H    ASN 102           H        ASN 102 -13.006   0.807  -9.772
  805    HA   ASN 102           HA       ASN 102 -14.965   2.666  -8.620
  806   1HB   ASN 102          1HB       ASN 102 -15.767   0.197  -8.957
  807   2HB   ASN 102          2HB       ASN 102 -14.754  -0.129  -7.553
  808   1HD2  ASN 102          1HD2      ASN 102 -15.988  -0.313  -5.836
  809   2HD2  ASN 102          2HD2      ASN 102 -17.307   0.719  -5.412
  810    H    LEU 103           H        LEU 103 -14.115   3.814  -7.020
  811    HA   LEU 103           HA       LEU 103 -11.607   2.910  -5.811
  812   1HB   LEU 103          1HB       LEU 103 -12.967   5.598  -5.687
  813   2HB   LEU 103          2HB       LEU 103 -11.381   5.212  -5.023
  814    HG   LEU 103           HG       LEU 103 -12.167   5.365  -7.928
  815   1HD1  LEU 103          1HD1      LEU 103 -11.081   7.335  -8.003
  816   2HD1  LEU 103          2HD1      LEU 103  -9.858   6.830  -6.839
  817   3HD1  LEU 103          3HD1      LEU 103 -11.441   7.366  -6.277
  818   1HD2  LEU 103          1HD2      LEU 103  -9.566   4.451  -6.704
  819   2HD2  LEU 103          2HD2      LEU 103  -9.832   4.778  -8.417
  820   3HD2  LEU 103          3HD2      LEU 103 -10.696   3.459  -7.625
  821    H    LEU 104           H        LEU 104 -11.505   2.191  -3.785
  822    HA   LEU 104           HA       LEU 104 -13.926   2.133  -2.187
  823   1HB   LEU 104          1HB       LEU 104 -11.982   0.315  -2.570
  824   2HB   LEU 104          2HB       LEU 104 -11.394   1.077  -1.093
  825    HG   LEU 104           HG       LEU 104 -12.695  -0.941  -0.627
  826   1HD1  LEU 104          1HD1      LEU 104 -14.441   1.285   0.298
  827   2HD1  LEU 104          2HD1      LEU 104 -12.742   1.283   0.772
  828   3HD1  LEU 104          3HD1      LEU 104 -13.777  -0.081   1.195
  829   1HD2  LEU 104          1HD2      LEU 104 -14.424   0.144  -2.614
  830   2HD2  LEU 104          2HD2      LEU 104 -15.329  -0.028  -1.110
  831   3HD2  LEU 104          3HD2      LEU 104 -14.508  -1.424  -1.809
  832    H    MET 105           H        MET 105 -10.922   3.846  -2.311
  833    HA   MET 105           HA       MET 105 -11.805   5.633  -0.234
  834   1HB   MET 105          1HB       MET 105 -10.809   4.220   1.313
  835   2HB   MET 105          2HB       MET 105  -9.544   3.721   0.198
  836   1HG   MET 105          1HG       MET 105  -8.207   5.465   0.711
  837   2HG   MET 105          2HG       MET 105  -9.558   6.564   0.979
  838   1HE   MET 105          1HE       MET 105  -7.007   4.565   3.985
  839   2HE   MET 105          2HE       MET 105  -7.703   3.359   2.902
  840   3HE   MET 105          3HE       MET 105  -6.817   4.733   2.240
  841    H    GLU 106           H        GLU 106 -11.008   7.652  -0.521
  842    HA   GLU 106           HA       GLU 106  -8.743   7.989  -2.366
  843   1HB   GLU 106          1HB       GLU 106 -11.206   8.420  -3.256
  844   2HB   GLU 106          2HB       GLU 106 -10.976   9.963  -2.445
  845   1HG   GLU 106          1HG       GLU 106  -8.665   9.762  -3.844
  846   2HG   GLU 106          2HG       GLU 106  -9.790   8.932  -4.917
  847    H    CYS 107           H        CYS 107  -7.199   8.769  -1.068
  848    HA   CYS 107           HA       CYS 107  -7.715  11.281   0.316
  849   1HB   CYS 107          1HB       CYS 107  -6.566   8.843   1.688
  850   2HB   CYS 107          2HB       CYS 107  -6.566  10.465   2.370
  851    HG   CYS 107           HG       CYS 107  -9.366  10.643   2.484
  852    H    GLY 108           H        GLY 108  -5.509  12.025   1.361
  853   1HA   GLY 108          1HA       GLY 108  -3.343  12.701   1.004
  854   2HA   GLY 108          2HA       GLY 108  -3.083  11.154   0.212
  855    H    ALA 109           H        ALA 109  -1.652  12.894  -0.949
  856    HA   ALA 109           HA       ALA 109  -3.194  14.039  -3.181
  857   1HB   ALA 109          1HB       ALA 109  -0.632  15.094  -3.319
  858   2HB   ALA 109          2HB       ALA 109  -2.074  15.900  -2.700
  859   3HB   ALA 109          3HB       ALA 109  -0.997  15.049  -1.593
  860    HA   PRO 110           HA       PRO 110  -1.337  11.292  -6.058
  861   1HB   PRO 110          1HB       PRO 110  -1.126  12.879  -8.251
  862   2HB   PRO 110          2HB       PRO 110  -2.671  12.256  -7.661
  863   1HG   PRO 110          1HG       PRO 110  -1.437  14.953  -7.254
  864   2HG   PRO 110          2HG       PRO 110  -3.118  14.538  -7.636
  865   1HD   PRO 110          1HD       PRO 110  -2.306  15.164  -5.130
  866   2HD   PRO 110          2HD       PRO 110  -3.618  14.011  -5.448
  867    H    ARG 111           H        ARG 111   0.674  11.400  -4.659
  868    HA   ARG 111           HA       ARG 111   2.865  12.663  -6.173
  869   1HB   ARG 111          1HB       ARG 111   4.051  13.086  -4.168
  870   2HB   ARG 111          2HB       ARG 111   2.403  13.622  -3.870
  871   1HG   ARG 111          1HG       ARG 111   1.934  11.599  -2.628
  872   2HG   ARG 111          2HG       ARG 111   3.548  10.981  -2.988
  873   1HD   ARG 111          1HD       ARG 111   2.800  13.340  -1.276
  874   2HD   ARG 111          2HD       ARG 111   3.624  11.861  -0.786
  875    HE   ARG 111           HE       ARG 111   5.314  12.895  -2.608
  876   1HH1  ARG 111          1HH1      ARG 111   3.734  14.253   0.181
  877   2HH1  ARG 111          2HH1      ARG 111   5.005  15.384   0.512
  878   1HH2  ARG 111          1HH2      ARG 111   6.993  14.379  -2.183
  879   2HH2  ARG 111          2HH2      ARG 111   6.857  15.455  -0.833
  880    H    SER 112           H        SER 112   4.870  11.515  -6.234
  881    HA   SER 112           HA       SER 112   5.254   8.946  -5.154
  882   1HB   SER 112          1HB       SER 112   3.396   8.602  -6.949
  883   2HB   SER 112          2HB       SER 112   4.717   8.771  -8.105
  884    HG   SER 112           HG       SER 112   4.332   6.584  -7.480
  885    H    GLN 113           H        GLN 113   7.377   9.088  -4.882
  886    HA   GLN 113           HA       GLN 113   9.587   9.497  -5.244
  887   1HB   GLN 113          1HB       GLN 113   9.005   7.678  -6.961
  888   2HB   GLN 113          2HB       GLN 113   9.043   8.967  -8.157
  889   1HG   GLN 113          1HG       GLN 113  11.396   9.441  -7.086
  890   2HG   GLN 113          2HG       GLN 113  11.263   7.751  -6.604
  891   1HE2  GLN 113          1HE2      GLN 113  12.441   9.729  -8.905
  892   2HE2  GLN 113          2HE2      GLN 113  12.477   8.645 -10.249
  893    H    GLY 114           H        GLY 114   9.302  11.757  -4.755
  894   1HA   GLY 114          1HA       GLY 114   9.154  13.562  -7.057
  895   2HA   GLY 114          2HA       GLY 114   9.038  14.028  -5.366
  896    H    GLN 115           H        GLN 115  10.643  15.396  -7.181
  897    HA   GLN 115           HA       GLN 115  13.119  15.400  -5.808
  898   1HB   GLN 115          1HB       GLN 115  12.963  13.531  -7.906
  899   2HB   GLN 115          2HB       GLN 115  13.909  14.877  -8.530
  900   1HG   GLN 115          1HG       GLN 115  15.517  14.664  -6.809
  901   2HG   GLN 115          2HG       GLN 115  14.497  13.550  -5.901
  902   1HE2  GLN 115          1HE2      GLN 115  16.844  12.590  -6.173
  903   2HE2  GLN 115          2HE2      GLN 115  16.981  11.426  -7.442
  904    H    ARG 116           H        ARG 116  11.525  16.198  -8.877
  905    HA   ARG 116           HA       ARG 116  12.951  18.747  -8.966
  906   1HB   ARG 116          1HB       ARG 116  12.082  16.962 -10.937
  907   2HB   ARG 116          2HB       ARG 116  11.014  18.351 -11.082
  908   1HG   ARG 116          1HG       ARG 116  13.222  19.720 -11.014
  909   2HG   ARG 116          2HG       ARG 116  13.967  18.185 -11.466
  910   1HD   ARG 116          1HD       ARG 116  12.635  18.049 -13.449
  911   2HD   ARG 116          2HD       ARG 116  11.667  19.437 -12.955
  912    HE   ARG 116           HE       ARG 116  14.239  19.484 -14.229
  913   1HH1  ARG 116          1HH1      ARG 116  12.044  21.230 -12.166
  914   2HH1  ARG 116          2HH1      ARG 116  12.708  22.783 -12.554
  915   1HH2  ARG 116          1HH2      ARG 116  15.121  21.523 -14.748
  916   2HH2  ARG 116          2HH2      ARG 116  14.457  22.948 -14.024
  Start of MODEL   19
    1    HA   PRO   2           HA       PRO   2  29.846   6.496  18.177
    2   1HB   PRO   2          1HB       PRO   2  31.505   4.492  17.401
    3   2HB   PRO   2          2HB       PRO   2  32.048   6.160  17.616
    4   1HG   PRO   2          1HG       PRO   2  32.304   3.830  19.478
    5   2HG   PRO   2          2HG       PRO   2  33.503   5.070  19.066
    6   1HD   PRO   2          1HD       PRO   2  32.056   5.146  21.354
    7   2HD   PRO   2          2HD       PRO   2  32.586   6.615  20.510
    8    H    SER   3           H        SER   3  29.278   4.592  16.645
    9    HA   SER   3           HA       SER   3  28.361   2.162  17.834
   10   1HB   SER   3          1HB       SER   3  25.923   2.588  17.324
   11   2HB   SER   3          2HB       SER   3  26.565   3.496  18.693
   12    HG   SER   3           HG       SER   3  25.909   4.401  16.109
   13    H    LYS   4           H        LYS   4  28.531   0.671  16.307
   14    HA   LYS   4           HA       LYS   4  28.305   1.510  13.493
   15   1HB   LYS   4          1HB       LYS   4  29.859  -0.765  14.735
   16   2HB   LYS   4          2HB       LYS   4  29.698  -0.509  13.002
   17   1HG   LYS   4          1HG       LYS   4  31.469   0.811  13.062
   18   2HG   LYS   4          2HG       LYS   4  30.578   1.930  14.097
   19   1HD   LYS   4          1HD       LYS   4  31.282   0.182  15.961
   20   2HD   LYS   4          2HD       LYS   4  32.583  -0.147  14.815
   21   1HE   LYS   4          1HE       LYS   4  33.400   2.043  14.941
   22   2HE   LYS   4          2HE       LYS   4  31.907   2.654  15.652
   23   1HZ   LYS   4          1HZ       LYS   4  32.464   1.887  17.713
   24   2HZ   LYS   4          2HZ       LYS   4  34.008   2.232  17.116
   25   3HZ   LYS   4          3HZ       LYS   4  33.443   0.638  17.127
   26    H    LYS   5           H        LYS   5  26.897   0.508  12.158
   27    HA   LYS   5           HA       LYS   5  24.987  -1.317  13.374
   28   1HB   LYS   5          1HB       LYS   5  24.953  -0.160  10.584
   29   2HB   LYS   5          2HB       LYS   5  23.611  -0.909  11.439
   30   1HG   LYS   5          1HG       LYS   5  23.709   0.936  13.097
   31   2HG   LYS   5          2HG       LYS   5  24.941   1.709  12.097
   32   1HD   LYS   5          1HD       LYS   5  23.392   1.897  10.257
   33   2HD   LYS   5          2HD       LYS   5  22.171   0.983  11.145
   34   1HE   LYS   5          1HE       LYS   5  23.054   3.193  12.734
   35   2HE   LYS   5          2HE       LYS   5  22.595   3.771  11.133
   36   1HZ   LYS   5          1HZ       LYS   5  20.440   2.945  11.377
   37   2HZ   LYS   5          2HZ       LYS   5  20.784   3.641  12.879
   38   3HZ   LYS   5          3HZ       LYS   5  20.851   1.961  12.691
   39    H    ASN   6           H        ASN   6  24.094  -2.926  11.493
   40    HA   ASN   6           HA       ASN   6  26.450  -4.464  10.613
   41   1HB   ASN   6          1HB       ASN   6  23.871  -5.339  11.867
   42   2HB   ASN   6          2HB       ASN   6  24.732  -6.436  10.791
   43   1HD2  ASN   6          1HD2      ASN   6  24.694  -4.882  13.865
   44   2HD2  ASN   6          2HD2      ASN   6  26.045  -5.718  14.544
   45    H    GLY   7           H        GLY   7  26.236  -5.690   8.662
   46   1HA   GLY   7          1HA       GLY   7  24.399  -4.403   6.767
   47   2HA   GLY   7          2HA       GLY   7  25.860  -5.284   6.345
   48    H    ARG   8           H        ARG   8  22.877  -5.474   5.629
   49    HA   ARG   8           HA       ARG   8  22.643  -8.374   6.099
   50   1HB   ARG   8          1HB       ARG   8  20.310  -6.512   5.669
   51   2HB   ARG   8          2HB       ARG   8  20.272  -8.183   6.215
   52   1HG   ARG   8          1HG       ARG   8  21.576  -7.368   8.250
   53   2HG   ARG   8          2HG       ARG   8  21.132  -5.743   7.726
   54   1HD   ARG   8          1HD       ARG   8  18.944  -7.721   7.851
   55   2HD   ARG   8          2HD       ARG   8  19.640  -7.233   9.396
   56    HE   ARG   8           HE       ARG   8  19.090  -4.952   7.833
   57   1HH1  ARG   8          1HH1      ARG   8  17.484  -7.445   9.657
   58   2HH1  ARG   8          2HH1      ARG   8  16.110  -6.462  10.039
   59   1HH2  ARG   8          1HH2      ARG   8  17.286  -3.647   8.329
   60   2HH2  ARG   8          2HH2      ARG   8  15.998  -4.302   9.283
   61    H    SER   9           H        SER   9  21.410  -9.534   4.413
   62    HA   SER   9           HA       SER   9  21.874  -8.331   1.762
   63   1HB   SER   9          1HB       SER   9  21.721 -11.097   1.405
   64   2HB   SER   9          2HB       SER   9  23.184 -10.113   1.378
   65    HG   SER   9           HG       SER   9  23.730 -10.887   3.259
   66    H    GLY  10           H        GLY  10  20.158  -8.065   0.489
   67   1HA   GLY  10          1HA       GLY  10  18.152  -9.469  -0.342
   68   2HA   GLY  10          2HA       GLY  10  17.623  -9.301   1.326
   69    HA   PRO  11           HA       PRO  11  15.812  -5.815  -1.142
   70   1HB   PRO  11          1HB       PRO  11  13.306  -6.092  -0.136
   71   2HB   PRO  11          2HB       PRO  11  13.883  -6.997  -1.541
   72   1HG   PRO  11          1HG       PRO  11  13.670  -7.867   1.316
   73   2HG   PRO  11          2HG       PRO  11  13.246  -8.756  -0.159
   74   1HD   PRO  11          1HD       PRO  11  15.559  -9.180   1.184
   75   2HD   PRO  11          2HD       PRO  11  15.433  -9.352  -0.579
   76    H    GLN  12           H        GLN  12  15.603  -3.765  -0.397
   77    HA   GLN  12           HA       GLN  12  15.802  -3.380   2.503
   78   1HB   GLN  12          1HB       GLN  12  16.753  -1.882   0.128
   79   2HB   GLN  12          2HB       GLN  12  16.266  -0.921   1.518
   80   1HG   GLN  12          1HG       GLN  12  17.866  -2.014   2.918
   81   2HG   GLN  12          2HG       GLN  12  18.260  -3.168   1.644
   82   1HE2  GLN  12          1HE2      GLN  12  19.636  -2.583   0.023
   83   2HE2  GLN  12          2HE2      GLN  12  20.518  -1.097   0.012
   84    HA   PRO  13           HA       PRO  13  11.838  -1.552   2.921
   85   1HB   PRO  13          1HB       PRO  13  12.313   0.499   4.635
   86   2HB   PRO  13          2HB       PRO  13  12.338  -1.196   5.135
   87   1HG   PRO  13          1HG       PRO  13  14.626   0.614   4.463
   88   2HG   PRO  13          2HG       PRO  13  14.472  -0.548   5.794
   89   1HD   PRO  13          1HD       PRO  13  15.864  -1.094   3.536
   90   2HD   PRO  13          2HD       PRO  13  15.000  -2.346   4.452
   91    H    HIS  14           H        HIS  14  10.527   0.008   2.055
   92    HA   HIS  14           HA       HIS  14  11.798   2.383   0.886
   93   1HB   HIS  14          1HB       HIS  14   9.918   0.479  -0.520
   94   2HB   HIS  14          2HB       HIS  14  10.319   2.083  -1.129
   95    HD1  HIS  14           1HD      HIS  14  11.703  -1.355  -0.733
   96    HD2  HIS  14           2HD      HIS  14  12.913   2.345  -2.186
   97    HE1  HIS  14           1HE      HIS  14  13.817  -1.797  -2.021
   98    H    LYS  15           H        LYS  15   9.898   3.827  -0.064
   99    HA   LYS  15           HA       LYS  15   7.991   4.141   2.147
  100   1HB   LYS  15          1HB       LYS  15   7.718   6.469   1.188
  101   2HB   LYS  15          2HB       LYS  15   9.295   6.105   1.876
  102   1HG   LYS  15          1HG       LYS  15   9.258   5.449  -0.919
  103   2HG   LYS  15          2HG       LYS  15   8.731   7.115  -0.667
  104   1HD   LYS  15          1HD       LYS  15  10.741   7.600   0.588
  105   2HD   LYS  15          2HD       LYS  15  11.249   5.913   0.484
  106   1HE   LYS  15          1HE       LYS  15  10.672   7.184  -2.098
  107   2HE   LYS  15          2HE       LYS  15  12.031   7.886  -1.221
  108   1HZ   LYS  15          1HZ       LYS  15  12.667   6.058  -2.725
  109   2HZ   LYS  15          2HZ       LYS  15  11.732   4.991  -1.805
  110   3HZ   LYS  15          3HZ       LYS  15  13.076   5.750  -1.112
  111    H    ARG  16           H        ARG  16   7.847   2.407  -0.387
  112    HA   ARG  16           HA       ARG  16   5.101   3.176  -1.058
  113   1HB   ARG  16          1HB       ARG  16   7.217   2.449  -3.091
  114   2HB   ARG  16          2HB       ARG  16   5.509   2.677  -3.442
  115   1HG   ARG  16          1HG       ARG  16   5.834   4.845  -3.718
  116   2HG   ARG  16          2HG       ARG  16   6.465   4.981  -2.076
  117   1HD   ARG  16          1HD       ARG  16   8.612   5.002  -2.766
  118   2HD   ARG  16          2HD       ARG  16   8.319   3.824  -4.044
  119    HE   ARG  16           HE       ARG  16   7.119   6.294  -4.705
  120   1HH1  ARG  16          1HH1      ARG  16  10.231   4.753  -4.457
  121   2HH1  ARG  16          2HH1      ARG  16  10.970   5.758  -5.660
  122   1HH2  ARG  16          1HH2      ARG  16   8.080   7.623  -6.290
  123   2HH2  ARG  16          2HH2      ARG  16   9.745   7.391  -6.701
  124    H    TRP  17           H        TRP  17   3.756   1.513  -0.864
  125    HA   TRP  17           HA       TRP  17   4.617  -1.180  -1.517
  126   1HB   TRP  17          1HB       TRP  17   3.797  -0.355   1.267
  127   2HB   TRP  17          2HB       TRP  17   3.717  -2.025   0.711
  128    HD1  TRP  17           HD       TRP  17   6.155   0.609   1.908
  129    HE1  TRP  17           1HE      TRP  17   8.490  -0.446   2.153
  130    HE3  TRP  17           3HE      TRP  17   5.252  -3.893  -0.340
  131    HZ2  TRP  17           2HZ      TRP  17   9.779  -2.866   1.480
  132    HZ3  TRP  17           3HZ      TRP  17   7.089  -5.522  -0.500
  133    HH2  TRP  17           HH       TRP  17   9.305  -5.017   0.392
  134    H    VAL  18           H        VAL  18   2.985  -2.401  -2.298
  135    HA   VAL  18           HA       VAL  18   0.293  -1.213  -2.240
  136    HB   VAL  18           HB       VAL  18  -0.181  -2.494  -4.270
  137   1HG1  VAL  18          1HG1      VAL  18   2.325  -0.823  -4.389
  138   2HG1  VAL  18          2HG1      VAL  18   1.379  -1.306  -5.799
  139   3HG1  VAL  18          3HG1      VAL  18   0.662  -0.265  -4.568
  140   1HG2  VAL  18          1HG2      VAL  18   2.548  -3.236  -4.903
  141   2HG2  VAL  18          2HG2      VAL  18   1.954  -4.071  -3.467
  142   3HG2  VAL  18          3HG2      VAL  18   1.070  -4.195  -4.987
  143    H    PHE  19           H        PHE  19  -1.534  -2.732  -2.242
  144    HA   PHE  19           HA       PHE  19  -0.958  -5.318  -0.990
  145   1HB   PHE  19          1HB       PHE  19  -2.768  -4.924   0.671
  146   2HB   PHE  19          2HB       PHE  19  -1.397  -3.839   0.876
  147    HD1  PHE  19           1HD      PHE  19  -1.578  -1.485   0.012
  148    HD2  PHE  19           2HD      PHE  19  -4.927  -4.095   0.309
  149    HE1  PHE  19           1HE      PHE  19  -3.093   0.451  -0.097
  150    HE2  PHE  19           2HE      PHE  19  -6.447  -2.164   0.199
  151    HZ   PHE  19           HZ       PHE  19  -5.530   0.113  -0.004
  152    H    THR  20           H        THR  20  -2.467  -6.921  -1.387
  153    HA   THR  20           HA       THR  20  -4.885  -6.272  -2.869
  154    HB   THR  20           HB       THR  20  -4.404  -7.827  -4.697
  155    HG1  THR  20           1HG      THR  20  -2.067  -8.231  -3.199
  156   1HG2  THR  20          1HG2      THR  20  -3.836  -5.419  -4.927
  157   2HG2  THR  20          2HG2      THR  20  -2.820  -6.468  -5.916
  158   3HG2  THR  20          3HG2      THR  20  -2.191  -5.792  -4.414
  159    H    LEU  21           H        LEU  21  -6.508  -7.552  -2.255
  160    HA   LEU  21           HA       LEU  21  -5.913 -10.237  -1.239
  161   1HB   LEU  21          1HB       LEU  21  -6.080  -8.729   0.688
  162   2HB   LEU  21          2HB       LEU  21  -7.681  -8.228   0.150
  163    HG   LEU  21           HG       LEU  21  -8.156 -10.831   0.367
  164   1HD1  LEU  21          1HD1      LEU  21  -5.694 -11.117   1.054
  165   2HD1  LEU  21          2HD1      LEU  21  -6.932 -11.943   1.999
  166   3HD1  LEU  21          3HD1      LEU  21  -6.205 -10.457   2.608
  167   1HD2  LEU  21          1HD2      LEU  21  -8.069  -9.390   2.961
  168   2HD2  LEU  21          2HD2      LEU  21  -9.382 -10.298   2.211
  169   3HD2  LEU  21          3HD2      LEU  21  -9.003  -8.670   1.650
  170    H    ASN  22           H        ASN  22  -7.263 -11.747  -1.989
  171    HA   ASN  22           HA       ASN  22  -9.381 -10.966  -3.781
  172   1HB   ASN  22          1HB       ASN  22  -7.707 -13.000  -3.929
  173   2HB   ASN  22          2HB       ASN  22  -8.936 -13.807  -2.959
  174   1HD2  ASN  22          1HD2      ASN  22 -10.674 -14.610  -3.941
  175   2HD2  ASN  22          2HD2      ASN  22 -11.075 -14.371  -5.605
  176    H    ASN  23           H        ASN  23 -11.503 -10.904  -3.370
  177    HA   ASN  23           HA       ASN  23 -13.439 -10.847  -2.168
  178   1HB   ASN  23          1HB       ASN  23 -13.404 -13.228  -2.688
  179   2HB   ASN  23          2HB       ASN  23 -12.394 -13.545  -1.281
  180   1HD2  ASN  23          1HD2      ASN  23 -15.231 -11.467  -1.641
  181   2HD2  ASN  23          2HD2      ASN  23 -16.191 -12.275  -0.453
  182    HA   PRO  24           HA       PRO  24 -11.163  -9.539   1.699
  183   1HB   PRO  24          1HB       PRO  24 -11.859  -6.920   1.533
  184   2HB   PRO  24          2HB       PRO  24 -10.420  -7.583   0.750
  185   1HG   PRO  24          1HG       PRO  24 -13.107  -6.979  -0.424
  186   2HG   PRO  24          2HG       PRO  24 -11.496  -6.659  -1.093
  187   1HD   PRO  24          1HD       PRO  24 -13.008  -8.764  -1.877
  188   2HD   PRO  24          2HD       PRO  24 -11.235  -8.827  -1.831
  189    H    SER  25           H        SER  25 -12.110  -9.226   3.680
  190    HA   SER  25           HA       SER  25 -14.997  -9.510   3.774
  191   1HB   SER  25          1HB       SER  25 -12.751 -10.103   5.549
  192   2HB   SER  25          2HB       SER  25 -14.118  -9.378   6.395
  193    HG   SER  25           HG       SER  25 -13.879 -11.855   5.223
  194    H    GLU  26           H        GLU  26 -16.292  -8.212   5.280
  195    HA   GLU  26           HA       GLU  26 -16.050  -5.465   4.774
  196   1HB   GLU  26          1HB       GLU  26 -17.900  -7.211   6.108
  197   2HB   GLU  26          2HB       GLU  26 -17.628  -5.782   7.096
  198   1HG   GLU  26          1HG       GLU  26 -17.978  -4.594   4.733
  199   2HG   GLU  26          2HG       GLU  26 -18.935  -6.050   4.462
  200    H    ASP  27           H        ASP  27 -14.862  -7.458   7.372
  201    HA   ASP  27           HA       ASP  27 -14.244  -5.277   9.132
  202   1HB   ASP  27          1HB       ASP  27 -13.571  -8.209   9.107
  203   2HB   ASP  27          2HB       ASP  27 -12.834  -7.116  10.275
  204    H    GLU  28           H        GLU  28 -12.330  -7.413   7.027
  205    HA   GLU  28           HA       GLU  28  -9.847  -6.174   7.550
  206   1HB   GLU  28          1HB       GLU  28 -10.792  -8.341   5.996
  207   2HB   GLU  28          2HB       GLU  28  -9.914  -7.281   4.903
  208   1HG   GLU  28          1HG       GLU  28  -8.818  -8.343   7.496
  209   2HG   GLU  28          2HG       GLU  28  -8.521  -9.056   5.911
  210    H    ARG  29           H        ARG  29 -12.232  -5.727   4.963
  211    HA   ARG  29           HA       ARG  29 -10.771  -3.835   3.480
  212   1HB   ARG  29          1HB       ARG  29 -12.705  -5.022   2.562
  213   2HB   ARG  29          2HB       ARG  29 -13.763  -4.203   3.703
  214   1HG   ARG  29          1HG       ARG  29 -12.621  -2.075   2.523
  215   2HG   ARG  29          2HG       ARG  29 -12.566  -3.236   1.194
  216   1HD   ARG  29          1HD       ARG  29 -15.098  -2.973   2.731
  217   2HD   ARG  29          2HD       ARG  29 -14.669  -1.681   1.610
  218    HE   ARG  29           HE       ARG  29 -14.512  -4.329   0.484
  219   1HH1  ARG  29          1HH1      ARG  29 -16.550  -1.575   1.104
  220   2HH1  ARG  29          2HH1      ARG  29 -17.663  -1.947  -0.170
  221   1HH2  ARG  29          1HH2      ARG  29 -15.970  -4.829  -1.197
  222   2HH2  ARG  29          2HH2      ARG  29 -17.333  -3.799  -1.478
  223    H    LYS  30           H        LYS  30 -13.020  -3.504   6.174
  224    HA   LYS  30           HA       LYS  30 -13.168  -0.665   6.088
  225   1HB   LYS  30          1HB       LYS  30 -13.925  -2.776   8.065
  226   2HB   LYS  30          2HB       LYS  30 -13.875  -1.099   8.592
  227   1HG   LYS  30          1HG       LYS  30 -15.338  -1.619   6.087
  228   2HG   LYS  30          2HG       LYS  30 -16.053  -2.277   7.561
  229   1HD   LYS  30          1HD       LYS  30 -15.127   0.433   7.958
  230   2HD   LYS  30          2HD       LYS  30 -16.265   0.335   6.613
  231   1HE   LYS  30          1HE       LYS  30 -17.887  -0.775   8.039
  232   2HE   LYS  30          2HE       LYS  30 -16.742  -0.774   9.379
  233   1HZ   LYS  30          1HZ       LYS  30 -18.490   1.299   8.494
  234   2HZ   LYS  30          2HZ       LYS  30 -16.891   1.841   8.590
  235   3HZ   LYS  30          3HZ       LYS  30 -17.636   1.162   9.948
  236    H    LYS  31           H        LYS  31 -11.068  -2.964   7.712
  237    HA   LYS  31           HA       LYS  31  -9.826  -1.210   9.513
  238   1HB   LYS  31          1HB       LYS  31  -9.510  -3.554   9.803
  239   2HB   LYS  31          2HB       LYS  31  -8.868  -3.738   8.176
  240   1HG   LYS  31          1HG       LYS  31  -6.890  -2.448   8.812
  241   2HG   LYS  31          2HG       LYS  31  -7.534  -2.276  10.447
  242   1HD   LYS  31          1HD       LYS  31  -6.886  -4.339  11.031
  243   2HD   LYS  31          2HD       LYS  31  -7.466  -5.042   9.520
  244   1HE   LYS  31          1HE       LYS  31  -5.105  -5.368   9.610
  245   2HE   LYS  31          2HE       LYS  31  -5.425  -4.120   8.406
  246   1HZ   LYS  31          1HZ       LYS  31  -4.527  -2.497   9.713
  247   2HZ   LYS  31          2HZ       LYS  31  -3.569  -3.805  10.192
  248   3HZ   LYS  31          3HZ       LYS  31  -4.858  -3.301  11.164
  249    H    ILE  32           H        ILE  32  -8.791  -2.240   6.263
  250    HA   ILE  32           HA       ILE  32  -6.515  -0.583   6.148
  251    HB   ILE  32           HB       ILE  32  -8.167  -1.952   4.051
  252   1HG1  ILE  32          1HG1      ILE  32  -5.262  -2.222   4.855
  253   2HG1  ILE  32          2HG1      ILE  32  -6.566  -3.240   5.457
  254   1HG2  ILE  32          1HG2      ILE  32  -6.377  -1.216   2.419
  255   2HG2  ILE  32          2HG2      ILE  32  -7.541   0.015   2.907
  256   3HG2  ILE  32          3HG2      ILE  32  -5.925   0.002   3.612
  257   1HD1  ILE  32          1HD1      ILE  32  -6.581  -3.193   2.588
  258   2HD1  ILE  32          2HD1      ILE  32  -4.991  -3.652   3.197
  259   3HD1  ILE  32          3HD1      ILE  32  -6.419  -4.560   3.691
  260    H    ARG  33           H        ARG  33  -9.854  -0.097   5.079
  261    HA   ARG  33           HA       ARG  33  -9.380   2.436   3.874
  262   1HB   ARG  33          1HB       ARG  33 -11.299   1.185   3.176
  263   2HB   ARG  33          2HB       ARG  33 -11.900   1.076   4.825
  264   1HG   ARG  33          1HG       ARG  33 -12.622   3.273   4.847
  265   2HG   ARG  33          2HG       ARG  33 -11.550   3.743   3.526
  266   1HD   ARG  33          1HD       ARG  33 -13.525   3.657   2.391
  267   2HD   ARG  33          2HD       ARG  33 -13.010   1.982   2.199
  268    HE   ARG  33           HE       ARG  33 -14.796   1.339   3.466
  269   1HH1  ARG  33          1HH1      ARG  33 -14.196   4.724   4.012
  270   2HH1  ARG  33          2HH1      ARG  33 -15.615   4.954   4.979
  271   1HH2  ARG  33          1HH2      ARG  33 -16.667   1.628   4.738
  272   2HH2  ARG  33          2HH2      ARG  33 -17.019   3.191   5.392
  273    H    ASP  34           H        ASP  34  -9.815   1.388   7.112
  274    HA   ASP  34           HA       ASP  34 -10.454   4.094   8.035
  275   1HB   ASP  34          1HB       ASP  34 -10.465   1.410   9.415
  276   2HB   ASP  34          2HB       ASP  34 -10.660   2.927  10.287
  277    H    LEU  35           H        LEU  35  -7.769   2.684   7.123
  278    HA   LEU  35           HA       LEU  35  -6.026   2.831   9.338
  279   1HB   LEU  35          1HB       LEU  35  -5.678   2.794   6.375
  280   2HB   LEU  35          2HB       LEU  35  -4.295   3.171   7.401
  281    HG   LEU  35           HG       LEU  35  -5.918   0.637   7.603
  282   1HD1  LEU  35          1HD1      LEU  35  -3.262   1.109   6.257
  283   2HD1  LEU  35          2HD1      LEU  35  -4.788   0.762   5.444
  284   3HD1  LEU  35          3HD1      LEU  35  -4.048  -0.454   6.484
  285   1HD2  LEU  35          1HD2      LEU  35  -4.785   1.269   9.665
  286   2HD2  LEU  35          2HD2      LEU  35  -3.263   1.439   8.790
  287   3HD2  LEU  35          3HD2      LEU  35  -4.023  -0.146   8.939
  288    HA   PRO  36           HA       PRO  36  -5.151   7.103   9.824
  289   1HB   PRO  36          1HB       PRO  36  -2.475   7.105  10.281
  290   2HB   PRO  36          2HB       PRO  36  -3.650   6.513  11.461
  291   1HG   PRO  36          1HG       PRO  36  -1.957   4.968   9.535
  292   2HG   PRO  36          2HG       PRO  36  -2.313   4.624  11.238
  293   1HD   PRO  36          1HD       PRO  36  -3.582   3.368   9.202
  294   2HD   PRO  36          2HD       PRO  36  -4.374   3.711  10.754
  295    H    ILE  37           H        ILE  37  -5.259   8.510   8.193
  296    HA   ILE  37           HA       ILE  37  -3.930   8.158   5.710
  297    HB   ILE  37           HB       ILE  37  -4.705  10.503   5.241
  298   1HG1  ILE  37          1HG1      ILE  37  -5.991  10.231   7.967
  299   2HG1  ILE  37          2HG1      ILE  37  -4.631  11.286   7.596
  300   1HG2  ILE  37          1HG2      ILE  37  -7.198   9.381   6.118
  301   2HG2  ILE  37          2HG2      ILE  37  -6.550   9.528   4.485
  302   3HG2  ILE  37          3HG2      ILE  37  -6.154   8.117   5.467
  303   1HD1  ILE  37          1HD1      ILE  37  -7.492  11.617   7.035
  304   2HD1  ILE  37          2HD1      ILE  37  -6.240  12.822   7.337
  305   3HD1  ILE  37          3HD1      ILE  37  -6.401  12.101   5.736
  306    H    SER  38           H        SER  38  -3.219   9.994   8.610
  307    HA   SER  38           HA       SER  38  -1.168  11.611   7.516
  308   1HB   SER  38          1HB       SER  38  -1.256  10.745  10.398
  309   2HB   SER  38          2HB       SER  38  -0.707  12.280   9.726
  310    HG   SER  38           HG       SER  38  -2.655  12.960  10.063
  311    H    LEU  39           H        LEU  39  -1.291   8.315   8.469
  312    HA   LEU  39           HA       LEU  39   1.491   7.963   9.001
  313   1HB   LEU  39          1HB       LEU  39  -0.694   6.478   9.488
  314   2HB   LEU  39          2HB       LEU  39  -0.103   5.669   8.038
  315    HG   LEU  39           HG       LEU  39   1.885   6.133  10.175
  316   1HD1  LEU  39          1HD1      LEU  39  -0.143   5.497  11.439
  317   2HD1  LEU  39          2HD1      LEU  39   1.138   4.288  11.526
  318   3HD1  LEU  39          3HD1      LEU  39  -0.250   4.027  10.470
  319   1HD2  LEU  39          1HD2      LEU  39   1.490   4.459   7.882
  320   2HD2  LEU  39          2HD2      LEU  39   1.781   3.464   9.309
  321   3HD2  LEU  39          3HD2      LEU  39   2.946   4.707   8.847
  322    H    PHE  40           H        PHE  40  -0.501   7.918   6.147
  323    HA   PHE  40           HA       PHE  40   1.892   7.302   4.543
  324   1HB   PHE  40          1HB       PHE  40  -0.897   6.676   3.608
  325   2HB   PHE  40          2HB       PHE  40   0.632   6.035   3.015
  326    HD1  PHE  40           2HD      PHE  40  -1.876   5.847   5.683
  327    HD2  PHE  40           1HD      PHE  40   1.708   4.190   4.094
  328    HE1  PHE  40           2HE      PHE  40  -2.134   3.889   7.151
  329    HE2  PHE  40           1HE      PHE  40   1.455   2.229   5.558
  330    HZ   PHE  40           HZ       PHE  40  -0.467   2.077   7.091
  331    H    ASP  41           H        ASP  41   2.536   9.027   3.455
  332    HA   ASP  41           HA       ASP  41   1.194  11.426   3.205
  333   1HB   ASP  41          1HB       ASP  41   3.673  10.797   2.699
  334   2HB   ASP  41          2HB       ASP  41   3.089  10.524   1.059
  335    H    TYR  42           H        TYR  42   0.924   8.549   1.271
  336    HA   TYR  42           HA       TYR  42  -1.269   9.794  -0.213
  337   1HB   TYR  42          1HB       TYR  42   0.677   9.974  -1.684
  338   2HB   TYR  42          2HB       TYR  42   0.988   8.250  -1.510
  339    HD1  TYR  42           1HD      TYR  42  -2.313   9.876  -1.988
  340    HD2  TYR  42           2HD      TYR  42   0.766   7.516  -3.735
  341    HE1  TYR  42           1HE      TYR  42  -3.765   9.425  -3.922
  342    HE2  TYR  42           2HE      TYR  42  -0.677   7.059  -5.674
  343    HH   TYR  42           HH       TYR  42  -3.941   8.444  -5.903
  344    H    PHE  43           H        PHE  43  -3.017   8.557  -0.137
  345    HA   PHE  43           HA       PHE  43  -2.695   5.643   0.056
  346   1HB   PHE  43          1HB       PHE  43  -3.353   7.074   2.239
  347   2HB   PHE  43          2HB       PHE  43  -4.957   6.848   1.550
  348    HD1  PHE  43           1HD      PHE  43  -4.015   4.085   0.290
  349    HD2  PHE  43           2HD      PHE  43  -4.020   5.768   4.200
  350    HE1  PHE  43           1HE      PHE  43  -4.112   1.825   1.260
  351    HE2  PHE  43           2HE      PHE  43  -4.116   3.512   5.175
  352    HZ   PHE  43           HZ       PHE  43  -4.161   1.536   3.705
  353    H    ILE  44           H        ILE  44  -3.632   4.774  -1.661
  354    HA   ILE  44           HA       ILE  44  -6.263   5.768  -2.495
  355    HB   ILE  44           HB       ILE  44  -4.912   6.807  -4.112
  356   1HG1  ILE  44          1HG1      ILE  44  -5.341   4.345  -5.700
  357   2HG1  ILE  44          2HG1      ILE  44  -6.750   4.967  -4.848
  358   1HG2  ILE  44          1HG2      ILE  44  -3.316   4.273  -4.055
  359   2HG2  ILE  44          2HG2      ILE  44  -3.207   5.387  -5.417
  360   3HG2  ILE  44          3HG2      ILE  44  -2.778   5.933  -3.796
  361   1HD1  ILE  44          1HD1      ILE  44  -5.478   7.150  -6.118
  362   2HD1  ILE  44          2HD1      ILE  44  -5.626   5.842  -7.292
  363   3HD1  ILE  44          3HD1      ILE  44  -7.058   6.444  -6.456
  364    H    VAL  45           H        VAL  45  -7.643   4.135  -2.388
  365    HA   VAL  45           HA       VAL  45  -6.677   1.425  -3.035
  366    HB   VAL  45           HB       VAL  45  -9.054   1.930  -1.273
  367   1HG1  VAL  45          1HG1      VAL  45  -7.547  -0.360  -2.212
  368   2HG1  VAL  45          2HG1      VAL  45  -7.674  -0.329  -0.452
  369   3HG1  VAL  45          3HG1      VAL  45  -9.133  -0.290  -1.444
  370   1HG2  VAL  45          1HG2      VAL  45  -7.423   1.530   0.648
  371   2HG2  VAL  45          2HG2      VAL  45  -6.151   1.959  -0.496
  372   3HG2  VAL  45          3HG2      VAL  45  -7.411   3.128  -0.097
  373    H    GLY  46           H        GLY  46  -7.992   0.088  -4.275
  374   1HA   GLY  46          1HA       GLY  46 -10.462   1.267  -5.348
  375   2HA   GLY  46          2HA       GLY  46  -9.209   0.749  -6.466
  376    H    GLU  47           H        GLU  47 -12.071  -0.150  -5.706
  377    HA   GLU  47           HA       GLU  47 -11.476  -2.983  -5.207
  378   1HB   GLU  47          1HB       GLU  47 -13.070  -2.104  -3.646
  379   2HB   GLU  47          2HB       GLU  47 -14.025  -1.391  -4.938
  380   1HG   GLU  47          1HG       GLU  47 -14.574  -3.635  -5.757
  381   2HG   GLU  47          2HG       GLU  47 -13.647  -4.333  -4.430
  382    H    GLU  48           H        GLU  48 -11.856  -4.507  -6.710
  383    HA   GLU  48           HA       GLU  48 -13.065  -3.624  -9.248
  384   1HB   GLU  48          1HB       GLU  48 -10.571  -4.350  -9.118
  385   2HB   GLU  48          2HB       GLU  48 -11.221  -5.980  -9.021
  386   1HG   GLU  48          1HG       GLU  48 -12.393  -5.624 -11.147
  387   2HG   GLU  48          2HG       GLU  48 -11.687  -4.012 -11.249
  388    H    GLY  49           H        GLY  49 -15.114  -4.311  -9.292
  389   1HA   GLY  49          1HA       GLY  49 -15.618  -7.164  -9.117
  390   2HA   GLY  49          2HA       GLY  49 -16.427  -6.190  -7.899
  391    H    ASN  50           H        ASN  50 -15.951  -6.366 -11.422
  392    HA   ASN  50           HA       ASN  50 -18.754  -5.508 -11.731
  393   1HB   ASN  50          1HB       ASN  50 -16.493  -4.172 -12.655
  394   2HB   ASN  50          2HB       ASN  50 -17.098  -5.021 -14.074
  395   1HD2  ASN  50          1HD2      ASN  50 -18.515  -3.294 -11.312
  396   2HD2  ASN  50          2HD2      ASN  50 -19.578  -2.313 -12.256
  397    H    GLU  51           H        GLU  51 -17.727  -8.211 -11.480
  398    HA   GLU  51           HA       GLU  51 -18.675  -9.252 -14.057
  399   1HB   GLU  51          1HB       GLU  51 -16.024  -9.444 -13.171
  400   2HB   GLU  51          2HB       GLU  51 -16.726 -11.025 -12.861
  401   1HG   GLU  51          1HG       GLU  51 -17.245 -11.359 -15.126
  402   2HG   GLU  51          2HG       GLU  51 -16.991  -9.659 -15.517
  403    H    GLU  52           H        GLU  52 -20.543 -10.202 -13.578
  404    HA   GLU  52           HA       GLU  52 -21.269 -11.162 -11.035
  405   1HB   GLU  52          1HB       GLU  52 -22.860 -10.473 -12.836
  406   2HB   GLU  52          2HB       GLU  52 -22.466 -11.957 -13.694
  407   1HG   GLU  52          1HG       GLU  52 -23.242 -12.447 -10.943
  408   2HG   GLU  52          2HG       GLU  52 -24.492 -11.609 -11.861
  409    H    GLY  53           H        GLY  53 -21.451 -13.246 -10.208
  410   1HA   GLY  53          1HA       GLY  53 -21.193 -15.587 -10.223
  411   2HA   GLY  53          2HA       GLY  53 -20.362 -15.463 -11.767
  412    H    ARG  54           H        ARG  54 -18.734 -13.200 -10.481
  413    HA   ARG  54           HA       ARG  54 -16.853 -14.970  -9.064
  414   1HB   ARG  54          1HB       ARG  54 -16.126 -14.078 -11.309
  415   2HB   ARG  54          2HB       ARG  54 -16.152 -12.468 -10.600
  416   1HG   ARG  54          1HG       ARG  54 -13.900 -13.383 -10.644
  417   2HG   ARG  54          2HG       ARG  54 -14.456 -13.138  -8.987
  418   1HD   ARG  54          1HD       ARG  54 -13.269 -15.288  -9.320
  419   2HD   ARG  54          2HD       ARG  54 -14.924 -15.483  -8.742
  420    HE   ARG  54           HE       ARG  54 -14.734 -15.620 -11.591
  421   1HH1  ARG  54          1HH1      ARG  54 -14.339 -17.434  -8.646
  422   2HH1  ARG  54          2HH1      ARG  54 -14.621 -18.968  -9.399
  423   1HH2  ARG  54          1HH2      ARG  54 -15.107 -17.635 -12.595
  424   2HH2  ARG  54          2HH2      ARG  54 -15.057 -19.081 -11.646
  425    H    THR  55           H        THR  55 -15.589 -14.034  -7.359
  426    HA   THR  55           HA       THR  55 -17.125 -12.151  -5.783
  427    HB   THR  55           HB       THR  55 -14.826 -12.648  -4.344
  428    HG1  THR  55           1HG      THR  55 -14.567 -14.957  -4.593
  429   1HG2  THR  55          1HG2      THR  55 -17.608 -13.406  -4.303
  430   2HG2  THR  55          2HG2      THR  55 -16.510 -13.109  -2.955
  431   3HG2  THR  55          3HG2      THR  55 -16.598 -14.712  -3.685
  432    HA   PRO  56           HA       PRO  56 -14.758  -8.526  -6.505
  433   1HB   PRO  56          1HB       PRO  56 -14.669  -7.399  -4.037
  434   2HB   PRO  56          2HB       PRO  56 -16.139  -7.449  -5.017
  435   1HG   PRO  56          1HG       PRO  56 -15.308  -9.227  -2.757
  436   2HG   PRO  56          2HG       PRO  56 -16.897  -8.516  -3.095
  437   1HD   PRO  56          1HD       PRO  56 -16.293 -11.086  -3.696
  438   2HD   PRO  56          2HD       PRO  56 -17.418 -10.117  -4.670
  439    H    HIS  57           H        HIS  57 -12.764  -7.380  -5.980
  440    HA   HIS  57           HA       HIS  57 -10.833  -8.891  -4.381
  441   1HB   HIS  57          1HB       HIS  57 -10.408  -9.749  -6.566
  442   2HB   HIS  57          2HB       HIS  57 -10.502  -8.145  -7.287
  443    HD1  HIS  57           1HD      HIS  57  -8.370  -6.825  -7.429
  444    HD2  HIS  57           2HD      HIS  57  -8.013 -10.184  -5.010
  445    HE1  HIS  57           1HE      HIS  57  -5.920  -7.010  -6.893
  446    H    LEU  58           H        LEU  58  -9.332  -7.651  -3.352
  447    HA   LEU  58           HA       LEU  58  -9.726  -4.763  -3.510
  448   1HB   LEU  58          1HB       LEU  58  -9.282  -6.555  -1.414
  449   2HB   LEU  58          2HB       LEU  58  -7.792  -5.623  -1.550
  450    HG   LEU  58           HG       LEU  58 -10.566  -4.569  -1.024
  451   1HD1  LEU  58          1HD1      LEU  58  -8.048  -4.778   0.600
  452   2HD1  LEU  58          2HD1      LEU  58  -9.650  -5.414   0.970
  453   3HD1  LEU  58          3HD1      LEU  58  -9.359  -3.675   1.020
  454   1HD2  LEU  58          1HD2      LEU  58  -9.888  -2.729  -2.098
  455   2HD2  LEU  58          2HD2      LEU  58  -8.208  -3.264  -2.149
  456   3HD2  LEU  58          3HD2      LEU  58  -8.838  -2.469  -0.705
  457    H    GLN  59           H        GLN  59  -8.243  -3.363  -4.263
  458    HA   GLN  59           HA       GLN  59  -5.473  -4.139  -4.579
  459   1HB   GLN  59          1HB       GLN  59  -6.258  -5.025  -6.636
  460   2HB   GLN  59          2HB       GLN  59  -7.284  -3.628  -6.932
  461   1HG   GLN  59          1HG       GLN  59  -5.367  -3.558  -8.382
  462   2HG   GLN  59          2HG       GLN  59  -5.282  -2.238  -7.217
  463   1HE2  GLN  59          1HE2      GLN  59  -3.710  -2.268  -5.625
  464   2HE2  GLN  59          2HE2      GLN  59  -2.347  -3.328  -5.688
  465    H    GLY  60           H        GLY  60  -4.473  -2.458  -3.689
  466   1HA   GLY  60          1HA       GLY  60  -4.983   0.208  -4.742
  467   2HA   GLY  60          2HA       GLY  60  -5.294  -0.010  -3.026
  468    H    PHE  61           H        PHE  61  -3.499   1.845  -3.613
  469    HA   PHE  61           HA       PHE  61  -0.946   0.575  -2.893
  470   1HB   PHE  61          1HB       PHE  61  -0.579   1.190  -5.142
  471   2HB   PHE  61          2HB       PHE  61  -1.442   2.713  -4.954
  472    HD1  PHE  61           2HD      PHE  61   1.426   1.029  -3.252
  473    HD2  PHE  61           1HD      PHE  61  -0.094   4.552  -5.095
  474    HE1  PHE  61           2HE      PHE  61   3.558   2.176  -2.811
  475    HE2  PHE  61           1HE      PHE  61   2.036   5.704  -4.658
  476    HZ   PHE  61           HZ       PHE  61   3.864   4.516  -3.513
  477    H    ALA  62           H        ALA  62   0.244   1.592  -1.333
  478    HA   ALA  62           HA       ALA  62  -0.746   4.160  -0.307
  479   1HB   ALA  62          1HB       ALA  62   0.064   2.730   1.950
  480   2HB   ALA  62          2HB       ALA  62  -1.583   3.175   1.499
  481   3HB   ALA  62          3HB       ALA  62  -0.929   1.610   1.017
  482    H    ASN  63           H        ASN  63   0.838   5.587  -0.037
  483    HA   ASN  63           HA       ASN  63   3.602   4.673  -0.200
  484   1HB   ASN  63          1HB       ASN  63   2.840   6.519  -1.665
  485   2HB   ASN  63          2HB       ASN  63   2.493   7.489  -0.237
  486   1HD2  ASN  63          1HD2      ASN  63   4.600   7.210  -2.617
  487   2HD2  ASN  63          2HD2      ASN  63   6.057   7.711  -1.834
  488    H    PHE  64           H        PHE  64   4.631   4.228   1.627
  489    HA   PHE  64           HA       PHE  64   3.744   5.114   4.178
  490   1HB   PHE  64          1HB       PHE  64   5.729   3.288   3.130
  491   2HB   PHE  64          2HB       PHE  64   6.392   4.239   4.455
  492    HD1  PHE  64           2HD      PHE  64   4.986   4.346   6.616
  493    HD2  PHE  64           1HD      PHE  64   4.449   1.416   3.576
  494    HE1  PHE  64           2HE      PHE  64   3.859   2.876   8.236
  495    HE2  PHE  64           1HE      PHE  64   3.320  -0.058   5.190
  496    HZ   PHE  64           HZ       PHE  64   3.025   0.671   7.524
  497    H    VAL  65           H        VAL  65   4.241   6.892   5.287
  498    HA   VAL  65           HA       VAL  65   5.634   9.038   4.141
  499    HB   VAL  65           HB       VAL  65   4.921   8.539   7.033
  500   1HG1  VAL  65          1HG1      VAL  65   5.068  11.232   6.787
  501   2HG1  VAL  65          2HG1      VAL  65   6.371  10.218   7.412
  502   3HG1  VAL  65          3HG1      VAL  65   6.381  10.728   5.724
  503   1HG2  VAL  65          1HG2      VAL  65   3.083   8.699   5.285
  504   2HG2  VAL  65          2HG2      VAL  65   2.978   9.816   6.646
  505   3HG2  VAL  65          3HG2      VAL  65   3.566  10.383   5.083
  506    H    LYS  66           H        LYS  66   6.730   6.332   5.980
  507    HA   LYS  66           HA       LYS  66   9.444   7.475   6.002
  508   1HB   LYS  66          1HB       LYS  66   7.969   6.005   8.154
  509   2HB   LYS  66          2HB       LYS  66   9.718   5.853   8.047
  510   1HG   LYS  66          1HG       LYS  66   9.508   7.593   9.519
  511   2HG   LYS  66          2HG       LYS  66   9.654   8.461   7.989
  512   1HD   LYS  66          1HD       LYS  66   7.855   9.502   9.050
  513   2HD   LYS  66          2HD       LYS  66   7.085   8.375   7.931
  514   1HE   LYS  66          1HE       LYS  66   5.966   7.534   9.657
  515   2HE   LYS  66          2HE       LYS  66   7.496   6.925  10.284
  516   1HZ   LYS  66          1HZ       LYS  66   5.949   8.559  11.653
  517   2HZ   LYS  66          2HZ       LYS  66   6.865   9.718  10.830
  518   3HZ   LYS  66          3HZ       LYS  66   7.633   8.571  11.808
  519    H    LYS  67           H        LYS  67  10.980   5.421   6.626
  520    HA   LYS  67           HA       LYS  67  10.658   3.643   4.353
  521   1HB   LYS  67          1HB       LYS  67  12.925   3.636   6.340
  522   2HB   LYS  67          2HB       LYS  67  12.930   3.028   4.690
  523   1HG   LYS  67          1HG       LYS  67  12.712   5.921   5.496
  524   2HG   LYS  67          2HG       LYS  67  14.161   5.121   4.881
  525   1HD   LYS  67          1HD       LYS  67  12.914   4.597   2.794
  526   2HD   LYS  67          2HD       LYS  67  11.558   5.542   3.413
  527   1HE   LYS  67          1HE       LYS  67  12.554   7.213   2.270
  528   2HE   LYS  67          2HE       LYS  67  13.553   7.324   3.718
  529   1HZ   LYS  67          1HZ       LYS  67  15.313   6.289   2.693
  530   2HZ   LYS  67          2HZ       LYS  67  14.668   7.181   1.409
  531   3HZ   LYS  67          3HZ       LYS  67  14.349   5.524   1.531
  532    H    GLN  68           H        GLN  68   9.746   1.711   4.501
  533    HA   GLN  68           HA       GLN  68   9.921   0.249   7.045
  534   1HB   GLN  68          1HB       GLN  68   7.456   0.483   5.311
  535   2HB   GLN  68          2HB       GLN  68   7.604  -0.530   6.741
  536   1HG   GLN  68          1HG       GLN  68   8.338   2.010   7.596
  537   2HG   GLN  68          2HG       GLN  68   6.963   2.270   6.525
  538   1HE2  GLN  68          1HE2      GLN  68   7.007   2.717   9.326
  539   2HE2  GLN  68          2HE2      GLN  68   5.856   1.647  10.045
  540    H    THR  69           H        THR  69   9.836  -2.039   6.872
  541    HA   THR  69           HA       THR  69  10.859  -3.005   4.316
  542    HB   THR  69           HB       THR  69  11.665  -4.920   5.466
  543    HG1  THR  69           1HG      THR  69  10.855  -5.613   7.350
  544   1HG2  THR  69          1HG2      THR  69  12.967  -3.954   7.330
  545   2HG2  THR  69          2HG2      THR  69  11.953  -2.512   7.267
  546   3HG2  THR  69          3HG2      THR  69  12.983  -2.927   5.897
  547    H    PHE  70           H        PHE  70  10.180  -5.322   3.746
  548    HA   PHE  70           HA       PHE  70   7.443  -5.323   3.114
  549   1HB   PHE  70          1HB       PHE  70   8.756  -6.571   1.648
  550   2HB   PHE  70          2HB       PHE  70   9.625  -7.374   2.952
  551    HD1  PHE  70           1HD      PHE  70   6.295  -7.167   1.325
  552    HD2  PHE  70           2HD      PHE  70   8.985  -9.491   3.666
  553    HE1  PHE  70           1HE      PHE  70   4.788  -9.102   1.129
  554    HE2  PHE  70           2HE      PHE  70   7.483 -11.430   3.473
  555    HZ   PHE  70           HZ       PHE  70   5.382 -11.237   2.203
  556    H    ASN  71           H        ASN  71   9.241  -7.384   5.403
  557    HA   ASN  71           HA       ASN  71   6.976  -8.680   6.454
  558   1HB   ASN  71          1HB       ASN  71   9.770  -8.774   6.846
  559   2HB   ASN  71          2HB       ASN  71   9.060  -8.467   8.428
  560   1HD2  ASN  71          1HD2      ASN  71   8.216 -10.426   5.588
  561   2HD2  ASN  71          2HD2      ASN  71   7.943 -11.888   6.469
  562    H    LYS  72           H        LYS  72   8.658  -5.729   7.383
  563    HA   LYS  72           HA       LYS  72   7.281  -5.304   9.818
  564   1HB   LYS  72          1HB       LYS  72   9.337  -4.142   9.454
  565   2HB   LYS  72          2HB       LYS  72   8.744  -3.431   7.959
  566   1HG   LYS  72          1HG       LYS  72   8.813  -1.826   9.816
  567   2HG   LYS  72          2HG       LYS  72   7.184  -2.056   9.178
  568   1HD   LYS  72          1HD       LYS  72   6.661  -3.563  11.021
  569   2HD   LYS  72          2HD       LYS  72   8.301  -3.385  11.648
  570   1HE   LYS  72          1HE       LYS  72   6.822  -0.876  11.200
  571   2HE   LYS  72          2HE       LYS  72   6.193  -1.914  12.478
  572   1HZ   LYS  72          1HZ       LYS  72   8.787  -1.962  13.043
  573   2HZ   LYS  72          2HZ       LYS  72   7.719  -0.824  13.695
  574   3HZ   LYS  72          3HZ       LYS  72   8.678  -0.417  12.362
  575    H    VAL  73           H        VAL  73   6.771  -4.017   6.542
  576    HA   VAL  73           HA       VAL  73   4.609  -2.360   7.062
  577    HB   VAL  73           HB       VAL  73   5.316  -3.951   4.605
  578   1HG1  VAL  73          1HG1      VAL  73   2.960  -3.700   4.452
  579   2HG1  VAL  73          2HG1      VAL  73   3.035  -2.029   5.014
  580   3HG1  VAL  73          3HG1      VAL  73   3.671  -2.455   3.425
  581   1HG2  VAL  73          1HG2      VAL  73   6.332  -2.047   3.831
  582   2HG2  VAL  73          2HG2      VAL  73   5.312  -0.977   4.792
  583   3HG2  VAL  73          3HG2      VAL  73   6.618  -1.877   5.563
  584    H    LYS  74           H        LYS  74   4.762  -5.819   6.906
  585    HA   LYS  74           HA       LYS  74   2.042  -6.378   6.432
  586   1HB   LYS  74          1HB       LYS  74   4.240  -7.929   7.788
  587   2HB   LYS  74          2HB       LYS  74   2.613  -8.574   7.619
  588   1HG   LYS  74          1HG       LYS  74   3.781  -7.543   5.136
  589   2HG   LYS  74          2HG       LYS  74   4.617  -8.934   5.831
  590   1HD   LYS  74          1HD       LYS  74   2.282  -9.983   6.033
  591   2HD   LYS  74          2HD       LYS  74   1.764  -8.714   4.920
  592   1HE   LYS  74          1HE       LYS  74   4.020  -9.688   3.706
  593   2HE   LYS  74          2HE       LYS  74   3.318 -11.139   4.420
  594   1HZ   LYS  74          1HZ       LYS  74   2.605 -10.215   2.051
  595   2HZ   LYS  74          2HZ       LYS  74   1.492  -9.369   3.002
  596   3HZ   LYS  74          3HZ       LYS  74   1.538 -11.059   3.057
  597    H    TRP  75           H        TRP  75   3.554  -4.949   9.079
  598    HA   TRP  75           HA       TRP  75   1.935  -5.947  11.188
  599   1HB   TRP  75          1HB       TRP  75   2.944  -4.317  12.546
  600   2HB   TRP  75          2HB       TRP  75   4.176  -4.693  11.345
  601    HD1  TRP  75           HD       TRP  75   3.150  -2.850   8.973
  602    HE1  TRP  75           1HE      TRP  75   3.353  -0.292   9.173
  603    HE3  TRP  75           3HE      TRP  75   3.496  -2.458  14.059
  604    HZ2  TRP  75           2HZ      TRP  75   3.624   1.637  11.216
  605    HZ3  TRP  75           3HZ      TRP  75   3.725  -0.220  15.056
  606    HH2  TRP  75           HH       TRP  75   3.789   1.784  13.662
  607    H    TYR  76           H        TYR  76   1.390  -3.681   8.677
  608    HA   TYR  76           HA       TYR  76  -1.033  -2.704  10.038
  609   1HB   TYR  76          1HB       TYR  76   0.986  -1.367   8.398
  610   2HB   TYR  76          2HB       TYR  76  -0.660  -1.040   7.868
  611    HD1  TYR  76           2HD      TYR  76  -2.065  -1.088  10.499
  612    HD2  TYR  76           1HD      TYR  76   1.636   0.671   9.355
  613    HE1  TYR  76           2HE      TYR  76  -2.312   0.582  12.288
  614    HE2  TYR  76           1HE      TYR  76   1.400   2.345  11.141
  615    HH   TYR  76           HH       TYR  76  -0.486   2.075  13.675
  616    H    LEU  77           H        LEU  77   0.241  -3.586   6.833
  617    HA   LEU  77           HA       LEU  77  -2.332  -3.767   5.626
  618   1HB   LEU  77          1HB       LEU  77   0.384  -4.765   4.801
  619   2HB   LEU  77          2HB       LEU  77  -1.058  -4.973   3.810
  620    HG   LEU  77           HG       LEU  77  -0.015  -2.281   4.670
  621   1HD1  LEU  77          1HD1      LEU  77   1.465  -3.839   3.137
  622   2HD1  LEU  77          2HD1      LEU  77   1.285  -2.117   2.805
  623   3HD1  LEU  77          3HD1      LEU  77   0.334  -3.294   1.899
  624   1HD2  LEU  77          1HD2      LEU  77  -2.064  -3.206   2.669
  625   2HD2  LEU  77          2HD2      LEU  77  -1.392  -1.575   2.683
  626   3HD2  LEU  77          3HD2      LEU  77  -2.307  -2.165   4.072
  627    H    GLY  78           H        GLY  78  -0.676  -5.775   7.762
  628   1HA   GLY  78          1HA       GLY  78  -1.204  -7.839   8.625
  629   2HA   GLY  78          2HA       GLY  78  -2.705  -7.757   7.714
  630    H    ALA  79           H        ALA  79  -1.041 -10.072   8.142
  631    HA   ALA  79           HA       ALA  79   0.429 -10.607   5.742
  632   1HB   ALA  79          1HB       ALA  79   0.944 -12.667   6.669
  633   2HB   ALA  79          2HB       ALA  79   0.723 -11.648   8.092
  634   3HB   ALA  79          3HB       ALA  79  -0.561 -12.746   7.585
  635    H    ARG  80           H        ARG  80  -2.859 -11.015   6.787
  636    HA   ARG  80           HA       ARG  80  -3.763 -13.031   5.125
  637   1HB   ARG  80          1HB       ARG  80  -5.275 -10.506   5.813
  638   2HB   ARG  80          2HB       ARG  80  -5.970 -12.050   5.338
  639   1HG   ARG  80          1HG       ARG  80  -4.956 -13.047   7.392
  640   2HG   ARG  80          2HG       ARG  80  -4.499 -11.415   7.882
  641   1HD   ARG  80          1HD       ARG  80  -6.501 -11.575   8.958
  642   2HD   ARG  80          2HD       ARG  80  -7.060 -10.949   7.407
  643    HE   ARG  80           HE       ARG  80  -8.100 -12.954   7.007
  644   1HH1  ARG  80          1HH1      ARG  80  -5.896 -13.308   9.678
  645   2HH1  ARG  80          2HH1      ARG  80  -6.455 -14.893  10.099
  646   1HH2  ARG  80          1HH2      ARG  80  -8.845 -15.040   7.551
  647   2HH2  ARG  80          2HH2      ARG  80  -8.132 -15.877   8.888
  648    H    CYS  81           H        CYS  81  -3.309  -9.597   4.410
  649    HA   CYS  81           HA       CYS  81  -4.123 -10.028   1.640
  650   1HB   CYS  81          1HB       CYS  81  -3.223  -7.436   2.898
  651   2HB   CYS  81          2HB       CYS  81  -4.141  -7.648   1.412
  652    HG   CYS  81           HG       CYS  81  -6.320  -7.063   2.643
  653    H    HIS  82           H        HIS  82  -2.740 -10.184  -0.016
  654    HA   HIS  82           HA       HIS  82   0.058 -10.439   0.501
  655   1HB   HIS  82          1HB       HIS  82  -1.366 -11.691  -1.251
  656   2HB   HIS  82          2HB       HIS  82  -1.162 -10.250  -2.244
  657    HD1  HIS  82           1HD      HIS  82   1.033 -12.764  -0.418
  658    HD2  HIS  82           2HD      HIS  82   1.080 -10.295  -3.759
  659    HE1  HIS  82           1HE      HIS  82   3.187 -13.284  -1.607
  660    H    ILE  83           H        ILE  83   1.590  -8.934   0.406
  661    HA   ILE  83           HA       ILE  83   0.924  -6.353  -0.851
  662    HB   ILE  83           HB       ILE  83   2.515  -5.301   0.664
  663   1HG1  ILE  83          1HG1      ILE  83   2.817  -8.031   1.934
  664   2HG1  ILE  83          2HG1      ILE  83   4.019  -7.276   0.894
  665   1HG2  ILE  83          1HG2      ILE  83   0.385  -7.005   1.926
  666   2HG2  ILE  83          2HG2      ILE  83   1.301  -5.805   2.836
  667   3HG2  ILE  83          3HG2      ILE  83   0.303  -5.302   1.472
  668   1HD1  ILE  83          1HD1      ILE  83   4.664  -6.979   3.174
  669   2HD1  ILE  83          2HD1      ILE  83   4.173  -5.415   2.522
  670   3HD1  ILE  83          3HD1      ILE  83   3.085  -6.309   3.582
  671    H    GLU  84           H        GLU  84   2.539  -5.261  -2.037
  672    HA   GLU  84           HA       GLU  84   5.016  -6.665  -2.626
  673   1HB   GLU  84          1HB       GLU  84   2.772  -6.954  -4.303
  674   2HB   GLU  84          2HB       GLU  84   3.852  -5.840  -5.129
  675   1HG   GLU  84          1HG       GLU  84   5.240  -8.140  -4.020
  676   2HG   GLU  84          2HG       GLU  84   3.993  -8.581  -5.185
  677    H    LYS  85           H        LYS  85   6.443  -5.355  -4.063
  678    HA   LYS  85           HA       LYS  85   6.427  -2.621  -3.174
  679   1HB   LYS  85          1HB       LYS  85   8.291  -4.108  -5.033
  680   2HB   LYS  85          2HB       LYS  85   8.550  -2.462  -4.470
  681   1HG   LYS  85          1HG       LYS  85   8.450  -3.428  -2.115
  682   2HG   LYS  85          2HG       LYS  85   8.610  -5.008  -2.887
  683   1HD   LYS  85          1HD       LYS  85  10.531  -2.725  -3.317
  684   2HD   LYS  85          2HD       LYS  85  10.767  -3.995  -2.114
  685   1HE   LYS  85          1HE       LYS  85  10.169  -5.273  -4.556
  686   2HE   LYS  85          2HE       LYS  85  11.361  -4.023  -4.912
  687   1HZ   LYS  85          1HZ       LYS  85  12.060  -6.412  -4.104
  688   2HZ   LYS  85          2HZ       LYS  85  11.829  -5.720  -2.578
  689   3HZ   LYS  85          3HZ       LYS  85  12.938  -5.037  -3.657
  690    H    ALA  86           H        ALA  86   5.826  -0.845  -4.267
  691    HA   ALA  86           HA       ALA  86   4.508  -1.199  -6.827
  692   1HB   ALA  86          1HB       ALA  86   4.452   1.511  -6.145
  693   2HB   ALA  86          2HB       ALA  86   3.163   0.326  -5.935
  694   3HB   ALA  86          3HB       ALA  86   4.299   0.635  -4.622
  695    H    LYS  87           H        LYS  87   4.917   0.236  -8.638
  696    HA   LYS  87           HA       LYS  87   7.574   1.455  -8.716
  697   1HB   LYS  87          1HB       LYS  87   8.267   0.302 -10.671
  698   2HB   LYS  87          2HB       LYS  87   7.696  -0.931  -9.554
  699   1HG   LYS  87          1HG       LYS  87   5.445  -0.269 -11.018
  700   2HG   LYS  87          2HG       LYS  87   6.754  -0.248 -12.203
  701   1HD   LYS  87          1HD       LYS  87   7.287  -2.485 -11.835
  702   2HD   LYS  87          2HD       LYS  87   6.477  -2.519 -10.267
  703   1HE   LYS  87          1HE       LYS  87   4.589  -3.210 -11.211
  704   2HE   LYS  87          2HE       LYS  87   4.592  -1.832 -12.310
  705   1HZ   LYS  87          1HZ       LYS  87   4.957  -3.280 -13.930
  706   2HZ   LYS  87          2HZ       LYS  87   5.208  -4.553 -12.845
  707   3HZ   LYS  87          3HZ       LYS  87   6.499  -3.554 -13.289
  708    H    GLY  88           H        GLY  88   7.783   3.147 -10.172
  709   1HA   GLY  88          1HA       GLY  88   6.981   4.341 -12.134
  710   2HA   GLY  88          2HA       GLY  88   5.353   3.846 -11.694
  711    H    THR  89           H        THR  89   4.748   6.077 -11.841
  712    HA   THR  89           HA       THR  89   5.730   7.744  -9.623
  713    HB   THR  89           HB       THR  89   5.070   9.682 -10.828
  714    HG1  THR  89           1HG      THR  89   4.051   9.228 -13.021
  715   1HG2  THR  89          1HG2      THR  89   6.529   9.629 -12.633
  716   2HG2  THR  89          2HG2      THR  89   6.096   7.974 -13.064
  717   3HG2  THR  89          3HG2      THR  89   7.103   8.283 -11.650
  718    H    ASP  90           H        ASP  90   3.962   9.382  -8.899
  719    HA   ASP  90           HA       ASP  90   1.964   7.979  -7.559
  720   1HB   ASP  90          1HB       ASP  90   2.751  10.166  -6.812
  721   2HB   ASP  90          2HB       ASP  90   2.073  10.922  -8.251
  722    H    GLN  91           H        GLN  91   1.853   9.747 -10.613
  723    HA   GLN  91           HA       GLN  91  -0.937   9.574 -11.004
  724   1HB   GLN  91          1HB       GLN  91   1.422  10.170 -12.718
  725   2HB   GLN  91          2HB       GLN  91  -0.082   9.745 -13.525
  726   1HG   GLN  91          1HG       GLN  91  -0.407  11.727 -11.408
  727   2HG   GLN  91          2HG       GLN  91   0.644  12.250 -12.723
  728   1HE2  GLN  91          1HE2      GLN  91  -2.539  11.789 -11.693
  729   2HE2  GLN  91          2HE2      GLN  91  -3.335  12.131 -13.187
  730    H    GLN  92           H        GLN  92   1.724   7.417 -11.788
  731    HA   GLN  92           HA       GLN  92   0.241   5.658 -13.447
  732   1HB   GLN  92          1HB       GLN  92   2.886   5.616 -12.100
  733   2HB   GLN  92          2HB       GLN  92   2.202   4.060 -12.553
  734   1HG   GLN  92          1HG       GLN  92   1.831   5.522 -14.825
  735   2HG   GLN  92          2HG       GLN  92   3.355   6.164 -14.214
  736   1HE2  GLN  92          1HE2      GLN  92   5.166   4.934 -14.306
  737   2HE2  GLN  92          2HE2      GLN  92   5.233   3.368 -15.032
  738    H    ASN  93           H        ASN  93   0.887   5.776  -9.988
  739    HA   ASN  93           HA       ASN  93  -0.354   3.234  -9.467
  740   1HB   ASN  93          1HB       ASN  93   0.706   5.449  -7.726
  741   2HB   ASN  93          2HB       ASN  93  -0.190   4.097  -7.038
  742   1HD2  ASN  93          1HD2      ASN  93   2.224   4.320  -9.625
  743   2HD2  ASN  93          2HD2      ASN  93   3.318   3.175  -8.935
  744    H    LYS  94           H        LYS  94  -1.266   6.633  -9.202
  745    HA   LYS  94           HA       LYS  94  -3.716   6.278  -7.877
  746   1HB   LYS  94          1HB       LYS  94  -2.555   8.459  -8.170
  747   2HB   LYS  94          2HB       LYS  94  -2.995   8.433  -9.872
  748   1HG   LYS  94          1HG       LYS  94  -5.322   8.582  -9.341
  749   2HG   LYS  94          2HG       LYS  94  -4.989   8.385  -7.619
  750   1HD   LYS  94          1HD       LYS  94  -3.940  10.509  -7.489
  751   2HD   LYS  94          2HD       LYS  94  -3.889  10.667  -9.246
  752   1HE   LYS  94          1HE       LYS  94  -5.860  11.686  -9.208
  753   2HE   LYS  94          2HE       LYS  94  -6.589  10.250  -8.492
  754   1HZ   LYS  94          1HZ       LYS  94  -5.407  12.571  -7.077
  755   2HZ   LYS  94          2HZ       LYS  94  -5.811  11.125  -6.298
  756   3HZ   LYS  94          3HZ       LYS  94  -7.016  12.050  -7.043
  757    H    GLU  95           H        GLU  95  -2.961   6.469 -11.344
  758    HA   GLU  95           HA       GLU  95  -5.656   6.106 -12.185
  759   1HB   GLU  95          1HB       GLU  95  -2.990   6.005 -13.556
  760   2HB   GLU  95          2HB       GLU  95  -4.438   5.477 -14.403
  761   1HG   GLU  95          1HG       GLU  95  -5.101   7.939 -13.267
  762   2HG   GLU  95          2HG       GLU  95  -3.471   8.136 -13.910
  763    H    TYR  96           H        TYR  96  -2.950   3.948 -11.589
  764    HA   TYR  96           HA       TYR  96  -3.904   1.631 -12.798
  765   1HB   TYR  96          1HB       TYR  96  -1.637   1.787 -11.932
  766   2HB   TYR  96          2HB       TYR  96  -2.244   1.928 -10.286
  767    HD1  TYR  96           2HD      TYR  96  -1.698  -0.360 -13.104
  768    HD2  TYR  96           1HD      TYR  96  -3.028  -0.011  -9.078
  769    HE1  TYR  96           2HE      TYR  96  -1.606  -2.806 -12.868
  770    HE2  TYR  96           1HE      TYR  96  -2.939  -2.456  -8.830
  771    HH   TYR  96           HH       TYR  96  -1.306  -4.443 -10.786
  772    H    CYS  97           H        CYS  97  -4.401   2.791  -9.475
  773    HA   CYS  97           HA       CYS  97  -6.045   0.620  -8.687
  774   1HB   CYS  97          1HB       CYS  97  -5.948   3.408  -7.519
  775   2HB   CYS  97          2HB       CYS  97  -6.571   1.965  -6.729
  776    HG   CYS  97           HG       CYS  97  -4.107   0.711  -6.500
  777    H    SER  98           H        SER  98  -6.688   3.742 -10.152
  778    HA   SER  98           HA       SER  98  -9.535   3.576  -9.826
  779   1HB   SER  98          1HB       SER  98  -8.474   5.760  -9.972
  780   2HB   SER  98          2HB       SER  98  -7.829   5.372 -11.567
  781    HG   SER  98           HG       SER  98  -9.829   5.504 -12.424
  782    H    LYS  99           H        LYS  99  -7.319   2.135 -11.912
  783    HA   LYS  99           HA       LYS  99  -8.642   2.064 -14.360
  784   1HB   LYS  99          1HB       LYS  99  -6.353   1.248 -14.049
  785   2HB   LYS  99          2HB       LYS  99  -6.951  -0.087 -13.073
  786   1HG   LYS  99          1HG       LYS  99  -8.319  -0.112 -15.566
  787   2HG   LYS  99          2HG       LYS  99  -6.585   0.020 -15.870
  788   1HD   LYS  99          1HD       LYS  99  -7.912  -2.049 -14.118
  789   2HD   LYS  99          2HD       LYS  99  -7.320  -2.320 -15.758
  790   1HE   LYS  99          1HE       LYS  99  -5.165  -1.190 -14.418
  791   2HE   LYS  99          2HE       LYS  99  -5.879  -2.296 -13.245
  792   1HZ   LYS  99          1HZ       LYS  99  -4.386  -2.878 -15.611
  793   2HZ   LYS  99          2HZ       LYS  99  -5.859  -3.710 -15.578
  794   3HZ   LYS  99          3HZ       LYS  99  -4.762  -3.882 -14.302
  795    H    GLU 100           H        GLU 100  -9.381   0.486 -11.380
  796    HA   GLU 100           HA       GLU 100 -10.987  -1.608 -12.467
  797   1HB   GLU 100          1HB       GLU 100 -11.041  -0.408  -9.693
  798   2HB   GLU 100          2HB       GLU 100 -11.753  -1.942 -10.170
  799   1HG   GLU 100          1HG       GLU 100  -9.724  -2.998 -10.324
  800   2HG   GLU 100          2HG       GLU 100  -8.845  -1.499 -10.617
  801    H    GLY 101           H        GLY 101 -11.481   1.738 -11.864
  802   1HA   GLY 101          1HA       GLY 101 -13.291   2.985 -12.694
  803   2HA   GLY 101          2HA       GLY 101 -14.221   1.500 -12.835
  804    H    ASN 102           H        ASN 102 -13.084   1.080  -9.914
  805    HA   ASN 102           HA       ASN 102 -15.002   2.841  -8.554
  806   1HB   ASN 102          1HB       ASN 102 -15.752   0.350  -9.054
  807   2HB   ASN 102          2HB       ASN 102 -14.763   0.008  -7.637
  808   1HD2  ASN 102          1HD2      ASN 102 -15.991  -0.209  -5.923
  809   2HD2  ASN 102          2HD2      ASN 102 -17.357   0.766  -5.514
  810    H    LEU 103           H        LEU 103 -14.093   3.869  -6.906
  811    HA   LEU 103           HA       LEU 103 -11.555   2.861  -5.842
  812   1HB   LEU 103          1HB       LEU 103 -12.849   5.566  -5.538
  813   2HB   LEU 103          2HB       LEU 103 -11.255   5.113  -4.939
  814    HG   LEU 103           HG       LEU 103 -12.119   5.452  -7.805
  815   1HD1  LEU 103          1HD1      LEU 103 -10.861   7.345  -7.835
  816   2HD1  LEU 103          2HD1      LEU 103  -9.748   6.763  -6.599
  817   3HD1  LEU 103          3HD1      LEU 103 -11.341   7.361  -6.138
  818   1HD2  LEU 103          1HD2      LEU 103  -9.731   4.877  -8.322
  819   2HD2  LEU 103          2HD2      LEU 103 -10.731   3.521  -7.800
  820   3HD2  LEU 103          3HD2      LEU 103  -9.594   4.264  -6.674
  821    H    LEU 104           H        LEU 104 -11.382   2.084  -3.837
  822    HA   LEU 104           HA       LEU 104 -13.764   1.946  -2.186
  823   1HB   LEU 104          1HB       LEU 104 -12.558  -0.083  -2.393
  824   2HB   LEU 104          2HB       LEU 104 -11.032   0.705  -1.996
  825    HG   LEU 104           HG       LEU 104 -11.745   0.973   0.312
  826   1HD1  LEU 104          1HD1      LEU 104 -14.249  -0.513  -0.459
  827   2HD1  LEU 104          2HD1      LEU 104 -14.165   1.227  -0.184
  828   3HD1  LEU 104          3HD1      LEU 104 -13.823   0.108   1.135
  829   1HD2  LEU 104          1HD2      LEU 104 -11.485  -1.250   0.982
  830   2HD2  LEU 104          2HD2      LEU 104 -10.711  -1.186  -0.601
  831   3HD2  LEU 104          3HD2      LEU 104 -12.328  -1.873  -0.436
  832    H    MET 105           H        MET 105 -10.776   3.684  -2.314
  833    HA   MET 105           HA       MET 105 -11.617   5.394  -0.162
  834   1HB   MET 105          1HB       MET 105 -10.623   3.915   1.326
  835   2HB   MET 105          2HB       MET 105  -9.363   3.455   0.189
  836   1HG   MET 105          1HG       MET 105  -8.017   5.166   0.770
  837   2HG   MET 105          2HG       MET 105  -9.360   6.268   1.064
  838   1HE   MET 105          1HE       MET 105  -6.711   4.206   2.236
  839   2HE   MET 105          2HE       MET 105  -6.858   4.081   3.989
  840   3HE   MET 105          3HE       MET 105  -7.673   2.911   2.950
  841    H    GLU 106           H        GLU 106 -10.808   7.415  -0.391
  842    HA   GLU 106           HA       GLU 106  -8.535   7.798  -2.213
  843   1HB   GLU 106          1HB       GLU 106 -10.635   8.195  -3.451
  844   2HB   GLU 106          2HB       GLU 106 -11.095   9.405  -2.261
  845   1HG   GLU 106          1HG       GLU 106  -8.643  10.298  -3.018
  846   2HG   GLU 106          2HG       GLU 106  -9.241   9.587  -4.515
  847    H    CYS 107           H        CYS 107  -7.017   8.556  -0.870
  848    HA   CYS 107           HA       CYS 107  -7.484  11.091   0.448
  849   1HB   CYS 107          1HB       CYS 107  -7.096   8.533   1.934
  850   2HB   CYS 107          2HB       CYS 107  -6.312   9.979   2.559
  851    HG   CYS 107           HG       CYS 107  -8.572  11.374   3.100
  852    H    GLY 108           H        GLY 108  -5.328  11.670   1.714
  853   1HA   GLY 108          1HA       GLY 108  -2.986  11.760   1.720
  854   2HA   GLY 108          2HA       GLY 108  -2.960  10.606   0.395
  855    H    ALA 109           H        ALA 109  -1.232  12.463  -0.003
  856    HA   ALA 109           HA       ALA 109  -2.515  14.532  -1.662
  857   1HB   ALA 109          1HB       ALA 109  -0.721  14.886   0.367
  858   2HB   ALA 109          2HB       ALA 109   0.321  14.904  -1.057
  859   3HB   ALA 109          3HB       ALA 109  -1.026  16.036  -0.935
  860    HA   PRO 110           HA       PRO 110  -0.740  12.918  -5.335
  861   1HB   PRO 110          1HB       PRO 110  -0.057  15.173  -6.684
  862   2HB   PRO 110          2HB       PRO 110  -1.732  14.657  -6.461
  863   1HG   PRO 110          1HG       PRO 110  -0.164  16.707  -4.945
  864   2HG   PRO 110          2HG       PRO 110  -1.836  16.786  -5.530
  865   1HD   PRO 110          1HD       PRO 110  -1.219  16.220  -2.955
  866   2HD   PRO 110          2HD       PRO 110  -2.645  15.541  -3.767
  867    H    ARG 111           H        ARG 111   1.127  11.831  -4.869
  868    HA   ARG 111           HA       ARG 111   3.538  13.104  -4.055
  869   1HB   ARG 111          1HB       ARG 111   2.724  10.346  -4.823
  870   2HB   ARG 111          2HB       ARG 111   4.438  10.735  -4.890
  871   1HG   ARG 111          1HG       ARG 111   2.729  11.183  -2.457
  872   2HG   ARG 111          2HG       ARG 111   3.655   9.710  -2.748
  873   1HD   ARG 111          1HD       ARG 111   4.978  12.394  -2.848
  874   2HD   ARG 111          2HD       ARG 111   4.693  11.591  -1.304
  875    HE   ARG 111           HE       ARG 111   5.992   9.895  -3.207
  876   1HH1  ARG 111          1HH1      ARG 111   6.495  12.420  -0.863
  877   2HH1  ARG 111          2HH1      ARG 111   8.146  11.990  -0.561
  878   1HH2  ARG 111          1HH2      ARG 111   8.164   9.319  -2.817
  879   2HH2  ARG 111          2HH2      ARG 111   9.095  10.226  -1.674
  880    H    SER 112           H        SER 112   5.524  13.229  -5.232
  881    HA   SER 112           HA       SER 112   5.441  12.944  -8.117
  882   1HB   SER 112          1HB       SER 112   6.168  15.306  -8.492
  883   2HB   SER 112          2HB       SER 112   4.517  15.170  -7.888
  884    HG   SER 112           HG       SER 112   6.753  16.263  -6.701
  885    H    GLN 113           H        GLN 113   6.946  11.421  -6.567
  886    HA   GLN 113           HA       GLN 113   9.069  10.680  -6.229
  887   1HB   GLN 113          1HB       GLN 113   9.213  12.401  -8.541
  888   2HB   GLN 113          2HB       GLN 113  10.707  12.489  -7.618
  889   1HG   GLN 113          1HG       GLN 113   9.695   9.773  -8.017
  890   2HG   GLN 113          2HG       GLN 113  10.136  10.617  -9.500
  891   1HE2  GLN 113          1HE2      GLN 113  11.521  10.768  -6.249
  892   2HE2  GLN 113          2HE2      GLN 113  13.112  10.280  -6.713
  893    H    GLY 114           H        GLY 114   9.345  11.103  -4.080
  894   1HA   GLY 114          1HA       GLY 114  10.135  13.777  -3.228
  895   2HA   GLY 114          2HA       GLY 114   9.775  12.413  -2.180
  896    H    GLN 115           H        GLN 115  12.213  14.227  -3.719
  897    HA   GLN 115           HA       GLN 115  14.269  12.917  -2.245
  898   1HB   GLN 115          1HB       GLN 115  13.984  11.325  -4.133
  899   2HB   GLN 115          2HB       GLN 115  14.371  12.625  -5.252
  900   1HG   GLN 115          1HG       GLN 115  16.546  12.824  -3.840
  901   2HG   GLN 115          2HG       GLN 115  16.144  11.182  -3.340
  902   1HE2  GLN 115          1HE2      GLN 115  18.071  10.487  -4.370
  903   2HE2  GLN 115          2HE2      GLN 115  18.132  10.284  -6.085
  904    H    ARG 116           H        ARG 116  13.736  14.869  -5.179
  905    HA   ARG 116           HA       ARG 116  15.419  16.962  -4.001
  906   1HB   ARG 116          1HB       ARG 116  15.810  15.585  -6.623
  907   2HB   ARG 116          2HB       ARG 116  16.193  17.297  -6.504
  908   1HG   ARG 116          1HG       ARG 116  17.377  16.079  -4.272
  909   2HG   ARG 116          2HG       ARG 116  17.718  15.031  -5.650
  910   1HD   ARG 116          1HD       ARG 116  18.069  17.959  -6.006
  911   2HD   ARG 116          2HD       ARG 116  19.261  17.100  -5.031
  912    HE   ARG 116           HE       ARG 116  19.022  17.040  -7.856
  913   1HH1  ARG 116          1HH1      ARG 116  19.803  15.046  -5.111
  914   2HH1  ARG 116          2HH1      ARG 116  20.833  13.983  -6.012
  915   1HH2  ARG 116          1HH2      ARG 116  20.374  15.647  -9.053
  916   2HH2  ARG 116          2HH2      ARG 116  21.157  14.326  -8.254
  Start of MODEL   20
    1    HA   PRO   2           HA       PRO   2  34.819  -0.221  17.977
    2   1HB   PRO   2          1HB       PRO   2  35.664  -1.367  15.665
    3   2HB   PRO   2          2HB       PRO   2  36.473   0.022  16.400
    4   1HG   PRO   2          1HG       PRO   2  37.201  -2.879  16.527
    5   2HG   PRO   2          2HG       PRO   2  38.252  -1.471  16.288
    6   1HD   PRO   2          1HD       PRO   2  37.997  -2.711  18.682
    7   2HD   PRO   2          2HD       PRO   2  38.298  -0.967  18.537
    8    H    SER   3           H        SER   3  32.977  -1.281  18.737
    9    HA   SER   3           HA       SER   3  32.465  -3.989  17.742
   10   1HB   SER   3          1HB       SER   3  31.191  -2.306  19.893
   11   2HB   SER   3          2HB       SER   3  30.409  -3.762  19.278
   12    HG   SER   3           HG       SER   3  31.944  -3.866  21.194
   13    H    LYS   4           H        LYS   4  31.375  -4.216  15.918
   14    HA   LYS   4           HA       LYS   4  29.148  -2.409  15.338
   15   1HB   LYS   4          1HB       LYS   4  29.875  -2.190  12.984
   16   2HB   LYS   4          2HB       LYS   4  31.006  -1.451  14.111
   17   1HG   LYS   4          1HG       LYS   4  31.635  -4.231  13.501
   18   2HG   LYS   4          2HG       LYS   4  31.656  -3.173  12.088
   19   1HD   LYS   4          1HD       LYS   4  33.116  -1.611  13.412
   20   2HD   LYS   4          2HD       LYS   4  33.229  -2.872  14.641
   21   1HE   LYS   4          1HE       LYS   4  33.965  -3.310  11.755
   22   2HE   LYS   4          2HE       LYS   4  35.123  -2.779  12.974
   23   1HZ   LYS   4          1HZ       LYS   4  35.440  -4.954  13.286
   24   2HZ   LYS   4          2HZ       LYS   4  33.995  -5.393  12.525
   25   3HZ   LYS   4          3HZ       LYS   4  33.985  -4.918  14.149
   26    H    LYS   5           H        LYS   5  27.534  -3.296  14.017
   27    HA   LYS   5           HA       LYS   5  27.701  -6.221  13.726
   28   1HB   LYS   5          1HB       LYS   5  25.649  -4.446  14.739
   29   2HB   LYS   5          2HB       LYS   5  25.026  -5.447  13.435
   30   1HG   LYS   5          1HG       LYS   5  26.603  -6.742  15.599
   31   2HG   LYS   5          2HG       LYS   5  24.939  -6.252  15.927
   32   1HD   LYS   5          1HD       LYS   5  24.204  -7.548  13.958
   33   2HD   LYS   5          2HD       LYS   5  25.868  -8.081  13.712
   34   1HE   LYS   5          1HE       LYS   5  24.596  -8.506  16.373
   35   2HE   LYS   5          2HE       LYS   5  24.142  -9.562  15.037
   36   1HZ   LYS   5          1HZ       LYS   5  26.333  -9.834  16.657
   37   2HZ   LYS   5          2HZ       LYS   5  26.967  -9.235  15.208
   38   3HZ   LYS   5          3HZ       LYS   5  26.050 -10.656  15.205
   39    H    ASN   6           H        ASN   6  27.884  -6.980  11.731
   40    HA   ASN   6           HA       ASN   6  26.566  -5.555   9.533
   41   1HB   ASN   6          1HB       ASN   6  29.454  -5.980   9.888
   42   2HB   ASN   6          2HB       ASN   6  28.841  -6.476   8.314
   43   1HD2  ASN   6          1HD2      ASN   6  27.283  -4.813   7.337
   44   2HD2  ASN   6          2HD2      ASN   6  27.810  -3.169   7.407
   45    H    GLY   7           H        GLY   7  24.990  -7.143   9.398
   46   1HA   GLY   7          1HA       GLY   7  25.938  -9.860   8.743
   47   2HA   GLY   7          2HA       GLY   7  24.357  -9.488   9.413
   48    H    ARG   8           H        ARG   8  22.693  -9.296   8.052
   49    HA   ARG   8           HA       ARG   8  23.248  -8.759   5.218
   50   1HB   ARG   8          1HB       ARG   8  22.986 -11.136   5.317
   51   2HB   ARG   8          2HB       ARG   8  21.566 -10.996   6.344
   52   1HG   ARG   8          1HG       ARG   8  20.338  -9.962   4.491
   53   2HG   ARG   8          2HG       ARG   8  21.762 -10.142   3.463
   54   1HD   ARG   8          1HD       ARG   8  20.512 -12.491   4.853
   55   2HD   ARG   8          2HD       ARG   8  19.920 -11.918   3.294
   56    HE   ARG   8           HE       ARG   8  22.723 -12.304   3.212
   57   1HH1  ARG   8          1HH1      ARG   8  19.710 -14.049   3.241
   58   2HH1  ARG   8          2HH1      ARG   8  20.344 -15.416   2.387
   59   1HH2  ARG   8          1HH2      ARG   8  23.569 -14.098   2.087
   60   2HH2  ARG   8          2HH2      ARG   8  22.539 -15.444   1.731
   61    H    SER   9           H        SER   9  21.703  -7.582   4.137
   62    HA   SER   9           HA       SER   9  19.103  -7.073   5.186
   63   1HB   SER   9          1HB       SER   9  20.594  -5.672   6.687
   64   2HB   SER   9          2HB       SER   9  20.992  -4.715   5.260
   65    HG   SER   9           HG       SER   9  18.628  -4.850   6.717
   66    H    GLY  10           H        GLY  10  19.335  -7.991   2.842
   67   1HA   GLY  10          1HA       GLY  10  20.086  -6.414   0.684
   68   2HA   GLY  10          2HA       GLY  10  18.834  -7.646   0.629
   69    HA   PRO  11           HA       PRO  11  15.711  -4.627   0.088
   70   1HB   PRO  11          1HB       PRO  11  13.694  -5.507   1.679
   71   2HB   PRO  11          2HB       PRO  11  14.158  -6.318   0.178
   72   1HG   PRO  11          1HG       PRO  11  14.876  -7.005   3.002
   73   2HG   PRO  11          2HG       PRO  11  14.388  -8.079   1.678
   74   1HD   PRO  11          1HD       PRO  11  16.974  -7.756   2.414
   75   2HD   PRO  11          2HD       PRO  11  16.492  -8.082   0.737
   76    H    GLN  12           H        GLN  12  15.021  -2.687   0.876
   77    HA   GLN  12           HA       GLN  12  15.461  -2.160   3.740
   78   1HB   GLN  12          1HB       GLN  12  16.446  -0.716   1.350
   79   2HB   GLN  12          2HB       GLN  12  15.853   0.285   2.669
   80   1HG   GLN  12          1HG       GLN  12  17.520  -1.711   3.786
   81   2HG   GLN  12          2HG       GLN  12  18.362  -1.009   2.405
   82   1HE2  GLN  12          1HE2      GLN  12  17.614   1.564   2.430
   83   2HE2  GLN  12          2HE2      GLN  12  18.115   2.338   3.890
   84    HA   PRO  13           HA       PRO  13  11.417  -0.480   3.971
   85   1HB   PRO  13          1HB       PRO  13  11.756   1.640   5.633
   86   2HB   PRO  13          2HB       PRO  13  11.829  -0.037   6.188
   87   1HG   PRO  13          1HG       PRO  13  14.066   1.842   5.532
   88   2HG   PRO  13          2HG       PRO  13  13.913   0.716   6.894
   89   1HD   PRO  13          1HD       PRO  13  15.400   0.157   4.700
   90   2HD   PRO  13          2HD       PRO  13  14.555  -1.100   5.627
   91    H    HIS  14           H        HIS  14  10.071   1.018   3.039
   92    HA   HIS  14           HA       HIS  14  11.288   3.400   1.830
   93   1HB   HIS  14          1HB       HIS  14   9.507   1.408   0.415
   94   2HB   HIS  14          2HB       HIS  14   9.930   2.991  -0.231
   95    HD1  HIS  14           1HD      HIS  14  11.308  -0.422   0.355
   96    HD2  HIS  14           2HD      HIS  14  12.567   3.227  -1.181
   97    HE1  HIS  14           1HE      HIS  14  13.481  -0.900  -0.818
   98    H    LYS  15           H        LYS  15   9.364   4.734   0.772
   99    HA   LYS  15           HA       LYS  15   7.365   5.027   2.905
  100   1HB   LYS  15          1HB       LYS  15   7.043   7.322   1.883
  101   2HB   LYS  15          2HB       LYS  15   8.603   7.033   2.643
  102   1HG   LYS  15          1HG       LYS  15   8.706   6.318  -0.136
  103   2HG   LYS  15          2HG       LYS  15   8.109   7.968   0.057
  104   1HD   LYS  15          1HD       LYS  15  10.157   7.984   1.816
  105   2HD   LYS  15          2HD       LYS  15  10.770   6.831   0.628
  106   1HE   LYS  15          1HE       LYS  15   9.694   8.918  -0.875
  107   2HE   LYS  15          2HE       LYS  15  10.533   9.706   0.461
  108   1HZ   LYS  15          1HZ       LYS  15  11.621   8.020  -1.679
  109   2HZ   LYS  15          2HZ       LYS  15  12.404   8.032  -0.180
  110   3HZ   LYS  15          3HZ       LYS  15  12.216   9.472  -1.047
  111    H    ARG  16           H        ARG  16   7.396   3.245   0.393
  112    HA   ARG  16           HA       ARG  16   4.644   3.877  -0.385
  113   1HB   ARG  16          1HB       ARG  16   6.863   3.240  -2.339
  114   2HB   ARG  16          2HB       ARG  16   5.159   3.385  -2.749
  115   1HG   ARG  16          1HG       ARG  16   5.148   5.678  -2.459
  116   2HG   ARG  16          2HG       ARG  16   6.582   5.656  -1.430
  117   1HD   ARG  16          1HD       ARG  16   7.907   4.951  -3.424
  118   2HD   ARG  16          2HD       ARG  16   6.462   5.190  -4.405
  119    HE   ARG  16           HE       ARG  16   7.007   7.527  -2.928
  120   1HH1  ARG  16          1HH1      ARG  16   8.212   5.678  -5.621
  121   2HH1  ARG  16          2HH1      ARG  16   8.907   7.050  -6.419
  122   1HH2  ARG  16          1HH2      ARG  16   7.918   9.340  -3.969
  123   2HH2  ARG  16          2HH2      ARG  16   8.739   9.132  -5.479
  124    H    TRP  17           H        TRP  17   3.391   2.153  -0.152
  125    HA   TRP  17           HA       TRP  17   4.423  -0.504  -0.751
  126   1HB   TRP  17          1HB       TRP  17   3.405   0.337   1.960
  127   2HB   TRP  17          2HB       TRP  17   3.402  -1.345   1.438
  128    HD1  TRP  17           HD       TRP  17   5.698   1.386   2.701
  129    HE1  TRP  17           1HE      TRP  17   8.043   0.403   3.103
  130    HE3  TRP  17           3HE      TRP  17   5.041  -3.195   0.529
  131    HZ2  TRP  17           2HZ      TRP  17   9.430  -1.997   2.569
  132    HZ3  TRP  17           3HZ      TRP  17   6.926  -4.776   0.516
  133    HH2  TRP  17           HH       TRP  17   9.075  -4.187   1.515
  134    H    VAL  18           H        VAL  18   2.913  -1.818  -1.619
  135    HA   VAL  18           HA       VAL  18   0.168  -0.770  -1.771
  136    HB   VAL  18           HB       VAL  18  -0.103  -2.149  -3.777
  137   1HG1  VAL  18          1HG1      VAL  18   1.880  -0.984  -5.097
  138   2HG1  VAL  18          2HG1      VAL  18   0.514  -0.064  -4.463
  139   3HG1  VAL  18          3HG1      VAL  18   2.040  -0.103  -3.578
  140   1HG2  VAL  18          1HG2      VAL  18   2.067  -3.563  -2.777
  141   2HG2  VAL  18          2HG2      VAL  18   1.280  -3.805  -4.337
  142   3HG2  VAL  18          3HG2      VAL  18   2.693  -2.756  -4.216
  143    H    PHE  19           H        PHE  19  -1.583  -2.376  -1.845
  144    HA   PHE  19           HA       PHE  19  -0.969  -4.858  -0.402
  145   1HB   PHE  19          1HB       PHE  19  -3.068  -4.484   0.951
  146   2HB   PHE  19          2HB       PHE  19  -1.733  -3.401   1.330
  147    HD1  PHE  19           1HD      PHE  19  -1.775  -1.061   0.461
  148    HD2  PHE  19           2HD      PHE  19  -5.133  -3.661   0.183
  149    HE1  PHE  19           1HE      PHE  19  -3.240   0.879   0.082
  150    HE2  PHE  19           2HE      PHE  19  -6.604  -1.726  -0.196
  151    HZ   PHE  19           HZ       PHE  19  -5.658   0.548  -0.248
  152    H    THR  20           H        THR  20  -2.292  -6.599  -0.865
  153    HA   THR  20           HA       THR  20  -4.550  -6.233  -2.666
  154    HB   THR  20           HB       THR  20  -3.722  -7.916  -4.273
  155    HG1  THR  20           1HG      THR  20  -1.935  -8.969  -3.865
  156   1HG2  THR  20          1HG2      THR  20  -2.497  -6.423  -5.549
  157   2HG2  THR  20          2HG2      THR  20  -1.618  -5.793  -4.156
  158   3HG2  THR  20          3HG2      THR  20  -3.303  -5.343  -4.413
  159    H    LEU  21           H        LEU  21  -6.149  -7.579  -2.141
  160    HA   LEU  21           HA       LEU  21  -5.523 -10.165  -0.924
  161   1HB   LEU  21          1HB       LEU  21  -5.906  -8.566   0.907
  162   2HB   LEU  21          2HB       LEU  21  -7.492  -8.196   0.234
  163    HG   LEU  21           HG       LEU  21  -7.596 -10.923   0.569
  164   1HD1  LEU  21          1HD1      LEU  21  -5.988  -9.702   2.800
  165   2HD1  LEU  21          2HD1      LEU  21  -5.570 -11.088   1.793
  166   3HD1  LEU  21          3HD1      LEU  21  -6.887 -11.212   2.960
  167   1HD2  LEU  21          1HD2      LEU  21  -9.222  -9.025   1.139
  168   2HD2  LEU  21          2HD2      LEU  21  -8.428  -8.996   2.713
  169   3HD2  LEU  21          3HD2      LEU  21  -9.240 -10.461   2.162
  170    H    ASN  22           H        ASN  22  -6.877 -11.782  -1.512
  171    HA   ASN  22           HA       ASN  22  -8.835 -11.179  -3.564
  172   1HB   ASN  22          1HB       ASN  22  -8.914 -13.575  -3.939
  173   2HB   ASN  22          2HB       ASN  22  -7.233 -13.060  -3.829
  174   1HD2  ASN  22          1HD2      ASN  22  -5.988 -13.719  -2.112
  175   2HD2  ASN  22          2HD2      ASN  22  -6.492 -14.946  -1.005
  176    H    ASN  23           H        ASN  23 -11.001 -11.304  -3.365
  177    HA   ASN  23           HA       ASN  23 -13.031 -11.272  -2.331
  178   1HB   ASN  23          1HB       ASN  23 -12.695 -13.707  -2.542
  179   2HB   ASN  23          2HB       ASN  23 -11.910 -13.730  -0.966
  180   1HD2  ASN  23          1HD2      ASN  23 -14.815 -12.074  -2.130
  181   2HD2  ASN  23          2HD2      ASN  23 -15.887 -12.770  -0.968
  182    HA   PRO  24           HA       PRO  24 -11.206  -9.319   1.499
  183   1HB   PRO  24          1HB       PRO  24 -12.107  -6.815   0.962
  184   2HB   PRO  24          2HB       PRO  24 -10.557  -7.426   0.370
  185   1HG   PRO  24          1HG       PRO  24 -13.181  -7.220  -1.056
  186   2HG   PRO  24          2HG       PRO  24 -11.554  -6.831  -1.645
  187   1HD   PRO  24          1HD       PRO  24 -12.813  -9.146  -2.267
  188   2HD   PRO  24          2HD       PRO  24 -11.050  -9.036  -2.088
  189    H    SER  25           H        SER  25 -12.335  -8.922   3.356
  190    HA   SER  25           HA       SER  25 -15.217  -9.345   3.230
  191   1HB   SER  25          1HB       SER  25 -13.124  -9.950   5.124
  192   2HB   SER  25          2HB       SER  25 -14.427  -9.064   5.916
  193    HG   SER  25           HG       SER  25 -14.521 -11.514   5.645
  194    H    GLU  26           H        GLU  26 -16.605  -8.058   4.735
  195    HA   GLU  26           HA       GLU  26 -16.427  -5.317   4.113
  196   1HB   GLU  26          1HB       GLU  26 -18.375  -5.032   5.509
  197   2HB   GLU  26          2HB       GLU  26 -18.547  -6.519   4.587
  198   1HG   GLU  26          1HG       GLU  26 -17.644  -7.710   6.645
  199   2HG   GLU  26          2HG       GLU  26 -17.924  -6.195   7.501
  200    H    ASP  27           H        ASP  27 -15.318  -7.190   6.832
  201    HA   ASP  27           HA       ASP  27 -14.844  -4.933   8.541
  202   1HB   ASP  27          1HB       ASP  27 -14.548  -7.844   8.699
  203   2HB   ASP  27          2HB       ASP  27 -13.266  -6.964   9.525
  204    H    GLU  28           H        GLU  28 -12.854  -7.001   6.464
  205    HA   GLU  28           HA       GLU  28 -10.365  -5.876   7.115
  206   1HB   GLU  28          1HB       GLU  28 -11.342  -7.835   5.331
  207   2HB   GLU  28          2HB       GLU  28 -10.433  -6.686   4.359
  208   1HG   GLU  28          1HG       GLU  28  -8.885  -8.319   4.986
  209   2HG   GLU  28          2HG       GLU  28  -8.566  -6.952   6.051
  210    H    ARG  29           H        ARG  29 -12.608  -5.137   4.455
  211    HA   ARG  29           HA       ARG  29 -11.052  -3.064   3.336
  212   1HB   ARG  29          1HB       ARG  29 -14.018  -3.619   3.178
  213   2HB   ARG  29          2HB       ARG  29 -13.192  -2.399   2.217
  214   1HG   ARG  29          1HG       ARG  29 -12.214  -3.931   0.856
  215   2HG   ARG  29          2HG       ARG  29 -12.129  -5.162   2.118
  216   1HD   ARG  29          1HD       ARG  29 -13.722  -5.789   0.379
  217   2HD   ARG  29          2HD       ARG  29 -14.532  -5.536   1.925
  218    HE   ARG  29           HE       ARG  29 -14.561  -3.165   0.370
  219   1HH1  ARG  29          1HH1      ARG  29 -16.048  -6.301   0.646
  220   2HH1  ARG  29          2HH1      ARG  29 -17.537  -5.803  -0.087
  221   1HH2  ARG  29          1HH2      ARG  29 -16.516  -2.498  -0.597
  222   2HH2  ARG  29          2HH2      ARG  29 -17.802  -3.640  -0.794
  223    H    LYS  30           H        LYS  30 -13.441  -3.142   5.894
  224    HA   LYS  30           HA       LYS  30 -13.828  -0.331   6.073
  225   1HB   LYS  30          1HB       LYS  30 -14.503  -2.698   7.746
  226   2HB   LYS  30          2HB       LYS  30 -14.514  -1.123   8.528
  227   1HG   LYS  30          1HG       LYS  30 -16.165  -0.305   7.002
  228   2HG   LYS  30          2HG       LYS  30 -16.056  -1.771   6.026
  229   1HD   LYS  30          1HD       LYS  30 -16.622  -2.806   8.473
  230   2HD   LYS  30          2HD       LYS  30 -17.493  -1.272   8.541
  231   1HE   LYS  30          1HE       LYS  30 -17.953  -2.432   5.992
  232   2HE   LYS  30          2HE       LYS  30 -18.221  -3.678   7.210
  233   1HZ   LYS  30          1HZ       LYS  30 -19.497  -1.623   8.314
  234   2HZ   LYS  30          2HZ       LYS  30 -20.248  -2.741   7.291
  235   3HZ   LYS  30          3HZ       LYS  30 -19.725  -1.253   6.679
  236    H    LYS  31           H        LYS  31 -11.663  -2.617   7.668
  237    HA   LYS  31           HA       LYS  31 -10.597  -0.861   9.585
  238   1HB   LYS  31          1HB       LYS  31 -10.207  -3.191   9.859
  239   2HB   LYS  31          2HB       LYS  31  -9.491  -3.332   8.259
  240   1HG   LYS  31          1HG       LYS  31  -7.585  -1.985   8.998
  241   2HG   LYS  31          2HG       LYS  31  -8.301  -1.869  10.608
  242   1HD   LYS  31          1HD       LYS  31  -7.620  -3.927  11.177
  243   2HD   LYS  31          2HD       LYS  31  -8.093  -4.610   9.620
  244   1HE   LYS  31          1HE       LYS  31  -5.712  -4.835   9.891
  245   2HE   LYS  31          2HE       LYS  31  -6.039  -3.653   8.625
  246   1HZ   LYS  31          1HZ       LYS  31  -5.180  -1.982   9.840
  247   2HZ   LYS  31          2HZ       LYS  31  -4.336  -3.227  10.611
  248   3HZ   LYS  31          3HZ       LYS  31  -5.738  -2.595  11.315
  249    H    ILE  32           H        ILE  32  -9.345  -1.785   6.380
  250    HA   ILE  32           HA       ILE  32  -7.144  -0.011   6.442
  251    HB   ILE  32           HB       ILE  32  -8.539  -1.486   4.234
  252   1HG1  ILE  32          1HG1      ILE  32  -5.699  -1.581   5.272
  253   2HG1  ILE  32          2HG1      ILE  32  -6.985  -2.673   5.773
  254   1HG2  ILE  32          1HG2      ILE  32  -6.387   0.594   3.958
  255   2HG2  ILE  32          2HG2      ILE  32  -6.670  -0.653   2.745
  256   3HG2  ILE  32          3HG2      ILE  32  -7.939   0.510   3.126
  257   1HD1  ILE  32          1HD1      ILE  32  -6.778  -2.641   2.915
  258   2HD1  ILE  32          2HD1      ILE  32  -5.210  -2.989   3.645
  259   3HD1  ILE  32          3HD1      ILE  32  -6.608  -3.989   4.040
  260    H    ARG  33           H        ARG  33 -10.437   0.283   5.208
  261    HA   ARG  33           HA       ARG  33 -10.033   2.816   3.967
  262   1HB   ARG  33          1HB       ARG  33 -11.841   1.417   3.213
  263   2HB   ARG  33          2HB       ARG  33 -12.539   1.368   4.827
  264   1HG   ARG  33          1HG       ARG  33 -13.160   3.666   4.710
  265   2HG   ARG  33          2HG       ARG  33 -12.260   3.887   3.208
  266   1HD   ARG  33          1HD       ARG  33 -13.944   3.100   1.967
  267   2HD   ARG  33          2HD       ARG  33 -14.209   1.734   3.048
  268    HE   ARG  33           HE       ARG  33 -15.926   2.890   4.007
  269   1HH1  ARG  33          1HH1      ARG  33 -13.884   5.132   2.297
  270   2HH1  ARG  33          2HH1      ARG  33 -14.937   6.485   2.548
  271   1HH2  ARG  33          1HH2      ARG  33 -17.321   4.664   4.345
  272   2HH2  ARG  33          2HH2      ARG  33 -16.891   6.217   3.714
  273    H    ASP  34           H        ASP  34 -10.582   1.793   7.195
  274    HA   ASP  34           HA       ASP  34 -11.414   4.473   8.036
  275   1HB   ASP  34          1HB       ASP  34 -11.356   1.811   9.455
  276   2HB   ASP  34          2HB       ASP  34 -11.666   3.326  10.297
  277    H    LEU  35           H        LEU  35  -8.611   3.182   7.298
  278    HA   LEU  35           HA       LEU  35  -7.013   3.505   9.614
  279   1HB   LEU  35          1HB       LEU  35  -6.482   3.305   6.685
  280   2HB   LEU  35          2HB       LEU  35  -5.181   3.802   7.765
  281    HG   LEU  35           HG       LEU  35  -6.711   1.212   7.999
  282   1HD1  LEU  35          1HD1      LEU  35  -3.985   1.765   6.838
  283   2HD1  LEU  35          2HD1      LEU  35  -5.415   1.237   5.951
  284   3HD1  LEU  35          3HD1      LEU  35  -4.667   0.166   7.136
  285   1HD2  LEU  35          1HD2      LEU  35  -5.793   2.017  10.112
  286   2HD2  LEU  35          2HD2      LEU  35  -4.205   2.195   9.363
  287   3HD2  LEU  35          3HD2      LEU  35  -4.921   0.593   9.543
  288    HA   PRO  36           HA       PRO  36  -6.336   7.832   9.885
  289   1HB   PRO  36          1HB       PRO  36  -3.696   7.974  10.501
  290   2HB   PRO  36          2HB       PRO  36  -4.919   7.405  11.643
  291   1HG   PRO  36          1HG       PRO  36  -3.051   5.820   9.923
  292   2HG   PRO  36          2HG       PRO  36  -3.499   5.563  11.619
  293   1HD   PRO  36          1HD       PRO  36  -4.589   4.136   9.592
  294   2HD   PRO  36          2HD       PRO  36  -5.489   4.537  11.069
  295    H    ILE  37           H        ILE  37  -6.386   9.144   8.176
  296    HA   ILE  37           HA       ILE  37  -4.909   8.698   5.795
  297    HB   ILE  37           HB       ILE  37  -5.708  11.016   5.177
  298   1HG1  ILE  37          1HG1      ILE  37  -7.238  10.780   7.775
  299   2HG1  ILE  37          2HG1      ILE  37  -5.846  11.831   7.539
  300   1HG2  ILE  37          1HG2      ILE  37  -8.234   9.889   5.838
  301   2HG2  ILE  37          2HG2      ILE  37  -7.390   9.877   4.289
  302   3HG2  ILE  37          3HG2      ILE  37  -7.120   8.578   5.450
  303   1HD1  ILE  37          1HD1      ILE  37  -7.440  12.577   5.473
  304   2HD1  ILE  37          2HD1      ILE  37  -8.626  12.174   6.715
  305   3HD1  ILE  37          3HD1      ILE  37  -7.377  13.374   7.045
  306    H    SER  38           H        SER  38  -4.415  10.723   8.617
  307    HA   SER  38           HA       SER  38  -2.356  12.342   7.554
  308   1HB   SER  38          1HB       SER  38  -3.614  11.914  10.131
  309   2HB   SER  38          2HB       SER  38  -1.871  12.117  10.302
  310    HG   SER  38           HG       SER  38  -2.268  14.161  10.078
  311    H    LEU  39           H        LEU  39  -2.422   9.094   8.687
  312    HA   LEU  39           HA       LEU  39   0.350   8.866   9.332
  313   1HB   LEU  39          1HB       LEU  39  -1.821   7.339   9.817
  314   2HB   LEU  39          2HB       LEU  39  -1.111   6.455   8.468
  315    HG   LEU  39           HG       LEU  39   0.714   7.163  10.686
  316   1HD1  LEU  39          1HD1      LEU  39  -1.279   6.517  11.923
  317   2HD1  LEU  39          2HD1      LEU  39  -0.034   5.274  12.047
  318   3HD1  LEU  39          3HD1      LEU  39  -1.409   5.040  10.967
  319   1HD2  LEU  39          1HD2      LEU  39   1.147   5.787   8.530
  320   2HD2  LEU  39          2HD2      LEU  39   0.342   4.485   9.406
  321   3HD2  LEU  39          3HD2      LEU  39   1.804   5.220  10.065
  322    H    PHE  40           H        PHE  40  -1.536   8.601   6.423
  323    HA   PHE  40           HA       PHE  40   0.923   7.943   4.940
  324   1HB   PHE  40          1HB       PHE  40  -1.839   7.196   3.995
  325   2HB   PHE  40          2HB       PHE  40  -0.288   6.597   3.416
  326    HD1  PHE  40           2HD      PHE  40  -2.810   6.364   6.054
  327    HD2  PHE  40           1HD      PHE  40   0.901   4.870   4.600
  328    HE1  PHE  40           2HE      PHE  40  -2.984   4.449   7.589
  329    HE2  PHE  40           1HE      PHE  40   0.733   2.951   6.132
  330    HZ   PHE  40           HZ       PHE  40  -1.211   2.740   7.630
  331    H    ASP  41           H        ASP  41   1.575   9.649   3.825
  332    HA   ASP  41           HA       ASP  41   0.161  11.978   3.365
  333   1HB   ASP  41          1HB       ASP  41   2.707  10.923   2.649
  334   2HB   ASP  41          2HB       ASP  41   1.987  11.620   1.201
  335    H    TYR  42           H        TYR  42   0.145   8.999   1.569
  336    HA   TYR  42           HA       TYR  42  -1.960  10.094  -0.151
  337   1HB   TYR  42          1HB       TYR  42   0.113  10.175  -1.461
  338   2HB   TYR  42          2HB       TYR  42   0.386   8.464  -1.150
  339    HD1  TYR  42           1HD      TYR  42  -2.883  10.005  -1.949
  340    HD2  TYR  42           2HD      TYR  42   0.369   7.664  -3.381
  341    HE1  TYR  42           1HE      TYR  42  -4.183   9.438  -3.958
  342    HE2  TYR  42           2HE      TYR  42  -0.922   7.092  -5.394
  343    HH   TYR  42           HH       TYR  42  -3.794   8.698  -6.255
  344    H    PHE  43           H        PHE  43  -3.702   8.846  -0.119
  345    HA   PHE  43           HA       PHE  43  -3.382   5.958   0.313
  346   1HB   PHE  43          1HB       PHE  43  -4.196   7.535   2.339
  347   2HB   PHE  43          2HB       PHE  43  -5.747   7.240   1.561
  348    HD1  PHE  43           1HD      PHE  43  -4.660   4.406   0.574
  349    HD2  PHE  43           2HD      PHE  43  -5.025   6.365   4.335
  350    HE1  PHE  43           1HE      PHE  43  -4.807   2.220   1.695
  351    HE2  PHE  43           2HE      PHE  43  -5.171   4.183   5.462
  352    HZ   PHE  43           HZ       PHE  43  -5.061   2.107   4.142
  353    H    ILE  44           H        ILE  44  -4.186   4.972  -1.410
  354    HA   ILE  44           HA       ILE  44  -6.768   5.863  -2.475
  355    HB   ILE  44           HB       ILE  44  -5.327   6.838  -4.056
  356   1HG1  ILE  44          1HG1      ILE  44  -5.611   4.292  -5.536
  357   2HG1  ILE  44          2HG1      ILE  44  -7.084   4.913  -4.798
  358   1HG2  ILE  44          1HG2      ILE  44  -3.206   6.028  -3.566
  359   2HG2  ILE  44          2HG2      ILE  44  -3.701   4.345  -3.740
  360   3HG2  ILE  44          3HG2      ILE  44  -3.525   5.364  -5.168
  361   1HD1  ILE  44          1HD1      ILE  44  -5.974   5.648  -7.240
  362   2HD1  ILE  44          2HD1      ILE  44  -7.317   6.422  -6.397
  363   3HD1  ILE  44          3HD1      ILE  44  -5.672   7.011  -6.162
  364    H    VAL  45           H        VAL  45  -8.124   4.211  -2.369
  365    HA   VAL  45           HA       VAL  45  -7.085   1.497  -2.870
  366    HB   VAL  45           HB       VAL  45  -9.464   1.985  -1.109
  367   1HG1  VAL  45          1HG1      VAL  45  -9.049  -0.279  -1.934
  368   2HG1  VAL  45          2HG1      VAL  45  -7.425  -0.235  -1.245
  369   3HG1  VAL  45          3HG1      VAL  45  -8.835  -0.184  -0.186
  370   1HG2  VAL  45          1HG2      VAL  45  -7.623   1.591   0.751
  371   2HG2  VAL  45          2HG2      VAL  45  -6.595   2.385  -0.442
  372   3HG2  VAL  45          3HG2      VAL  45  -8.026   3.209   0.176
  373    H    GLY  46           H        GLY  46  -8.205   0.225  -4.263
  374   1HA   GLY  46          1HA       GLY  46 -10.779   1.256  -5.272
  375   2HA   GLY  46          2HA       GLY  46  -9.512   0.758  -6.383
  376    H    GLU  47           H        GLU  47 -12.327  -0.227  -5.723
  377    HA   GLU  47           HA       GLU  47 -11.781  -2.963  -4.883
  378   1HB   GLU  47          1HB       GLU  47 -13.927  -1.290  -4.487
  379   2HB   GLU  47          2HB       GLU  47 -14.501  -2.337  -5.777
  380   1HG   GLU  47          1HG       GLU  47 -13.555  -3.135  -3.041
  381   2HG   GLU  47          2HG       GLU  47 -15.170  -3.308  -3.725
  382    H    GLU  48           H        GLU  48 -11.731  -4.689  -6.203
  383    HA   GLU  48           HA       GLU  48 -12.036  -4.182  -9.077
  384   1HB   GLU  48          1HB       GLU  48  -9.876  -5.049  -8.527
  385   2HB   GLU  48          2HB       GLU  48 -10.573  -6.329  -7.544
  386   1HG   GLU  48          1HG       GLU  48  -9.688  -6.978  -9.825
  387   2HG   GLU  48          2HG       GLU  48 -11.313  -7.521  -9.413
  388    H    GLY  49           H        GLY  49 -13.866  -4.803 -10.002
  389   1HA   GLY  49          1HA       GLY  49 -14.973  -7.415  -9.499
  390   2HA   GLY  49          2HA       GLY  49 -15.978  -6.108  -8.891
  391    H    ASN  50           H        ASN  50 -14.146  -6.860 -11.860
  392    HA   ASN  50           HA       ASN  50 -16.524  -6.039 -13.395
  393   1HB   ASN  50          1HB       ASN  50 -14.022  -4.821 -13.434
  394   2HB   ASN  50          2HB       ASN  50 -14.025  -5.834 -14.874
  395   1HD2  ASN  50          1HD2      ASN  50 -16.534  -3.958 -13.211
  396   2HD2  ASN  50          2HD2      ASN  50 -16.999  -3.034 -14.595
  397    H    GLU  51           H        GLU  51 -15.829  -8.695 -12.453
  398    HA   GLU  51           HA       GLU  51 -15.863 -10.048 -15.035
  399   1HB   GLU  51          1HB       GLU  51 -13.561 -10.009 -13.377
  400   2HB   GLU  51          2HB       GLU  51 -14.252 -11.623 -13.272
  401   1HG   GLU  51          1HG       GLU  51 -14.125 -11.904 -15.642
  402   2HG   GLU  51          2HG       GLU  51 -13.639 -10.224 -15.862
  403    H    GLU  52           H        GLU  52 -17.722 -11.120 -14.973
  404    HA   GLU  52           HA       GLU  52 -18.986 -11.922 -12.550
  405   1HB   GLU  52          1HB       GLU  52 -20.733 -12.788 -13.925
  406   2HB   GLU  52          2HB       GLU  52 -20.174 -11.299 -14.676
  407   1HG   GLU  52          1HG       GLU  52 -18.634 -12.959 -16.022
  408   2HG   GLU  52          2HG       GLU  52 -19.901 -14.108 -15.594
  409    H    GLY  53           H        GLY  53 -19.356 -14.004 -11.748
  410   1HA   GLY  53          1HA       GLY  53 -19.085 -16.345 -11.673
  411   2HA   GLY  53          2HA       GLY  53 -17.919 -16.229 -12.983
  412    H    ARG  54           H        ARG  54 -16.639 -13.937 -11.411
  413    HA   ARG  54           HA       ARG  54 -15.127 -15.660  -9.561
  414   1HB   ARG  54          1HB       ARG  54 -13.900 -14.799 -11.582
  415   2HB   ARG  54          2HB       ARG  54 -14.122 -13.174 -10.948
  416   1HG   ARG  54          1HG       ARG  54 -12.814 -13.707  -8.996
  417   2HG   ARG  54          2HG       ARG  54 -12.678 -15.389  -9.511
  418   1HD   ARG  54          1HD       ARG  54 -11.255 -14.861 -11.278
  419   2HD   ARG  54          2HD       ARG  54 -11.729 -13.163 -11.275
  420    HE   ARG  54           HE       ARG  54 -10.554 -13.535  -8.846
  421   1HH1  ARG  54          1HH1      ARG  54  -9.584 -14.073 -12.146
  422   2HH1  ARG  54          2HH1      ARG  54  -7.902 -13.798 -11.833
  423   1HH2  ARG  54          1HH2      ARG  54  -8.342 -13.171  -8.422
  424   2HH2  ARG  54          2HH2      ARG  54  -7.197 -13.286  -9.715
  425    H    THR  55           H        THR  55 -14.217 -14.613  -7.663
  426    HA   THR  55           HA       THR  55 -16.140 -12.832  -6.445
  427    HB   THR  55           HB       THR  55 -14.101 -13.099  -4.612
  428    HG1  THR  55           1HG      THR  55 -13.225 -15.078  -4.823
  429   1HG2  THR  55          1HG2      THR  55 -16.766 -14.117  -5.042
  430   2HG2  THR  55          2HG2      THR  55 -15.958 -13.698  -3.531
  431   3HG2  THR  55          3HG2      THR  55 -15.767 -15.312  -4.216
  432    HA   PRO  56           HA       PRO  56 -14.003  -9.020  -6.847
  433   1HB   PRO  56          1HB       PRO  56 -14.436  -7.859  -4.432
  434   2HB   PRO  56          2HB       PRO  56 -15.705  -8.051  -5.647
  435   1HG   PRO  56          1HG       PRO  56 -15.127  -9.721  -3.230
  436   2HG   PRO  56          2HG       PRO  56 -16.689  -9.158  -3.853
  437   1HD   PRO  56          1HD       PRO  56 -15.773 -11.672  -4.273
  438   2HD   PRO  56          2HD       PRO  56 -16.793 -10.818  -5.449
  439    H    HIS  57           H        HIS  57 -12.207  -7.731  -6.085
  440    HA   HIS  57           HA       HIS  57 -10.476  -9.004  -4.097
  441   1HB   HIS  57          1HB       HIS  57  -9.632  -9.930  -6.130
  442   2HB   HIS  57          2HB       HIS  57  -9.701  -8.370  -6.945
  443    HD1  HIS  57           1HD      HIS  57  -7.906  -6.567  -6.132
  444    HD2  HIS  57           2HD      HIS  57  -7.278 -10.464  -4.836
  445    HE1  HIS  57           1HE      HIS  57  -5.518  -6.638  -5.347
  446    H    LEU  58           H        LEU  58  -9.229  -7.602  -2.931
  447    HA   LEU  58           HA       LEU  58  -9.814  -4.767  -3.307
  448   1HB   LEU  58          1HB       LEU  58  -9.701  -6.350  -1.076
  449   2HB   LEU  58          2HB       LEU  58  -8.139  -5.536  -1.034
  450    HG   LEU  58           HG       LEU  58 -10.870  -4.264  -0.976
  451   1HD1  LEU  58          1HD1      LEU  58  -9.927  -3.331   1.169
  452   2HD1  LEU  58          2HD1      LEU  58  -8.613  -4.494   0.998
  453   3HD1  LEU  58          3HD1      LEU  58 -10.275  -5.060   1.168
  454   1HD2  LEU  58          1HD2      LEU  58  -8.168  -2.929  -1.109
  455   2HD2  LEU  58          2HD2      LEU  58  -9.719  -2.119  -0.888
  456   3HD2  LEU  58          3HD2      LEU  58  -9.369  -2.957  -2.401
  457    H    GLN  59           H        GLN  59  -8.455  -3.595  -4.476
  458    HA   GLN  59           HA       GLN  59  -5.571  -4.104  -4.209
  459   1HB   GLN  59          1HB       GLN  59  -6.118  -5.010  -6.338
  460   2HB   GLN  59          2HB       GLN  59  -7.148  -3.641  -6.735
  461   1HG   GLN  59          1HG       GLN  59  -5.115  -3.477  -7.983
  462   2HG   GLN  59          2HG       GLN  59  -5.149  -2.194  -6.775
  463   1HE2  GLN  59          1HE2      GLN  59  -3.783  -2.344  -4.969
  464   2HE2  GLN  59          2HE2      GLN  59  -2.384  -3.358  -4.978
  465    H    GLY  60           H        GLY  60  -4.669  -2.387  -3.293
  466   1HA   GLY  60          1HA       GLY  60  -5.264   0.267  -4.341
  467   2HA   GLY  60          2HA       GLY  60  -5.620   0.008  -2.639
  468    H    PHE  61           H        PHE  61  -3.879   1.958  -3.230
  469    HA   PHE  61           HA       PHE  61  -1.312   0.814  -2.367
  470   1HB   PHE  61          1HB       PHE  61  -0.857   1.369  -4.608
  471   2HB   PHE  61          2HB       PHE  61  -1.809   2.848  -4.527
  472    HD1  PHE  61           2HD      PHE  61   1.075   1.385  -2.655
  473    HD2  PHE  61           1HD      PHE  61  -0.575   4.765  -4.648
  474    HE1  PHE  61           2HE      PHE  61   3.116   2.667  -2.163
  475    HE2  PHE  61           1HE      PHE  61   1.465   6.052  -4.160
  476    HZ   PHE  61           HZ       PHE  61   3.313   5.004  -2.915
  477    H    ALA  62           H        ALA  62  -0.226   1.929  -0.797
  478    HA   ALA  62           HA       ALA  62  -1.354   4.487   0.101
  479   1HB   ALA  62          1HB       ALA  62  -0.702   3.346   2.475
  480   2HB   ALA  62          2HB       ALA  62  -2.327   3.372   1.789
  481   3HB   ALA  62          3HB       ALA  62  -1.302   1.952   1.577
  482    H    ASN  63           H        ASN  63   0.162   5.981   0.400
  483    HA   ASN  63           HA       ASN  63   2.963   5.170   0.375
  484   1HB   ASN  63          1HB       ASN  63   2.212   6.945  -1.170
  485   2HB   ASN  63          2HB       ASN  63   1.738   7.933   0.209
  486   1HD2  ASN  63          1HD2      ASN  63   3.986   7.704  -2.041
  487   2HD2  ASN  63          2HD2      ASN  63   5.371   8.293  -1.192
  488    H    PHE  64           H        PHE  64   4.037   4.921   2.208
  489    HA   PHE  64           HA       PHE  64   2.982   5.782   4.720
  490   1HB   PHE  64          1HB       PHE  64   5.147   4.079   3.781
  491   2HB   PHE  64          2HB       PHE  64   5.633   5.060   5.160
  492    HD1  PHE  64           2HD      PHE  64   4.346   4.908   7.285
  493    HD2  PHE  64           1HD      PHE  64   3.688   2.246   4.029
  494    HE1  PHE  64           2HE      PHE  64   3.206   3.341   8.801
  495    HE2  PHE  64           1HE      PHE  64   2.547   0.675   5.540
  496    HZ   PHE  64           HZ       PHE  64   2.305   1.221   7.929
  497    H    VAL  65           H        VAL  65   3.338   7.615   5.791
  498    HA   VAL  65           HA       VAL  65   4.653   9.804   4.636
  499    HB   VAL  65           HB       VAL  65   3.823   9.318   7.496
  500   1HG1  VAL  65          1HG1      VAL  65   3.939  11.967   7.393
  501   2HG1  VAL  65          2HG1      VAL  65   5.327  10.988   7.872
  502   3HG1  VAL  65          3HG1      VAL  65   5.213  11.612   6.226
  503   1HG2  VAL  65          1HG2      VAL  65   1.900  10.608   6.987
  504   2HG2  VAL  65          2HG2      VAL  65   2.561  11.109   5.431
  505   3HG2  VAL  65          3HG2      VAL  65   2.070   9.434   5.683
  506    H    LYS  66           H        LYS  66   5.821   7.225   6.622
  507    HA   LYS  66           HA       LYS  66   8.470   8.513   6.689
  508   1HB   LYS  66          1HB       LYS  66   8.848   7.139   8.801
  509   2HB   LYS  66          2HB       LYS  66   7.772   8.523   8.943
  510   1HG   LYS  66          1HG       LYS  66   6.513   5.929   8.302
  511   2HG   LYS  66          2HG       LYS  66   7.188   6.113   9.923
  512   1HD   LYS  66          1HD       LYS  66   5.507   8.322   8.866
  513   2HD   LYS  66          2HD       LYS  66   4.696   6.826   9.337
  514   1HE   LYS  66          1HE       LYS  66   5.327   7.034  11.556
  515   2HE   LYS  66          2HE       LYS  66   6.683   8.094  11.176
  516   1HZ   LYS  66          1HZ       LYS  66   4.089   8.810  11.938
  517   2HZ   LYS  66          2HZ       LYS  66   4.323   9.353  10.354
  518   3HZ   LYS  66          3HZ       LYS  66   5.391   9.828  11.577
  519    H    LYS  67           H        LYS  67  10.072   6.538   7.459
  520    HA   LYS  67           HA       LYS  67   9.925   4.683   5.221
  521   1HB   LYS  67          1HB       LYS  67  12.019   5.970   6.635
  522   2HB   LYS  67          2HB       LYS  67  12.214   4.240   6.888
  523   1HG   LYS  67          1HG       LYS  67  13.486   4.929   4.967
  524   2HG   LYS  67          2HG       LYS  67  12.147   3.900   4.450
  525   1HD   LYS  67          1HD       LYS  67  11.427   5.505   3.091
  526   2HD   LYS  67          2HD       LYS  67  11.252   6.603   4.462
  527   1HE   LYS  67          1HE       LYS  67  12.712   7.720   3.022
  528   2HE   LYS  67          2HE       LYS  67  13.774   6.991   4.226
  529   1HZ   LYS  67          1HZ       LYS  67  14.844   6.363   2.344
  530   2HZ   LYS  67          2HZ       LYS  67  13.441   6.334   1.399
  531   3HZ   LYS  67          3HZ       LYS  67  13.775   5.056   2.457
  532    H    GLN  68           H        GLN  68   9.162   2.690   5.413
  533    HA   GLN  68           HA       GLN  68   9.382   1.319   7.998
  534   1HB   GLN  68          1HB       GLN  68   6.893   1.492   6.293
  535   2HB   GLN  68          2HB       GLN  68   7.088   0.395   7.654
  536   1HG   GLN  68          1HG       GLN  68   7.748   2.945   8.612
  537   2HG   GLN  68          2HG       GLN  68   6.295   3.144   7.634
  538   1HE2  GLN  68          1HE2      GLN  68   5.054   0.726   8.064
  539   2HE2  GLN  68          2HE2      GLN  68   4.579   0.612   9.721
  540    H    THR  69           H        THR  69   9.320  -0.993   7.869
  541    HA   THR  69           HA       THR  69  10.409  -1.969   5.341
  542    HB   THR  69           HB       THR  69  11.300  -3.805   6.522
  543    HG1  THR  69           1HG      THR  69  10.457  -4.577   8.357
  544   1HG2  THR  69          1HG2      THR  69  12.470  -1.731   7.026
  545   2HG2  THR  69          2HG2      THR  69  12.482  -2.794   8.433
  546   3HG2  THR  69          3HG2      THR  69  11.377  -1.421   8.374
  547    H    PHE  70           H        PHE  70   9.813  -4.348   4.856
  548    HA   PHE  70           HA       PHE  70   7.098  -4.440   4.150
  549   1HB   PHE  70          1HB       PHE  70   8.458  -5.735   2.779
  550   2HB   PHE  70          2HB       PHE  70   9.333  -6.435   4.137
  551    HD1  PHE  70           1HD      PHE  70   6.145  -6.509   2.280
  552    HD2  PHE  70           2HD      PHE  70   8.632  -8.452   5.135
  553    HE1  PHE  70           1HE      PHE  70   4.707  -8.503   2.171
  554    HE2  PHE  70           2HE      PHE  70   7.199 -10.449   5.030
  555    HZ   PHE  70           HZ       PHE  70   5.234 -10.477   3.546
  556    H    ASN  71           H        ASN  71   8.866  -6.350   6.587
  557    HA   ASN  71           HA       ASN  71   6.619  -7.667   7.630
  558   1HB   ASN  71          1HB       ASN  71   9.413  -7.194   8.521
  559   2HB   ASN  71          2HB       ASN  71   8.256  -7.668   9.761
  560   1HD2  ASN  71          1HD2      ASN  71   9.986  -8.637   6.932
  561   2HD2  ASN  71          2HD2      ASN  71   9.582 -10.316   7.003
  562    H    LYS  72           H        LYS  72   8.192  -4.639   8.557
  563    HA   LYS  72           HA       LYS  72   6.642  -4.134  10.857
  564   1HB   LYS  72          1HB       LYS  72   8.828  -2.992   9.919
  565   2HB   LYS  72          2HB       LYS  72   7.677  -1.889   9.176
  566   1HG   LYS  72          1HG       LYS  72   7.477  -2.490  12.092
  567   2HG   LYS  72          2HG       LYS  72   8.689  -1.348  11.507
  568   1HD   LYS  72          1HD       LYS  72   7.112   0.174  10.807
  569   2HD   LYS  72          2HD       LYS  72   5.868  -1.059  10.581
  570   1HE   LYS  72          1HE       LYS  72   5.259   0.260  12.476
  571   2HE   LYS  72          2HE       LYS  72   5.784  -1.317  13.063
  572   1HZ   LYS  72          1HZ       LYS  72   6.794   1.219  13.724
  573   2HZ   LYS  72          2HZ       LYS  72   8.025   0.336  12.972
  574   3HZ   LYS  72          3HZ       LYS  72   7.250  -0.289  14.340
  575    H    VAL  73           H        VAL  73   6.299  -2.995   7.504
  576    HA   VAL  73           HA       VAL  73   4.069  -1.384   7.812
  577    HB   VAL  73           HB       VAL  73   4.966  -3.073   5.487
  578   1HG1  VAL  73          1HG1      VAL  73   2.670  -2.951   5.077
  579   2HG1  VAL  73          2HG1      VAL  73   2.547  -1.315   5.727
  580   3HG1  VAL  73          3HG1      VAL  73   3.336  -1.591   4.174
  581   1HG2  VAL  73          1HG2      VAL  73   6.147  -0.919   6.393
  582   2HG2  VAL  73          2HG2      VAL  73   5.938  -1.159   4.658
  583   3HG2  VAL  73          3HG2      VAL  73   4.844  -0.092   5.539
  584    H    LYS  74           H        LYS  74   4.312  -4.844   7.833
  585    HA   LYS  74           HA       LYS  74   1.632  -5.490   7.245
  586   1HB   LYS  74          1HB       LYS  74   3.580  -7.009   8.989
  587   2HB   LYS  74          2HB       LYS  74   2.124  -7.661   8.249
  588   1HG   LYS  74          1HG       LYS  74   3.452  -6.662   6.087
  589   2HG   LYS  74          2HG       LYS  74   4.776  -7.220   7.112
  590   1HD   LYS  74          1HD       LYS  74   4.383  -9.291   6.403
  591   2HD   LYS  74          2HD       LYS  74   2.813  -9.227   7.209
  592   1HE   LYS  74          1HE       LYS  74   3.451  -8.499   4.356
  593   2HE   LYS  74          2HE       LYS  74   2.445  -9.830   4.927
  594   1HZ   LYS  74          1HZ       LYS  74   0.981  -8.059   5.927
  595   2HZ   LYS  74          2HZ       LYS  74   0.975  -8.155   4.239
  596   3HZ   LYS  74          3HZ       LYS  74   1.850  -6.931   5.013
  597    H    TRP  75           H        TRP  75   2.969  -3.903   9.892
  598    HA   TRP  75           HA       TRP  75   1.268  -4.854  11.961
  599   1HB   TRP  75          1HB       TRP  75   2.169  -3.142  13.297
  600   2HB   TRP  75          2HB       TRP  75   3.472  -3.549  12.183
  601    HD1  TRP  75           HD       TRP  75   2.515  -1.834   9.676
  602    HE1  TRP  75           1HE      TRP  75   2.678   0.733   9.767
  603    HE3  TRP  75           3HE      TRP  75   2.650  -1.208  14.748
  604    HZ2  TRP  75           2HZ      TRP  75   2.842   2.756  11.729
  605    HZ3  TRP  75           3HZ      TRP  75   2.811   1.075  15.651
  606    HH2  TRP  75           HH       TRP  75   2.905   3.015  14.171
  607    H    TYR  76           H        TYR  76   0.810  -2.704   9.332
  608    HA   TYR  76           HA       TYR  76  -1.700  -1.726  10.525
  609   1HB   TYR  76          1HB       TYR  76   0.374  -0.414   8.931
  610   2HB   TYR  76          2HB       TYR  76  -1.251  -0.141   8.313
  611    HD1  TYR  76           2HD      TYR  76  -2.777  -0.114  10.877
  612    HD2  TYR  76           1HD      TYR  76   0.943   1.670   9.836
  613    HE1  TYR  76           2HE      TYR  76  -3.137   1.619  12.585
  614    HE2  TYR  76           1HE      TYR  76   0.593   3.408  11.541
  615    HH   TYR  76           HH       TYR  76  -0.915   3.422  13.871
  616    H    LEU  77           H        LEU  77  -0.245  -2.697   7.424
  617    HA   LEU  77           HA       LEU  77  -2.718  -2.959   6.063
  618   1HB   LEU  77          1HB       LEU  77   0.059  -3.962   5.525
  619   2HB   LEU  77          2HB       LEU  77  -1.293  -4.371   4.470
  620    HG   LEU  77           HG       LEU  77  -0.471  -1.536   5.070
  621   1HD1  LEU  77          1HD1      LEU  77   1.168  -3.248   3.804
  622   2HD1  LEU  77          2HD1      LEU  77   1.049  -1.535   3.405
  623   3HD1  LEU  77          3HD1      LEU  77   0.167  -2.726   2.449
  624   1HD2  LEU  77          1HD2      LEU  77  -1.676  -1.264   2.814
  625   2HD2  LEU  77          2HD2      LEU  77  -2.654  -1.517   4.259
  626   3HD2  LEU  77          3HD2      LEU  77  -2.356  -2.856   3.149
  627    H    GLY  78           H        GLY  78  -0.739  -5.164   7.948
  628   1HA   GLY  78          1HA       GLY  78  -1.552  -7.063   9.068
  629   2HA   GLY  78          2HA       GLY  78  -2.979  -7.030   8.042
  630    H    ALA  79           H        ALA  79  -1.235  -9.276   8.727
  631    HA   ALA  79           HA       ALA  79   0.338  -9.902   6.415
  632   1HB   ALA  79          1HB       ALA  79  -0.213 -11.101   9.003
  633   2HB   ALA  79          2HB       ALA  79  -0.126 -12.293   7.707
  634   3HB   ALA  79          3HB       ALA  79   1.229 -11.201   7.992
  635    H    ARG  80           H        ARG  80  -2.966 -10.359   7.369
  636    HA   ARG  80           HA       ARG  80  -3.746 -12.530   5.854
  637   1HB   ARG  80          1HB       ARG  80  -5.319  -9.986   6.296
  638   2HB   ARG  80          2HB       ARG  80  -5.987 -11.548   5.840
  639   1HG   ARG  80          1HG       ARG  80  -4.540 -12.082   8.139
  640   2HG   ARG  80          2HG       ARG  80  -5.298 -10.519   8.452
  641   1HD   ARG  80          1HD       ARG  80  -6.941 -11.961   9.164
  642   2HD   ARG  80          2HD       ARG  80  -7.426 -11.689   7.491
  643    HE   ARG  80           HE       ARG  80  -6.985 -13.889   7.041
  644   1HH1  ARG  80          1HH1      ARG  80  -5.511 -13.025  10.075
  645   2HH1  ARG  80          2HH1      ARG  80  -5.063 -14.651  10.469
  646   1HH2  ARG  80          1HH2      ARG  80  -6.400 -16.035   7.550
  647   2HH2  ARG  80          2HH2      ARG  80  -5.568 -16.362   9.032
  648    H    CYS  81           H        CYS  81  -3.219  -9.196   4.842
  649    HA   CYS  81           HA       CYS  81  -3.879  -9.927   2.079
  650   1HB   CYS  81          1HB       CYS  81  -4.080  -7.594   1.616
  651   2HB   CYS  81          2HB       CYS  81  -4.918  -7.885   3.135
  652    HG   CYS  81           HG       CYS  81  -2.678  -6.974   4.672
  653    H    HIS  82           H        HIS  82  -2.413  -9.771   0.424
  654    HA   HIS  82           HA       HIS  82   0.361  -9.936   1.164
  655   1HB   HIS  82          1HB       HIS  82  -0.743 -11.324  -0.638
  656   2HB   HIS  82          2HB       HIS  82  -0.788  -9.868  -1.629
  657    HD1  HIS  82           1HD      HIS  82   1.906 -11.724   0.334
  658    HD2  HIS  82           2HD      HIS  82   1.323  -9.792  -3.298
  659    HE1  HIS  82           1HE      HIS  82   4.087 -11.940  -0.900
  660    H    ILE  83           H        ILE  83   1.806  -8.345   1.177
  661    HA   ILE  83           HA       ILE  83   1.092  -5.809  -0.142
  662    HB   ILE  83           HB       ILE  83   2.509  -4.669   1.492
  663   1HG1  ILE  83          1HG1      ILE  83   2.767  -7.341   2.881
  664   2HG1  ILE  83          2HG1      ILE  83   4.028  -6.644   1.870
  665   1HG2  ILE  83          1HG2      ILE  83   0.243  -4.728   2.100
  666   2HG2  ILE  83          2HG2      ILE  83   0.319  -6.432   2.543
  667   3HG2  ILE  83          3HG2      ILE  83   1.113  -5.223   3.552
  668   1HD1  ILE  83          1HD1      ILE  83   4.455  -6.254   4.229
  669   2HD1  ILE  83          2HD1      ILE  83   4.181  -4.736   3.375
  670   3HD1  ILE  83          3HD1      ILE  83   2.907  -5.423   4.382
  671    H    GLU  84           H        GLU  84   2.658  -4.694  -1.307
  672    HA   GLU  84           HA       GLU  84   5.296  -5.884  -1.618
  673   1HB   GLU  84          1HB       GLU  84   3.493  -6.807  -3.320
  674   2HB   GLU  84          2HB       GLU  84   3.817  -5.287  -4.142
  675   1HG   GLU  84          1HG       GLU  84   6.148  -5.840  -4.352
  676   2HG   GLU  84          2HG       GLU  84   5.921  -7.305  -3.398
  677    H    LYS  85           H        LYS  85   6.717  -4.514  -3.004
  678    HA   LYS  85           HA       LYS  85   6.428  -1.766  -2.238
  679   1HB   LYS  85          1HB       LYS  85   8.524  -3.483  -3.310
  680   2HB   LYS  85          2HB       LYS  85   8.528  -1.888  -4.051
  681   1HG   LYS  85          1HG       LYS  85   9.237  -0.874  -2.177
  682   2HG   LYS  85          2HG       LYS  85   8.268  -1.908  -1.124
  683   1HD   LYS  85          1HD       LYS  85  10.559  -2.382  -0.670
  684   2HD   LYS  85          2HD       LYS  85   9.912  -3.749  -1.580
  685   1HE   LYS  85          1HE       LYS  85  10.837  -2.066  -3.552
  686   2HE   LYS  85          2HE       LYS  85  12.032  -1.870  -2.270
  687   1HZ   LYS  85          1HZ       LYS  85  11.196  -4.421  -3.539
  688   2HZ   LYS  85          2HZ       LYS  85  12.237  -4.313  -2.211
  689   3HZ   LYS  85          3HZ       LYS  85  12.695  -3.653  -3.699
  690    H    ALA  86           H        ALA  86   5.736  -0.079  -3.414
  691    HA   ALA  86           HA       ALA  86   4.665  -0.628  -6.072
  692   1HB   ALA  86          1HB       ALA  86   3.771   0.898  -3.912
  693   2HB   ALA  86          2HB       ALA  86   4.221   2.065  -5.156
  694   3HB   ALA  86          3HB       ALA  86   3.052   0.796  -5.520
  695    H    LYS  87           H        LYS  87   5.001   0.899  -7.825
  696    HA   LYS  87           HA       LYS  87   7.341   2.618  -7.644
  697   1HB   LYS  87          1HB       LYS  87   8.558   1.584  -9.407
  698   2HB   LYS  87          2HB       LYS  87   8.135   0.305  -8.275
  699   1HG   LYS  87          1HG       LYS  87   6.025   0.289 -10.033
  700   2HG   LYS  87          2HG       LYS  87   7.408   0.645 -11.070
  701   1HD   LYS  87          1HD       LYS  87   8.580  -1.310 -10.050
  702   2HD   LYS  87          2HD       LYS  87   7.083  -1.700  -9.200
  703   1HE   LYS  87          1HE       LYS  87   7.022  -3.051 -11.103
  704   2HE   LYS  87          2HE       LYS  87   5.991  -1.683 -11.520
  705   1HZ   LYS  87          1HZ       LYS  87   8.729  -1.245 -12.224
  706   2HZ   LYS  87          2HZ       LYS  87   7.338  -1.109 -13.176
  707   3HZ   LYS  87          3HZ       LYS  87   8.089  -2.613 -12.986
  708    H    GLY  88           H        GLY  88   7.344   4.284  -9.122
  709   1HA   GLY  88          1HA       GLY  88   6.560   5.029 -11.372
  710   2HA   GLY  88          2HA       GLY  88   4.989   4.392 -10.906
  711    H    THR  89           H        THR  89   4.635   6.768 -11.652
  712    HA   THR  89           HA       THR  89   5.151   8.700  -9.535
  713    HB   THR  89           HB       THR  89   4.389  10.386 -11.021
  714    HG1  THR  89           1HG      THR  89   3.222   8.227 -12.444
  715   1HG2  THR  89          1HG2      THR  89   6.588   9.272 -11.567
  716   2HG2  THR  89          2HG2      THR  89   5.826  10.136 -12.903
  717   3HG2  THR  89          3HG2      THR  89   5.732   8.377 -12.822
  718    H    ASP  90           H        ASP  90   3.202  10.255  -9.135
  719    HA   ASP  90           HA       ASP  90   1.295   8.910  -7.640
  720   1HB   ASP  90          1HB       ASP  90  -0.022  11.131  -7.892
  721   2HB   ASP  90          2HB       ASP  90   1.551  11.167  -7.101
  722    H    GLN  91           H        GLN  91   1.135  10.040 -10.981
  723    HA   GLN  91           HA       GLN  91  -1.600   9.388 -11.376
  724   1HB   GLN  91          1HB       GLN  91   0.699  10.006 -13.198
  725   2HB   GLN  91          2HB       GLN  91  -0.821   9.423 -13.863
  726   1HG   GLN  91          1HG       GLN  91  -0.569  11.843 -12.095
  727   2HG   GLN  91          2HG       GLN  91  -0.578  11.894 -13.857
  728   1HE2  GLN  91          1HE2      GLN  91  -2.447  11.889 -11.058
  729   2HE2  GLN  91          2HE2      GLN  91  -4.001  11.718 -11.793
  730    H    GLN  92           H        GLN  92   1.415   7.635 -11.800
  731    HA   GLN  92           HA       GLN  92   0.364   5.445 -13.239
  732   1HB   GLN  92          1HB       GLN  92   2.850   5.995 -11.705
  733   2HB   GLN  92          2HB       GLN  92   2.453   4.310 -12.017
  734   1HG   GLN  92          1HG       GLN  92   3.969   5.505 -13.679
  735   2HG   GLN  92          2HG       GLN  92   2.621   4.568 -14.322
  736   1HE2  GLN  92          1HE2      GLN  92   4.142   7.580 -14.219
  737   2HE2  GLN  92          2HE2      GLN  92   2.953   8.488 -15.081
  738    H    ASN  93           H        ASN  93   0.791   6.051  -9.782
  739    HA   ASN  93           HA       ASN  93  -0.197   3.454  -9.030
  740   1HB   ASN  93          1HB       ASN  93   0.613   5.927  -7.531
  741   2HB   ASN  93          2HB       ASN  93  -0.247   4.631  -6.704
  742   1HD2  ASN  93          1HD2      ASN  93   2.192   4.482  -9.257
  743   2HD2  ASN  93          2HD2      ASN  93   3.339   3.564  -8.349
  744    H    LYS  94           H        LYS  94  -1.450   6.767  -9.037
  745    HA   LYS  94           HA       LYS  94  -3.920   6.225  -7.815
  746   1HB   LYS  94          1HB       LYS  94  -3.003   8.496  -8.118
  747   2HB   LYS  94          2HB       LYS  94  -3.258   8.360  -9.853
  748   1HG   LYS  94          1HG       LYS  94  -5.523   8.608  -9.682
  749   2HG   LYS  94          2HG       LYS  94  -5.582   7.954  -8.044
  750   1HD   LYS  94          1HD       LYS  94  -5.144   9.961  -7.083
  751   2HD   LYS  94          2HD       LYS  94  -4.088  10.480  -8.398
  752   1HE   LYS  94          1HE       LYS  94  -5.740  11.658  -9.300
  753   2HE   LYS  94          2HE       LYS  94  -6.756  10.221  -9.385
  754   1HZ   LYS  94          1HZ       LYS  94  -6.469  11.926  -6.972
  755   2HZ   LYS  94          2HZ       LYS  94  -7.539  10.633  -7.175
  756   3HZ   LYS  94          3HZ       LYS  94  -7.741  12.047  -8.080
  757    H    GLU  95           H        GLU  95  -2.958   6.255 -11.228
  758    HA   GLU  95           HA       GLU  95  -5.559   5.661 -12.221
  759   1HB   GLU  95          1HB       GLU  95  -2.814   5.445 -13.457
  760   2HB   GLU  95          2HB       GLU  95  -4.292   5.076 -14.334
  761   1HG   GLU  95          1HG       GLU  95  -5.074   7.343 -14.046
  762   2HG   GLU  95          2HG       GLU  95  -3.662   7.731 -13.065
  763    H    TYR  96           H        TYR  96  -2.778   3.727 -11.286
  764    HA   TYR  96           HA       TYR  96  -3.520   1.272 -12.372
  765   1HB   TYR  96          1HB       TYR  96  -1.319   1.670 -11.379
  766   2HB   TYR  96          2HB       TYR  96  -2.050   1.821  -9.784
  767    HD1  TYR  96           2HD      TYR  96  -1.207  -0.525 -12.493
  768    HD2  TYR  96           1HD      TYR  96  -2.697  -0.118  -8.528
  769    HE1  TYR  96           2HE      TYR  96  -0.948  -2.947 -12.153
  770    HE2  TYR  96           1HE      TYR  96  -2.441  -2.539  -8.177
  771    HH   TYR  96           HH       TYR  96  -1.127  -4.636 -10.727
  772    H    CYS  97           H        CYS  97  -4.281   2.641  -9.181
  773    HA   CYS  97           HA       CYS  97  -5.836   0.435  -8.317
  774   1HB   CYS  97          1HB       CYS  97  -5.890   3.312  -7.381
  775   2HB   CYS  97          2HB       CYS  97  -6.612   1.950  -6.533
  776    HG   CYS  97           HG       CYS  97  -3.338   2.777  -6.839
  777    H    SER  98           H        SER  98  -6.578   3.392 -10.054
  778    HA   SER  98           HA       SER  98  -9.424   3.062  -9.875
  779   1HB   SER  98          1HB       SER  98  -8.177   5.267 -10.197
  780   2HB   SER  98          2HB       SER  98  -7.954   4.779 -11.877
  781    HG   SER  98           HG       SER  98  -9.836   6.085 -11.526
  782    H    LYS  99           H        LYS  99  -6.996   1.635 -11.726
  783    HA   LYS  99           HA       LYS  99  -8.180   1.298 -14.227
  784   1HB   LYS  99          1HB       LYS  99  -5.851   0.693 -13.741
  785   2HB   LYS  99          2HB       LYS  99  -6.400  -0.626 -12.716
  786   1HG   LYS  99          1HG       LYS  99  -7.454  -1.677 -14.677
  787   2HG   LYS  99          2HG       LYS  99  -6.818  -0.378 -15.688
  788   1HD   LYS  99          1HD       LYS  99  -5.384  -2.332 -15.829
  789   2HD   LYS  99          2HD       LYS  99  -4.533  -1.009 -15.029
  790   1HE   LYS  99          1HE       LYS  99  -4.298  -2.177 -13.140
  791   2HE   LYS  99          2HE       LYS  99  -5.986  -2.686 -13.154
  792   1HZ   LYS  99          1HZ       LYS  99  -5.487  -4.623 -14.159
  793   2HZ   LYS  99          2HZ       LYS  99  -3.959  -4.361 -13.482
  794   3HZ   LYS  99          3HZ       LYS  99  -4.247  -3.964 -15.101
  795    H    GLU 100           H        GLU 100  -8.977  -0.092 -11.179
  796    HA   GLU 100           HA       GLU 100 -10.334  -2.401 -12.163
  797   1HB   GLU 100          1HB       GLU 100 -10.539  -0.955  -9.517
  798   2HB   GLU 100          2HB       GLU 100 -11.304  -2.498  -9.868
  799   1HG   GLU 100          1HG       GLU 100  -9.320  -3.645  -9.860
  800   2HG   GLU 100          2HG       GLU 100  -8.369  -2.219 -10.271
  801    H    GLY 101           H        GLY 101 -11.124   0.927 -11.936
  802   1HA   GLY 101          1HA       GLY 101 -12.969   1.979 -12.900
  803   2HA   GLY 101          2HA       GLY 101 -13.731   0.408 -13.097
  804    H    ASN 102           H        ASN 102 -12.730   0.381 -10.012
  805    HA   ASN 102           HA       ASN 102 -15.102   1.774  -8.977
  806   1HB   ASN 102          1HB       ASN 102 -14.979  -0.958  -9.187
  807   2HB   ASN 102          2HB       ASN 102 -14.404  -0.695  -7.543
  808   1HD2  ASN 102          1HD2      ASN 102 -16.691  -2.050  -7.881
  809   2HD2  ASN 102          2HD2      ASN 102 -18.048  -1.093  -7.402
  810    H    LEU 103           H        LEU 103 -14.608   3.142  -7.401
  811    HA   LEU 103           HA       LEU 103 -11.992   2.923  -6.109
  812   1HB   LEU 103          1HB       LEU 103 -13.591   5.082  -7.039
  813   2HB   LEU 103          2HB       LEU 103 -13.384   5.260  -5.298
  814    HG   LEU 103           HG       LEU 103 -11.713   6.492  -6.682
  815   1HD1  LEU 103          1HD1      LEU 103 -11.117   4.571  -4.533
  816   2HD1  LEU 103          2HD1      LEU 103 -10.827   6.308  -4.622
  817   3HD1  LEU 103          3HD1      LEU 103  -9.722   5.188  -5.419
  818   1HD2  LEU 103          1HD2      LEU 103 -10.028   4.210  -7.200
  819   2HD2  LEU 103          2HD2      LEU 103 -10.541   5.500  -8.289
  820   3HD2  LEU 103          3HD2      LEU 103 -11.559   4.076  -8.066
  821    H    LEU 104           H        LEU 104 -11.754   2.387  -4.030
  822    HA   LEU 104           HA       LEU 104 -14.177   1.923  -2.450
  823   1HB   LEU 104          1HB       LEU 104 -12.158   0.250  -2.911
  824   2HB   LEU 104          2HB       LEU 104 -11.505   1.063  -1.490
  825    HG   LEU 104           HG       LEU 104 -12.630  -1.027  -0.908
  826   1HD1  LEU 104          1HD1      LEU 104 -14.426   1.116   0.123
  827   2HD1  LEU 104          2HD1      LEU 104 -12.703   1.179   0.490
  828   3HD1  LEU 104          3HD1      LEU 104 -13.658  -0.221   0.980
  829   1HD2  LEU 104          1HD2      LEU 104 -14.470  -0.275  -2.839
  830   2HD2  LEU 104          2HD2      LEU 104 -15.346  -0.106  -1.317
  831   3HD2  LEU 104          3HD2      LEU 104 -14.599  -1.648  -1.740
  832    H    MET 105           H        MET 105 -11.219   3.773  -2.511
  833    HA   MET 105           HA       MET 105 -12.236   5.554  -0.498
  834   1HB   MET 105          1HB       MET 105 -11.329   4.140   1.112
  835   2HB   MET 105          2HB       MET 105  -9.974   3.680   0.091
  836   1HG   MET 105          1HG       MET 105  -8.719   5.439   0.723
  837   2HG   MET 105          2HG       MET 105 -10.105   6.519   0.856
  838   1HE   MET 105          1HE       MET 105  -7.790   4.619   4.096
  839   2HE   MET 105          2HE       MET 105  -8.375   3.371   2.995
  840   3HE   MET 105          3HE       MET 105  -7.463   4.745   2.367
  841    H    GLU 106           H        GLU 106 -11.439   7.578  -0.751
  842    HA   GLU 106           HA       GLU 106  -9.060   7.921  -2.444
  843   1HB   GLU 106          1HB       GLU 106 -11.338   8.276  -3.618
  844   2HB   GLU 106          2HB       GLU 106 -11.430   9.755  -2.671
  845   1HG   GLU 106          1HG       GLU 106  -9.086  10.238  -3.657
  846   2HG   GLU 106          2HG       GLU 106  -9.533   9.027  -4.858
  847    H    CYS 107           H        CYS 107  -7.617   8.730  -1.052
  848    HA   CYS 107           HA       CYS 107  -8.193  11.283   0.200
  849   1HB   CYS 107          1HB       CYS 107  -7.663   8.766   1.739
  850   2HB   CYS 107          2HB       CYS 107  -7.095  10.306   2.371
  851    HG   CYS 107           HG       CYS 107  -9.463   9.689   3.680
  852    H    GLY 108           H        GLY 108  -6.097  11.970   1.492
  853   1HA   GLY 108          1HA       GLY 108  -3.847  12.448   1.438
  854   2HA   GLY 108          2HA       GLY 108  -3.606  10.927   0.592
  855    H    ALA 109           H        ALA 109  -1.976  12.748  -0.252
  856    HA   ALA 109           HA       ALA 109  -3.201  13.998  -2.620
  857   1HB   ALA 109          1HB       ALA 109  -1.183  14.893  -0.725
  858   2HB   ALA 109          2HB       ALA 109  -0.676  15.073  -2.405
  859   3HB   ALA 109          3HB       ALA 109  -2.173  15.823  -1.851
  860    HA   PRO 110           HA       PRO 110  -0.942  11.446  -5.382
  861   1HB   PRO 110          1HB       PRO 110  -0.249  13.187  -7.346
  862   2HB   PRO 110          2HB       PRO 110  -1.906  12.621  -7.104
  863   1HG   PRO 110          1HG       PRO 110  -0.636  15.189  -6.237
  864   2HG   PRO 110          2HG       PRO 110  -2.236  14.918  -6.952
  865   1HD   PRO 110          1HD       PRO 110  -1.871  15.286  -4.294
  866   2HD   PRO 110          2HD       PRO 110  -3.157  14.252  -4.947
  867    H    ARG 111           H        ARG 111   0.888  10.848  -4.205
  868    HA   ARG 111           HA       ARG 111   3.141  12.555  -3.860
  869   1HB   ARG 111          1HB       ARG 111   2.578   9.654  -3.408
  870   2HB   ARG 111          2HB       ARG 111   4.248  10.206  -3.400
  871   1HG   ARG 111          1HG       ARG 111   2.500  11.871  -1.778
  872   2HG   ARG 111          2HG       ARG 111   2.540  10.186  -1.254
  873   1HD   ARG 111          1HD       ARG 111   4.428  10.697  -0.185
  874   2HD   ARG 111          2HD       ARG 111   5.188  10.769  -1.774
  875    HE   ARG 111           HE       ARG 111   4.482  12.997  -0.074
  876   1HH1  ARG 111          1HH1      ARG 111   5.322  11.938  -3.282
  877   2HH1  ARG 111          2HH1      ARG 111   5.867  13.501  -3.796
  878   1HH2  ARG 111          1HH2      ARG 111   5.196  15.059  -0.739
  879   2HH2  ARG 111          2HH2      ARG 111   5.796  15.275  -2.348
  880    H    SER 112           H        SER 112   4.569  13.126  -5.348
  881    HA   SER 112           HA       SER 112   4.806  11.530  -7.790
  882   1HB   SER 112          1HB       SER 112   6.277  14.090  -7.561
  883   2HB   SER 112          2HB       SER 112   5.317  13.455  -8.897
  884    HG   SER 112           HG       SER 112   4.427  15.322  -7.740
  885    H    GLN 113           H        GLN 113   7.162  11.759  -8.762
  886    HA   GLN 113           HA       GLN 113   8.942  10.614  -6.738
  887   1HB   GLN 113          1HB       GLN 113   8.542   9.247  -8.718
  888   2HB   GLN 113          2HB       GLN 113   9.087  10.557  -9.757
  889   1HG   GLN 113          1HG       GLN 113  11.311  10.398  -8.568
  890   2HG   GLN 113          2HG       GLN 113  10.715   8.898  -7.859
  891   1HE2  GLN 113          1HE2      GLN 113  12.587   7.991  -8.972
  892   2HE2  GLN 113          2HE2      GLN 113  12.428   7.533 -10.631
  893    H    GLY 114           H        GLY 114   8.652  13.279  -8.977
  894   1HA   GLY 114          1HA       GLY 114   9.759  15.356  -8.542
  895   2HA   GLY 114          2HA       GLY 114  11.060  14.460  -7.773
  896    H    GLN 115           H        GLN 115  12.626  15.518  -9.030
  897    HA   GLN 115           HA       GLN 115  13.000  14.317 -11.648
  898   1HB   GLN 115          1HB       GLN 115  11.965  16.932 -11.402
  899   2HB   GLN 115          2HB       GLN 115  13.644  17.107 -11.894
  900   1HG   GLN 115          1HG       GLN 115  13.054  15.327 -13.675
  901   2HG   GLN 115          2HG       GLN 115  11.386  15.779 -13.326
  902   1HE2  GLN 115          1HE2      GLN 115  13.748  16.283 -15.434
  903   2HE2  GLN 115          2HE2      GLN 115  13.419  17.910 -15.913
  904    H    ARG 116           H        ARG 116  15.179  15.303 -12.589
  905    HA   ARG 116           HA       ARG 116  17.242  14.441 -10.947
  906   1HB   ARG 116          1HB       ARG 116  17.254  14.816 -13.477
  907   2HB   ARG 116          2HB       ARG 116  17.608  16.500 -13.116
  908   1HG   ARG 116          1HG       ARG 116  19.701  15.993 -12.220
  909   2HG   ARG 116          2HG       ARG 116  19.300  14.286 -12.019
  910   1HD   ARG 116          1HD       ARG 116  19.653  15.718 -14.651
  911   2HD   ARG 116          2HD       ARG 116  20.835  14.650 -13.895
  912    HE   ARG 116           HE       ARG 116  18.304  13.380 -14.275
  913   1HH1  ARG 116          1HH1      ARG 116  21.277  14.270 -15.853
  914   2HH1  ARG 116          2HH1      ARG 116  21.175  13.012 -17.041
  915   1HH2  ARG 116          1HH2      ARG 116  18.159  11.720 -15.833
  916   2HH2  ARG 116          2HH2      ARG 116  19.401  11.563 -17.029
  Start of MODEL   21
    1    HA   PRO   2           HA       PRO   2  33.232   5.765  19.375
    2   1HB   PRO   2          1HB       PRO   2  30.569   6.037  18.922
    3   2HB   PRO   2          2HB       PRO   2  31.331   6.469  20.457
    4   1HG   PRO   2          1HG       PRO   2  30.530   8.236  18.178
    5   2HG   PRO   2          2HG       PRO   2  30.326   8.495  19.920
    6   1HD   PRO   2          1HD       PRO   2  32.312   9.661  18.496
    7   2HD   PRO   2          2HD       PRO   2  32.504   9.195  20.199
    8    H    SER   3           H        SER   3  31.657   4.263  18.044
    9    HA   SER   3           HA       SER   3  31.930   4.852  15.178
   10   1HB   SER   3          1HB       SER   3  32.930   2.799  14.686
   11   2HB   SER   3          2HB       SER   3  33.729   3.259  16.189
   12    HG   SER   3           HG       SER   3  32.742   1.021  15.903
   13    H    LYS   4           H        LYS   4  30.672   3.147  13.866
   14    HA   LYS   4           HA       LYS   4  28.212   2.368  15.274
   15   1HB   LYS   4          1HB       LYS   4  28.376   3.809  12.622
   16   2HB   LYS   4          2HB       LYS   4  26.908   3.095  13.276
   17   1HG   LYS   4          1HG       LYS   4  28.264   4.936  15.103
   18   2HG   LYS   4          2HG       LYS   4  27.678   5.680  13.613
   19   1HD   LYS   4          1HD       LYS   4  25.446   4.810  14.033
   20   2HD   LYS   4          2HD       LYS   4  26.020   3.991  15.487
   21   1HE   LYS   4          1HE       LYS   4  25.042   5.935  16.311
   22   2HE   LYS   4          2HE       LYS   4  26.758   6.334  16.256
   23   1HZ   LYS   4          1HZ       LYS   4  26.158   7.237  13.922
   24   2HZ   LYS   4          2HZ       LYS   4  25.802   8.167  15.289
   25   3HZ   LYS   4          3HZ       LYS   4  24.578   7.283  14.525
   26    H    LYS   5           H        LYS   5  26.807   1.024  13.605
   27    HA   LYS   5           HA       LYS   5  28.622  -0.923  12.339
   28   1HB   LYS   5          1HB       LYS   5  26.024  -1.373  13.809
   29   2HB   LYS   5          2HB       LYS   5  26.800  -2.606  12.823
   30   1HG   LYS   5          1HG       LYS   5  28.869  -2.082  14.342
   31   2HG   LYS   5          2HG       LYS   5  27.634  -1.469  15.444
   32   1HD   LYS   5          1HD       LYS   5  26.531  -3.592  15.496
   33   2HD   LYS   5          2HD       LYS   5  27.560  -4.216  14.204
   34   1HE   LYS   5          1HE       LYS   5  28.633  -3.293  16.861
   35   2HE   LYS   5          2HE       LYS   5  28.141  -4.958  16.551
   36   1HZ   LYS   5          1HZ       LYS   5  30.588  -4.328  16.234
   37   2HZ   LYS   5          2HZ       LYS   5  30.084  -3.609  14.788
   38   3HZ   LYS   5          3HZ       LYS   5  29.847  -5.265  15.036
   39    H    ASN   6           H        ASN   6  28.378  -1.200  10.223
   40    HA   ASN   6           HA       ASN   6  25.857  -0.313   8.983
   41   1HB   ASN   6          1HB       ASN   6  28.357   0.690   8.502
   42   2HB   ASN   6          2HB       ASN   6  28.216  -0.526   7.236
   43   1HD2  ASN   6          1HD2      ASN   6  27.255   2.554   8.330
   44   2HD2  ASN   6          2HD2      ASN   6  26.208   2.951   7.014
   45    H    GLY   7           H        GLY   7  24.727  -1.744   7.813
   46   1HA   GLY   7          1HA       GLY   7  25.831  -3.875   6.335
   47   2HA   GLY   7          2HA       GLY   7  25.291  -4.485   7.892
   48    H    ARG   8           H        ARG   8  24.321  -4.973   5.117
   49    HA   ARG   8           HA       ARG   8  21.525  -4.893   5.714
   50   1HB   ARG   8          1HB       ARG   8  22.328  -2.575   4.653
   51   2HB   ARG   8          2HB       ARG   8  22.121  -3.486   3.163
   52   1HG   ARG   8          1HG       ARG   8  19.870  -3.544   3.347
   53   2HG   ARG   8          2HG       ARG   8  19.906  -3.627   5.109
   54   1HD   ARG   8          1HD       ARG   8  19.006  -1.516   4.627
   55   2HD   ARG   8          2HD       ARG   8  20.691  -1.204   5.040
   56    HE   ARG   8           HE       ARG   8  20.309  -1.560   2.232
   57   1HH1  ARG   8          1HH1      ARG   8  20.041   0.728   4.843
   58   2HH1  ARG   8          2HH1      ARG   8  20.222   2.115   3.820
   59   1HH2  ARG   8          1HH2      ARG   8  20.549   0.258   0.875
   60   2HH2  ARG   8          2HH2      ARG   8  20.511   1.846   1.563
   61    H    SER   9           H        SER   9  20.240  -6.043   4.132
   62    HA   SER   9           HA       SER   9  21.881  -7.873   2.507
   63   1HB   SER   9          1HB       SER   9  19.161  -8.775   3.071
   64   2HB   SER   9          2HB       SER   9  20.695  -9.612   3.309
   65    HG   SER   9           HG       SER   9  19.514  -9.146   5.271
   66    H    GLY  10           H        GLY  10  20.018  -9.040   0.935
   67   1HA   GLY  10          1HA       GLY  10  19.718  -7.296  -1.197
   68   2HA   GLY  10          2HA       GLY  10  18.791  -8.774  -0.988
   69    HA   PRO  11           HA       PRO  11  15.094  -6.536  -0.281
   70   1HB   PRO  11          1HB       PRO  11  13.949  -7.796   1.833
   71   2HB   PRO  11          2HB       PRO  11  14.053  -8.521   0.224
   72   1HG   PRO  11          1HG       PRO  11  15.789  -8.972   2.621
   73   2HG   PRO  11          2HG       PRO  11  15.132 -10.157   1.476
   74   1HD   PRO  11          1HD       PRO  11  17.685  -9.264   1.345
   75   2HD   PRO  11          2HD       PRO  11  16.759  -9.725  -0.098
   76    H    GLN  12           H        GLN  12  14.799  -4.564   0.529
   77    HA   GLN  12           HA       GLN  12  15.478  -4.066   3.344
   78   1HB   GLN  12          1HB       GLN  12  16.192  -1.726   2.521
   79   2HB   GLN  12          2HB       GLN  12  17.309  -3.067   2.300
   80   1HG   GLN  12          1HG       GLN  12  16.875  -3.200   0.004
   81   2HG   GLN  12          2HG       GLN  12  15.414  -2.223   0.138
   82   1HE2  GLN  12          1HE2      GLN  12  16.204  -0.848  -1.491
   83   2HE2  GLN  12          2HE2      GLN  12  17.427   0.327  -1.161
   84    HA   PRO  13           HA       PRO  13  11.574  -2.097   3.687
   85   1HB   PRO  13          1HB       PRO  13  12.107  -0.101   5.447
   86   2HB   PRO  13          2HB       PRO  13  12.037  -1.803   5.918
   87   1HG   PRO  13          1HG       PRO  13  14.426  -0.097   5.331
   88   2HG   PRO  13          2HG       PRO  13  14.183  -1.271   6.637
   89   1HD   PRO  13          1HD       PRO  13  15.601  -1.848   4.404
   90   2HD   PRO  13          2HD       PRO  13  14.655  -3.071   5.276
   91    H    HIS  14           H        HIS  14  10.354  -0.417   2.880
   92    HA   HIS  14           HA       HIS  14  11.763   1.907   1.779
   93   1HB   HIS  14          1HB       HIS  14   9.842   0.139   0.252
   94   2HB   HIS  14          2HB       HIS  14  10.390   1.718  -0.305
   95    HD1  HIS  14           1HD      HIS  14  11.353  -1.829  -0.169
   96    HD2  HIS  14           2HD      HIS  14  13.189   1.812  -0.967
   97    HE1  HIS  14           1HE      HIS  14  13.527  -2.405  -1.294
   98    H    LYS  15           H        LYS  15   9.951   3.439   0.789
   99    HA   LYS  15           HA       LYS  15   7.974   3.776   2.935
  100   1HB   LYS  15          1HB       LYS  15   7.826   6.135   2.027
  101   2HB   LYS  15          2HB       LYS  15   9.361   5.693   2.764
  102   1HG   LYS  15          1HG       LYS  15   9.402   5.110  -0.048
  103   2HG   LYS  15          2HG       LYS  15   8.936   6.790   0.231
  104   1HD   LYS  15          1HD       LYS  15  10.917   7.075   1.667
  105   2HD   LYS  15          2HD       LYS  15  11.389   5.409   1.324
  106   1HE   LYS  15          1HE       LYS  15  11.074   7.600  -0.726
  107   2HE   LYS  15          2HE       LYS  15  12.606   7.029  -0.068
  108   1HZ   LYS  15          1HZ       LYS  15  12.481   5.801  -1.965
  109   2HZ   LYS  15          2HZ       LYS  15  10.791   5.719  -1.957
  110   3HZ   LYS  15          3HZ       LYS  15  11.690   4.742  -0.909
  111    H    ARG  16           H        ARG  16   7.860   2.104   0.361
  112    HA   ARG  16           HA       ARG  16   5.174   2.994  -0.395
  113   1HB   ARG  16          1HB       ARG  16   7.088   2.022  -2.499
  114   2HB   ARG  16          2HB       ARG  16   5.569   2.882  -2.708
  115   1HG   ARG  16          1HG       ARG  16   6.922   4.739  -1.345
  116   2HG   ARG  16          2HG       ARG  16   8.272   3.914  -2.129
  117   1HD   ARG  16          1HD       ARG  16   5.864   5.125  -3.481
  118   2HD   ARG  16          2HD       ARG  16   7.512   5.750  -3.510
  119    HE   ARG  16           HE       ARG  16   7.697   3.207  -4.514
  120   1HH1  ARG  16          1HH1      ARG  16   5.916   6.085  -5.329
  121   2HH1  ARG  16          2HH1      ARG  16   5.860   5.728  -7.023
  122   1HH2  ARG  16          1HH2      ARG  16   7.630   2.726  -6.742
  123   2HH2  ARG  16          2HH2      ARG  16   6.834   3.816  -7.826
  124    H    TRP  17           H        TRP  17   3.763   1.378  -0.304
  125    HA   TRP  17           HA       TRP  17   4.549  -1.327  -0.997
  126   1HB   TRP  17          1HB       TRP  17   3.671  -0.544   1.781
  127   2HB   TRP  17          2HB       TRP  17   3.533  -2.193   1.177
  128    HD1  TRP  17           HD       TRP  17   6.058   0.306   2.494
  129    HE1  TRP  17           1HE      TRP  17   8.330  -0.865   2.792
  130    HE3  TRP  17           3HE      TRP  17   5.002  -4.118   0.161
  131    HZ2  TRP  17           2HZ      TRP  17   9.518  -3.338   2.126
  132    HZ3  TRP  17           3HZ      TRP  17   6.761  -5.834   0.034
  133    HH2  TRP  17           HH       TRP  17   8.972  -5.449   0.996
  134    H    VAL  18           H        VAL  18   2.897  -2.481  -1.846
  135    HA   VAL  18           HA       VAL  18   0.241  -1.207  -1.821
  136    HB   VAL  18           HB       VAL  18  -0.209  -2.289  -3.943
  137   1HG1  VAL  18          1HG1      VAL  18   2.344  -0.722  -3.754
  138   2HG1  VAL  18          2HG1      VAL  18   1.671  -1.217  -5.309
  139   3HG1  VAL  18          3HG1      VAL  18   0.741  -0.169  -4.237
  140   1HG2  VAL  18          1HG2      VAL  18   0.883  -4.093  -4.639
  141   2HG2  VAL  18          2HG2      VAL  18   2.418  -3.224  -4.621
  142   3HG2  VAL  18          3HG2      VAL  18   1.847  -4.035  -3.163
  143    H    PHE  19           H        PHE  19  -1.620  -2.677  -1.966
  144    HA   PHE  19           HA       PHE  19  -1.128  -5.325  -0.798
  145   1HB   PHE  19          1HB       PHE  19  -3.142  -4.946   0.678
  146   2HB   PHE  19          2HB       PHE  19  -1.717  -4.001   1.099
  147    HD1  PHE  19           1HD      PHE  19  -1.622  -1.589   0.485
  148    HD2  PHE  19           2HD      PHE  19  -5.167  -3.909   0.070
  149    HE1  PHE  19           1HE      PHE  19  -2.955   0.475   0.365
  150    HE2  PHE  19           2HE      PHE  19  -6.506  -1.848  -0.051
  151    HZ   PHE  19           HZ       PHE  19  -5.400   0.348   0.095
  152    H    THR  20           H        THR  20  -2.590  -6.919  -1.363
  153    HA   THR  20           HA       THR  20  -4.889  -6.230  -3.009
  154    HB   THR  20           HB       THR  20  -4.208  -7.885  -4.773
  155    HG1  THR  20           1HG      THR  20  -1.673  -7.612  -3.492
  156   1HG2  THR  20          1HG2      THR  20  -3.910  -5.315  -4.847
  157   2HG2  THR  20          2HG2      THR  20  -3.073  -6.299  -6.048
  158   3HG2  THR  20          3HG2      THR  20  -2.193  -5.668  -4.656
  159    H    LEU  21           H        LEU  21  -6.550  -7.528  -2.561
  160    HA   LEU  21           HA       LEU  21  -6.040 -10.253  -1.620
  161   1HB   LEU  21          1HB       LEU  21  -6.282  -8.792   0.358
  162   2HB   LEU  21          2HB       LEU  21  -7.877  -8.315  -0.219
  163    HG   LEU  21           HG       LEU  21  -8.194 -10.990  -0.120
  164   1HD1  LEU  21          1HD1      LEU  21  -7.113 -11.957   1.733
  165   2HD1  LEU  21          2HD1      LEU  21  -6.471 -10.405   2.271
  166   3HD1  LEU  21          3HD1      LEU  21  -5.842 -11.160   0.806
  167   1HD2  LEU  21          1HD2      LEU  21  -9.666 -10.552   1.555
  168   2HD2  LEU  21          2HD2      LEU  21  -9.342  -8.895   1.045
  169   3HD2  LEU  21          3HD2      LEU  21  -8.520  -9.560   2.457
  170    H    ASN  22           H        ASN  22  -7.455 -11.722  -2.381
  171    HA   ASN  22           HA       ASN  22  -9.429 -10.834  -4.293
  172   1HB   ASN  22          1HB       ASN  22  -7.813 -12.986  -4.256
  173   2HB   ASN  22          2HB       ASN  22  -9.260 -13.703  -3.553
  174   1HD2  ASN  22          1HD2      ASN  22 -11.312 -12.749  -4.821
  175   2HD2  ASN  22          2HD2      ASN  22 -11.222 -13.008  -6.527
  176    H    ASN  23           H        ASN  23 -11.569 -10.711  -4.003
  177    HA   ASN  23           HA       ASN  23 -13.563 -10.594  -2.904
  178   1HB   ASN  23          1HB       ASN  23 -13.577 -12.971  -3.452
  179   2HB   ASN  23          2HB       ASN  23 -12.668 -13.336  -1.988
  180   1HD2  ASN  23          1HD2      ASN  23 -15.404 -11.156  -2.505
  181   2HD2  ASN  23          2HD2      ASN  23 -16.462 -11.938  -1.385
  182    HA   PRO  24           HA       PRO  24 -11.450  -9.417   1.098
  183   1HB   PRO  24          1HB       PRO  24 -12.021  -6.769   0.923
  184   2HB   PRO  24          2HB       PRO  24 -10.570  -7.487   0.215
  185   1HG   PRO  24          1HG       PRO  24 -13.156  -6.754  -1.102
  186   2HG   PRO  24          2HG       PRO  24 -11.497  -6.501  -1.676
  187   1HD   PRO  24          1HD       PRO  24 -13.053  -8.529  -2.568
  188   2HD   PRO  24          2HD       PRO  24 -11.289  -8.671  -2.422
  189    H    SER  25           H        SER  25 -12.492  -9.057   3.027
  190    HA   SER  25           HA       SER  25 -15.401  -9.167   2.936
  191   1HB   SER  25          1HB       SER  25 -13.335 -10.094   4.753
  192   2HB   SER  25          2HB       SER  25 -14.599  -9.216   5.614
  193    HG   SER  25           HG       SER  25 -16.098 -10.646   4.882
  194    H    GLU  26           H        GLU  26 -16.704  -7.824   4.353
  195    HA   GLU  26           HA       GLU  26 -16.173  -5.090   4.054
  196   1HB   GLU  26          1HB       GLU  26 -18.262  -6.740   5.220
  197   2HB   GLU  26          2HB       GLU  26 -17.996  -5.272   6.149
  198   1HG   GLU  26          1HG       GLU  26 -18.336  -3.926   4.155
  199   2HG   GLU  26          2HG       GLU  26 -18.561  -5.387   3.195
  200    H    ASP  27           H        ASP  27 -15.452  -7.322   6.636
  201    HA   ASP  27           HA       ASP  27 -14.847  -5.349   8.606
  202   1HB   ASP  27          1HB       ASP  27 -14.969  -8.200   8.468
  203   2HB   ASP  27          2HB       ASP  27 -13.403  -7.743   9.134
  204    H    GLU  28           H        GLU  28 -12.883  -7.289   6.376
  205    HA   GLU  28           HA       GLU  28 -10.395  -6.217   7.244
  206   1HB   GLU  28          1HB       GLU  28 -11.232  -8.266   5.528
  207   2HB   GLU  28          2HB       GLU  28 -10.351  -7.143   4.503
  208   1HG   GLU  28          1HG       GLU  28  -8.834  -8.799   5.315
  209   2HG   GLU  28          2HG       GLU  28  -8.451  -7.258   6.080
  210    H    ARG  29           H        ARG  29 -12.493  -5.542   4.457
  211    HA   ARG  29           HA       ARG  29 -10.877  -3.582   3.270
  212   1HB   ARG  29          1HB       ARG  29 -12.616  -3.238   1.817
  213   2HB   ARG  29          2HB       ARG  29 -13.082  -4.805   2.465
  214   1HG   ARG  29          1HG       ARG  29 -14.521  -3.587   4.118
  215   2HG   ARG  29          2HG       ARG  29 -14.175  -2.108   3.219
  216   1HD   ARG  29          1HD       ARG  29 -15.449  -4.596   2.085
  217   2HD   ARG  29          2HD       ARG  29 -16.308  -3.128   2.548
  218    HE   ARG  29           HE       ARG  29 -14.732  -3.548   0.168
  219   1HH1  ARG  29          1HH1      ARG  29 -16.139  -1.212   2.332
  220   2HH1  ARG  29          2HH1      ARG  29 -16.156   0.061   1.157
  221   1HH2  ARG  29          1HH2      ARG  29 -14.749  -1.881  -1.389
  222   2HH2  ARG  29          2HH2      ARG  29 -15.366  -0.321  -0.960
  223    H    LYS  30           H        LYS  30 -13.166  -3.428   5.907
  224    HA   LYS  30           HA       LYS  30 -13.390  -0.590   5.982
  225   1HB   LYS  30          1HB       LYS  30 -15.103  -1.969   6.993
  226   2HB   LYS  30          2HB       LYS  30 -13.929  -2.695   8.083
  227   1HG   LYS  30          1HG       LYS  30 -13.686  -0.692   9.311
  228   2HG   LYS  30          2HG       LYS  30 -14.547   0.245   8.088
  229   1HD   LYS  30          1HD       LYS  30 -15.924  -2.034   9.444
  230   2HD   LYS  30          2HD       LYS  30 -15.763  -0.489  10.283
  231   1HE   LYS  30          1HE       LYS  30 -16.655  -0.159   7.543
  232   2HE   LYS  30          2HE       LYS  30 -17.739  -1.195   8.470
  233   1HZ   LYS  30          1HZ       LYS  30 -18.585   0.849   8.958
  234   2HZ   LYS  30          2HZ       LYS  30 -17.091   1.636   8.858
  235   3HZ   LYS  30          3HZ       LYS  30 -17.469   0.709  10.222
  236    H    LYS  31           H        LYS  31 -11.292  -2.943   7.554
  237    HA   LYS  31           HA       LYS  31 -10.078  -1.214   9.407
  238   1HB   LYS  31          1HB       LYS  31  -9.802  -3.571   9.678
  239   2HB   LYS  31          2HB       LYS  31  -9.105  -3.739   8.072
  240   1HG   LYS  31          1HG       LYS  31  -7.565  -1.887   9.636
  241   2HG   LYS  31          2HG       LYS  31  -7.753  -3.418  10.494
  242   1HD   LYS  31          1HD       LYS  31  -7.157  -3.767   7.664
  243   2HD   LYS  31          2HD       LYS  31  -5.899  -2.879   8.527
  244   1HE   LYS  31          1HE       LYS  31  -7.030  -5.566   9.302
  245   2HE   LYS  31          2HE       LYS  31  -5.462  -5.280   8.550
  246   1HZ   LYS  31          1HZ       LYS  31  -6.306  -4.854  11.304
  247   2HZ   LYS  31          2HZ       LYS  31  -5.251  -3.701  10.657
  248   3HZ   LYS  31          3HZ       LYS  31  -4.802  -5.331  10.693
  249    H    ILE  32           H        ILE  32  -8.983  -2.240   6.175
  250    HA   ILE  32           HA       ILE  32  -6.681  -0.629   6.107
  251    HB   ILE  32           HB       ILE  32  -8.346  -1.911   3.967
  252   1HG1  ILE  32          1HG1      ILE  32  -5.457  -2.273   4.791
  253   2HG1  ILE  32          2HG1      ILE  32  -6.792  -3.267   5.364
  254   1HG2  ILE  32          1HG2      ILE  32  -6.049  -0.008   3.591
  255   2HG2  ILE  32          2HG2      ILE  32  -6.519  -1.189   2.370
  256   3HG2  ILE  32          3HG2      ILE  32  -7.657   0.062   2.869
  257   1HD1  ILE  32          1HD1      ILE  32  -5.210  -3.679   3.108
  258   2HD1  ILE  32          2HD1      ILE  32  -6.668  -4.556   3.573
  259   3HD1  ILE  32          3HD1      ILE  32  -6.781  -3.164   2.496
  260    H    ARG  33           H        ARG  33  -9.996  -0.035   5.017
  261    HA   ARG  33           HA       ARG  33  -9.436   2.517   3.881
  262   1HB   ARG  33          1HB       ARG  33 -11.363   1.315   3.110
  263   2HB   ARG  33          2HB       ARG  33 -12.011   1.199   4.740
  264   1HG   ARG  33          1HG       ARG  33 -12.270   3.658   4.768
  265   2HG   ARG  33          2HG       ARG  33 -11.731   3.698   3.088
  266   1HD   ARG  33          1HD       ARG  33 -13.824   3.335   2.443
  267   2HD   ARG  33          2HD       ARG  33 -13.766   1.761   3.235
  268    HE   ARG  33           HE       ARG  33 -15.136   2.595   4.853
  269   1HH1  ARG  33          1HH1      ARG  33 -13.571   5.258   3.247
  270   2HH1  ARG  33          2HH1      ARG  33 -14.463   6.470   4.106
  271   1HH2  ARG  33          1HH2      ARG  33 -16.316   4.181   5.991
  272   2HH2  ARG  33          2HH2      ARG  33 -16.023   5.856   5.667
  273    H    ASP  34           H        ASP  34  -9.979   1.389   7.077
  274    HA   ASP  34           HA       ASP  34 -10.577   4.084   8.058
  275   1HB   ASP  34          1HB       ASP  34 -11.928   2.101   8.835
  276   2HB   ASP  34          2HB       ASP  34 -10.479   1.518   9.650
  277    H    LEU  35           H        LEU  35  -7.903   2.643   7.174
  278    HA   LEU  35           HA       LEU  35  -6.210   2.657   9.424
  279   1HB   LEU  35          1HB       LEU  35  -5.794   2.776   6.472
  280   2HB   LEU  35          2HB       LEU  35  -4.430   3.074   7.548
  281    HG   LEU  35           HG       LEU  35  -6.095   0.560   7.595
  282   1HD1  LEU  35          1HD1      LEU  35  -4.942   0.798   5.447
  283   2HD1  LEU  35          2HD1      LEU  35  -4.260  -0.508   6.416
  284   3HD1  LEU  35          3HD1      LEU  35  -3.415   1.036   6.298
  285   1HD2  LEU  35          1HD2      LEU  35  -4.967   1.053   9.691
  286   2HD2  LEU  35          2HD2      LEU  35  -3.438   1.265   8.837
  287   3HD2  LEU  35          3HD2      LEU  35  -4.207  -0.322   8.887
  288    HA   PRO  36           HA       PRO  36  -5.283   6.881  10.167
  289   1HB   PRO  36          1HB       PRO  36  -2.621   6.811  10.693
  290   2HB   PRO  36          2HB       PRO  36  -3.837   6.177  11.808
  291   1HG   PRO  36          1HG       PRO  36  -2.118   4.708   9.846
  292   2HG   PRO  36          2HG       PRO  36  -2.526   4.279  11.518
  293   1HD   PRO  36          1HD       PRO  36  -3.759   3.158   9.383
  294   2HD   PRO  36          2HD       PRO  36  -4.587   3.431  10.930
  295    H    ILE  37           H        ILE  37  -5.289   8.408   8.648
  296    HA   ILE  37           HA       ILE  37  -3.913   8.158   6.171
  297    HB   ILE  37           HB       ILE  37  -4.625  10.550   5.827
  298   1HG1  ILE  37          1HG1      ILE  37  -6.042  10.128   8.467
  299   2HG1  ILE  37          2HG1      ILE  37  -4.624  11.148   8.249
  300   1HG2  ILE  37          1HG2      ILE  37  -7.175   9.464   6.508
  301   2HG2  ILE  37          2HG2      ILE  37  -6.421   9.616   4.922
  302   3HG2  ILE  37          3HG2      ILE  37  -6.141   8.173   5.896
  303   1HD1  ILE  37          1HD1      ILE  37  -6.273  12.157   6.360
  304   2HD1  ILE  37          2HD1      ILE  37  -7.431  11.652   7.591
  305   3HD1  ILE  37          3HD1      ILE  37  -6.136  12.775   8.006
  306    H    SER  38           H        SER  38  -3.242   9.802   9.193
  307    HA   SER  38           HA       SER  38  -1.124  11.429   8.237
  308   1HB   SER  38          1HB       SER  38  -0.912  12.142  10.404
  309   2HB   SER  38          2HB       SER  38  -2.516  11.419  10.525
  310    HG   SER  38           HG       SER  38  -1.711  10.085  11.917
  311    H    LEU  39           H        LEU  39  -1.363   8.097   8.898
  312    HA   LEU  39           HA       LEU  39   1.398   7.654   9.548
  313   1HB   LEU  39          1HB       LEU  39  -0.834   6.206   9.921
  314   2HB   LEU  39          2HB       LEU  39  -0.228   5.443   8.453
  315    HG   LEU  39           HG       LEU  39   1.725   5.767  10.645
  316   1HD1  LEU  39          1HD1      LEU  39  -0.350   5.145  11.843
  317   2HD1  LEU  39          2HD1      LEU  39   0.899   3.903  11.918
  318   3HD1  LEU  39          3HD1      LEU  39  -0.471   3.711  10.824
  319   1HD2  LEU  39          1HD2      LEU  39   1.584   3.138   9.697
  320   2HD2  LEU  39          2HD2      LEU  39   2.765   4.375   9.262
  321   3HD2  LEU  39          3HD2      LEU  39   1.306   4.168   8.292
  322    H    PHE  40           H        PHE  40  -0.512   7.812   6.650
  323    HA   PHE  40           HA       PHE  40   1.904   7.208   5.078
  324   1HB   PHE  40          1HB       PHE  40  -0.864   6.648   4.046
  325   2HB   PHE  40          2HB       PHE  40   0.674   6.006   3.479
  326    HD1  PHE  40           2HD      PHE  40  -1.937   5.747   6.033
  327    HD2  PHE  40           1HD      PHE  40   1.711   4.127   4.556
  328    HE1  PHE  40           2HE      PHE  40  -2.267   3.746   7.425
  329    HE2  PHE  40           1HE      PHE  40   1.387   2.122   5.945
  330    HZ   PHE  40           HZ       PHE  40  -0.603   1.930   7.383
  331    H    ASP  41           H        ASP  41   2.587   8.972   4.079
  332    HA   ASP  41           HA       ASP  41   1.273  11.389   3.890
  333   1HB   ASP  41          1HB       ASP  41   3.625  10.170   2.581
  334   2HB   ASP  41          2HB       ASP  41   2.906  11.534   1.729
  335    H    TYR  42           H        TYR  42   1.054   8.603   1.810
  336    HA   TYR  42           HA       TYR  42  -1.113   9.916   0.345
  337   1HB   TYR  42          1HB       TYR  42   0.840  10.175  -1.087
  338   2HB   TYR  42          2HB       TYR  42   1.192   8.455  -0.962
  339    HD1  TYR  42           1HD      TYR  42  -2.152   9.980  -1.446
  340    HD2  TYR  42           2HD      TYR  42   1.051   7.823  -3.231
  341    HE1  TYR  42           1HE      TYR  42  -3.548   9.557  -3.426
  342    HE2  TYR  42           2HE      TYR  42  -0.336   7.395  -5.217
  343    HH   TYR  42           HH       TYR  42  -2.467   7.445  -6.019
  344    H    PHE  43           H        PHE  43  -2.861   8.678   0.339
  345    HA   PHE  43           HA       PHE  43  -2.543   5.758   0.385
  346   1HB   PHE  43          1HB       PHE  43  -3.236   7.081   2.629
  347   2HB   PHE  43          2HB       PHE  43  -4.828   6.874   1.907
  348    HD1  PHE  43           1HD      PHE  43  -3.885   4.185   0.528
  349    HD2  PHE  43           2HD      PHE  43  -3.874   5.675   4.515
  350    HE1  PHE  43           1HE      PHE  43  -3.974   1.881   1.385
  351    HE2  PHE  43           2HE      PHE  43  -3.962   3.373   5.379
  352    HZ   PHE  43           HZ       PHE  43  -4.011   1.472   3.814
  353    H    ILE  44           H        ILE  44  -3.476   4.959  -1.368
  354    HA   ILE  44           HA       ILE  44  -6.078   6.028  -2.203
  355    HB   ILE  44           HB       ILE  44  -4.668   7.092  -3.759
  356   1HG1  ILE  44          1HG1      ILE  44  -5.147   4.721  -5.458
  357   2HG1  ILE  44          2HG1      ILE  44  -6.549   5.317  -4.578
  358   1HG2  ILE  44          1HG2      ILE  44  -2.986   5.692  -5.095
  359   2HG2  ILE  44          2HG2      ILE  44  -2.571   6.120  -3.436
  360   3HG2  ILE  44          3HG2      ILE  44  -3.161   4.500  -3.807
  361   1HD1  ILE  44          1HD1      ILE  44  -6.817   6.951  -6.038
  362   2HD1  ILE  44          2HD1      ILE  44  -5.163   7.508  -5.783
  363   3HD1  ILE  44          3HD1      ILE  44  -5.499   6.267  -6.989
  364    H    VAL  45           H        VAL  45  -7.492   4.423  -2.174
  365    HA   VAL  45           HA       VAL  45  -6.572   1.717  -2.901
  366    HB   VAL  45           HB       VAL  45  -8.955   2.205  -1.142
  367   1HG1  VAL  45          1HG1      VAL  45  -7.762  -0.060  -2.283
  368   2HG1  VAL  45          2HG1      VAL  45  -7.366  -0.117  -0.564
  369   3HG1  VAL  45          3HG1      VAL  45  -9.050  -0.014  -1.079
  370   1HG2  VAL  45          1HG2      VAL  45  -7.322   3.324   0.105
  371   2HG2  VAL  45          2HG2      VAL  45  -7.331   1.691   0.772
  372   3HG2  VAL  45          3HG2      VAL  45  -6.060   2.178  -0.349
  373    H    GLY  46           H        GLY  46  -7.915   0.443  -4.185
  374   1HA   GLY  46          1HA       GLY  46 -10.316   1.752  -5.277
  375   2HA   GLY  46          2HA       GLY  46  -9.081   1.145  -6.370
  376    H    GLU  47           H        GLU  47 -12.011   0.441  -5.605
  377    HA   GLU  47           HA       GLU  47 -11.672  -2.379  -4.935
  378   1HB   GLU  47          1HB       GLU  47 -13.433  -1.095  -3.790
  379   2HB   GLU  47          2HB       GLU  47 -14.190  -0.755  -5.340
  380   1HG   GLU  47          1HG       GLU  47 -14.267  -3.339  -5.572
  381   2HG   GLU  47          2HG       GLU  47 -14.059  -3.318  -3.822
  382    H    GLU  48           H        GLU  48 -11.906  -4.015  -6.346
  383    HA   GLU  48           HA       GLU  48 -12.677  -3.322  -9.105
  384   1HB   GLU  48          1HB       GLU  48 -10.258  -4.016  -8.653
  385   2HB   GLU  48          2HB       GLU  48 -10.893  -5.624  -8.335
  386   1HG   GLU  48          1HG       GLU  48 -11.853  -4.511 -10.841
  387   2HG   GLU  48          2HG       GLU  48 -10.097  -4.646 -10.773
  388    H    GLY  49           H        GLY  49 -13.844  -4.898 -10.316
  389   1HA   GLY  49          1HA       GLY  49 -14.726  -7.322  -9.965
  390   2HA   GLY  49          2HA       GLY  49 -15.534  -6.574  -8.596
  391    H    ASN  50           H        ASN  50 -15.004  -5.532 -11.962
  392    HA   ASN  50           HA       ASN  50 -17.851  -4.864 -12.121
  393   1HB   ASN  50          1HB       ASN  50 -15.690  -3.393 -12.841
  394   2HB   ASN  50          2HB       ASN  50 -16.067  -4.170 -14.375
  395   1HD2  ASN  50          1HD2      ASN  50 -17.990  -2.830 -11.709
  396   2HD2  ASN  50          2HD2      ASN  50 -18.969  -1.811 -12.704
  397    H    GLU  51           H        GLU  51 -17.282  -7.580 -12.190
  398    HA   GLU  51           HA       GLU  51 -18.235  -8.238 -14.868
  399   1HB   GLU  51          1HB       GLU  51 -15.680  -8.537 -14.666
  400   2HB   GLU  51          2HB       GLU  51 -16.060  -9.908 -13.634
  401   1HG   GLU  51          1HG       GLU  51 -16.036 -11.080 -15.529
  402   2HG   GLU  51          2HG       GLU  51 -17.643 -10.403 -15.784
  403    H    GLU  52           H        GLU  52 -20.118  -9.196 -14.504
  404    HA   GLU  52           HA       GLU  52 -20.924 -10.338 -12.081
  405   1HB   GLU  52          1HB       GLU  52 -22.298  -9.548 -14.170
  406   2HB   GLU  52          2HB       GLU  52 -22.127 -11.223 -14.676
  407   1HG   GLU  52          1HG       GLU  52 -23.393 -12.024 -12.912
  408   2HG   GLU  52          2HG       GLU  52 -23.151 -10.568 -11.948
  409    H    GLY  53           H        GLY  53 -21.189 -12.478 -11.407
  410   1HA   GLY  53          1HA       GLY  53 -20.955 -14.817 -11.577
  411   2HA   GLY  53          2HA       GLY  53 -20.025 -14.595 -13.052
  412    H    ARG  54           H        ARG  54 -18.454 -12.454 -11.530
  413    HA   ARG  54           HA       ARG  54 -16.694 -14.337 -10.103
  414   1HB   ARG  54          1HB       ARG  54 -15.797 -13.351 -12.235
  415   2HB   ARG  54          2HB       ARG  54 -15.871 -11.771 -11.466
  416   1HG   ARG  54          1HG       ARG  54 -14.232 -12.383  -9.860
  417   2HG   ARG  54          2HG       ARG  54 -14.297 -14.077 -10.352
  418   1HD   ARG  54          1HD       ARG  54 -13.726 -12.474 -12.639
  419   2HD   ARG  54          2HD       ARG  54 -12.624 -12.020 -11.340
  420    HE   ARG  54           HE       ARG  54 -12.624 -14.466 -12.820
  421   1HH1  ARG  54          1HH1      ARG  54 -11.854 -13.028  -9.744
  422   2HH1  ARG  54          2HH1      ARG  54 -10.653 -14.211  -9.345
  423   1HH2  ARG  54          1HH2      ARG  54 -11.046 -16.030 -12.305
  424   2HH2  ARG  54          2HH2      ARG  54 -10.194 -15.918 -10.802
  425    H    THR  55           H        THR  55 -15.504 -13.502  -8.284
  426    HA   THR  55           HA       THR  55 -17.117 -11.703  -6.687
  427    HB   THR  55           HB       THR  55 -14.894 -12.293  -5.163
  428    HG1  THR  55           1HG      THR  55 -14.079 -14.138  -5.809
  429   1HG2  THR  55          1HG2      THR  55 -16.709 -14.375  -4.706
  430   2HG2  THR  55          2HG2      THR  55 -17.679 -13.028  -5.301
  431   3HG2  THR  55          3HG2      THR  55 -16.647 -12.814  -3.887
  432    HA   PRO  56           HA       PRO  56 -14.713  -8.053  -7.083
  433   1HB   PRO  56          1HB       PRO  56 -14.761  -7.061  -4.557
  434   2HB   PRO  56          2HB       PRO  56 -16.173  -7.053  -5.619
  435   1HG   PRO  56          1HG       PRO  56 -15.471  -8.954  -3.415
  436   2HG   PRO  56          2HG       PRO  56 -17.038  -8.220  -3.803
  437   1HD   PRO  56          1HD       PRO  56 -16.404 -10.756  -4.507
  438   2HD   PRO  56          2HD       PRO  56 -17.472  -9.731  -5.488
  439    H    HIS  57           H        HIS  57 -12.750  -6.946  -6.390
  440    HA   HIS  57           HA       HIS  57 -10.912  -8.548  -4.768
  441   1HB   HIS  57          1HB       HIS  57 -10.407  -9.272  -7.004
  442   2HB   HIS  57          2HB       HIS  57 -10.378  -7.612  -7.592
  443    HD1  HIS  57           1HD      HIS  57  -8.238  -6.260  -7.214
  444    HD2  HIS  57           2HD      HIS  57  -8.104 -10.079  -5.584
  445    HE1  HIS  57           1HE      HIS  57  -5.832  -6.640  -6.589
  446    H    LEU  58           H        LEU  58  -9.484  -7.370  -3.581
  447    HA   LEU  58           HA       LEU  58  -9.839  -4.469  -3.644
  448   1HB   LEU  58          1HB       LEU  58  -9.501  -6.399  -1.595
  449   2HB   LEU  58          2HB       LEU  58  -8.114  -5.313  -1.540
  450    HG   LEU  58           HG       LEU  58 -11.024  -4.577  -1.258
  451   1HD1  LEU  58          1HD1      LEU  58  -9.854  -3.584   0.903
  452   2HD1  LEU  58          2HD1      LEU  58  -8.728  -4.904   0.590
  453   3HD1  LEU  58          3HD1      LEU  58 -10.440  -5.247   0.835
  454   1HD2  LEU  58          1HD2      LEU  58  -9.518  -2.345  -0.666
  455   2HD2  LEU  58          2HD2      LEU  58 -10.466  -2.603  -2.131
  456   3HD2  LEU  58          3HD2      LEU  58  -8.745  -2.990  -2.114
  457    H    GLN  59           H        GLN  59  -8.279  -3.075  -4.223
  458    HA   GLN  59           HA       GLN  59  -5.503  -3.898  -4.319
  459   1HB   GLN  59          1HB       GLN  59  -6.112  -4.664  -6.478
  460   2HB   GLN  59          2HB       GLN  59  -7.094  -3.239  -6.790
  461   1HG   GLN  59          1HG       GLN  59  -5.013  -3.197  -8.053
  462   2HG   GLN  59          2HG       GLN  59  -5.105  -1.861  -6.907
  463   1HE2  GLN  59          1HE2      GLN  59  -3.124  -4.150  -8.147
  464   2HE2  GLN  59          2HE2      GLN  59  -1.973  -4.272  -6.865
  465    H    GLY  60           H        GLY  60  -4.551  -2.287  -3.262
  466   1HA   GLY  60          1HA       GLY  60  -4.998   0.450  -4.189
  467   2HA   GLY  60          2HA       GLY  60  -5.312   0.117  -2.492
  468    H    PHE  61           H        PHE  61  -3.437   1.994  -3.275
  469    HA   PHE  61           HA       PHE  61  -0.936   0.684  -2.440
  470   1HB   PHE  61          1HB       PHE  61  -0.588   1.237  -4.726
  471   2HB   PHE  61          2HB       PHE  61  -1.334   2.820  -4.532
  472    HD1  PHE  61           2HD      PHE  61   1.351   1.012  -2.674
  473    HD2  PHE  61           1HD      PHE  61   0.214   4.474  -4.873
  474    HE1  PHE  61           2HE      PHE  61   3.565   1.999  -2.257
  475    HE2  PHE  61           1HE      PHE  61   2.427   5.467  -4.461
  476    HZ   PHE  61           HZ       PHE  61   4.106   4.230  -3.151
  477    H    ALA  62           H        ALA  62   0.247   1.695  -0.879
  478    HA   ALA  62           HA       ALA  62  -0.636   4.339   0.038
  479   1HB   ALA  62          1HB       ALA  62  -1.329   2.002   1.356
  480   2HB   ALA  62          2HB       ALA  62   0.043   2.627   2.271
  481   3HB   ALA  62          3HB       ALA  62  -1.379   3.637   2.015
  482    H    ASN  63           H        ASN  63   0.987   5.667   0.620
  483    HA   ASN  63           HA       ASN  63   3.708   4.610   0.446
  484   1HB   ASN  63          1HB       ASN  63   2.441   7.253  -0.014
  485   2HB   ASN  63          2HB       ASN  63   4.082   7.271   0.628
  486   1HD2  ASN  63          1HD2      ASN  63   2.613   7.738  -2.084
  487   2HD2  ASN  63          2HD2      ASN  63   3.672   6.974  -3.215
  488    H    PHE  64           H        PHE  64   4.643   4.029   2.285
  489    HA   PHE  64           HA       PHE  64   3.722   4.841   4.843
  490   1HB   PHE  64          1HB       PHE  64   5.680   2.996   3.770
  491   2HB   PHE  64          2HB       PHE  64   6.321   3.853   5.167
  492    HD1  PHE  64           2HD      PHE  64   4.846   3.891   7.279
  493    HD2  PHE  64           1HD      PHE  64   4.309   1.157   4.062
  494    HE1  PHE  64           2HE      PHE  64   3.606   2.381   8.774
  495    HE2  PHE  64           1HE      PHE  64   3.068  -0.357   5.552
  496    HZ   PHE  64           HZ       PHE  64   2.716   0.253   7.912
  497    H    VAL  65           H        VAL  65   4.229   6.561   6.030
  498    HA   VAL  65           HA       VAL  65   5.745   8.695   5.036
  499    HB   VAL  65           HB       VAL  65   4.862   8.082   7.856
  500   1HG1  VAL  65          1HG1      VAL  65   6.514   9.571   8.347
  501   2HG1  VAL  65          2HG1      VAL  65   6.462  10.326   6.753
  502   3HG1  VAL  65          3HG1      VAL  65   5.225  10.707   7.951
  503   1HG2  VAL  65          1HG2      VAL  65   3.038   9.495   7.449
  504   2HG2  VAL  65          2HG2      VAL  65   3.776  10.179   6.001
  505   3HG2  VAL  65          3HG2      VAL  65   3.173   8.522   5.985
  506    H    LYS  66           H        LYS  66   6.675   5.874   6.794
  507    HA   LYS  66           HA       LYS  66   9.427   6.910   6.954
  508   1HB   LYS  66          1HB       LYS  66   9.676   5.363   8.962
  509   2HB   LYS  66          2HB       LYS  66   8.727   6.823   9.207
  510   1HG   LYS  66          1HG       LYS  66   7.238   4.409   8.385
  511   2HG   LYS  66          2HG       LYS  66   7.932   4.403  10.009
  512   1HD   LYS  66          1HD       LYS  66   6.463   6.835   9.150
  513   2HD   LYS  66          2HD       LYS  66   5.514   5.388   9.498
  514   1HE   LYS  66          1HE       LYS  66   7.528   5.843  11.521
  515   2HE   LYS  66          2HE       LYS  66   6.482   7.249  11.333
  516   1HZ   LYS  66          1HZ       LYS  66   5.554   4.468  11.807
  517   2HZ   LYS  66          2HZ       LYS  66   4.562   5.829  11.655
  518   3HZ   LYS  66          3HZ       LYS  66   5.615   5.694  12.972
  519    H    LYS  67           H        LYS  67  10.838   4.744   7.577
  520    HA   LYS  67           HA       LYS  67  10.506   3.064   5.219
  521   1HB   LYS  67          1HB       LYS  67  12.760   3.275   7.224
  522   2HB   LYS  67          2HB       LYS  67  12.772   2.223   5.815
  523   1HG   LYS  67          1HG       LYS  67  12.204   5.052   5.260
  524   2HG   LYS  67          2HG       LYS  67  13.823   4.705   5.871
  525   1HD   LYS  67          1HD       LYS  67  14.084   2.997   4.100
  526   2HD   LYS  67          2HD       LYS  67  12.501   3.453   3.464
  527   1HE   LYS  67          1HE       LYS  67  13.260   5.617   2.876
  528   2HE   LYS  67          2HE       LYS  67  14.745   5.427   3.807
  529   1HZ   LYS  67          1HZ       LYS  67  14.310   3.479   1.697
  530   2HZ   LYS  67          2HZ       LYS  67  15.730   4.267   2.167
  531   3HZ   LYS  67          3HZ       LYS  67  14.609   5.062   1.182
  532    H    GLN  68           H        GLN  68   9.594   1.126   5.306
  533    HA   GLN  68           HA       GLN  68   9.743  -0.411   7.802
  534   1HB   GLN  68          1HB       GLN  68   7.239  -0.100   6.139
  535   2HB   GLN  68          2HB       GLN  68   7.406  -1.075   7.593
  536   1HG   GLN  68          1HG       GLN  68   7.800   1.904   7.538
  537   2HG   GLN  68          2HG       GLN  68   6.260   1.126   7.898
  538   1HE2  GLN  68          1HE2      GLN  68   8.580   2.676   9.363
  539   2HE2  GLN  68          2HE2      GLN  68   8.683   1.826  10.863
  540    H    THR  69           H        THR  69   9.567  -2.689   7.548
  541    HA   THR  69           HA       THR  69  10.517  -3.595   4.945
  542    HB   THR  69           HB       THR  69  11.300  -5.546   5.997
  543    HG1  THR  69           1HG      THR  69  10.578  -6.185   8.069
  544   1HG2  THR  69          1HG2      THR  69  12.585  -3.576   6.649
  545   2HG2  THR  69          2HG2      THR  69  12.551  -4.755   7.960
  546   3HG2  THR  69          3HG2      THR  69  11.522  -3.325   8.032
  547    H    PHE  70           H        PHE  70   9.732  -5.866   4.300
  548    HA   PHE  70           HA       PHE  70   7.003  -5.715   3.663
  549   1HB   PHE  70          1HB       PHE  70   8.332  -6.978   2.190
  550   2HB   PHE  70          2HB       PHE  70   9.038  -7.924   3.496
  551    HD1  PHE  70           1HD      PHE  70   5.706  -7.228   1.970
  552    HD2  PHE  70           2HD      PHE  70   8.292 -10.073   3.795
  553    HE1  PHE  70           1HE      PHE  70   4.030  -8.989   1.593
  554    HE2  PHE  70           2HE      PHE  70   6.621 -11.838   3.420
  555    HZ   PHE  70           HZ       PHE  70   4.486 -11.298   2.317
  556    H    ASN  71           H        ASN  71   8.688  -7.889   5.930
  557    HA   ASN  71           HA       ASN  71   6.386  -9.147   6.924
  558   1HB   ASN  71          1HB       ASN  71   8.802  -9.883   7.212
  559   2HB   ASN  71          2HB       ASN  71   8.920  -8.686   8.499
  560   1HD2  ASN  71          1HD2      ASN  71   9.470 -11.084   9.299
  561   2HD2  ASN  71          2HD2      ASN  71   8.169 -11.819  10.167
  562    H    LYS  72           H        LYS  72   8.133  -6.271   8.013
  563    HA   LYS  72           HA       LYS  72   6.635  -5.836  10.364
  564   1HB   LYS  72          1HB       LYS  72   8.877  -4.752   9.427
  565   2HB   LYS  72          2HB       LYS  72   7.758  -3.520   8.860
  566   1HG   LYS  72          1HG       LYS  72   8.147  -4.418  11.707
  567   2HG   LYS  72          2HG       LYS  72   8.664  -2.886  10.999
  568   1HD   LYS  72          1HD       LYS  72   6.262  -2.399  10.503
  569   2HD   LYS  72          2HD       LYS  72   5.836  -3.847  11.417
  570   1HE   LYS  72          1HE       LYS  72   7.214  -1.369  12.434
  571   2HE   LYS  72          2HE       LYS  72   5.612  -1.961  12.869
  572   1HZ   LYS  72          1HZ       LYS  72   7.060  -4.055  13.555
  573   2HZ   LYS  72          2HZ       LYS  72   6.766  -2.771  14.616
  574   3HZ   LYS  72          3HZ       LYS  72   8.232  -2.856  13.777
  575    H    VAL  73           H        VAL  73   6.348  -4.433   7.105
  576    HA   VAL  73           HA       VAL  73   4.205  -2.735   7.555
  577    HB   VAL  73           HB       VAL  73   4.977  -4.281   5.086
  578   1HG1  VAL  73          1HG1      VAL  73   2.712  -3.914   4.692
  579   2HG1  VAL  73          2HG1      VAL  73   2.721  -2.355   5.520
  580   3HG1  VAL  73          3HG1      VAL  73   3.489  -2.521   3.940
  581   1HG2  VAL  73          1HG2      VAL  73   6.132  -2.409   4.428
  582   2HG2  VAL  73          2HG2      VAL  73   5.130  -1.319   5.386
  583   3HG2  VAL  73          3HG2      VAL  73   6.346  -2.322   6.177
  584    H    LYS  74           H        LYS  74   4.272  -6.188   7.330
  585    HA   LYS  74           HA       LYS  74   1.570  -6.658   6.673
  586   1HB   LYS  74          1HB       LYS  74   3.455  -8.374   8.300
  587   2HB   LYS  74          2HB       LYS  74   1.946  -8.914   7.577
  588   1HG   LYS  74          1HG       LYS  74   3.312  -7.829   5.447
  589   2HG   LYS  74          2HG       LYS  74   4.579  -8.613   6.393
  590   1HD   LYS  74          1HD       LYS  74   3.947 -10.448   5.245
  591   2HD   LYS  74          2HD       LYS  74   2.662 -10.520   6.454
  592   1HE   LYS  74          1HE       LYS  74   1.134  -9.404   4.981
  593   2HE   LYS  74          2HE       LYS  74   2.415  -9.091   3.811
  594   1HZ   LYS  74          1HZ       LYS  74   2.608 -11.449   3.413
  595   2HZ   LYS  74          2HZ       LYS  74   1.007 -10.964   3.168
  596   3HZ   LYS  74          3HZ       LYS  74   1.434 -11.786   4.583
  597    H    TRP  75           H        TRP  75   2.958  -5.333   9.440
  598    HA   TRP  75           HA       TRP  75   1.192  -6.335  11.425
  599   1HB   TRP  75          1HB       TRP  75   2.148  -4.744  12.876
  600   2HB   TRP  75          2HB       TRP  75   3.445  -5.152  11.757
  601    HD1  TRP  75           HD       TRP  75   2.611  -3.249   9.343
  602    HE1  TRP  75           1HE      TRP  75   2.901  -0.703   9.586
  603    HE3  TRP  75           3HE      TRP  75   2.708  -2.925  14.444
  604    HZ2  TRP  75           2HZ      TRP  75   3.141   1.192  11.664
  605    HZ3  TRP  75           3HZ      TRP  75   2.972  -0.709  15.481
  606    HH2  TRP  75           HH       TRP  75   3.184   1.305  14.118
  607    H    TYR  76           H        TYR  76   0.846  -4.009   8.936
  608    HA   TYR  76           HA       TYR  76  -1.622  -2.989  10.181
  609   1HB   TYR  76          1HB       TYR  76   0.512  -1.688   8.655
  610   2HB   TYR  76          2HB       TYR  76  -1.100  -1.304   8.063
  611    HD1  TYR  76           2HD      TYR  76  -2.627  -1.336  10.616
  612    HD2  TYR  76           1HD      TYR  76   1.192   0.297   9.690
  613    HE1  TYR  76           2HE      TYR  76  -2.900   0.312  12.421
  614    HE2  TYR  76           1HE      TYR  76   0.930   1.949  11.494
  615    HH   TYR  76           HH       TYR  76  -0.741   1.819  13.878
  616    H    LEU  77           H        LEU  77  -0.204  -3.867   7.036
  617    HA   LEU  77           HA       LEU  77  -2.731  -3.982   5.712
  618   1HB   LEU  77          1HB       LEU  77  -0.004  -5.011   4.955
  619   2HB   LEU  77          2HB       LEU  77  -1.413  -5.101   3.899
  620    HG   LEU  77           HG       LEU  77  -0.128  -2.564   4.910
  621   1HD1  LEU  77          1HD1      LEU  77   0.489  -2.272   2.524
  622   2HD1  LEU  77          2HD1      LEU  77  -0.059  -3.920   2.221
  623   3HD1  LEU  77          3HD1      LEU  77   1.301  -3.629   3.305
  624   1HD2  LEU  77          1HD2      LEU  77  -2.488  -2.234   4.601
  625   2HD2  LEU  77          2HD2      LEU  77  -2.439  -3.038   3.032
  626   3HD2  LEU  77          3HD2      LEU  77  -1.630  -1.486   3.255
  627    H    GLY  78           H        GLY  78  -1.170  -6.051   7.859
  628   1HA   GLY  78          1HA       GLY  78  -1.745  -8.134   8.646
  629   2HA   GLY  78          2HA       GLY  78  -3.198  -8.028   7.664
  630    H    ALA  79           H        ALA  79  -1.587 -10.362   8.108
  631    HA   ALA  79           HA       ALA  79   0.023 -10.841   5.788
  632   1HB   ALA  79          1HB       ALA  79  -0.615 -13.320   6.826
  633   2HB   ALA  79          2HB       ALA  79   0.795 -12.344   7.240
  634   3HB   ALA  79          3HB       ALA  79  -0.661 -12.252   8.229
  635    H    ARG  80           H        ARG  80  -3.327 -11.256   6.622
  636    HA   ARG  80           HA       ARG  80  -4.138 -13.204   4.832
  637   1HB   ARG  80          1HB       ARG  80  -5.672 -10.701   5.555
  638   2HB   ARG  80          2HB       ARG  80  -6.352 -12.203   4.946
  639   1HG   ARG  80          1HG       ARG  80  -4.843 -12.857   7.235
  640   2HG   ARG  80          2HG       ARG  80  -5.810 -11.436   7.634
  641   1HD   ARG  80          1HD       ARG  80  -6.826 -14.036   6.492
  642   2HD   ARG  80          2HD       ARG  80  -7.035 -13.469   8.149
  643    HE   ARG  80           HE       ARG  80  -8.110 -11.505   6.552
  644   1HH1  ARG  80          1HH1      ARG  80  -8.659 -14.900   7.089
  645   2HH1  ARG  80          2HH1      ARG  80 -10.349 -14.819   6.716
  646   1HH2  ARG  80          1HH2      ARG  80 -10.333 -11.385   6.058
  647   2HH2  ARG  80          2HH2      ARG  80 -11.300 -12.819   6.129
  648    H    CYS  81           H        CYS  81  -3.642  -9.744   4.284
  649    HA   CYS  81           HA       CYS  81  -4.324 -10.039   1.466
  650   1HB   CYS  81          1HB       CYS  81  -3.387  -7.534   2.866
  651   2HB   CYS  81          2HB       CYS  81  -4.256  -7.654   1.341
  652    HG   CYS  81           HG       CYS  81  -5.436  -7.732   4.490
  653    H    HIS  82           H        HIS  82  -2.889 -10.025  -0.178
  654    HA   HIS  82           HA       HIS  82  -0.137 -10.516   0.413
  655   1HB   HIS  82          1HB       HIS  82  -1.263 -11.634  -1.457
  656   2HB   HIS  82          2HB       HIS  82  -1.515 -10.080  -2.245
  657    HD1  HIS  82           1HD      HIS  82   0.770 -12.858  -2.157
  658    HD2  HIS  82           2HD      HIS  82   1.083  -8.781  -2.895
  659    HE1  HIS  82           1HE      HIS  82   2.954 -12.559  -3.366
  660    H    ILE  83           H        ILE  83   1.552  -9.161   0.388
  661    HA   ILE  83           HA       ILE  83   1.049  -6.378  -0.437
  662    HB   ILE  83           HB       ILE  83   3.277  -7.160   1.410
  663   1HG1  ILE  83          1HG1      ILE  83   0.403  -6.618   2.187
  664   2HG1  ILE  83          2HG1      ILE  83   1.283  -8.125   2.417
  665   1HG2  ILE  83          1HG2      ILE  83   1.635  -4.641   1.197
  666   2HG2  ILE  83          2HG2      ILE  83   3.091  -4.881   2.161
  667   3HG2  ILE  83          3HG2      ILE  83   3.187  -4.898   0.401
  668   1HD1  ILE  83          1HD1      ILE  83   2.890  -6.715   3.843
  669   2HD1  ILE  83          2HD1      ILE  83   1.584  -5.529   3.863
  670   3HD1  ILE  83          3HD1      ILE  83   1.316  -7.146   4.512
  671    H    GLU  84           H        GLU  84   2.511  -5.325  -1.736
  672    HA   GLU  84           HA       GLU  84   4.965  -6.665  -2.530
  673   1HB   GLU  84          1HB       GLU  84   2.664  -7.009  -4.061
  674   2HB   GLU  84          2HB       GLU  84   3.555  -5.746  -4.899
  675   1HG   GLU  84          1HG       GLU  84   5.492  -7.163  -5.076
  676   2HG   GLU  84          2HG       GLU  84   4.705  -8.413  -4.114
  677    H    LYS  85           H        LYS  85   6.276  -5.276  -4.011
  678    HA   LYS  85           HA       LYS  85   6.225  -2.559  -3.034
  679   1HB   LYS  85          1HB       LYS  85   8.115  -3.707  -5.084
  680   2HB   LYS  85          2HB       LYS  85   8.374  -2.319  -4.035
  681   1HG   LYS  85          1HG       LYS  85   8.276  -3.902  -2.088
  682   2HG   LYS  85          2HG       LYS  85   8.298  -5.222  -3.260
  683   1HD   LYS  85          1HD       LYS  85  10.385  -3.643  -4.090
  684   2HD   LYS  85          2HD       LYS  85  10.465  -3.496  -2.333
  685   1HE   LYS  85          1HE       LYS  85  11.819  -5.349  -2.908
  686   2HE   LYS  85          2HE       LYS  85  10.329  -6.014  -2.240
  687   1HZ   LYS  85          1HZ       LYS  85   9.662  -6.799  -4.258
  688   2HZ   LYS  85          2HZ       LYS  85  11.337  -6.932  -4.453
  689   3HZ   LYS  85          3HZ       LYS  85  10.507  -5.627  -5.140
  690    H    ALA  86           H        ALA  86   5.570  -0.785  -4.097
  691    HA   ALA  86           HA       ALA  86   4.226  -1.134  -6.642
  692   1HB   ALA  86          1HB       ALA  86   3.920   0.581  -4.413
  693   2HB   ALA  86          2HB       ALA  86   4.252   1.592  -5.821
  694   3HB   ALA  86          3HB       ALA  86   2.902   0.457  -5.848
  695    H    LYS  87           H        LYS  87   4.588   0.317  -8.450
  696    HA   LYS  87           HA       LYS  87   7.244   1.541  -8.570
  697   1HB   LYS  87          1HB       LYS  87   7.584   0.503 -10.837
  698   2HB   LYS  87          2HB       LYS  87   7.675  -0.618  -9.486
  699   1HG   LYS  87          1HG       LYS  87   6.107  -1.878 -10.399
  700   2HG   LYS  87          2HG       LYS  87   4.981  -0.519 -10.392
  701   1HD   LYS  87          1HD       LYS  87   5.918   0.242 -12.537
  702   2HD   LYS  87          2HD       LYS  87   7.000  -1.153 -12.546
  703   1HE   LYS  87          1HE       LYS  87   4.797  -2.516 -12.292
  704   2HE   LYS  87          2HE       LYS  87   4.031  -1.048 -12.897
  705   1HZ   LYS  87          1HZ       LYS  87   4.467  -2.385 -14.763
  706   2HZ   LYS  87          2HZ       LYS  87   6.042  -2.742 -14.260
  707   3HZ   LYS  87          3HZ       LYS  87   5.657  -1.183 -14.793
  708    H    GLY  88           H        GLY  88   7.397   3.299  -9.928
  709   1HA   GLY  88          1HA       GLY  88   6.539   4.508 -11.882
  710   2HA   GLY  88          2HA       GLY  88   4.926   4.043 -11.366
  711    H    THR  89           H        THR  89   5.301   6.634 -11.876
  712    HA   THR  89           HA       THR  89   6.138   8.122  -9.572
  713    HB   THR  89           HB       THR  89   5.496  10.083 -10.749
  714    HG1  THR  89           1HG      THR  89   3.881  10.121 -12.144
  715   1HG2  THR  89          1HG2      THR  89   6.280   8.250 -12.994
  716   2HG2  THR  89          2HG2      THR  89   7.402   8.628 -11.687
  717   3HG2  THR  89          3HG2      THR  89   6.768   9.920 -12.706
  718    H    ASP  90           H        ASP  90   4.521   9.874  -8.751
  719    HA   ASP  90           HA       ASP  90   2.584   8.632  -7.204
  720   1HB   ASP  90          1HB       ASP  90   1.784  10.861  -6.653
  721   2HB   ASP  90          2HB       ASP  90   3.544  10.864  -6.727
  722    H    GLN  91           H        GLN  91   2.263  10.250 -10.328
  723    HA   GLN  91           HA       GLN  91  -0.569  10.054 -10.454
  724   1HB   GLN  91          1HB       GLN  91   1.195  11.491 -11.839
  725   2HB   GLN  91          2HB       GLN  91   1.045  10.139 -12.954
  726   1HG   GLN  91          1HG       GLN  91  -0.505  11.736 -13.681
  727   2HG   GLN  91          2HG       GLN  91  -1.453  10.502 -12.852
  728   1HE2  GLN  91          1HE2      GLN  91  -3.155  11.791 -12.316
  729   2HE2  GLN  91          2HE2      GLN  91  -3.046  13.100 -11.193
  730    H    GLN  92           H        GLN  92   2.079   7.993 -11.497
  731    HA   GLN  92           HA       GLN  92   0.595   6.224 -13.102
  732   1HB   GLN  92          1HB       GLN  92   3.261   6.326 -11.934
  733   2HB   GLN  92          2HB       GLN  92   2.620   4.689 -11.986
  734   1HG   GLN  92          1HG       GLN  92   2.009   5.666 -14.478
  735   2HG   GLN  92          2HG       GLN  92   3.579   6.392 -14.136
  736   1HE2  GLN  92          1HE2      GLN  92   5.377   5.088 -13.935
  737   2HE2  GLN  92          2HE2      GLN  92   5.382   3.427 -14.410
  738    H    ASN  93           H        ASN  93   1.318   6.227  -9.643
  739    HA   ASN  93           HA       ASN  93   0.072   3.705  -9.140
  740   1HB   ASN  93          1HB       ASN  93   0.576   5.875  -7.104
  741   2HB   ASN  93          2HB       ASN  93   0.480   4.137  -6.834
  742   1HD2  ASN  93          1HD2      ASN  93   2.068   3.206  -8.876
  743   2HD2  ASN  93          2HD2      ASN  93   3.699   3.709  -8.606
  744    H    LYS  94           H        LYS  94  -0.918   7.086  -8.807
  745    HA   LYS  94           HA       LYS  94  -3.398   6.629  -7.574
  746   1HB   LYS  94          1HB       LYS  94  -2.316   8.842  -7.705
  747   2HB   LYS  94          2HB       LYS  94  -2.610   8.876  -9.438
  748   1HG   LYS  94          1HG       LYS  94  -4.766   9.451  -9.194
  749   2HG   LYS  94          2HG       LYS  94  -4.991   8.419  -7.780
  750   1HD   LYS  94          1HD       LYS  94  -3.939  10.048  -6.357
  751   2HD   LYS  94          2HD       LYS  94  -3.504  11.043  -7.748
  752   1HE   LYS  94          1HE       LYS  94  -5.783  11.576  -8.177
  753   2HE   LYS  94          2HE       LYS  94  -6.348  10.371  -7.022
  754   1HZ   LYS  94          1HZ       LYS  94  -6.525  12.281  -5.803
  755   2HZ   LYS  94          2HZ       LYS  94  -5.184  13.018  -6.523
  756   3HZ   LYS  94          3HZ       LYS  94  -4.961  11.802  -5.368
  757    H    GLU  95           H        GLU  95  -2.519   6.917 -11.000
  758    HA   GLU  95           HA       GLU  95  -5.176   6.591 -11.963
  759   1HB   GLU  95          1HB       GLU  95  -2.459   6.421 -13.240
  760   2HB   GLU  95          2HB       GLU  95  -3.914   6.023 -14.144
  761   1HG   GLU  95          1HG       GLU  95  -4.230   8.534 -12.785
  762   2HG   GLU  95          2HG       GLU  95  -2.773   8.540 -13.777
  763    H    TYR  96           H        TYR  96  -2.525   4.392 -11.278
  764    HA   TYR  96           HA       TYR  96  -3.446   2.104 -12.566
  765   1HB   TYR  96          1HB       TYR  96  -1.212   2.325 -11.516
  766   2HB   TYR  96          2HB       TYR  96  -1.968   2.241  -9.929
  767    HD1  TYR  96           2HD      TYR  96  -1.052   0.344 -12.929
  768    HD2  TYR  96           1HD      TYR  96  -2.805   0.142  -9.057
  769    HE1  TYR  96           2HE      TYR  96  -0.882  -2.109 -12.986
  770    HE2  TYR  96           1HE      TYR  96  -2.638  -2.311  -9.103
  771    HH   TYR  96           HH       TYR  96  -1.463  -4.019 -11.972
  772    H    CYS  97           H        CYS  97  -3.974   3.074  -9.176
  773    HA   CYS  97           HA       CYS  97  -5.719   0.959  -8.545
  774   1HB   CYS  97          1HB       CYS  97  -5.657   3.703  -7.277
  775   2HB   CYS  97          2HB       CYS  97  -6.274   2.222  -6.555
  776    HG   CYS  97           HG       CYS  97  -3.401   1.235  -7.108
  777    H    SER  98           H        SER  98  -6.259   4.137  -9.929
  778    HA   SER  98           HA       SER  98  -9.116   4.016  -9.709
  779   1HB   SER  98          1HB       SER  98  -7.754   6.145  -9.823
  780   2HB   SER  98          2HB       SER  98  -7.502   5.806 -11.535
  781    HG   SER  98           HG       SER  98  -9.611   6.940 -10.352
  782    H    LYS  99           H        LYS  99  -6.857   2.588 -11.758
  783    HA   LYS  99           HA       LYS  99  -8.102   2.605 -14.249
  784   1HB   LYS  99          1HB       LYS  99  -5.807   1.702 -13.672
  785   2HB   LYS  99          2HB       LYS  99  -6.612   0.252 -13.085
  786   1HG   LYS  99          1HG       LYS  99  -7.391  -0.308 -15.239
  787   2HG   LYS  99          2HG       LYS  99  -6.977   1.283 -15.882
  788   1HD   LYS  99          1HD       LYS  99  -5.352  -0.378 -16.602
  789   2HD   LYS  99          2HD       LYS  99  -4.597   0.796 -15.521
  790   1HE   LYS  99          1HE       LYS  99  -4.023  -0.802 -14.085
  791   2HE   LYS  99          2HE       LYS  99  -5.677  -1.411 -14.022
  792   1HZ   LYS  99          1HZ       LYS  99  -5.256  -2.990 -15.570
  793   2HZ   LYS  99          2HZ       LYS  99  -3.689  -2.853 -14.948
  794   3HZ   LYS  99          3HZ       LYS  99  -4.098  -2.067 -16.388
  795    H    GLU 100           H        GLU 100  -8.976   0.982 -11.335
  796    HA   GLU 100           HA       GLU 100 -10.568  -1.070 -12.518
  797   1HB   GLU 100          1HB       GLU 100 -10.525   0.093  -9.731
  798   2HB   GLU 100          2HB       GLU 100 -11.523  -1.275 -10.201
  799   1HG   GLU 100          1HG       GLU 100  -9.753  -2.701 -10.352
  800   2HG   GLU 100          2HG       GLU 100  -8.612  -1.419 -10.755
  801    H    GLY 101           H        GLY 101 -11.040   2.273 -11.866
  802   1HA   GLY 101          1HA       GLY 101 -12.796   3.564 -12.742
  803   2HA   GLY 101          2HA       GLY 101 -13.737   2.096 -12.961
  804    H    ASN 102           H        ASN 102 -12.704   1.626  -9.992
  805    HA   ASN 102           HA       ASN 102 -14.689   3.354  -8.688
  806   1HB   ASN 102          1HB       ASN 102 -15.394   0.860  -9.247
  807   2HB   ASN 102          2HB       ASN 102 -14.463   0.513  -7.793
  808   1HD2  ASN 102          1HD2      ASN 102 -16.235  -0.122  -6.613
  809   2HD2  ASN 102          2HD2      ASN 102 -17.443   0.987  -6.068
  810    H    LEU 103           H        LEU 103 -13.856   4.368  -6.993
  811    HA   LEU 103           HA       LEU 103 -11.367   3.346  -5.824
  812   1HB   LEU 103          1HB       LEU 103 -12.637   6.072  -5.614
  813   2HB   LEU 103          2HB       LEU 103 -11.087   5.605  -4.917
  814    HG   LEU 103           HG       LEU 103 -11.782   5.946  -7.826
  815   1HD1  LEU 103          1HD1      LEU 103 -11.140   7.905  -6.313
  816   2HD1  LEU 103          2HD1      LEU 103 -10.241   7.700  -7.816
  817   3HD1  LEU 103          3HD1      LEU 103  -9.528   7.188  -6.286
  818   1HD2  LEU 103          1HD2      LEU 103  -9.372   5.298  -8.199
  819   2HD2  LEU 103          2HD2      LEU 103 -10.466   3.979  -7.783
  820   3HD2  LEU 103          3HD2      LEU 103  -9.382   4.645  -6.561
  821    H    LEU 104           H        LEU 104 -11.302   2.570  -3.814
  822    HA   LEU 104           HA       LEU 104 -13.756   2.488  -2.268
  823   1HB   LEU 104          1HB       LEU 104 -12.715   0.424  -2.275
  824   2HB   LEU 104          2HB       LEU 104 -11.104   1.123  -2.126
  825    HG   LEU 104           HG       LEU 104 -11.437   1.548   0.211
  826   1HD1  LEU 104          1HD1      LEU 104 -13.489   2.052   0.902
  827   2HD1  LEU 104          2HD1      LEU 104 -13.817   0.320   0.915
  828   3HD1  LEU 104          3HD1      LEU 104 -14.231   1.285  -0.502
  829   1HD2  LEU 104          1HD2      LEU 104 -12.069  -1.179  -0.815
  830   2HD2  LEU 104          2HD2      LEU 104 -12.133  -0.876   0.921
  831   3HD2  LEU 104          3HD2      LEU 104 -10.635  -0.596   0.031
  832    H    MET 105           H        MET 105 -10.475   3.774  -1.964
  833    HA   MET 105           HA       MET 105 -11.453   5.627   0.074
  834   1HB   MET 105          1HB       MET 105 -10.509   4.130   1.561
  835   2HB   MET 105          2HB       MET 105  -9.270   3.618   0.424
  836   1HG   MET 105          1HG       MET 105  -7.855   5.287   0.994
  837   2HG   MET 105          2HG       MET 105  -9.156   6.422   1.344
  838   1HE   MET 105          1HE       MET 105  -7.642   2.915   3.091
  839   2HE   MET 105          2HE       MET 105  -6.594   4.155   2.402
  840   3HE   MET 105          3HE       MET 105  -6.721   3.980   4.153
  841    H    GLU 106           H        GLU 106 -10.611   7.640  -0.088
  842    HA   GLU 106           HA       GLU 106  -8.291   8.035  -1.848
  843   1HB   GLU 106          1HB       GLU 106 -10.904   8.655  -2.572
  844   2HB   GLU 106          2HB       GLU 106 -10.231  10.193  -2.049
  845   1HG   GLU 106          1HG       GLU 106  -8.244   9.566  -3.582
  846   2HG   GLU 106          2HG       GLU 106  -9.384   8.433  -4.305
  847    H    CYS 107           H        CYS 107  -6.798   8.754  -0.459
  848    HA   CYS 107           HA       CYS 107  -7.288  11.254   0.921
  849   1HB   CYS 107          1HB       CYS 107  -6.855   8.656   2.336
  850   2HB   CYS 107          2HB       CYS 107  -6.155  10.119   3.019
  851    HG   CYS 107           HG       CYS 107  -8.467  11.374   3.595
  852    H    GLY 108           H        GLY 108  -5.155  11.830   2.205
  853   1HA   GLY 108          1HA       GLY 108  -2.867  12.154   2.181
  854   2HA   GLY 108          2HA       GLY 108  -2.723  10.762   1.117
  855    H    ALA 109           H        ALA 109  -1.035  12.543   0.416
  856    HA   ALA 109           HA       ALA 109  -2.285  14.231  -1.648
  857   1HB   ALA 109          1HB       ALA 109  -1.103  15.761  -0.457
  858   2HB   ALA 109          2HB       ALA 109   0.094  14.583   0.083
  859   3HB   ALA 109          3HB       ALA 109   0.175  15.235  -1.554
  860    HA   PRO 110           HA       PRO 110  -0.414  11.960  -4.903
  861   1HB   PRO 110          1HB       PRO 110   0.283  13.922  -6.645
  862   2HB   PRO 110          2HB       PRO 110  -1.394  13.438  -6.363
  863   1HG   PRO 110          1HG       PRO 110   0.122  15.760  -5.236
  864   2HG   PRO 110          2HG       PRO 110  -1.536  15.704  -5.861
  865   1HD   PRO 110          1HD       PRO 110  -0.975  15.651  -3.213
  866   2HD   PRO 110          2HD       PRO 110  -2.376  14.812  -3.909
  867    H    ARG 111           H        ARG 111   1.404  11.383  -3.414
  868    HA   ARG 111           HA       ARG 111   3.908  12.705  -4.230
  869   1HB   ARG 111          1HB       ARG 111   4.873  12.075  -2.123
  870   2HB   ARG 111          2HB       ARG 111   3.341  12.878  -1.804
  871   1HG   ARG 111          1HG       ARG 111   2.569  11.112  -0.714
  872   2HG   ARG 111          2HG       ARG 111   2.956  10.040  -2.062
  873   1HD   ARG 111          1HD       ARG 111   5.207  10.983  -0.379
  874   2HD   ARG 111          2HD       ARG 111   4.099   9.811   0.336
  875    HE   ARG 111           HE       ARG 111   4.697   8.725  -2.073
  876   1HH1  ARG 111          1HH1      ARG 111   6.620   9.931   0.566
  877   2HH1  ARG 111          2HH1      ARG 111   7.938   8.844   0.273
  878   1HH2  ARG 111          1HH2      ARG 111   6.425   7.290  -2.469
  879   2HH2  ARG 111          2HH2      ARG 111   7.826   7.344  -1.454
  880    H    SER 112           H        SER 112   5.757  11.367  -4.572
  881    HA   SER 112           HA       SER 112   5.139   8.536  -5.086
  882   1HB   SER 112          1HB       SER 112   5.835   8.627  -7.247
  883   2HB   SER 112          2HB       SER 112   5.438  10.339  -7.097
  884    HG   SER 112           HG       SER 112   7.674   9.552  -7.854
  885    H    GLN 113           H        GLN 113   7.474   7.518  -5.793
  886    HA   GLN 113           HA       GLN 113   8.900   7.201  -3.451
  887   1HB   GLN 113          1HB       GLN 113   9.114   5.603  -5.232
  888   2HB   GLN 113          2HB       GLN 113   9.784   6.819  -6.312
  889   1HG   GLN 113          1HG       GLN 113  11.349   6.599  -3.902
  890   2HG   GLN 113          2HG       GLN 113  11.183   5.038  -4.702
  891   1HE2  GLN 113          1HE2      GLN 113  13.383   7.146  -4.380
  892   2HE2  GLN 113          2HE2      GLN 113  14.012   7.315  -5.979
  893    H    GLY 114           H        GLY 114   9.928   9.116  -6.286
  894   1HA   GLY 114          1HA       GLY 114  10.654  11.458  -5.349
  895   2HA   GLY 114          2HA       GLY 114  11.901  10.472  -4.599
  896    H    GLN 115           H        GLN 115  13.232  12.042  -5.899
  897    HA   GLN 115           HA       GLN 115  13.431  11.276  -8.721
  898   1HB   GLN 115          1HB       GLN 115  14.867  13.267  -8.953
  899   2HB   GLN 115          2HB       GLN 115  13.280  13.664  -8.307
  900   1HG   GLN 115          1HG       GLN 115  14.108  14.377  -6.350
  901   2HG   GLN 115          2HG       GLN 115  15.338  13.115  -6.290
  902   1HE2  GLN 115          1HE2      GLN 115  17.295  13.928  -6.249
  903   2HE2  GLN 115          2HE2      GLN 115  17.842  15.325  -7.105
  904    H    ARG 116           H        ARG 116  15.964  11.682  -9.384
  905    HA   ARG 116           HA       ARG 116  17.405   9.655  -7.821
  906   1HB   ARG 116          1HB       ARG 116  17.214  10.294 -10.681
  907   2HB   ARG 116          2HB       ARG 116  18.854   9.989 -10.124
  908   1HG   ARG 116          1HG       ARG 116  18.335   7.854 -10.562
  909   2HG   ARG 116          2HG       ARG 116  17.558   7.918  -8.979
  910   1HD   ARG 116          1HD       ARG 116  15.836   7.083 -10.225
  911   2HD   ARG 116          2HD       ARG 116  15.523   8.810 -10.396
  912    HE   ARG 116           HE       ARG 116  17.219   7.833 -12.465
  913   1HH1  ARG 116          1HH1      ARG 116  13.903   8.002 -11.416
  914   2HH1  ARG 116          2HH1      ARG 116  13.254   7.883 -13.018
  915   1HH2  ARG 116          1HH2      ARG 116  16.376   7.677 -14.579
  916   2HH2  ARG 116          2HH2      ARG 116  14.662   7.697 -14.816
  Start of MODEL   22
    1    HA   PRO   2           HA       PRO   2  33.069   5.259  16.904
    2   1HB   PRO   2          1HB       PRO   2  32.553   3.201  18.598
    3   2HB   PRO   2          2HB       PRO   2  33.968   4.248  18.761
    4   1HG   PRO   2          1HG       PRO   2  31.363   4.340  20.233
    5   2HG   PRO   2          2HG       PRO   2  33.010   4.529  20.861
    6   1HD   PRO   2          1HD       PRO   2  31.384   6.639  20.375
    7   2HD   PRO   2          2HD       PRO   2  33.147   6.730  20.190
    8    H    SER   3           H        SER   3  32.050   3.992  15.440
    9    HA   SER   3           HA       SER   3  29.436   2.884  15.940
   10   1HB   SER   3          1HB       SER   3  29.786   5.362  14.376
   11   2HB   SER   3          2HB       SER   3  28.804   4.121  13.597
   12    HG   SER   3           HG       SER   3  27.401   4.164  15.299
   13    H    LYS   4           H        LYS   4  30.281   0.892  15.458
   14    HA   LYS   4           HA       LYS   4  31.956   0.285  13.296
   15   1HB   LYS   4          1HB       LYS   4  29.983  -1.478  14.760
   16   2HB   LYS   4          2HB       LYS   4  31.220  -2.064  13.656
   17   1HG   LYS   4          1HG       LYS   4  31.935  -0.412  16.049
   18   2HG   LYS   4          2HG       LYS   4  31.689  -2.156  16.171
   19   1HD   LYS   4          1HD       LYS   4  33.340  -2.167  14.101
   20   2HD   LYS   4          2HD       LYS   4  33.841  -0.624  14.799
   21   1HE   LYS   4          1HE       LYS   4  33.626  -3.112  16.465
   22   2HE   LYS   4          2HE       LYS   4  35.080  -2.746  15.538
   23   1HZ   LYS   4          1HZ       LYS   4  33.997  -1.411  17.902
   24   2HZ   LYS   4          2HZ       LYS   4  34.797  -0.450  16.763
   25   3HZ   LYS   4          3HZ       LYS   4  35.604  -1.746  17.491
   26    H    LYS   5           H        LYS   5  31.363  -1.148  11.443
   27    HA   LYS   5           HA       LYS   5  28.703  -0.500  10.362
   28   1HB   LYS   5          1HB       LYS   5  29.787  -0.284   8.114
   29   2HB   LYS   5          2HB       LYS   5  30.218   0.986   9.252
   30   1HG   LYS   5          1HG       LYS   5  32.382   0.285   9.435
   31   2HG   LYS   5          2HG       LYS   5  31.985  -1.395   9.067
   32   1HD   LYS   5          1HD       LYS   5  31.381  -0.445   6.715
   33   2HD   LYS   5          2HD       LYS   5  32.398   0.910   7.207
   34   1HE   LYS   5          1HE       LYS   5  34.308  -0.391   7.305
   35   2HE   LYS   5          2HE       LYS   5  33.400  -1.889   7.510
   36   1HZ   LYS   5          1HZ       LYS   5  34.456  -0.916   5.170
   37   2HZ   LYS   5          2HZ       LYS   5  32.793  -0.645   5.026
   38   3HZ   LYS   5          3HZ       LYS   5  33.372  -2.205   5.329
   39    H    ASN   6           H        ASN   6  27.705  -2.084   9.169
   40    HA   ASN   6           HA       ASN   6  29.169  -4.556   8.624
   41   1HB   ASN   6          1HB       ASN   6  27.343  -4.253  10.793
   42   2HB   ASN   6          2HB       ASN   6  26.592  -5.301   9.593
   43   1HD2  ASN   6          1HD2      ASN   6  27.611  -5.906  12.263
   44   2HD2  ASN   6          2HD2      ASN   6  28.783  -7.158  12.050
   45    H    GLY   7           H        GLY   7  28.884  -4.920   6.528
   46   1HA   GLY   7          1HA       GLY   7  26.631  -3.832   5.099
   47   2HA   GLY   7          2HA       GLY   7  27.941  -4.784   4.417
   48    H    ARG   8           H        ARG   8  24.696  -4.763   5.189
   49    HA   ARG   8           HA       ARG   8  24.545  -7.694   5.329
   50   1HB   ARG   8          1HB       ARG   8  23.222  -5.720   6.782
   51   2HB   ARG   8          2HB       ARG   8  22.017  -6.292   5.635
   52   1HG   ARG   8          1HG       ARG   8  22.259  -8.548   6.419
   53   2HG   ARG   8          2HG       ARG   8  23.604  -8.081   7.462
   54   1HD   ARG   8          1HD       ARG   8  20.935  -6.762   7.756
   55   2HD   ARG   8          2HD       ARG   8  21.226  -8.347   8.472
   56    HE   ARG   8           HE       ARG   8  23.327  -6.808   9.305
   57   1HH1  ARG   8          1HH1      ARG   8  19.859  -6.589   9.514
   58   2HH1  ARG   8          2HH1      ARG   8  19.874  -5.726  11.016
   59   1HH2  ARG   8          1HH2      ARG   8  23.360  -5.672  11.282
   60   2HH2  ARG   8          2HH2      ARG   8  21.865  -5.204  12.021
   61    H    SER   9           H        SER   9  22.602  -8.644   4.177
   62    HA   SER   9           HA       SER   9  22.208  -7.312   1.578
   63   1HB   SER   9          1HB       SER   9  22.563  -9.292   0.406
   64   2HB   SER   9          2HB       SER   9  23.756  -9.419   1.699
   65    HG   SER   9           HG       SER   9  22.028 -11.204   1.145
   66    H    GLY  10           H        GLY  10  20.204  -7.657   0.538
   67   1HA   GLY  10          1HA       GLY  10  18.069  -9.003   0.682
   68   2HA   GLY  10          2HA       GLY  10  18.079  -8.554   2.382
   69    HA   PRO  11           HA       PRO  11  15.694  -5.434  -0.233
   70   1HB   PRO  11          1HB       PRO  11  13.256  -5.883   0.873
   71   2HB   PRO  11          2HB       PRO  11  13.847  -6.765  -0.540
   72   1HG   PRO  11          1HG       PRO  11  13.809  -7.601   2.334
   73   2HG   PRO  11          2HG       PRO  11  13.399  -8.544   0.889
   74   1HD   PRO  11          1HD       PRO  11  15.787  -8.769   2.147
   75   2HD   PRO  11          2HD       PRO  11  15.608  -8.979   0.393
   76    H    GLN  12           H        GLN  12  15.077  -3.413   0.501
   77    HA   GLN  12           HA       GLN  12  15.343  -2.978   3.403
   78   1HB   GLN  12          1HB       GLN  12  16.371  -1.487   1.052
   79   2HB   GLN  12          2HB       GLN  12  15.823  -0.527   2.420
   80   1HG   GLN  12          1HG       GLN  12  17.590  -1.074   3.669
   81   2HG   GLN  12          2HG       GLN  12  17.553  -2.761   3.157
   82   1HE2  GLN  12          1HE2      GLN  12  19.526  -0.287   3.276
   83   2HE2  GLN  12          2HE2      GLN  12  20.433  -0.496   1.821
   84    HA   PRO  13           HA       PRO  13  11.338  -1.204   3.609
   85   1HB   PRO  13          1HB       PRO  13  11.703   0.879   5.312
   86   2HB   PRO  13          2HB       PRO  13  11.729  -0.808   5.838
   87   1HG   PRO  13          1HG       PRO  13  14.018   1.027   5.246
   88   2HG   PRO  13          2HG       PRO  13  13.820  -0.118   6.585
   89   1HD   PRO  13          1HD       PRO  13  15.324  -0.675   4.403
   90   2HD   PRO  13          2HD       PRO  13  14.436  -1.927   5.296
   91    H    HIS  14           H        HIS  14  10.048   0.315   2.648
   92    HA   HIS  14           HA       HIS  14  11.353   2.674   1.476
   93   1HB   HIS  14          1HB       HIS  14   9.345   0.916   0.051
   94   2HB   HIS  14          2HB       HIS  14  10.109   2.363  -0.599
   95    HD1  HIS  14           1HD      HIS  14  10.460  -1.222  -0.508
   96    HD2  HIS  14           2HD      HIS  14  13.048   2.011  -0.839
   97    HE1  HIS  14           1HE      HIS  14  12.601  -2.167  -1.429
   98    H    LYS  15           H        LYS  15   9.482   4.111   0.462
   99    HA   LYS  15           HA       LYS  15   7.541   4.493   2.632
  100   1HB   LYS  15          1HB       LYS  15   7.307   6.802   1.622
  101   2HB   LYS  15          2HB       LYS  15   8.871   6.437   2.341
  102   1HG   LYS  15          1HG       LYS  15   8.868   5.723  -0.440
  103   2HG   LYS  15          2HG       LYS  15   8.355   7.399  -0.231
  104   1HD   LYS  15          1HD       LYS  15  10.386   8.065   0.501
  105   2HD   LYS  15          2HD       LYS  15  10.674   6.565   1.386
  106   1HE   LYS  15          1HE       LYS  15  11.151   5.427  -0.744
  107   2HE   LYS  15          2HE       LYS  15  10.908   6.950  -1.598
  108   1HZ   LYS  15          1HZ       LYS  15  12.838   7.837  -0.744
  109   2HZ   LYS  15          2HZ       LYS  15  13.284   6.221  -0.964
  110   3HZ   LYS  15          3HZ       LYS  15  12.883   6.785   0.579
  111    H    ARG  16           H        ARG  16   7.409   2.691   0.157
  112    HA   ARG  16           HA       ARG  16   4.682   3.461  -0.572
  113   1HB   ARG  16          1HB       ARG  16   6.835   2.741  -2.570
  114   2HB   ARG  16          2HB       ARG  16   5.128   2.926  -2.950
  115   1HG   ARG  16          1HG       ARG  16   5.274   5.284  -2.175
  116   2HG   ARG  16          2HG       ARG  16   7.015   5.063  -1.989
  117   1HD   ARG  16          1HD       ARG  16   5.390   4.925  -4.519
  118   2HD   ARG  16          2HD       ARG  16   6.655   6.083  -4.107
  119    HE   ARG  16           HE       ARG  16   7.965   3.732  -4.034
  120   1HH1  ARG  16          1HH1      ARG  16   5.869   5.192  -6.399
  121   2HH1  ARG  16          2HH1      ARG  16   6.643   4.428  -7.748
  122   1HH2  ARG  16          1HH2      ARG  16   8.992   2.720  -5.801
  123   2HH2  ARG  16          2HH2      ARG  16   8.418   3.021  -7.406
  124    H    TRP  17           H        TRP  17   3.330   1.794  -0.434
  125    HA   TRP  17           HA       TRP  17   4.229  -0.903  -1.019
  126   1HB   TRP  17          1HB       TRP  17   3.329  -0.030   1.723
  127   2HB   TRP  17          2HB       TRP  17   3.217  -1.706   1.193
  128    HD1  TRP  17           HD       TRP  17   5.709   0.895   2.374
  129    HE1  TRP  17           1HE      TRP  17   8.000  -0.226   2.716
  130    HE3  TRP  17           3HE      TRP  17   4.708  -3.656   0.271
  131    HZ2  TRP  17           2HZ      TRP  17   9.222  -2.710   2.168
  132    HZ3  TRP  17           3HZ      TRP  17   6.493  -5.349   0.220
  133    HH2  TRP  17           HH       TRP  17   8.703  -4.884   1.148
  134    H    VAL  18           H        VAL  18   2.634  -2.144  -1.845
  135    HA   VAL  18           HA       VAL  18  -0.071  -0.979  -1.883
  136    HB   VAL  18           HB       VAL  18  -0.462  -2.217  -3.945
  137   1HG1  VAL  18          1HG1      VAL  18   0.411   0.000  -4.199
  138   2HG1  VAL  18          2HG1      VAL  18   2.062  -0.570  -3.946
  139   3HG1  VAL  18          3HG1      VAL  18   1.180  -1.038  -5.400
  140   1HG2  VAL  18          1HG2      VAL  18   2.243  -2.993  -4.547
  141   2HG2  VAL  18          2HG2      VAL  18   1.683  -3.790  -3.076
  142   3HG2  VAL  18          3HG2      VAL  18   0.768  -3.961  -4.574
  143    H    PHE  19           H        PHE  19  -1.874  -2.531  -1.977
  144    HA   PHE  19           HA       PHE  19  -1.296  -5.098  -0.679
  145   1HB   PHE  19          1HB       PHE  19  -3.323  -4.718   0.781
  146   2HB   PHE  19          2HB       PHE  19  -1.928  -3.712   1.159
  147    HD1  PHE  19           1HD      PHE  19  -1.908  -1.328   0.440
  148    HD2  PHE  19           2HD      PHE  19  -5.379  -3.772   0.128
  149    HE1  PHE  19           1HE      PHE  19  -3.304   0.687   0.231
  150    HE2  PHE  19           2HE      PHE  19  -6.780  -1.761  -0.083
  151    HZ   PHE  19           HZ       PHE  19  -5.744   0.472  -0.033
  152    H    THR  20           H        THR  20  -2.695  -6.764  -1.179
  153    HA   THR  20           HA       THR  20  -5.025  -6.230  -2.837
  154    HB   THR  20           HB       THR  20  -4.364  -7.692  -4.644
  155    HG1  THR  20           1HG      THR  20  -2.808  -9.082  -4.335
  156   1HG2  THR  20          1HG2      THR  20  -2.098  -5.766  -4.131
  157   2HG2  THR  20          2HG2      THR  20  -3.691  -5.283  -4.715
  158   3HG2  THR  20          3HG2      THR  20  -2.677  -6.345  -5.692
  159    H    LEU  21           H        LEU  21  -6.630  -7.580  -2.336
  160    HA   LEU  21           HA       LEU  21  -6.005 -10.243  -1.294
  161   1HB   LEU  21          1HB       LEU  21  -6.302  -8.723   0.629
  162   2HB   LEU  21          2HB       LEU  21  -7.915  -8.329   0.039
  163    HG   LEU  21           HG       LEU  21  -7.941 -11.091   0.253
  164   1HD1  LEU  21          1HD1      LEU  21  -5.964 -11.299   1.490
  165   2HD1  LEU  21          2HD1      LEU  21  -7.251 -11.337   2.694
  166   3HD1  LEU  21          3HD1      LEU  21  -6.311  -9.864   2.454
  167   1HD2  LEU  21          1HD2      LEU  21  -9.543  -9.106   0.953
  168   2HD2  LEU  21          2HD2      LEU  21  -8.855  -9.433   2.543
  169   3HD2  LEU  21          3HD2      LEU  21  -9.692 -10.713   1.665
  170    H    ASN  22           H        ASN  22  -7.404 -11.805  -1.923
  171    HA   ASN  22           HA       ASN  22  -9.379 -11.091  -3.907
  172   1HB   ASN  22          1HB       ASN  22  -7.720 -13.205  -3.703
  173   2HB   ASN  22          2HB       ASN  22  -9.164 -13.898  -2.973
  174   1HD2  ASN  22          1HD2      ASN  22  -7.816 -14.517  -5.497
  175   2HD2  ASN  22          2HD2      ASN  22  -9.013 -14.326  -6.728
  176    H    ASN  23           H        ASN  23 -11.541 -11.079  -3.676
  177    HA   ASN  23           HA       ASN  23 -13.555 -10.944  -2.616
  178   1HB   ASN  23          1HB       ASN  23 -13.445 -13.365  -2.895
  179   2HB   ASN  23          2HB       ASN  23 -12.539 -13.519  -1.392
  180   1HD2  ASN  23          1HD2      ASN  23 -15.373 -11.554  -2.175
  181   2HD2  ASN  23          2HD2      ASN  23 -16.407 -12.257  -0.983
  182    HA   PRO  24           HA       PRO  24 -11.555  -9.230   1.249
  183   1HB   PRO  24          1HB       PRO  24 -12.238  -6.646   0.772
  184   2HB   PRO  24          2HB       PRO  24 -10.745  -7.373   0.165
  185   1HG   PRO  24          1HG       PRO  24 -13.340  -6.909  -1.254
  186   2HG   PRO  24          2HG       PRO  24 -11.685  -6.647  -1.834
  187   1HD   PRO  24          1HD       PRO  24 -13.136  -8.830  -2.511
  188   2HD   PRO  24          2HD       PRO  24 -11.371  -8.876  -2.330
  189    H    SER  25           H        SER  25 -12.661  -8.887   3.112
  190    HA   SER  25           HA       SER  25 -15.571  -8.976   2.959
  191   1HB   SER  25          1HB       SER  25 -13.665 -10.120   4.684
  192   2HB   SER  25          2HB       SER  25 -14.539  -8.936   5.656
  193    HG   SER  25           HG       SER  25 -15.492 -11.084   5.566
  194    H    GLU  26           H        GLU  26 -16.886  -7.590   4.321
  195    HA   GLU  26           HA       GLU  26 -16.358  -4.875   3.965
  196   1HB   GLU  26          1HB       GLU  26 -18.437  -6.487   5.146
  197   2HB   GLU  26          2HB       GLU  26 -18.127  -5.073   6.144
  198   1HG   GLU  26          1HG       GLU  26 -18.219  -3.870   3.778
  199   2HG   GLU  26          2HG       GLU  26 -19.234  -5.263   3.407
  200    H    ASP  27           H        ASP  27 -15.545  -7.029   6.579
  201    HA   ASP  27           HA       ASP  27 -14.920  -5.009   8.492
  202   1HB   ASP  27          1HB       ASP  27 -14.459  -7.954   8.273
  203   2HB   ASP  27          2HB       ASP  27 -13.532  -7.040   9.460
  204    H    GLU  28           H        GLU  28 -12.936  -7.027   6.336
  205    HA   GLU  28           HA       GLU  28 -10.453  -5.944   7.081
  206   1HB   GLU  28          1HB       GLU  28 -11.428  -7.827   5.176
  207   2HB   GLU  28          2HB       GLU  28 -10.366  -6.705   4.338
  208   1HG   GLU  28          1HG       GLU  28  -9.593  -8.133   6.866
  209   2HG   GLU  28          2HG       GLU  28  -9.270  -8.764   5.252
  210    H    ARG  29           H        ARG  29 -12.606  -5.146   4.365
  211    HA   ARG  29           HA       ARG  29 -11.011  -3.107   3.275
  212   1HB   ARG  29          1HB       ARG  29 -13.932  -3.775   3.109
  213   2HB   ARG  29          2HB       ARG  29 -13.316  -2.302   2.373
  214   1HG   ARG  29          1HG       ARG  29 -12.071  -3.449   0.800
  215   2HG   ARG  29          2HG       ARG  29 -12.033  -4.928   1.762
  216   1HD   ARG  29          1HD       ARG  29 -13.508  -5.122  -0.197
  217   2HD   ARG  29          2HD       ARG  29 -14.380  -5.315   1.322
  218    HE   ARG  29           HE       ARG  29 -14.532  -2.630   0.582
  219   1HH1  ARG  29          1HH1      ARG  29 -15.626  -5.736  -0.548
  220   2HH1  ARG  29          2HH1      ARG  29 -17.048  -5.104  -1.310
  221   1HH2  ARG  29          1HH2      ARG  29 -16.400  -1.786  -0.418
  222   2HH2  ARG  29          2HH2      ARG  29 -17.486  -2.857  -1.236
  223    H    LYS  30           H        LYS  30 -13.331  -3.124   5.890
  224    HA   LYS  30           HA       LYS  30 -13.626  -0.304   6.100
  225   1HB   LYS  30          1HB       LYS  30 -14.346  -2.668   7.747
  226   2HB   LYS  30          2HB       LYS  30 -14.240  -1.124   8.582
  227   1HG   LYS  30          1HG       LYS  30 -15.885  -0.164   7.098
  228   2HG   LYS  30          2HG       LYS  30 -15.937  -1.652   6.150
  229   1HD   LYS  30          1HD       LYS  30 -17.329  -2.642   7.596
  230   2HD   LYS  30          2HD       LYS  30 -16.400  -2.096   8.993
  231   1HE   LYS  30          1HE       LYS  30 -18.529  -1.094   9.193
  232   2HE   LYS  30          2HE       LYS  30 -17.445   0.178   8.634
  233   1HZ   LYS  30          1HZ       LYS  30 -18.243  -0.377   6.333
  234   2HZ   LYS  30          2HZ       LYS  30 -19.391   0.344   7.346
  235   3HZ   LYS  30          3HZ       LYS  30 -19.450  -1.321   7.051
  236    H    LYS  31           H        LYS  31 -11.482  -2.666   7.609
  237    HA   LYS  31           HA       LYS  31 -10.307  -0.961   9.508
  238   1HB   LYS  31          1HB       LYS  31  -9.980  -3.309   9.740
  239   2HB   LYS  31          2HB       LYS  31  -9.304  -3.444   8.121
  240   1HG   LYS  31          1HG       LYS  31  -7.338  -2.194   8.820
  241   2HG   LYS  31          2HG       LYS  31  -8.018  -2.013  10.439
  242   1HD   LYS  31          1HD       LYS  31  -6.888  -3.884  10.929
  243   2HD   LYS  31          2HD       LYS  31  -8.159  -4.722  10.036
  244   1HE   LYS  31          1HE       LYS  31  -5.505  -3.776   8.959
  245   2HE   LYS  31          2HE       LYS  31  -5.997  -5.445   9.240
  246   1HZ   LYS  31          1HZ       LYS  31  -7.282  -3.598   7.302
  247   2HZ   LYS  31          2HZ       LYS  31  -7.674  -5.225   7.541
  248   3HZ   LYS  31          3HZ       LYS  31  -6.166  -4.804   6.900
  249    H    ILE  32           H        ILE  32  -9.182  -1.886   6.256
  250    HA   ILE  32           HA       ILE  32  -6.928  -0.180   6.265
  251    HB   ILE  32           HB       ILE  32  -8.443  -1.581   4.087
  252   1HG1  ILE  32          1HG1      ILE  32  -5.573  -1.774   5.024
  253   2HG1  ILE  32          2HG1      ILE  32  -6.873  -2.835   5.555
  254   1HG2  ILE  32          1HG2      ILE  32  -7.823   0.410   2.983
  255   2HG2  ILE  32          2HG2      ILE  32  -6.243   0.441   3.764
  256   3HG2  ILE  32          3HG2      ILE  32  -6.600  -0.782   2.545
  257   1HD1  ILE  32          1HD1      ILE  32  -6.760  -2.766   2.692
  258   2HD1  ILE  32          2HD1      ILE  32  -5.182  -3.175   3.366
  259   3HD1  ILE  32          3HD1      ILE  32  -6.599  -4.135   3.792
  260    H    ARG  33           H        ARG  33 -10.244   0.227   5.116
  261    HA   ARG  33           HA       ARG  33  -9.800   2.769   3.910
  262   1HB   ARG  33          1HB       ARG  33 -11.670   1.431   3.190
  263   2HB   ARG  33          2HB       ARG  33 -12.326   1.386   4.821
  264   1HG   ARG  33          1HG       ARG  33 -13.173   3.495   4.691
  265   2HG   ARG  33          2HG       ARG  33 -11.937   4.041   3.556
  266   1HD   ARG  33          1HD       ARG  33 -13.628   3.906   2.070
  267   2HD   ARG  33          2HD       ARG  33 -13.184   2.200   2.041
  268    HE   ARG  33           HE       ARG  33 -15.192   1.715   3.010
  269   1HH1  ARG  33          1HH1      ARG  33 -14.478   5.081   3.544
  270   2HH1  ARG  33          2HH1      ARG  33 -16.016   5.427   4.263
  271   1HH2  ARG  33          1HH2      ARG  33 -17.219   2.159   3.956
  272   2HH2  ARG  33          2HH2      ARG  33 -17.574   3.764   4.498
  273    H    ASP  34           H        ASP  34 -10.288   1.712   7.137
  274    HA   ASP  34           HA       ASP  34 -11.008   4.405   8.039
  275   1HB   ASP  34          1HB       ASP  34 -12.278   2.389   8.869
  276   2HB   ASP  34          2HB       ASP  34 -10.808   1.893   9.705
  277    H    LEU  35           H        LEU  35  -8.274   3.032   7.212
  278    HA   LEU  35           HA       LEU  35  -6.603   3.224   9.481
  279   1HB   LEU  35          1HB       LEU  35  -6.163   3.150   6.532
  280   2HB   LEU  35          2HB       LEU  35  -4.818   3.565   7.592
  281    HG   LEU  35           HG       LEU  35  -6.405   1.006   7.769
  282   1HD1  LEU  35          1HD1      LEU  35  -5.211   1.052   5.676
  283   2HD1  LEU  35          2HD1      LEU  35  -4.394  -0.042   6.793
  284   3HD1  LEU  35          3HD1      LEU  35  -3.733   1.565   6.491
  285   1HD2  LEU  35          1HD2      LEU  35  -3.815   1.859   9.061
  286   2HD2  LEU  35          2HD2      LEU  35  -4.573   0.273   9.208
  287   3HD2  LEU  35          3HD2      LEU  35  -5.373   1.698   9.872
  288    HA   PRO  36           HA       PRO  36  -5.801   7.513   9.940
  289   1HB   PRO  36          1HB       PRO  36  -3.141   7.556  10.484
  290   2HB   PRO  36          2HB       PRO  36  -4.347   6.964  11.633
  291   1HG   PRO  36          1HG       PRO  36  -2.572   5.416   9.785
  292   2HG   PRO  36          2HG       PRO  36  -2.980   5.089  11.479
  293   1HD   PRO  36          1HD       PRO  36  -4.164   3.791   9.419
  294   2HD   PRO  36          2HD       PRO  36  -5.011   4.144  10.939
  295    H    ILE  37           H        ILE  37  -5.870   8.900   8.291
  296    HA   ILE  37           HA       ILE  37  -4.457   8.533   5.856
  297    HB   ILE  37           HB       ILE  37  -5.243  10.864   5.335
  298   1HG1  ILE  37          1HG1      ILE  37  -6.634  10.604   8.009
  299   2HG1  ILE  37          2HG1      ILE  37  -5.263  11.661   7.691
  300   1HG2  ILE  37          1HG2      ILE  37  -6.700   8.457   5.609
  301   2HG2  ILE  37          2HG2      ILE  37  -7.765   9.778   6.087
  302   3HG2  ILE  37          3HG2      ILE  37  -6.998   9.795   4.499
  303   1HD1  ILE  37          1HD1      ILE  37  -6.946  12.465   5.753
  304   2HD1  ILE  37          2HD1      ILE  37  -8.097  11.976   6.998
  305   3HD1  ILE  37          3HD1      ILE  37  -6.868  13.188   7.360
  306    H    SER  38           H        SER  38  -3.860  10.406   8.758
  307    HA   SER  38           HA       SER  38  -1.797  12.040   7.712
  308   1HB   SER  38          1HB       SER  38  -1.414  12.733   9.931
  309   2HB   SER  38          2HB       SER  38  -3.131  12.334   9.899
  310    HG   SER  38           HG       SER  38  -1.227  11.306  11.444
  311    H    LEU  39           H        LEU  39  -1.908   8.751   8.679
  312    HA   LEU  39           HA       LEU  39   0.863   8.443   9.301
  313   1HB   LEU  39          1HB       LEU  39  -1.327   6.934   9.732
  314   2HB   LEU  39          2HB       LEU  39  -0.655   6.108   8.328
  315    HG   LEU  39           HG       LEU  39   1.228   6.656  10.537
  316   1HD1  LEU  39          1HD1      LEU  39  -0.797   6.020  11.763
  317   2HD1  LEU  39          2HD1      LEU  39   0.453   4.781  11.867
  318   3HD1  LEU  39          3HD1      LEU  39  -0.921   4.557  10.786
  319   1HD2  LEU  39          1HD2      LEU  39   2.013   4.430   9.940
  320   2HD2  LEU  39          2HD2      LEU  39   1.878   5.451   8.508
  321   3HD2  LEU  39          3HD2      LEU  39   0.649   4.230   8.841
  322    H    PHE  40           H        PHE  40  -1.049   8.341   6.395
  323    HA   PHE  40           HA       PHE  40   1.391   7.718   4.865
  324   1HB   PHE  40          1HB       PHE  40  -1.371   7.085   3.856
  325   2HB   PHE  40          2HB       PHE  40   0.174   6.438   3.314
  326    HD1  PHE  40           2HD      PHE  40  -2.415   6.269   5.902
  327    HD2  PHE  40           1HD      PHE  40   1.224   4.608   4.449
  328    HE1  PHE  40           2HE      PHE  40  -2.716   4.326   7.380
  329    HE2  PHE  40           1HE      PHE  40   0.928   2.661   5.924
  330    HZ   PHE  40           HZ       PHE  40  -1.043   2.519   7.393
  331    H    ASP  41           H        ASP  41   2.063   9.410   3.742
  332    HA   ASP  41           HA       ASP  41   0.700  11.808   3.436
  333   1HB   ASP  41          1HB       ASP  41   3.056  10.575   2.061
  334   2HB   ASP  41          2HB       ASP  41   2.381  12.074   1.428
  335    H    TYR  42           H        TYR  42   0.458   8.886   1.618
  336    HA   TYR  42           HA       TYR  42  -1.620  10.098  -0.033
  337   1HB   TYR  42          1HB       TYR  42   0.379  10.264  -1.420
  338   2HB   TYR  42          2HB       TYR  42   0.718   8.555  -1.176
  339    HD1  TYR  42           1HD      TYR  42  -2.597  10.071  -1.858
  340    HD2  TYR  42           2HD      TYR  42   0.631   7.764  -3.395
  341    HE1  TYR  42           1HE      TYR  42  -3.940   9.527  -3.846
  342    HE2  TYR  42           2HE      TYR  42  -0.703   7.214  -5.387
  343    HH   TYR  42           HH       TYR  42  -4.055   8.326  -5.718
  344    H    PHE  43           H        PHE  43  -3.365   8.856  -0.008
  345    HA   PHE  43           HA       PHE  43  -3.043   5.947   0.246
  346   1HB   PHE  43          1HB       PHE  43  -3.796   7.410   2.378
  347   2HB   PHE  43          2HB       PHE  43  -5.369   7.164   1.627
  348    HD1  PHE  43           1HD      PHE  43  -4.380   4.387   0.451
  349    HD2  PHE  43           2HD      PHE  43  -4.518   6.131   4.331
  350    HE1  PHE  43           1HE      PHE  43  -4.506   2.143   1.452
  351    HE2  PHE  43           2HE      PHE  43  -4.643   3.890   5.338
  352    HZ   PHE  43           HZ       PHE  43  -4.636   1.892   3.898
  353    H    ILE  44           H        ILE  44  -3.918   5.036  -1.481
  354    HA   ILE  44           HA       ILE  44  -6.503   6.028  -2.452
  355    HB   ILE  44           HB       ILE  44  -5.060   7.005  -4.034
  356   1HG1  ILE  44          1HG1      ILE  44  -5.471   4.525  -5.591
  357   2HG1  ILE  44          2HG1      ILE  44  -6.903   5.163  -4.790
  358   1HG2  ILE  44          1HG2      ILE  44  -3.331   5.536  -5.232
  359   2HG2  ILE  44          2HG2      ILE  44  -2.964   6.080  -3.595
  360   3HG2  ILE  44          3HG2      ILE  44  -3.529   4.432  -3.870
  361   1HD1  ILE  44          1HD1      ILE  44  -5.469   6.139  -7.125
  362   2HD1  ILE  44          2HD1      ILE  44  -7.133   6.419  -6.610
  363   3HD1  ILE  44          3HD1      ILE  44  -5.826   7.397  -5.942
  364    H    VAL  45           H        VAL  45  -7.907   4.416  -2.361
  365    HA   VAL  45           HA       VAL  45  -6.955   1.681  -2.921
  366    HB   VAL  45           HB       VAL  45  -9.342   2.240  -1.188
  367   1HG1  VAL  45          1HG1      VAL  45  -9.405   0.028  -0.952
  368   2HG1  VAL  45          2HG1      VAL  45  -8.190  -0.070  -2.227
  369   3HG1  VAL  45          3HG1      VAL  45  -7.693  -0.041  -0.535
  370   1HG2  VAL  45          1HG2      VAL  45  -7.689   1.816   0.740
  371   2HG2  VAL  45          2HG2      VAL  45  -6.445   2.303  -0.412
  372   3HG2  VAL  45          3HG2      VAL  45  -7.736   3.425   0.019
  373    H    GLY  46           H        GLY  46  -8.097   0.461  -4.344
  374   1HA   GLY  46          1HA       GLY  46 -10.600   1.610  -5.405
  375   2HA   GLY  46          2HA       GLY  46  -9.336   1.042  -6.484
  376    H    GLU  47           H        GLU  47 -12.215   0.209  -5.873
  377    HA   GLU  47           HA       GLU  47 -11.789  -2.571  -5.078
  378   1HB   GLU  47          1HB       GLU  47 -13.786  -0.850  -4.447
  379   2HB   GLU  47          2HB       GLU  47 -14.500  -1.668  -5.830
  380   1HG   GLU  47          1HG       GLU  47 -13.349  -3.102  -3.452
  381   2HG   GLU  47          2HG       GLU  47 -15.049  -2.665  -3.612
  382    H    GLU  48           H        GLU  48 -11.894  -4.255  -6.448
  383    HA   GLU  48           HA       GLU  48 -12.579  -3.676  -9.255
  384   1HB   GLU  48          1HB       GLU  48 -10.235  -4.125  -9.130
  385   2HB   GLU  48          2HB       GLU  48 -10.495  -5.528  -8.104
  386   1HG   GLU  48          1HG       GLU  48 -11.172  -6.854  -9.847
  387   2HG   GLU  48          2HG       GLU  48 -11.698  -5.486 -10.826
  388    H    GLY  49           H        GLY  49 -14.560  -4.464  -9.608
  389   1HA   GLY  49          1HA       GLY  49 -15.037  -7.286  -8.935
  390   2HA   GLY  49          2HA       GLY  49 -16.219  -6.082  -8.446
  391    H    ASN  50           H        ASN  50 -14.536  -5.611 -11.424
  392    HA   ASN  50           HA       ASN  50 -17.000  -5.721 -12.894
  393   1HB   ASN  50          1HB       ASN  50 -14.905  -4.179 -13.243
  394   2HB   ASN  50          2HB       ASN  50 -14.320  -5.523 -14.219
  395   1HD2  ASN  50          1HD2      ASN  50 -17.500  -4.018 -13.760
  396   2HD2  ASN  50          2HD2      ASN  50 -17.792  -3.726 -15.438
  397    H    GLU  51           H        GLU  51 -17.432  -8.011 -12.407
  398    HA   GLU  51           HA       GLU  51 -16.952  -9.659 -14.611
  399   1HB   GLU  51          1HB       GLU  51 -14.843  -9.695 -12.665
  400   2HB   GLU  51          2HB       GLU  51 -15.642 -11.261 -12.683
  401   1HG   GLU  51          1HG       GLU  51 -15.209 -11.539 -15.010
  402   2HG   GLU  51          2HG       GLU  51 -14.625  -9.882 -15.153
  403    H    GLU  52           H        GLU  52 -19.118 -10.096 -14.458
  404    HA   GLU  52           HA       GLU  52 -20.497 -10.806 -12.124
  405   1HB   GLU  52          1HB       GLU  52 -22.229 -11.700 -13.661
  406   2HB   GLU  52          2HB       GLU  52 -21.695 -10.081 -14.090
  407   1HG   GLU  52          1HG       GLU  52 -20.148 -11.161 -15.759
  408   2HG   GLU  52          2HG       GLU  52 -20.997 -12.672 -15.437
  409    H    GLY  53           H        GLY  53 -20.992 -12.741 -11.167
  410   1HA   GLY  53          1HA       GLY  53 -21.047 -15.079 -10.940
  411   2HA   GLY  53          2HA       GLY  53 -20.038 -15.220 -12.371
  412    H    ARG  54           H        ARG  54 -18.325 -13.023 -10.991
  413    HA   ARG  54           HA       ARG  54 -16.803 -14.918  -9.328
  414   1HB   ARG  54          1HB       ARG  54 -15.756 -14.052 -11.476
  415   2HB   ARG  54          2HB       ARG  54 -15.696 -12.473 -10.703
  416   1HG   ARG  54          1HG       ARG  54 -14.216 -13.280  -9.011
  417   2HG   ARG  54          2HG       ARG  54 -14.405 -14.943  -9.572
  418   1HD   ARG  54          1HD       ARG  54 -12.834 -14.685 -11.131
  419   2HD   ARG  54          2HD       ARG  54 -13.555 -13.182 -11.705
  420    HE   ARG  54           HE       ARG  54 -12.015 -12.018 -10.478
  421   1HH1  ARG  54          1HH1      ARG  54 -12.090 -15.319  -9.375
  422   2HH1  ARG  54          2HH1      ARG  54 -10.717 -15.139  -8.334
  423   1HH2  ARG  54          1HH2      ARG  54 -10.206 -11.769  -9.111
  424   2HH2  ARG  54          2HH2      ARG  54  -9.646 -13.119  -8.184
  425    H    THR  55           H        THR  55 -15.493 -13.909  -7.587
  426    HA   THR  55           HA       THR  55 -17.152 -12.056  -6.092
  427    HB   THR  55           HB       THR  55 -14.932 -12.517  -4.526
  428    HG1  THR  55           1HG      THR  55 -13.986 -14.106  -5.651
  429   1HG2  THR  55          1HG2      THR  55 -16.373 -13.758  -3.176
  430   2HG2  THR  55          2HG2      THR  55 -17.239 -14.434  -4.555
  431   3HG2  THR  55          3HG2      THR  55 -17.474 -12.744  -4.108
  432    HA   PRO  56           HA       PRO  56 -14.795  -8.403  -6.696
  433   1HB   PRO  56          1HB       PRO  56 -14.847  -7.271  -4.230
  434   2HB   PRO  56          2HB       PRO  56 -16.263  -7.340  -5.284
  435   1HG   PRO  56          1HG       PRO  56 -15.528  -9.105  -2.980
  436   2HG   PRO  56          2HG       PRO  56 -17.106  -8.414  -3.402
  437   1HD   PRO  56          1HD       PRO  56 -16.441 -10.977  -3.965
  438   2HD   PRO  56          2HD       PRO  56 -17.526 -10.023  -4.997
  439    H    HIS  57           H        HIS  57 -12.838  -7.247  -6.100
  440    HA   HIS  57           HA       HIS  57 -10.978  -8.713  -4.380
  441   1HB   HIS  57          1HB       HIS  57 -10.411  -9.615  -6.501
  442   2HB   HIS  57          2HB       HIS  57 -10.533  -8.044  -7.286
  443    HD1  HIS  57           1HD      HIS  57  -8.413  -6.759  -7.529
  444    HD2  HIS  57           2HD      HIS  57  -8.095  -9.798  -4.714
  445    HE1  HIS  57           1HE      HIS  57  -5.989  -6.808  -6.863
  446    H    LEU  58           H        LEU  58  -9.553  -7.441  -3.290
  447    HA   LEU  58           HA       LEU  58  -9.949  -4.559  -3.535
  448   1HB   LEU  58          1HB       LEU  58  -9.726  -6.241  -1.369
  449   2HB   LEU  58          2HB       LEU  58  -8.136  -5.486  -1.447
  450    HG   LEU  58           HG       LEU  58 -10.798  -4.111  -1.114
  451   1HD1  LEU  58          1HD1      LEU  58  -8.397  -4.470   0.664
  452   2HD1  LEU  58          2HD1      LEU  58 -10.042  -5.040   0.939
  453   3HD1  LEU  58          3HD1      LEU  58  -9.688  -3.313   0.986
  454   1HD2  LEU  58          1HD2      LEU  58  -8.051  -2.934  -1.517
  455   2HD2  LEU  58          2HD2      LEU  58  -9.465  -2.029  -0.976
  456   3HD2  LEU  58          3HD2      LEU  58  -9.447  -2.761  -2.581
  457    H    GLN  59           H        GLN  59  -8.426  -3.164  -4.216
  458    HA   GLN  59           HA       GLN  59  -5.641  -3.935  -4.356
  459   1HB   GLN  59          1HB       GLN  59  -6.313  -4.865  -6.438
  460   2HB   GLN  59          2HB       GLN  59  -7.305  -3.466  -6.825
  461   1HG   GLN  59          1HG       GLN  59  -5.318  -3.416  -8.158
  462   2HG   GLN  59          2HG       GLN  59  -5.259  -2.100  -6.986
  463   1HE2  GLN  59          1HE2      GLN  59  -3.842  -2.267  -5.212
  464   2HE2  GLN  59          2HE2      GLN  59  -2.477  -3.324  -5.253
  465    H    GLY  60           H        GLY  60  -4.698  -2.233  -3.444
  466   1HA   GLY  60          1HA       GLY  60  -5.186   0.415  -4.565
  467   2HA   GLY  60          2HA       GLY  60  -5.540   0.215  -2.855
  468    H    PHE  61           H        PHE  61  -3.745   2.079  -3.423
  469    HA   PHE  61           HA       PHE  61  -1.201   0.841  -2.620
  470   1HB   PHE  61          1HB       PHE  61  -0.794   1.434  -4.872
  471   2HB   PHE  61          2HB       PHE  61  -1.658   2.959  -4.713
  472    HD1  PHE  61           2HD      PHE  61   1.145   1.306  -2.880
  473    HD2  PHE  61           1HD      PHE  61  -0.281   4.773  -4.895
  474    HE1  PHE  61           2HE      PHE  61   3.268   2.454  -2.401
  475    HE2  PHE  61           1HE      PHE  61   1.840   5.926  -4.420
  476    HZ   PHE  61           HZ       PHE  61   3.618   4.767  -3.170
  477    H    ALA  62           H        ALA  62  -0.071   1.878  -1.034
  478    HA   ALA  62           HA       ALA  62  -1.100   4.455  -0.071
  479   1HB   ALA  62          1HB       ALA  62  -1.318   1.921   1.276
  480   2HB   ALA  62          2HB       ALA  62  -0.357   3.054   2.227
  481   3HB   ALA  62          3HB       ALA  62  -1.989   3.491   1.721
  482    H    ASN  63           H        ASN  63   0.472   5.891   0.223
  483    HA   ASN  63           HA       ASN  63   3.242   4.985   0.159
  484   1HB   ASN  63          1HB       ASN  63   2.461   6.829  -1.337
  485   2HB   ASN  63          2HB       ASN  63   2.170   7.813   0.095
  486   1HD2  ASN  63          1HD2      ASN  63   4.245   7.395  -2.323
  487   2HD2  ASN  63          2HD2      ASN  63   5.721   7.884  -1.570
  488    H    PHE  64           H        PHE  64   4.210   4.558   2.022
  489    HA   PHE  64           HA       PHE  64   3.246   5.477   4.534
  490   1HB   PHE  64          1HB       PHE  64   5.246   3.626   3.573
  491   2HB   PHE  64          2HB       PHE  64   5.887   4.598   4.894
  492    HD1  PHE  64           2HD      PHE  64   4.427   4.758   7.019
  493    HD2  PHE  64           1HD      PHE  64   3.951   1.768   4.028
  494    HE1  PHE  64           2HE      PHE  64   3.255   3.327   8.641
  495    HE2  PHE  64           1HE      PHE  64   2.778   0.332   5.645
  496    HZ   PHE  64           HZ       PHE  64   2.429   1.111   7.955
  497    H    VAL  65           H        VAL  65   3.731   7.254   5.655
  498    HA   VAL  65           HA       VAL  65   5.146   9.393   4.525
  499    HB   VAL  65           HB       VAL  65   4.346   8.892   7.392
  500   1HG1  VAL  65          1HG1      VAL  65   4.587  11.537   7.323
  501   2HG1  VAL  65          2HG1      VAL  65   5.931  10.483   7.767
  502   3HG1  VAL  65          3HG1      VAL  65   5.823  11.134   6.132
  503   1HG2  VAL  65          1HG2      VAL  65   2.471  10.261   6.952
  504   2HG2  VAL  65          2HG2      VAL  65   3.126  10.790   5.402
  505   3HG2  VAL  65          3HG2      VAL  65   2.570   9.129   5.603
  506    H    LYS  66           H        LYS  66   6.201   6.707   6.429
  507    HA   LYS  66           HA       LYS  66   8.922   7.835   6.462
  508   1HB   LYS  66          1HB       LYS  66   9.262   6.438   8.561
  509   2HB   LYS  66          2HB       LYS  66   8.263   7.875   8.730
  510   1HG   LYS  66          1HG       LYS  66   6.855   5.357   8.102
  511   2HG   LYS  66          2HG       LYS  66   7.575   5.489   9.708
  512   1HD   LYS  66          1HD       LYS  66   5.999   7.800   8.716
  513   2HD   LYS  66          2HD       LYS  66   5.111   6.345   9.175
  514   1HE   LYS  66          1HE       LYS  66   7.137   7.008  11.128
  515   2HE   LYS  66          2HE       LYS  66   6.035   8.358  10.866
  516   1HZ   LYS  66          1HZ       LYS  66   5.327   5.595  11.677
  517   2HZ   LYS  66          2HZ       LYS  66   4.184   6.750  11.211
  518   3HZ   LYS  66          3HZ       LYS  66   5.139   7.011  12.583
  519    H    LYS  67           H        LYS  67  10.408   5.754   7.199
  520    HA   LYS  67           HA       LYS  67  10.132   3.945   4.942
  521   1HB   LYS  67          1HB       LYS  67  12.329   4.142   7.010
  522   2HB   LYS  67          2HB       LYS  67  12.385   3.194   5.530
  523   1HG   LYS  67          1HG       LYS  67  11.756   5.895   4.870
  524   2HG   LYS  67          2HG       LYS  67  13.173   5.869   5.922
  525   1HD   LYS  67          1HD       LYS  67  14.196   4.180   4.422
  526   2HD   LYS  67          2HD       LYS  67  12.808   4.343   3.344
  527   1HE   LYS  67          1HE       LYS  67  13.390   6.499   2.716
  528   2HE   LYS  67          2HE       LYS  67  14.381   6.756   4.151
  529   1HZ   LYS  67          1HZ       LYS  67  15.166   4.701   2.201
  530   2HZ   LYS  67          2HZ       LYS  67  16.133   5.599   3.259
  531   3HZ   LYS  67          3HZ       LYS  67  15.498   6.327   1.870
  532    H    GLN  68           H        GLN  68   9.258   1.992   5.081
  533    HA   GLN  68           HA       GLN  68   9.323   0.579   7.653
  534   1HB   GLN  68          1HB       GLN  68   6.891   0.842   5.876
  535   2HB   GLN  68          2HB       GLN  68   6.996  -0.162   7.316
  536   1HG   GLN  68          1HG       GLN  68   7.368   2.821   7.335
  537   2HG   GLN  68          2HG       GLN  68   5.824   2.020   7.621
  538   1HE2  GLN  68          1HE2      GLN  68   5.344   1.922   9.683
  539   2HE2  GLN  68          2HE2      GLN  68   6.454   1.683  10.984
  540    H    THR  69           H        THR  69   9.180  -1.713   7.502
  541    HA   THR  69           HA       THR  69  10.204  -2.725   4.958
  542    HB   THR  69           HB       THR  69  11.075  -4.572   6.119
  543    HG1  THR  69           1HG      THR  69  10.391  -5.112   8.235
  544   1HG2  THR  69          1HG2      THR  69  12.285  -3.610   8.042
  545   2HG2  THR  69          2HG2      THR  69  11.209  -2.213   8.001
  546   3HG2  THR  69          3HG2      THR  69  12.291  -2.533   6.646
  547    H    PHE  70           H        PHE  70   9.513  -5.066   4.464
  548    HA   PHE  70           HA       PHE  70   6.778  -5.066   3.834
  549   1HB   PHE  70          1HB       PHE  70   8.066  -6.387   2.416
  550   2HB   PHE  70          2HB       PHE  70   8.944  -7.135   3.746
  551    HD1  PHE  70           1HD      PHE  70   5.671  -7.039   2.025
  552    HD2  PHE  70           2HD      PHE  70   8.237  -9.170   4.669
  553    HE1  PHE  70           1HE      PHE  70   4.160  -8.978   1.924
  554    HE2  PHE  70           2HE      PHE  70   6.731 -11.112   4.571
  555    HZ   PHE  70           HZ       PHE  70   4.689 -11.019   3.197
  556    H    ASN  71           H        ASN  71   8.554  -7.040   6.214
  557    HA   ASN  71           HA       ASN  71   6.304  -8.312   7.303
  558   1HB   ASN  71          1HB       ASN  71   9.099  -8.273   7.780
  559   2HB   ASN  71          2HB       ASN  71   8.308  -7.958   9.321
  560   1HD2  ASN  71          1HD2      ASN  71   9.447 -10.317   7.360
  561   2HD2  ASN  71          2HD2      ASN  71   8.515 -11.654   7.937
  562    H    LYS  72           H        LYS  72   7.948  -5.311   8.190
  563    HA   LYS  72           HA       LYS  72   6.463  -4.786  10.530
  564   1HB   LYS  72          1HB       LYS  72   8.646  -3.676   9.498
  565   2HB   LYS  72          2HB       LYS  72   7.473  -2.531   8.862
  566   1HG   LYS  72          1HG       LYS  72   7.918  -3.219  11.759
  567   2HG   LYS  72          2HG       LYS  72   8.375  -1.721  10.944
  568   1HD   LYS  72          1HD       LYS  72   5.948  -1.364  10.433
  569   2HD   LYS  72          2HD       LYS  72   5.589  -2.751  11.463
  570   1HE   LYS  72          1HE       LYS  72   6.877  -0.148  12.263
  571   2HE   LYS  72          2HE       LYS  72   5.307  -0.770  12.769
  572   1HZ   LYS  72          1HZ       LYS  72   7.986  -1.797  13.511
  573   2HZ   LYS  72          2HZ       LYS  72   6.561  -2.661  13.800
  574   3HZ   LYS  72          3HZ       LYS  72   6.801  -1.156  14.535
  575    H    VAL  73           H        VAL  73   6.077  -3.605   7.195
  576    HA   VAL  73           HA       VAL  73   3.873  -1.970   7.566
  577    HB   VAL  73           HB       VAL  73   4.679  -3.642   5.194
  578   1HG1  VAL  73          1HG1      VAL  73   2.323  -3.373   4.966
  579   2HG1  VAL  73          2HG1      VAL  73   2.411  -1.675   5.438
  580   3HG1  VAL  73          3HG1      VAL  73   3.091  -2.199   3.897
  581   1HG2  VAL  73          1HG2      VAL  73   4.694  -0.663   5.305
  582   2HG2  VAL  73          2HG2      VAL  73   5.973  -1.560   6.123
  583   3HG2  VAL  73          3HG2      VAL  73   5.726  -1.760   4.388
  584    H    LYS  74           H        LYS  74   4.074  -5.427   7.559
  585    HA   LYS  74           HA       LYS  74   1.377  -6.033   6.991
  586   1HB   LYS  74          1HB       LYS  74   3.350  -7.591   8.672
  587   2HB   LYS  74          2HB       LYS  74   1.858  -8.222   7.986
  588   1HG   LYS  74          1HG       LYS  74   3.163  -7.196   5.794
  589   2HG   LYS  74          2HG       LYS  74   4.472  -7.869   6.768
  590   1HD   LYS  74          1HD       LYS  74   3.938  -9.853   5.898
  591   2HD   LYS  74          2HD       LYS  74   2.480  -9.793   6.892
  592   1HE   LYS  74          1HE       LYS  74   1.191  -8.918   5.113
  593   2HE   LYS  74          2HE       LYS  74   2.626  -8.561   4.152
  594   1HZ   LYS  74          1HZ       LYS  74   1.130 -10.726   3.802
  595   2HZ   LYS  74          2HZ       LYS  74   2.256 -11.343   4.902
  596   3HZ   LYS  74          3HZ       LYS  74   2.782 -10.676   3.440
  597    H    TRP  75           H        TRP  75   2.768  -4.491   9.635
  598    HA   TRP  75           HA       TRP  75   1.074  -5.450  11.712
  599   1HB   TRP  75          1HB       TRP  75   2.035  -3.791  13.070
  600   2HB   TRP  75          2HB       TRP  75   3.313  -4.200  11.928
  601    HD1  TRP  75           HD       TRP  75   2.382  -2.412   9.474
  602    HE1  TRP  75           1HE      TRP  75   2.592   0.149   9.619
  603    HE3  TRP  75           3HE      TRP  75   2.546  -1.898  14.557
  604    HZ2  TRP  75           2HZ      TRP  75   2.801   2.126  11.623
  605    HZ3  TRP  75           3HZ      TRP  75   2.752   0.362  15.508
  606    HH2  TRP  75           HH       TRP  75   2.877   2.331  14.070
  607    H    TYR  76           H        TYR  76   0.636  -3.250   9.125
  608    HA   TYR  76           HA       TYR  76  -1.830  -2.223  10.367
  609   1HB   TYR  76          1HB       TYR  76   0.254  -0.946   8.760
  610   2HB   TYR  76          2HB       TYR  76  -1.370  -0.627   8.163
  611    HD1  TYR  76           2HD      TYR  76  -2.870  -0.585  10.740
  612    HD2  TYR  76           1HD      TYR  76   0.886   1.112   9.682
  613    HE1  TYR  76           2HE      TYR  76  -3.169   1.139  12.468
  614    HE2  TYR  76           1HE      TYR  76   0.598   2.840  11.409
  615    HH   TYR  76           HH       TYR  76  -1.061   2.764  13.828
  616    H    LEU  77           H        LEU  77  -0.447  -3.203   7.236
  617    HA   LEU  77           HA       LEU  77  -2.968  -3.402   5.934
  618   1HB   LEU  77          1HB       LEU  77  -0.230  -4.452   5.268
  619   2HB   LEU  77          2HB       LEU  77  -1.630  -4.714   4.229
  620    HG   LEU  77           HG       LEU  77  -0.516  -2.011   4.977
  621   1HD1  LEU  77          1HD1      LEU  77   0.481  -1.914   2.841
  622   2HD1  LEU  77          2HD1      LEU  77  -0.327  -3.389   2.312
  623   3HD1  LEU  77          3HD1      LEU  77   0.951  -3.471   3.524
  624   1HD2  LEU  77          1HD2      LEU  77  -2.599  -2.805   2.944
  625   2HD2  LEU  77          2HD2      LEU  77  -2.000  -1.173   3.244
  626   3HD2  LEU  77          3HD2      LEU  77  -2.921  -2.018   4.489
  627    H    GLY  78           H        GLY  78  -0.887  -5.685   7.627
  628   1HA   GLY  78          1HA       GLY  78  -1.666  -7.611   8.738
  629   2HA   GLY  78          2HA       GLY  78  -3.135  -7.545   7.775
  630    H    ALA  79           H        ALA  79  -1.406  -9.825   8.302
  631    HA   ALA  79           HA       ALA  79   0.095 -10.374   5.923
  632   1HB   ALA  79          1HB       ALA  79  -0.400 -11.672   8.475
  633   2HB   ALA  79          2HB       ALA  79  -0.365 -12.811   7.129
  634   3HB   ALA  79          3HB       ALA  79   1.012 -11.748   7.421
  635    H    ARG  80           H        ARG  80  -3.186 -10.833   6.952
  636    HA   ARG  80           HA       ARG  80  -4.036 -12.930   5.371
  637   1HB   ARG  80          1HB       ARG  80  -5.599 -10.398   5.900
  638   2HB   ARG  80          2HB       ARG  80  -6.259 -11.981   5.508
  639   1HG   ARG  80          1HG       ARG  80  -4.619 -12.308   7.780
  640   2HG   ARG  80          2HG       ARG  80  -5.625 -10.884   8.056
  641   1HD   ARG  80          1HD       ARG  80  -6.708 -12.930   8.857
  642   2HD   ARG  80          2HD       ARG  80  -7.622 -12.176   7.552
  643    HE   ARG  80           HE       ARG  80  -5.829 -14.165   6.580
  644   1HH1  ARG  80          1HH1      ARG  80  -8.917 -13.694   8.117
  645   2HH1  ARG  80          2HH1      ARG  80  -9.587 -15.176   7.519
  646   1HH2  ARG  80          1HH2      ARG  80  -6.701 -16.118   5.786
  647   2HH2  ARG  80          2HH2      ARG  80  -8.325 -16.554   6.194
  648    H    CYS  81           H        CYS  81  -3.466  -9.572   4.482
  649    HA   CYS  81           HA       CYS  81  -4.227 -10.173   1.712
  650   1HB   CYS  81          1HB       CYS  81  -4.355  -7.799   1.353
  651   2HB   CYS  81          2HB       CYS  81  -5.223  -8.170   2.838
  652    HG   CYS  81           HG       CYS  81  -1.987  -7.288   3.189
  653    H    HIS  82           H        HIS  82  -2.797 -10.042   0.040
  654    HA   HIS  82           HA       HIS  82  -0.010 -10.250   0.692
  655   1HB   HIS  82          1HB       HIS  82  -1.299 -11.500  -1.162
  656   2HB   HIS  82          2HB       HIS  82  -1.115 -10.020  -2.099
  657    HD1  HIS  82           1HD      HIS  82   1.148 -12.422  -0.196
  658    HD2  HIS  82           2HD      HIS  82   1.148  -9.998  -3.571
  659    HE1  HIS  82           1HE      HIS  82   3.361 -12.832  -1.318
  660    H    ILE  83           H        ILE  83   1.461  -8.683   0.714
  661    HA   ILE  83           HA       ILE  83   0.769  -6.108  -0.544
  662    HB   ILE  83           HB       ILE  83   2.144  -4.995   1.128
  663   1HG1  ILE  83          1HG1      ILE  83   2.503  -7.751   2.326
  664   2HG1  ILE  83          2HG1      ILE  83   3.755  -6.814   1.518
  665   1HG2  ILE  83          1HG2      ILE  83  -0.208  -5.272   1.620
  666   2HG2  ILE  83          2HG2      ILE  83   0.099  -6.858   2.326
  667   3HG2  ILE  83          3HG2      ILE  83   0.732  -5.409   3.106
  668   1HD1  ILE  83          1HD1      ILE  83   3.584  -5.104   3.258
  669   2HD1  ILE  83          2HD1      ILE  83   2.351  -6.069   4.072
  670   3HD1  ILE  83          3HD1      ILE  83   3.996  -6.686   3.920
  671    H    GLU  84           H        GLU  84   2.349  -5.001  -1.687
  672    HA   GLU  84           HA       GLU  84   4.996  -6.172  -1.956
  673   1HB   GLU  84          1HB       GLU  84   3.082  -6.990  -3.723
  674   2HB   GLU  84          2HB       GLU  84   3.762  -5.607  -4.567
  675   1HG   GLU  84          1HG       GLU  84   5.803  -7.347  -3.456
  676   2HG   GLU  84          2HG       GLU  84   4.740  -8.177  -4.591
  677    H    LYS  85           H        LYS  85   6.422  -4.807  -3.337
  678    HA   LYS  85           HA       LYS  85   6.077  -2.049  -2.630
  679   1HB   LYS  85          1HB       LYS  85   8.264  -1.731  -3.719
  680   2HB   LYS  85          2HB       LYS  85   8.290  -3.058  -2.565
  681   1HG   LYS  85          1HG       LYS  85   8.013  -4.638  -4.456
  682   2HG   LYS  85          2HG       LYS  85   8.149  -3.271  -5.564
  683   1HD   LYS  85          1HD       LYS  85  10.374  -3.215  -5.369
  684   2HD   LYS  85          2HD       LYS  85  10.300  -3.333  -3.609
  685   1HE   LYS  85          1HE       LYS  85  11.390  -5.287  -4.167
  686   2HE   LYS  85          2HE       LYS  85   9.714  -5.826  -4.073
  687   1HZ   LYS  85          1HZ       LYS  85   9.645  -6.253  -6.257
  688   2HZ   LYS  85          2HZ       LYS  85  11.333  -6.283  -6.155
  689   3HZ   LYS  85          3HZ       LYS  85  10.543  -4.882  -6.677
  690    H    ALA  86           H        ALA  86   5.388  -0.396  -3.854
  691    HA   ALA  86           HA       ALA  86   4.270  -0.997  -6.460
  692   1HB   ALA  86          1HB       ALA  86   2.772   0.501  -5.807
  693   2HB   ALA  86          2HB       ALA  86   3.739   0.884  -4.382
  694   3HB   ALA  86          3HB       ALA  86   4.011   1.754  -5.892
  695    H    LYS  87           H        LYS  87   4.673   0.359  -8.332
  696    HA   LYS  87           HA       LYS  87   7.241   1.762  -8.343
  697   1HB   LYS  87          1HB       LYS  87   7.836   0.606 -10.494
  698   2HB   LYS  87          2HB       LYS  87   7.882  -0.422  -9.068
  699   1HG   LYS  87          1HG       LYS  87   5.975  -1.585  -9.686
  700   2HG   LYS  87          2HG       LYS  87   5.432  -0.310 -10.779
  701   1HD   LYS  87          1HD       LYS  87   7.398  -0.821 -12.231
  702   2HD   LYS  87          2HD       LYS  87   7.750  -2.198 -11.184
  703   1HE   LYS  87          1HE       LYS  87   5.734  -3.282 -11.774
  704   2HE   LYS  87          2HE       LYS  87   5.086  -1.826 -12.528
  705   1HZ   LYS  87          1HZ       LYS  87   7.014  -3.758 -13.567
  706   2HZ   LYS  87          2HZ       LYS  87   7.229  -2.139 -14.008
  707   3HZ   LYS  87          3HZ       LYS  87   5.776  -2.927 -14.368
  708    H    GLY  88           H        GLY  88   7.382   3.432  -9.810
  709   1HA   GLY  88          1HA       GLY  88   6.565   4.394 -11.937
  710   2HA   GLY  88          2HA       GLY  88   4.952   3.927 -11.419
  711    H    THR  89           H        THR  89   4.940   6.387 -12.083
  712    HA   THR  89           HA       THR  89   5.763   8.144  -9.926
  713    HB   THR  89           HB       THR  89   5.103   9.965 -11.301
  714    HG1  THR  89           1HG      THR  89   3.940   9.480 -13.321
  715   1HG2  THR  89          1HG2      THR  89   6.078   7.916 -13.281
  716   2HG2  THR  89          2HG2      THR  89   7.116   8.596 -12.027
  717   3HG2  THR  89          3HG2      THR  89   6.406   9.648 -13.251
  718    H    ASP  90           H        ASP  90   4.042   9.895  -9.341
  719    HA   ASP  90           HA       ASP  90   2.093   8.720  -7.759
  720   1HB   ASP  90          1HB       ASP  90   2.851  10.986  -7.354
  721   2HB   ASP  90          2HB       ASP  90   2.190  11.520  -8.897
  722    H    GLN  91           H        GLN  91   1.841  10.003 -11.040
  723    HA   GLN  91           HA       GLN  91  -0.972   9.670 -11.259
  724   1HB   GLN  91          1HB       GLN  91   0.374  11.192 -12.694
  725   2HB   GLN  91          2HB       GLN  91   1.081   9.783 -13.474
  726   1HG   GLN  91          1HG       GLN  91  -0.693  10.737 -14.825
  727   2HG   GLN  91          2HG       GLN  91  -1.111   9.112 -14.284
  728   1HE2  GLN  91          1HE2      GLN  91  -3.304   9.436 -14.528
  729   2HE2  GLN  91          2HE2      GLN  91  -4.219  10.455 -13.474
  730    H    GLN  92           H        GLN  92   1.794   7.623 -11.965
  731    HA   GLN  92           HA       GLN  92   0.391   5.625 -13.395
  732   1HB   GLN  92          1HB       GLN  92   3.051   5.846 -12.086
  733   2HB   GLN  92          2HB       GLN  92   2.450   4.227 -12.422
  734   1HG   GLN  92          1HG       GLN  92   3.928   5.336 -14.174
  735   2HG   GLN  92          2HG       GLN  92   2.434   4.577 -14.722
  736   1HE2  GLN  92          1HE2      GLN  92   4.270   7.413 -14.628
  737   2HE2  GLN  92          2HE2      GLN  92   3.114   8.478 -15.346
  738    H    ASN  93           H        ASN  93   1.184   6.034  -9.975
  739    HA   ASN  93           HA       ASN  93   0.089   3.513  -9.185
  740   1HB   ASN  93          1HB       ASN  93   0.543   5.901  -7.396
  741   2HB   ASN  93          2HB       ASN  93   0.531   4.198  -6.945
  742   1HD2  ASN  93          1HD2      ASN  93   2.104   3.124  -8.927
  743   2HD2  ASN  93          2HD2      ASN  93   3.718   3.718  -8.761
  744    H    LYS  94           H        LYS  94  -1.042   6.873  -9.032
  745    HA   LYS  94           HA       LYS  94  -3.486   6.360  -7.748
  746   1HB   LYS  94          1HB       LYS  94  -2.485   8.610  -7.983
  747   2HB   LYS  94          2HB       LYS  94  -2.830   8.569  -9.707
  748   1HG   LYS  94          1HG       LYS  94  -5.195   8.546  -9.291
  749   2HG   LYS  94          2HG       LYS  94  -4.925   8.403  -7.552
  750   1HD   LYS  94          1HD       LYS  94  -4.655  10.607  -7.329
  751   2HD   LYS  94          2HD       LYS  94  -3.521  10.675  -8.680
  752   1HE   LYS  94          1HE       LYS  94  -5.602  10.478 -10.171
  753   2HE   LYS  94          2HE       LYS  94  -6.514  10.893  -8.720
  754   1HZ   LYS  94          1HZ       LYS  94  -4.475  12.734  -8.861
  755   2HZ   LYS  94          2HZ       LYS  94  -6.108  13.002  -9.210
  756   3HZ   LYS  94          3HZ       LYS  94  -5.035  12.589 -10.451
  757    H    GLU  95           H        GLU  95  -2.687   6.618 -11.201
  758    HA   GLU  95           HA       GLU  95  -5.322   6.149 -12.125
  759   1HB   GLU  95          1HB       GLU  95  -3.403   7.176 -13.429
  760   2HB   GLU  95          2HB       GLU  95  -2.782   5.544 -13.635
  761   1HG   GLU  95          1HG       GLU  95  -3.966   5.593 -15.530
  762   2HG   GLU  95          2HG       GLU  95  -5.323   5.207 -14.473
  763    H    TYR  96           H        TYR  96  -2.618   4.041 -11.364
  764    HA   TYR  96           HA       TYR  96  -3.502   1.678 -12.538
  765   1HB   TYR  96          1HB       TYR  96  -1.274   1.848 -11.616
  766   2HB   TYR  96          2HB       TYR  96  -1.917   2.101  -9.998
  767    HD1  TYR  96           1HD      TYR  96  -2.899   0.234  -8.745
  768    HD2  TYR  96           2HD      TYR  96  -1.159  -0.355 -12.582
  769    HE1  TYR  96           1HE      TYR  96  -2.829  -2.190  -8.334
  770    HE2  TYR  96           2HE      TYR  96  -1.085  -2.781 -12.183
  771    HH   TYR  96           HH       TYR  96  -1.551  -4.156  -9.133
  772    H    CYS  97           H        CYS  97  -4.169   2.969  -9.298
  773    HA   CYS  97           HA       CYS  97  -5.788   0.794  -8.471
  774   1HB   CYS  97          1HB       CYS  97  -5.726   3.647  -7.464
  775   2HB   CYS  97          2HB       CYS  97  -6.498   2.295  -6.645
  776    HG   CYS  97           HG       CYS  97  -3.173   2.159  -7.350
  777    H    SER  98           H        SER  98  -6.447   3.818 -10.125
  778    HA   SER  98           HA       SER  98  -9.303   3.565  -9.928
  779   1HB   SER  98          1HB       SER  98  -8.214   5.772 -10.113
  780   2HB   SER  98          2HB       SER  98  -7.635   5.345 -11.723
  781    HG   SER  98           HG       SER  98  -9.769   6.576 -11.354
  782    H    LYS  99           H        LYS  99  -6.926   2.147 -11.851
  783    HA   LYS  99           HA       LYS  99  -8.141   1.935 -14.352
  784   1HB   LYS  99          1HB       LYS  99  -5.822   1.260 -13.917
  785   2HB   LYS  99          2HB       LYS  99  -6.390  -0.083 -12.934
  786   1HG   LYS  99          1HG       LYS  99  -7.511  -1.014 -14.937
  787   2HG   LYS  99          2HG       LYS  99  -6.797   0.286 -15.894
  788   1HD   LYS  99          1HD       LYS  99  -5.454  -1.716 -16.103
  789   2HD   LYS  99          2HD       LYS  99  -4.553  -0.486 -15.214
  790   1HE   LYS  99          1HE       LYS  99  -4.463  -1.738 -13.359
  791   2HE   LYS  99          2HE       LYS  99  -6.153  -2.222 -13.497
  792   1HZ   LYS  99          1HZ       LYS  99  -3.755  -3.561 -14.450
  793   2HZ   LYS  99          2HZ       LYS  99  -5.093  -3.622 -15.483
  794   3HZ   LYS  99          3HZ       LYS  99  -5.216  -4.215 -13.903
  795    H    GLU 100           H        GLU 100  -8.934   0.441 -11.351
  796    HA   GLU 100           HA       GLU 100 -10.359  -1.792 -12.414
  797   1HB   GLU 100          1HB       GLU 100 -10.654  -0.480  -9.706
  798   2HB   GLU 100          2HB       GLU 100 -11.203  -2.090 -10.150
  799   1HG   GLU 100          1HG       GLU 100  -9.043  -2.941 -10.234
  800   2HG   GLU 100          2HG       GLU 100  -8.316  -1.341 -10.369
  801    H    GLY 101           H        GLY 101 -11.069   1.541 -12.018
  802   1HA   GLY 101          1HA       GLY 101 -12.900   2.671 -12.927
  803   2HA   GLY 101          2HA       GLY 101 -13.709   1.128 -13.155
  804    H    ASN 102           H        ASN 102 -12.643   0.979 -10.094
  805    HA   ASN 102           HA       ASN 102 -14.938   2.419  -8.958
  806   1HB   ASN 102          1HB       ASN 102 -14.822  -0.361  -9.241
  807   2HB   ASN 102          2HB       ASN 102 -14.425  -0.065  -7.551
  808   1HD2  ASN 102          1HD2      ASN 102 -16.091  -0.043  -6.245
  809   2HD2  ASN 102          2HD2      ASN 102 -17.709   0.403  -6.656
  810    H    LEU 103           H        LEU 103 -14.399   3.639  -7.272
  811    HA   LEU 103           HA       LEU 103 -11.761   3.246  -6.055
  812   1HB   LEU 103          1HB       LEU 103 -13.292   5.534  -6.835
  813   2HB   LEU 103          2HB       LEU 103 -12.954   5.618  -5.107
  814    HG   LEU 103           HG       LEU 103 -11.309   6.812  -6.556
  815   1HD1  LEU 103          1HD1      LEU 103  -9.852   6.512  -4.908
  816   2HD1  LEU 103          2HD1      LEU 103  -9.557   4.841  -5.389
  817   3HD1  LEU 103          3HD1      LEU 103 -10.896   5.223  -4.307
  818   1HD2  LEU 103          1HD2      LEU 103 -10.037   5.780  -8.123
  819   2HD2  LEU 103          2HD2      LEU 103 -11.450   4.729  -8.219
  820   3HD2  LEU 103          3HD2      LEU 103 -10.044   4.234  -7.275
  821    H    LEU 104           H        LEU 104 -11.539   2.585  -4.013
  822    HA   LEU 104           HA       LEU 104 -13.962   2.168  -2.429
  823   1HB   LEU 104          1HB       LEU 104 -12.387   0.287  -2.852
  824   2HB   LEU 104          2HB       LEU 104 -11.168   1.159  -1.925
  825    HG   LEU 104           HG       LEU 104 -12.464   0.930   0.091
  826   1HD1  LEU 104          1HD1      LEU 104 -14.687   0.989  -0.226
  827   2HD1  LEU 104          2HD1      LEU 104 -14.528  -0.764  -0.333
  828   3HD1  LEU 104          3HD1      LEU 104 -14.590   0.207  -1.804
  829   1HD2  LEU 104          1HD2      LEU 104 -11.053  -0.914  -0.239
  830   2HD2  LEU 104          2HD2      LEU 104 -12.080  -1.583  -1.508
  831   3HD2  LEU 104          3HD2      LEU 104 -12.620  -1.613   0.171
  832    H    MET 105           H        MET 105 -10.990   3.978  -2.465
  833    HA   MET 105           HA       MET 105 -11.944   5.684  -0.360
  834   1HB   MET 105          1HB       MET 105 -11.019   4.216   1.182
  835   2HB   MET 105          2HB       MET 105  -9.704   3.755   0.110
  836   1HG   MET 105          1HG       MET 105  -8.392   5.474   0.750
  837   2HG   MET 105          2HG       MET 105  -9.752   6.572   0.976
  838   1HE   MET 105          1HE       MET 105  -7.322   4.525   4.003
  839   2HE   MET 105          2HE       MET 105  -8.077   3.268   3.024
  840   3HE   MET 105          3HE       MET 105  -7.155   4.555   2.247
  841    H    GLU 106           H        GLU 106 -11.132   7.709  -0.549
  842    HA   GLU 106           HA       GLU 106  -8.782   8.097  -2.272
  843   1HB   GLU 106          1HB       GLU 106 -11.138   8.525  -3.338
  844   2HB   GLU 106          2HB       GLU 106 -11.082  10.012  -2.401
  845   1HG   GLU 106          1HG       GLU 106  -8.685  10.164  -3.554
  846   2HG   GLU 106          2HG       GLU 106  -9.517   9.199  -4.772
  847    H    CYS 107           H        CYS 107  -7.309   8.849  -0.881
  848    HA   CYS 107           HA       CYS 107  -7.829  11.364   0.458
  849   1HB   CYS 107          1HB       CYS 107  -7.420   8.789   1.916
  850   2HB   CYS 107          2HB       CYS 107  -6.712  10.254   2.585
  851    HG   CYS 107           HG       CYS 107  -9.477   9.247   3.426
  852    H    GLY 108           H        GLY 108  -5.713  11.959   1.771
  853   1HA   GLY 108          1HA       GLY 108  -3.417  12.254   1.787
  854   2HA   GLY 108          2HA       GLY 108  -3.271  10.893   0.684
  855    H    ALA 109           H        ALA 109  -1.575  12.677   0.032
  856    HA   ALA 109           HA       ALA 109  -2.813  14.431  -1.985
  857   1HB   ALA 109          1HB       ALA 109  -0.033  15.007  -1.509
  858   2HB   ALA 109          2HB       ALA 109  -1.443  16.052  -1.331
  859   3HB   ALA 109          3HB       ALA 109  -0.941  15.015   0.003
  860    HA   PRO 110           HA       PRO 110  -0.969  12.178  -5.271
  861   1HB   PRO 110          1HB       PRO 110  -0.422  14.164  -7.040
  862   2HB   PRO 110          2HB       PRO 110  -2.063  13.601  -6.705
  863   1HG   PRO 110          1HG       PRO 110  -0.628  15.998  -5.632
  864   2HG   PRO 110          2HG       PRO 110  -2.300  15.859  -6.206
  865   1HD   PRO 110          1HD       PRO 110  -1.656  15.846  -3.576
  866   2HD   PRO 110          2HD       PRO 110  -3.035  14.936  -4.226
  867    H    ARG 111           H        ARG 111   0.932  11.553  -4.043
  868    HA   ARG 111           HA       ARG 111   3.338  13.051  -4.853
  869   1HB   ARG 111          1HB       ARG 111   4.372  12.608  -2.799
  870   2HB   ARG 111          2HB       ARG 111   2.721  13.023  -2.358
  871   1HG   ARG 111          1HG       ARG 111   2.182  10.646  -2.149
  872   2HG   ARG 111          2HG       ARG 111   3.844  10.238  -2.578
  873   1HD   ARG 111          1HD       ARG 111   3.535  12.154  -0.365
  874   2HD   ARG 111          2HD       ARG 111   2.951  10.522  -0.041
  875    HE   ARG 111           HE       ARG 111   5.129   9.733  -0.171
  876   1HH1  ARG 111          1HH1      ARG 111   4.978  13.104  -1.028
  877   2HH1  ARG 111          2HH1      ARG 111   6.692  13.338  -0.939
  878   1HH2  ARG 111          1HH2      ARG 111   7.387  10.028  -0.050
  879   2HH2  ARG 111          2HH2      ARG 111   8.062  11.587  -0.383
  880    H    SER 112           H        SER 112   5.232  11.802  -5.289
  881    HA   SER 112           HA       SER 112   4.643   9.006  -6.013
  882   1HB   SER 112          1HB       SER 112   5.689   9.248  -8.041
  883   2HB   SER 112          2HB       SER 112   5.127  10.906  -7.828
  884    HG   SER 112           HG       SER 112   7.542  10.251  -8.275
  885    H    GLN 113           H        GLN 113   7.110   8.097  -6.642
  886    HA   GLN 113           HA       GLN 113   8.231   7.419  -4.199
  887   1HB   GLN 113          1HB       GLN 113   8.552   6.373  -6.553
  888   2HB   GLN 113          2HB       GLN 113   9.885   7.510  -6.704
  889   1HG   GLN 113          1HG       GLN 113  10.271   6.319  -4.229
  890   2HG   GLN 113          2HG       GLN 113   9.745   5.005  -5.279
  891   1HE2  GLN 113          1HE2      GLN 113  11.437   3.934  -5.987
  892   2HE2  GLN 113          2HE2      GLN 113  12.920   4.621  -6.548
  893    H    GLY 114           H        GLY 114   9.086   8.772  -2.760
  894   1HA   GLY 114          1HA       GLY 114  10.250  11.280  -3.481
  895   2HA   GLY 114          2HA       GLY 114  10.223  10.570  -1.874
  896    H    GLN 115           H        GLN 115  12.362  11.940  -3.484
  897    HA   GLN 115           HA       GLN 115  14.530  10.335  -2.621
  898   1HB   GLN 115          1HB       GLN 115  13.786   9.130  -4.724
  899   2HB   GLN 115          2HB       GLN 115  14.284  10.559  -5.620
  900   1HG   GLN 115          1HG       GLN 115  16.456  10.054  -5.464
  901   2HG   GLN 115          2HG       GLN 115  16.315   9.516  -3.792
  902   1HE2  GLN 115          1HE2      GLN 115  16.429   8.587  -7.080
  903   2HE2  GLN 115          2HE2      GLN 115  16.319   6.880  -6.839
  904    H    ARG 116           H        ARG 116  13.977  12.550  -5.366
  905    HA   ARG 116           HA       ARG 116  15.388  14.675  -3.998
  906   1HB   ARG 116          1HB       ARG 116  17.096  14.965  -5.703
  907   2HB   ARG 116          2HB       ARG 116  17.218  13.360  -4.996
  908   1HG   ARG 116          1HG       ARG 116  16.867  12.360  -6.952
  909   2HG   ARG 116          2HG       ARG 116  15.511  13.419  -7.346
  910   1HD   ARG 116          1HD       ARG 116  18.228  14.595  -7.461
  911   2HD   ARG 116          2HD       ARG 116  17.805  13.429  -8.714
  912    HE   ARG 116           HE       ARG 116  15.835  15.490  -8.308
  913   1HH1  ARG 116          1HH1      ARG 116  18.742  14.577  -9.992
  914   2HH1  ARG 116          2HH1      ARG 116  18.487  15.682 -11.302
  915   1HH2  ARG 116          1HH2      ARG 116  15.488  16.949 -10.026
  916   2HH2  ARG 116          2HH2      ARG 116  16.635  17.031 -11.320
  Start of MODEL   23
    1    HA   PRO   2           HA       PRO   2  34.639   4.998   8.434
    2   1HB   PRO   2          1HB       PRO   2  33.044   2.836   8.824
    3   2HB   PRO   2          2HB       PRO   2  33.868   3.159   7.294
    4   1HG   PRO   2          1HG       PRO   2  34.644   1.299   9.508
    5   2HG   PRO   2          2HG       PRO   2  34.687   1.032   7.756
    6   1HD   PRO   2          1HD       PRO   2  36.897   1.662   9.189
    7   2HD   PRO   2          2HD       PRO   2  36.672   2.175   7.504
    8    H    SER   3           H        SER   3  32.422   4.577   9.789
    9    HA   SER   3           HA       SER   3  33.069   4.346  12.635
   10   1HB   SER   3          1HB       SER   3  32.972   6.816  11.542
   11   2HB   SER   3          2HB       SER   3  31.267   6.593  11.934
   12    HG   SER   3           HG       SER   3  31.790   7.022  13.911
   13    H    LYS   4           H        LYS   4  31.232   3.981  13.991
   14    HA   LYS   4           HA       LYS   4  29.249   3.009  14.538
   15   1HB   LYS   4          1HB       LYS   4  28.612   4.990  12.719
   16   2HB   LYS   4          2HB       LYS   4  27.827   3.567  12.046
   17   1HG   LYS   4          1HG       LYS   4  26.167   3.814  13.482
   18   2HG   LYS   4          2HG       LYS   4  27.294   3.592  14.823
   19   1HD   LYS   4          1HD       LYS   4  27.594   5.873  15.115
   20   2HD   LYS   4          2HD       LYS   4  27.068   6.254  13.474
   21   1HE   LYS   4          1HE       LYS   4  24.781   5.336  14.236
   22   2HE   LYS   4          2HE       LYS   4  25.413   5.536  15.870
   23   1HZ   LYS   4          1HZ       LYS   4  24.279   7.476  14.228
   24   2HZ   LYS   4          2HZ       LYS   4  25.913   7.877  14.395
   25   3HZ   LYS   4          3HZ       LYS   4  24.946   7.683  15.769
   26    H    LYS   5           H        LYS   5  27.693   1.273  13.879
   27    HA   LYS   5           HA       LYS   5  28.904  -0.508  11.866
   28   1HB   LYS   5          1HB       LYS   5  28.214  -2.413  13.292
   29   2HB   LYS   5          2HB       LYS   5  29.398  -1.373  14.072
   30   1HG   LYS   5          1HG       LYS   5  27.992  -0.793  15.716
   31   2HG   LYS   5          2HG       LYS   5  26.606  -0.675  14.630
   32   1HD   LYS   5          1HD       LYS   5  27.633  -3.398  15.086
   33   2HD   LYS   5          2HD       LYS   5  26.915  -2.611  16.494
   34   1HE   LYS   5          1HE       LYS   5  24.948  -2.056  14.977
   35   2HE   LYS   5          2HE       LYS   5  25.647  -3.200  13.832
   36   1HZ   LYS   5          1HZ       LYS   5  23.888  -3.975  15.566
   37   2HZ   LYS   5          2HZ       LYS   5  25.217  -4.052  16.608
   38   3HZ   LYS   5          3HZ       LYS   5  25.203  -4.971  15.188
   39    H    ASN   6           H        ASN   6  27.372  -2.182  11.044
   40    HA   ASN   6           HA       ASN   6  24.552  -1.588  11.245
   41   1HB   ASN   6          1HB       ASN   6  24.155  -0.927   9.029
   42   2HB   ASN   6          2HB       ASN   6  25.589  -0.013   9.485
   43   1HD2  ASN   6          1HD2      ASN   6  27.689  -1.101   8.941
   44   2HD2  ASN   6          2HD2      ASN   6  27.783  -1.895   7.410
   45    H    GLY   7           H        GLY   7  23.554  -2.966   9.139
   46   1HA   GLY   7          1HA       GLY   7  24.831  -5.622   9.302
   47   2HA   GLY   7          2HA       GLY   7  23.107  -5.430   9.584
   48    H    ARG   8           H        ARG   8  24.000  -7.159   7.656
   49    HA   ARG   8           HA       ARG   8  23.101  -5.804   5.207
   50   1HB   ARG   8          1HB       ARG   8  25.643  -6.321   5.361
   51   2HB   ARG   8          2HB       ARG   8  25.155  -7.990   5.100
   52   1HG   ARG   8          1HG       ARG   8  23.865  -6.321   3.175
   53   2HG   ARG   8          2HG       ARG   8  25.598  -5.989   3.178
   54   1HD   ARG   8          1HD       ARG   8  24.856  -8.834   3.287
   55   2HD   ARG   8          2HD       ARG   8  24.428  -8.001   1.794
   56    HE   ARG   8           HE       ARG   8  27.026  -8.788   2.606
   57   1HH1  ARG   8          1HH1      ARG   8  25.305  -6.246   0.963
   58   2HH1  ARG   8          2HH1      ARG   8  26.661  -5.779  -0.009
   59   1HH2  ARG   8          1HH2      ARG   8  28.818  -8.181   1.332
   60   2HH2  ARG   8          2HH2      ARG   8  28.658  -6.880   0.201
   61    H    SER   9           H        SER   9  22.066  -7.189   3.657
   62    HA   SER   9           HA       SER   9  21.522  -9.918   4.123
   63   1HB   SER   9          1HB       SER   9  20.203  -8.826   6.003
   64   2HB   SER   9          2HB       SER   9  19.172  -8.128   4.754
   65    HG   SER   9           HG       SER   9  19.531 -10.837   5.448
   66    H    GLY  10           H        GLY  10  19.776  -7.029   2.952
   67   1HA   GLY  10          1HA       GLY  10  20.085  -7.029   0.337
   68   2HA   GLY  10          2HA       GLY  10  19.099  -8.475   0.500
   69    HA   PRO  11           HA       PRO  11  15.414  -6.112   0.484
   70   1HB   PRO  11          1HB       PRO  11  13.890  -7.306   2.387
   71   2HB   PRO  11          2HB       PRO  11  14.247  -8.060   0.829
   72   1HG   PRO  11          1HG       PRO  11  15.535  -8.514   3.493
   73   2HG   PRO  11          2HG       PRO  11  15.050  -9.701   2.268
   74   1HD   PRO  11          1HD       PRO  11  17.612  -8.876   2.564
   75   2HD   PRO  11          2HD       PRO  11  16.934  -9.337   0.990
   76    H    GLN  12           H        GLN  12  15.068  -4.113   1.201
   77    HA   GLN  12           HA       GLN  12  15.406  -3.567   4.076
   78   1HB   GLN  12          1HB       GLN  12  16.015  -1.196   3.257
   79   2HB   GLN  12          2HB       GLN  12  17.229  -2.462   3.131
   80   1HG   GLN  12          1HG       GLN  12  15.519  -2.181   0.771
   81   2HG   GLN  12          2HG       GLN  12  16.521  -0.776   1.129
   82   1HE2  GLN  12          1HE2      GLN  12  16.588  -2.862  -1.018
   83   2HE2  GLN  12          2HE2      GLN  12  18.211  -3.453  -1.002
   84    HA   PRO  13           HA       PRO  13  11.366  -1.860   4.137
   85   1HB   PRO  13          1HB       PRO  13  11.653   0.191   5.892
   86   2HB   PRO  13          2HB       PRO  13  11.665  -1.505   6.387
   87   1HG   PRO  13          1HG       PRO  13  13.969   0.349   5.922
   88   2HG   PRO  13          2HG       PRO  13  13.721  -0.821   7.231
   89   1HD   PRO  13          1HD       PRO  13  15.314  -1.332   5.102
   90   2HD   PRO  13          2HD       PRO  13  14.397  -2.603   5.935
   91    H    HIS  14           H        HIS  14  10.146  -0.413   3.036
   92    HA   HIS  14           HA       HIS  14  11.488   1.985   1.974
   93   1HB   HIS  14          1HB       HIS  14   9.420   0.376   0.473
   94   2HB   HIS  14          2HB       HIS  14  10.405   1.699  -0.143
   95    HD1  HIS  14           1HD      HIS  14  10.206  -1.810  -0.335
   96    HD2  HIS  14           2HD      HIS  14  13.347   0.868   0.138
   97    HE1  HIS  14           1HE      HIS  14  12.270  -3.065  -1.031
   98    H    LYS  15           H        LYS  15   9.657   3.456   0.935
   99    HA   LYS  15           HA       LYS  15   7.672   3.843   3.066
  100   1HB   LYS  15          1HB       LYS  15   7.509   6.174   2.078
  101   2HB   LYS  15          2HB       LYS  15   9.033   5.770   2.856
  102   1HG   LYS  15          1HG       LYS  15   9.112   5.106   0.056
  103   2HG   LYS  15          2HG       LYS  15   8.661   6.796   0.295
  104   1HD   LYS  15          1HD       LYS  15  10.628   7.046   1.796
  105   2HD   LYS  15          2HD       LYS  15  11.101   5.395   1.387
  106   1HE   LYS  15          1HE       LYS  15  11.966   6.025  -0.574
  107   2HE   LYS  15          2HE       LYS  15  10.565   7.021  -0.963
  108   1HZ   LYS  15          1HZ       LYS  15  12.940   8.052  -0.537
  109   2HZ   LYS  15          2HZ       LYS  15  12.405   8.029   1.067
  110   3HZ   LYS  15          3HZ       LYS  15  11.524   8.870  -0.106
  111    H    ARG  16           H        ARG  16   7.574   2.088   0.557
  112    HA   ARG  16           HA       ARG  16   4.886   2.929  -0.237
  113   1HB   ARG  16          1HB       ARG  16   6.905   2.003  -2.278
  114   2HB   ARG  16          2HB       ARG  16   5.304   2.670  -2.569
  115   1HG   ARG  16          1HG       ARG  16   6.156   4.813  -1.526
  116   2HG   ARG  16          2HG       ARG  16   7.768   4.104  -1.633
  117   1HD   ARG  16          1HD       ARG  16   5.977   4.223  -4.032
  118   2HD   ARG  16          2HD       ARG  16   6.934   5.623  -3.551
  119    HE   ARG  16           HE       ARG  16   7.891   3.210  -4.775
  120   1HH1  ARG  16          1HH1      ARG  16   8.738   5.915  -2.754
  121   2HH1  ARG  16          2HH1      ARG  16  10.427   5.832  -3.127
  122   1HH2  ARG  16          1HH2      ARG  16  10.114   3.091  -5.274
  123   2HH2  ARG  16          2HH2      ARG  16  11.209   4.226  -4.561
  124    H    TRP  17           H        TRP  17   3.499   1.293  -0.122
  125    HA   TRP  17           HA       TRP  17   4.338  -1.414  -0.747
  126   1HB   TRP  17          1HB       TRP  17   3.393  -0.589   1.998
  127   2HB   TRP  17          2HB       TRP  17   3.323  -2.254   1.429
  128    HD1  TRP  17           HD       TRP  17   5.740   0.362   2.725
  129    HE1  TRP  17           1HE      TRP  17   8.043  -0.727   3.097
  130    HE3  TRP  17           3HE      TRP  17   4.869  -4.158   0.499
  131    HZ2  TRP  17           2HZ      TRP  17   9.320  -3.178   2.522
  132    HZ3  TRP  17           3HZ      TRP  17   6.684  -5.818   0.452
  133    HH2  TRP  17           HH       TRP  17   8.863  -5.336   1.443
  134    H    VAL  18           H        VAL  18   2.721  -2.601  -1.611
  135    HA   VAL  18           HA       VAL  18   0.052  -1.360  -1.674
  136    HB   VAL  18           HB       VAL  18  -0.351  -2.584  -3.738
  137   1HG1  VAL  18          1HG1      VAL  18   0.583  -0.426  -4.049
  138   2HG1  VAL  18          2HG1      VAL  18   2.206  -0.997  -3.657
  139   3HG1  VAL  18          3HG1      VAL  18   1.429  -1.505  -5.157
  140   1HG2  VAL  18          1HG2      VAL  18   1.702  -4.246  -2.832
  141   2HG2  VAL  18          2HG2      VAL  18   0.818  -4.374  -4.353
  142   3HG2  VAL  18          3HG2      VAL  18   2.333  -3.474  -4.287
  143    H    PHE  19           H        PHE  19  -1.801  -2.843  -1.772
  144    HA   PHE  19           HA       PHE  19  -1.324  -5.427  -0.465
  145   1HB   PHE  19          1HB       PHE  19  -3.326  -4.988   0.990
  146   2HB   PHE  19          2HB       PHE  19  -1.927  -3.983   1.352
  147    HD1  PHE  19           1HD      PHE  19  -1.893  -1.612   0.587
  148    HD2  PHE  19           2HD      PHE  19  -5.377  -4.042   0.323
  149    HE1  PHE  19           1HE      PHE  19  -3.278   0.407   0.341
  150    HE2  PHE  19           2HE      PHE  19  -6.768  -2.028   0.075
  151    HZ   PHE  19           HZ       PHE  19  -5.719   0.200   0.083
  152    H    THR  20           H        THR  20  -2.797  -7.042  -0.954
  153    HA   THR  20           HA       THR  20  -5.069  -6.426  -2.664
  154    HB   THR  20           HB       THR  20  -4.443  -7.966  -4.425
  155    HG1  THR  20           1HG      THR  20  -3.026  -9.449  -3.924
  156   1HG2  THR  20          1HG2      THR  20  -2.049  -6.196  -3.994
  157   2HG2  THR  20          2HG2      THR  20  -3.630  -5.547  -4.428
  158   3HG2  THR  20          3HG2      THR  20  -2.806  -6.665  -5.515
  159    H    LEU  21           H        LEU  21  -6.749  -7.685  -2.167
  160    HA   LEU  21           HA       LEU  21  -6.267 -10.346  -1.041
  161   1HB   LEU  21          1HB       LEU  21  -6.578  -8.772   0.827
  162   2HB   LEU  21          2HB       LEU  21  -8.140  -8.309   0.155
  163    HG   LEU  21           HG       LEU  21  -8.601 -10.910   0.411
  164   1HD1  LEU  21          1HD1      LEU  21  -6.817 -10.450   2.772
  165   2HD1  LEU  21          2HD1      LEU  21  -6.195 -11.154   1.280
  166   3HD1  LEU  21          3HD1      LEU  21  -7.491 -11.961   2.163
  167   1HD2  LEU  21          1HD2      LEU  21  -8.731  -9.445   2.979
  168   2HD2  LEU  21          2HD2      LEU  21  -9.987 -10.325   2.107
  169   3HD2  LEU  21          3HD2      LEU  21  -9.528  -8.701   1.592
  170    H    ASN  22           H        ASN  22  -7.527 -11.851  -1.928
  171    HA   ASN  22           HA       ASN  22  -9.483 -11.100  -3.893
  172   1HB   ASN  22          1HB       ASN  22  -9.698 -13.497  -4.304
  173   2HB   ASN  22          2HB       ASN  22  -7.997 -13.046  -4.214
  174   1HD2  ASN  22          1HD2      ASN  22  -6.749 -13.776  -2.527
  175   2HD2  ASN  22          2HD2      ASN  22  -7.280 -15.004  -1.433
  176    H    ASN  23           H        ASN  23 -11.623 -10.950  -3.662
  177    HA   ASN  23           HA       ASN  23 -13.655 -10.812  -2.639
  178   1HB   ASN  23          1HB       ASN  23 -13.634 -13.207  -3.121
  179   2HB   ASN  23          2HB       ASN  23 -12.791 -13.522  -1.606
  180   1HD2  ASN  23          1HD2      ASN  23 -15.513 -11.383  -2.333
  181   2HD2  ASN  23          2HD2      ASN  23 -16.617 -12.127  -1.232
  182    HA   PRO  24           HA       PRO  24 -11.687  -9.514   1.399
  183   1HB   PRO  24          1HB       PRO  24 -12.266  -6.875   1.132
  184   2HB   PRO  24          2HB       PRO  24 -10.788  -7.604   0.493
  185   1HG   PRO  24          1HG       PRO  24 -13.332  -6.923  -0.930
  186   2HG   PRO  24          2HG       PRO  24 -11.656  -6.675  -1.454
  187   1HD   PRO  24          1HD       PRO  24 -13.170  -8.737  -2.342
  188   2HD   PRO  24          2HD       PRO  24 -11.411  -8.864  -2.133
  189    H    SER  25           H        SER  25 -12.788  -9.037   3.285
  190    HA   SER  25           HA       SER  25 -15.693  -9.205   3.104
  191   1HB   SER  25          1HB       SER  25 -13.664  -9.963   5.068
  192   2HB   SER  25          2HB       SER  25 -15.055  -9.160   5.796
  193    HG   SER  25           HG       SER  25 -16.336 -10.767   5.174
  194    H    GLU  26           H        GLU  26 -17.023  -7.849   4.545
  195    HA   GLU  26           HA       GLU  26 -16.538  -5.111   4.106
  196   1HB   GLU  26          1HB       GLU  26 -18.643  -6.741   5.207
  197   2HB   GLU  26          2HB       GLU  26 -18.392  -5.323   6.215
  198   1HG   GLU  26          1HG       GLU  26 -18.383  -4.170   3.791
  199   2HG   GLU  26          2HG       GLU  26 -19.444  -5.541   3.475
  200    H    ASP  27           H        ASP  27 -15.793  -7.234   6.763
  201    HA   ASP  27           HA       ASP  27 -15.260  -5.169   8.669
  202   1HB   ASP  27          1HB       ASP  27 -15.428  -7.996   8.690
  203   2HB   ASP  27          2HB       ASP  27 -13.816  -7.577   9.263
  204    H    GLU  28           H        GLU  28 -13.203  -7.263   6.658
  205    HA   GLU  28           HA       GLU  28 -10.764  -6.069   7.489
  206   1HB   GLU  28          1HB       GLU  28 -11.511  -8.276   5.947
  207   2HB   GLU  28          2HB       GLU  28 -10.640  -7.229   4.835
  208   1HG   GLU  28          1HG       GLU  28  -9.103  -8.772   5.822
  209   2HG   GLU  28          2HG       GLU  28  -8.762  -7.154   6.435
  210    H    ARG  29           H        ARG  29 -12.797  -5.661   4.605
  211    HA   ARG  29           HA       ARG  29 -11.181  -3.801   3.278
  212   1HB   ARG  29          1HB       ARG  29 -13.137  -5.017   2.296
  213   2HB   ARG  29          2HB       ARG  29 -14.198  -3.942   3.196
  214   1HG   ARG  29          1HG       ARG  29 -12.628  -2.149   1.913
  215   2HG   ARG  29          2HG       ARG  29 -12.669  -3.467   0.741
  216   1HD   ARG  29          1HD       ARG  29 -14.620  -2.618   0.070
  217   2HD   ARG  29          2HD       ARG  29 -15.289  -3.275   1.563
  218    HE   ARG  29           HE       ARG  29 -14.237  -0.784   2.177
  219   1HH1  ARG  29          1HH1      ARG  29 -16.739  -2.106   0.150
  220   2HH1  ARG  29          2HH1      ARG  29 -17.741  -0.695   0.244
  221   1HH2  ARG  29          1HH2      ARG  29 -15.546   1.079   2.308
  222   2HH2  ARG  29          2HH2      ARG  29 -17.061   1.116   1.471
  223    H    LYS  30           H        LYS  30 -13.626  -3.388   5.774
  224    HA   LYS  30           HA       LYS  30 -13.732  -0.550   5.631
  225   1HB   LYS  30          1HB       LYS  30 -15.568  -1.750   6.624
  226   2HB   LYS  30          2HB       LYS  30 -14.505  -2.490   7.814
  227   1HG   LYS  30          1HG       LYS  30 -14.695  -0.761   9.194
  228   2HG   LYS  30          2HG       LYS  30 -14.378   0.402   7.904
  229   1HD   LYS  30          1HD       LYS  30 -16.535   0.952   8.534
  230   2HD   LYS  30          2HD       LYS  30 -16.816  -0.142   7.177
  231   1HE   LYS  30          1HE       LYS  30 -18.279  -0.986   8.736
  232   2HE   LYS  30          2HE       LYS  30 -16.849  -1.970   9.047
  233   1HZ   LYS  30          1HZ       LYS  30 -16.321  -0.700  10.937
  234   2HZ   LYS  30          2HZ       LYS  30 -17.982  -0.997  11.051
  235   3HZ   LYS  30          3HZ       LYS  30 -17.427   0.519  10.545
  236    H    LYS  31           H        LYS  31 -11.782  -2.845   7.438
  237    HA   LYS  31           HA       LYS  31 -10.652  -1.077   9.298
  238   1HB   LYS  31          1HB       LYS  31 -10.393  -3.429   9.629
  239   2HB   LYS  31          2HB       LYS  31  -9.612  -3.628   8.066
  240   1HG   LYS  31          1HG       LYS  31  -8.157  -1.744   9.674
  241   2HG   LYS  31          2HG       LYS  31  -8.390  -3.260  10.549
  242   1HD   LYS  31          1HD       LYS  31  -7.643  -3.651   7.758
  243   2HD   LYS  31          2HD       LYS  31  -6.432  -2.756   8.679
  244   1HE   LYS  31          1HE       LYS  31  -7.616  -5.429   9.426
  245   2HE   LYS  31          2HE       LYS  31  -6.009  -5.161   8.754
  246   1HZ   LYS  31          1HZ       LYS  31  -5.845  -3.574  10.829
  247   2HZ   LYS  31          2HZ       LYS  31  -5.503  -5.226  10.951
  248   3HZ   LYS  31          3HZ       LYS  31  -7.008  -4.635  11.450
  249    H    ILE  32           H        ILE  32  -9.401  -2.165   6.145
  250    HA   ILE  32           HA       ILE  32  -7.098  -0.549   6.164
  251    HB   ILE  32           HB       ILE  32  -8.637  -1.898   3.972
  252   1HG1  ILE  32          1HG1      ILE  32  -5.796  -2.216   4.961
  253   2HG1  ILE  32          2HG1      ILE  32  -7.154  -3.207   5.484
  254   1HG2  ILE  32          1HG2      ILE  32  -7.905   0.048   2.859
  255   2HG2  ILE  32          2HG2      ILE  32  -6.340   0.015   3.669
  256   3HG2  ILE  32          3HG2      ILE  32  -6.730  -1.204   2.457
  257   1HD1  ILE  32          1HD1      ILE  32  -6.920  -4.539   3.736
  258   2HD1  ILE  32          2HD1      ILE  32  -6.982  -3.175   2.619
  259   3HD1  ILE  32          3HD1      ILE  32  -5.445  -3.662   3.332
  260    H    ARG  33           H        ARG  33 -10.348  -0.005   4.872
  261    HA   ARG  33           HA       ARG  33  -9.743   2.516   3.698
  262   1HB   ARG  33          1HB       ARG  33 -11.628   1.296   2.866
  263   2HB   ARG  33          2HB       ARG  33 -12.349   1.205   4.467
  264   1HG   ARG  33          1HG       ARG  33 -12.926   3.483   4.455
  265   2HG   ARG  33          2HG       ARG  33 -11.880   3.820   3.073
  266   1HD   ARG  33          1HD       ARG  33 -13.562   3.420   1.681
  267   2HD   ARG  33          2HD       ARG  33 -13.731   1.790   2.332
  268    HE   ARG  33           HE       ARG  33 -15.532   2.498   3.571
  269   1HH1  ARG  33          1HH1      ARG  33 -13.848   5.255   2.274
  270   2HH1  ARG  33          2HH1      ARG  33 -15.078   6.386   2.730
  271   1HH2  ARG  33          1HH2      ARG  33 -17.159   3.977   4.177
  272   2HH2  ARG  33          2HH2      ARG  33 -16.961   5.658   3.813
  273    H    ASP  34           H        ASP  34 -10.430   1.484   6.897
  274    HA   ASP  34           HA       ASP  34 -11.094   4.199   7.770
  275   1HB   ASP  34          1HB       ASP  34 -12.461   2.246   8.561
  276   2HB   ASP  34          2HB       ASP  34 -11.037   1.667   9.421
  277    H    LEU  35           H        LEU  35  -8.368   2.763   7.042
  278    HA   LEU  35           HA       LEU  35  -6.777   2.906   9.371
  279   1HB   LEU  35          1HB       LEU  35  -6.228   2.836   6.439
  280   2HB   LEU  35          2HB       LEU  35  -4.915   3.205   7.555
  281    HG   LEU  35           HG       LEU  35  -6.580   0.691   7.645
  282   1HD1  LEU  35          1HD1      LEU  35  -4.571  -0.409   6.739
  283   2HD1  LEU  35          2HD1      LEU  35  -3.837   1.175   6.494
  284   3HD1  LEU  35          3HD1      LEU  35  -5.292   0.731   5.602
  285   1HD2  LEU  35          1HD2      LEU  35  -4.827  -0.105   9.150
  286   2HD2  LEU  35          2HD2      LEU  35  -5.626   1.329   9.797
  287   3HD2  LEU  35          3HD2      LEU  35  -4.030   1.466   9.057
  288    HA   PRO  36           HA       PRO  36  -5.883   7.172   9.874
  289   1HB   PRO  36          1HB       PRO  36  -3.243   7.148  10.506
  290   2HB   PRO  36          2HB       PRO  36  -4.500   6.582  11.612
  291   1HG   PRO  36          1HG       PRO  36  -2.703   4.998   9.816
  292   2HG   PRO  36          2HG       PRO  36  -3.174   4.675  11.495
  293   1HD   PRO  36          1HD       PRO  36  -4.321   3.414   9.391
  294   2HD   PRO  36          2HD       PRO  36  -5.209   3.781  10.884
  295    H    ILE  37           H        ILE  37  -5.863   8.569   8.232
  296    HA   ILE  37           HA       ILE  37  -4.387   8.176   5.840
  297    HB   ILE  37           HB       ILE  37  -5.093  10.521   5.299
  298   1HG1  ILE  37          1HG1      ILE  37  -6.505  10.321   7.968
  299   2HG1  ILE  37          2HG1      ILE  37  -5.129  11.362   7.624
  300   1HG2  ILE  37          1HG2      ILE  37  -6.898   9.549   4.451
  301   2HG2  ILE  37          2HG2      ILE  37  -6.618   8.171   5.513
  302   3HG2  ILE  37          3HG2      ILE  37  -7.659   9.493   6.040
  303   1HD1  ILE  37          1HD1      ILE  37  -6.752  12.884   7.302
  304   2HD1  ILE  37          2HD1      ILE  37  -6.796  12.168   5.691
  305   3HD1  ILE  37          3HD1      ILE  37  -7.967  11.668   6.910
  306    H    SER  38           H        SER  38  -3.832  10.038   8.762
  307    HA   SER  38           HA       SER  38  -1.692  11.611   7.794
  308   1HB   SER  38          1HB       SER  38  -2.856  10.963  10.434
  309   2HB   SER  38          2HB       SER  38  -1.158  11.441  10.450
  310    HG   SER  38           HG       SER  38  -1.995  13.378  10.411
  311    H    LEU  39           H        LEU  39  -1.917   8.318   8.744
  312    HA   LEU  39           HA       LEU  39   0.828   7.929   9.426
  313   1HB   LEU  39          1HB       LEU  39  -1.410   6.478   9.793
  314   2HB   LEU  39          2HB       LEU  39  -0.732   5.645   8.396
  315    HG   LEU  39           HG       LEU  39   1.099   6.123  10.672
  316   1HD1  LEU  39          1HD1      LEU  39   0.257   4.264  11.951
  317   2HD1  LEU  39          2HD1      LEU  39  -1.050   4.014  10.794
  318   3HD1  LEU  39          3HD1      LEU  39  -1.012   5.477  11.778
  319   1HD2  LEU  39          1HD2      LEU  39   1.081   3.457   9.799
  320   2HD2  LEU  39          2HD2      LEU  39   2.268   4.707   9.425
  321   3HD2  LEU  39          3HD2      LEU  39   0.891   4.448   8.353
  322    H    PHE  40           H        PHE  40  -1.012   7.902   6.472
  323    HA   PHE  40           HA       PHE  40   1.451   7.240   4.998
  324   1HB   PHE  40          1HB       PHE  40  -1.292   6.641   3.920
  325   2HB   PHE  40          2HB       PHE  40   0.258   5.974   3.418
  326    HD1  PHE  40           2HD      PHE  40  -2.395   5.845   5.946
  327    HD2  PHE  40           1HD      PHE  40   1.248   4.125   4.572
  328    HE1  PHE  40           2HE      PHE  40  -2.761   3.906   7.414
  329    HE2  PHE  40           1HE      PHE  40   0.887   2.182   6.038
  330    HZ   PHE  40           HZ       PHE  40  -1.119   2.071   7.463
  331    H    ASP  41           H        ASP  41   2.171   8.958   3.946
  332    HA   ASP  41           HA       ASP  41   0.854  11.363   3.602
  333   1HB   ASP  41          1HB       ASP  41   3.379  10.456   3.090
  334   2HB   ASP  41          2HB       ASP  41   2.767  10.714   1.459
  335    H    TYR  42           H        TYR  42   0.682   8.470   1.690
  336    HA   TYR  42           HA       TYR  42  -1.384   9.722   0.040
  337   1HB   TYR  42          1HB       TYR  42   0.649   9.856  -1.304
  338   2HB   TYR  42          2HB       TYR  42   0.942   8.136  -1.070
  339    HD1  TYR  42           1HD      TYR  42  -2.296   9.789  -1.829
  340    HD2  TYR  42           2HD      TYR  42   0.854   7.319  -3.269
  341    HE1  TYR  42           1HE      TYR  42  -3.613   9.296  -3.847
  342    HE2  TYR  42           2HE      TYR  42  -0.453   6.820  -5.292
  343    HH   TYR  42           HH       TYR  42  -2.549   6.919  -6.200
  344    H    PHE  43           H        PHE  43  -3.152   8.511   0.020
  345    HA   PHE  43           HA       PHE  43  -2.888   5.596   0.267
  346   1HB   PHE  43          1HB       PHE  43  -3.657   7.061   2.391
  347   2HB   PHE  43          2HB       PHE  43  -5.219   6.849   1.607
  348    HD1  PHE  43           1HD      PHE  43  -4.236   4.059   0.437
  349    HD2  PHE  43           2HD      PHE  43  -4.465   5.788   4.320
  350    HE1  PHE  43           1HE      PHE  43  -4.425   1.812   1.423
  351    HE2  PHE  43           2HE      PHE  43  -4.654   3.544   5.312
  352    HZ   PHE  43           HZ       PHE  43  -4.633   1.552   3.863
  353    H    ILE  44           H        ILE  44  -3.737   4.716  -1.490
  354    HA   ILE  44           HA       ILE  44  -6.289   5.750  -2.502
  355    HB   ILE  44           HB       ILE  44  -4.806   6.726  -4.045
  356   1HG1  ILE  44          1HG1      ILE  44  -5.205   4.269  -5.639
  357   2HG1  ILE  44          2HG1      ILE  44  -6.648   4.904  -4.856
  358   1HG2  ILE  44          1HG2      ILE  44  -3.067   5.251  -5.222
  359   2HG2  ILE  44          2HG2      ILE  44  -2.728   5.778  -3.574
  360   3HG2  ILE  44          3HG2      ILE  44  -3.303   4.138  -3.875
  361   1HD1  ILE  44          1HD1      ILE  44  -6.860   6.384  -6.478
  362   2HD1  ILE  44          2HD1      ILE  44  -5.293   7.076  -6.058
  363   3HD1  ILE  44          3HD1      ILE  44  -5.393   5.771  -7.240
  364    H    VAL  45           H        VAL  45  -7.714   4.155  -2.459
  365    HA   VAL  45           HA       VAL  45  -6.782   1.415  -3.026
  366    HB   VAL  45           HB       VAL  45  -9.211   1.959  -1.355
  367   1HG1  VAL  45          1HG1      VAL  45  -7.789  -0.282  -0.472
  368   2HG1  VAL  45          2HG1      VAL  45  -9.281  -0.262  -1.415
  369   3HG1  VAL  45          3HG1      VAL  45  -7.720  -0.340  -2.233
  370   1HG2  VAL  45          1HG2      VAL  45  -6.343   2.016  -0.465
  371   2HG2  VAL  45          2HG2      VAL  45  -7.622   3.185  -0.135
  372   3HG2  VAL  45          3HG2      VAL  45  -7.656   1.600   0.637
  373    H    GLY  46           H        GLY  46  -7.939   0.197  -4.453
  374   1HA   GLY  46          1HA       GLY  46 -10.408   1.378  -5.551
  375   2HA   GLY  46          2HA       GLY  46  -9.121   0.851  -6.626
  376    H    GLU  47           H        GLU  47 -12.002  -0.023  -6.086
  377    HA   GLU  47           HA       GLU  47 -11.581  -2.813  -5.337
  378   1HB   GLU  47          1HB       GLU  47 -13.493  -1.737  -4.331
  379   2HB   GLU  47          2HB       GLU  47 -14.090  -1.231  -5.906
  380   1HG   GLU  47          1HG       GLU  47 -15.059  -3.201  -6.309
  381   2HG   GLU  47          2HG       GLU  47 -13.701  -4.115  -5.656
  382    H    GLU  48           H        GLU  48 -11.615  -4.479  -6.733
  383    HA   GLU  48           HA       GLU  48 -12.266  -3.889  -9.546
  384   1HB   GLU  48          1HB       GLU  48  -9.843  -4.162  -9.220
  385   2HB   GLU  48          2HB       GLU  48 -10.117  -5.745  -8.507
  386   1HG   GLU  48          1HG       GLU  48 -11.274  -5.364 -11.177
  387   2HG   GLU  48          2HG       GLU  48  -9.514  -5.318 -11.102
  388    H    GLY  49           H        GLY  49 -14.176  -4.829  -9.919
  389   1HA   GLY  49          1HA       GLY  49 -14.508  -7.572 -10.119
  390   2HA   GLY  49          2HA       GLY  49 -15.113  -7.127  -8.530
  391    H    ASN  50           H        ASN  50 -15.443  -6.375 -11.980
  392    HA   ASN  50           HA       ASN  50 -18.261  -5.690 -11.458
  393   1HB   ASN  50          1HB       ASN  50 -16.318  -4.042 -12.560
  394   2HB   ASN  50          2HB       ASN  50 -17.197  -4.644 -13.962
  395   1HD2  ASN  50          1HD2      ASN  50 -18.137  -3.728 -10.664
  396   2HD2  ASN  50          2HD2      ASN  50 -19.366  -2.612 -11.144
  397    H    GLU  51           H        GLU  51 -17.163  -8.317 -12.013
  398    HA   GLU  51           HA       GLU  51 -18.566  -8.856 -14.545
  399   1HB   GLU  51          1HB       GLU  51 -15.857  -9.194 -14.164
  400   2HB   GLU  51          2HB       GLU  51 -16.494 -10.802 -13.848
  401   1HG   GLU  51          1HG       GLU  51 -17.678 -10.687 -16.035
  402   2HG   GLU  51          2HG       GLU  51 -16.840  -9.169 -16.349
  403    H    GLU  52           H        GLU  52 -20.352  -9.962 -14.131
  404    HA   GLU  52           HA       GLU  52 -20.983 -11.199 -11.717
  405   1HB   GLU  52          1HB       GLU  52 -22.437 -10.527 -13.836
  406   2HB   GLU  52          2HB       GLU  52 -22.218 -12.227 -14.228
  407   1HG   GLU  52          1HG       GLU  52 -23.502 -12.942 -12.494
  408   2HG   GLU  52          2HG       GLU  52 -23.108 -11.552 -11.484
  409    H    GLY  53           H        GLY  53 -21.090 -13.366 -11.066
  410   1HA   GLY  53          1HA       GLY  53 -20.686 -15.681 -11.272
  411   2HA   GLY  53          2HA       GLY  53 -19.791 -15.370 -12.752
  412    H    ARG  54           H        ARG  54 -18.358 -13.140 -11.237
  413    HA   ARG  54           HA       ARG  54 -16.488 -14.891  -9.779
  414   1HB   ARG  54          1HB       ARG  54 -15.459 -14.153 -11.828
  415   2HB   ARG  54          2HB       ARG  54 -15.916 -12.484 -11.511
  416   1HG   ARG  54          1HG       ARG  54 -14.384 -12.346  -9.678
  417   2HG   ARG  54          2HG       ARG  54 -14.028 -14.071  -9.788
  418   1HD   ARG  54          1HD       ARG  54 -13.121 -13.695 -12.059
  419   2HD   ARG  54          2HD       ARG  54 -13.396 -11.966 -11.853
  420    HE   ARG  54           HE       ARG  54 -11.850 -12.814  -9.707
  421   1HH1  ARG  54          1HH1      ARG  54 -11.586 -12.588 -13.171
  422   2HH1  ARG  54          2HH1      ARG  54  -9.867 -12.372 -13.156
  423   1HH2  ARG  54          1HH2      ARG  54  -9.587 -12.530  -9.675
  424   2HH2  ARG  54          2HH2      ARG  54  -8.731 -12.341 -11.167
  425    H    THR  55           H        THR  55 -15.475 -14.057  -7.927
  426    HA   THR  55           HA       THR  55 -17.084 -12.161  -6.468
  427    HB   THR  55           HB       THR  55 -14.887 -12.664  -4.878
  428    HG1  THR  55           1HG      THR  55 -14.523 -14.920  -5.133
  429   1HG2  THR  55          1HG2      THR  55 -17.027 -14.690  -4.769
  430   2HG2  THR  55          2HG2      THR  55 -17.565 -13.011  -4.724
  431   3HG2  THR  55          3HG2      THR  55 -16.427 -13.605  -3.515
  432    HA   PRO  56           HA       PRO  56 -14.694  -8.516  -6.986
  433   1HB   PRO  56          1HB       PRO  56 -14.796  -7.410  -4.509
  434   2HB   PRO  56          2HB       PRO  56 -16.189  -7.460  -5.597
  435   1HG   PRO  56          1HG       PRO  56 -15.518  -9.253  -3.295
  436   2HG   PRO  56          2HG       PRO  56 -17.081  -8.548  -3.746
  437   1HD   PRO  56          1HD       PRO  56 -16.418 -11.110  -4.321
  438   2HD   PRO  56          2HD       PRO  56 -17.473 -10.138  -5.368
  439    H    HIS  57           H        HIS  57 -12.747  -7.374  -6.326
  440    HA   HIS  57           HA       HIS  57 -10.934  -8.875  -4.585
  441   1HB   HIS  57          1HB       HIS  57 -10.378  -9.727  -6.757
  442   2HB   HIS  57          2HB       HIS  57 -10.363  -8.108  -7.450
  443    HD1  HIS  57           1HD      HIS  57  -8.266 -10.533  -5.598
  444    HD2  HIS  57           2HD      HIS  57  -8.065  -6.562  -6.803
  445    HE1  HIS  57           1HE      HIS  57  -5.858  -9.864  -5.310
  446    H    LEU  58           H        LEU  58  -9.527  -7.627  -3.444
  447    HA   LEU  58           HA       LEU  58  -9.886  -4.735  -3.680
  448   1HB   LEU  58          1HB       LEU  58  -9.565  -6.551  -1.516
  449   2HB   LEU  58          2HB       LEU  58  -8.210  -5.425  -1.494
  450    HG   LEU  58           HG       LEU  58 -11.144  -4.748  -1.330
  451   1HD1  LEU  58          1HD1      LEU  58 -10.600  -5.313   0.809
  452   2HD1  LEU  58          2HD1      LEU  58 -10.085  -3.627   0.816
  453   3HD1  LEU  58          3HD1      LEU  58  -8.895  -4.911   0.603
  454   1HD2  LEU  58          1HD2      LEU  58 -10.285  -2.406  -1.013
  455   2HD2  LEU  58          2HD2      LEU  58 -10.156  -3.042  -2.653
  456   3HD2  LEU  58          3HD2      LEU  58  -8.729  -2.974  -1.618
  457    H    GLN  59           H        GLN  59  -8.298  -3.359  -4.252
  458    HA   GLN  59           HA       GLN  59  -5.526  -4.182  -4.254
  459   1HB   GLN  59          1HB       GLN  59  -5.964  -5.069  -6.370
  460   2HB   GLN  59          2HB       GLN  59  -7.100  -3.790  -6.777
  461   1HG   GLN  59          1HG       GLN  59  -5.032  -3.597  -8.047
  462   2HG   GLN  59          2HG       GLN  59  -5.280  -2.205  -6.994
  463   1HE2  GLN  59          1HE2      GLN  59  -3.403  -5.076  -7.563
  464   2HE2  GLN  59          2HE2      GLN  59  -2.113  -4.692  -6.480
  465    H    GLY  60           H        GLY  60  -4.618  -2.504  -3.263
  466   1HA   GLY  60          1HA       GLY  60  -5.008   0.163  -4.387
  467   2HA   GLY  60          2HA       GLY  60  -5.428  -0.050  -2.694
  468    H    PHE  61           H        PHE  61  -3.512   1.772  -3.440
  469    HA   PHE  61           HA       PHE  61  -1.043   0.495  -2.464
  470   1HB   PHE  61          1HB       PHE  61  -0.587   1.085  -4.716
  471   2HB   PHE  61          2HB       PHE  61  -1.393   2.642  -4.550
  472    HD1  PHE  61           2HD      PHE  61   1.290   0.871  -2.650
  473    HD2  PHE  61           1HD      PHE  61   0.077   4.384  -4.725
  474    HE1  PHE  61           2HE      PHE  61   3.448   1.926  -2.118
  475    HE2  PHE  61           1HE      PHE  61   2.234   5.445  -4.197
  476    HZ   PHE  61           HZ       PHE  61   3.922   4.216  -2.891
  477    H    ALA  62           H        ALA  62   0.063   1.508  -0.846
  478    HA   ALA  62           HA       ALA  62  -0.940   4.105   0.091
  479   1HB   ALA  62          1HB       ALA  62  -0.290   2.686   2.407
  480   2HB   ALA  62          2HB       ALA  62  -1.898   3.160   1.858
  481   3HB   ALA  62          3HB       ALA  62  -1.251   1.576   1.429
  482    H    ASN  63           H        ASN  63   0.650   5.508   0.438
  483    HA   ASN  63           HA       ASN  63   3.403   4.551   0.436
  484   1HB   ASN  63          1HB       ASN  63   2.719   6.422  -1.056
  485   2HB   ASN  63          2HB       ASN  63   2.364   7.392   0.370
  486   1HD2  ASN  63          1HD2      ASN  63   4.469   7.253  -1.943
  487   2HD2  ASN  63          2HD2      ASN  63   5.940   7.627  -1.119
  488    H    PHE  64           H        PHE  64   4.317   4.078   2.315
  489    HA   PHE  64           HA       PHE  64   3.310   4.986   4.816
  490   1HB   PHE  64          1HB       PHE  64   5.298   3.104   3.879
  491   2HB   PHE  64          2HB       PHE  64   5.911   4.035   5.241
  492    HD1  PHE  64           2HD      PHE  64   4.377   4.186   7.315
  493    HD2  PHE  64           1HD      PHE  64   3.952   1.264   4.249
  494    HE1  PHE  64           2HE      PHE  64   3.118   2.748   8.865
  495    HE2  PHE  64           1HE      PHE  64   2.692  -0.178   5.794
  496    HZ   PHE  64           HZ       PHE  64   2.275   0.563   8.105
  497    H    VAL  65           H        VAL  65   3.753   6.786   5.901
  498    HA   VAL  65           HA       VAL  65   5.311   8.861   4.844
  499    HB   VAL  65           HB       VAL  65   4.365   8.449   7.683
  500   1HG1  VAL  65          1HG1      VAL  65   5.878  10.091   8.068
  501   2HG1  VAL  65          2HG1      VAL  65   5.889  10.627   6.386
  502   3HG1  VAL  65          3HG1      VAL  65   4.572  11.106   7.457
  503   1HG2  VAL  65          1HG2      VAL  65   2.667   8.590   5.788
  504   2HG2  VAL  65          2HG2      VAL  65   2.471   9.724   7.125
  505   3HG2  VAL  65          3HG2      VAL  65   3.181  10.267   5.605
  506    H    LYS  66           H        LYS  66   6.174   6.136   6.757
  507    HA   LYS  66           HA       LYS  66   8.904   7.208   7.023
  508   1HB   LYS  66          1HB       LYS  66   7.210   5.775   9.034
  509   2HB   LYS  66          2HB       LYS  66   8.957   5.573   9.077
  510   1HG   LYS  66          1HG       LYS  66   8.678   7.316  10.531
  511   2HG   LYS  66          2HG       LYS  66   8.968   8.184   9.022
  512   1HD   LYS  66          1HD       LYS  66   7.117   9.267   9.947
  513   2HD   LYS  66          2HD       LYS  66   6.413   8.169   8.757
  514   1HE   LYS  66          1HE       LYS  66   5.145   7.318  10.370
  515   2HE   LYS  66          2HE       LYS  66   6.606   6.707  11.144
  516   1HZ   LYS  66          1HZ       LYS  66   4.934   8.943  11.873
  517   2HZ   LYS  66          2HZ       LYS  66   6.590   9.281  11.915
  518   3HZ   LYS  66          3HZ       LYS  66   5.965   8.004  12.831
  519    H    LYS  67           H        LYS  67  10.324   5.110   7.769
  520    HA   LYS  67           HA       LYS  67  10.128   3.333   5.476
  521   1HB   LYS  67          1HB       LYS  67  12.247   4.327   7.169
  522   2HB   LYS  67          2HB       LYS  67  12.317   2.573   7.064
  523   1HG   LYS  67          1HG       LYS  67  13.694   3.478   5.345
  524   2HG   LYS  67          2HG       LYS  67  12.260   2.782   4.585
  525   1HD   LYS  67          1HD       LYS  67  11.862   4.734   3.601
  526   2HD   LYS  67          2HD       LYS  67  11.659   5.477   5.189
  527   1HE   LYS  67          1HE       LYS  67  14.379   5.320   4.972
  528   2HE   LYS  67          2HE       LYS  67  13.895   5.630   3.305
  529   1HZ   LYS  67          1HZ       LYS  67  14.303   7.580   4.981
  530   2HZ   LYS  67          2HZ       LYS  67  12.702   7.263   5.424
  531   3HZ   LYS  67          3HZ       LYS  67  13.071   7.674   3.825
  532    H    GLN  68           H        GLN  68   9.206   1.401   5.573
  533    HA   GLN  68           HA       GLN  68   9.207  -0.051   8.126
  534   1HB   GLN  68          1HB       GLN  68   6.810   0.031   6.297
  535   2HB   GLN  68          2HB       GLN  68   6.909  -0.662   7.910
  536   1HG   GLN  68          1HG       GLN  68   7.049   2.260   7.203
  537   2HG   GLN  68          2HG       GLN  68   5.700   1.422   7.967
  538   1HE2  GLN  68          1HE2      GLN  68   7.022  -0.140   9.798
  539   2HE2  GLN  68          2HE2      GLN  68   7.778   0.870  10.979
  540    H    THR  69           H        THR  69   9.080  -2.334   7.946
  541    HA   THR  69           HA       THR  69  10.188  -3.324   5.436
  542    HB   THR  69           HB       THR  69  10.917  -5.238   6.609
  543    HG1  THR  69           1HG      THR  69  10.149  -5.646   8.782
  544   1HG2  THR  69          1HG2      THR  69  11.077  -2.891   8.504
  545   2HG2  THR  69          2HG2      THR  69  12.198  -3.253   7.192
  546   3HG2  THR  69          3HG2      THR  69  12.088  -4.333   8.582
  547    H    PHE  70           H        PHE  70   9.470  -5.607   4.809
  548    HA   PHE  70           HA       PHE  70   6.788  -5.539   4.019
  549   1HB   PHE  70          1HB       PHE  70   8.145  -6.876   2.677
  550   2HB   PHE  70          2HB       PHE  70   8.889  -7.678   4.057
  551    HD1  PHE  70           1HD      PHE  70   5.735  -7.412   2.132
  552    HD2  PHE  70           2HD      PHE  70   8.071  -9.719   4.841
  553    HE1  PHE  70           1HE      PHE  70   4.168  -9.292   1.877
  554    HE2  PHE  70           2HE      PHE  70   6.508 -11.603   4.590
  555    HZ   PHE  70           HZ       PHE  70   4.554 -11.391   3.106
  556    H    ASN  71           H        ASN  71   8.335  -7.613   6.473
  557    HA   ASN  71           HA       ASN  71   5.919  -8.751   7.397
  558   1HB   ASN  71          1HB       ASN  71   8.347  -9.573   7.731
  559   2HB   ASN  71          2HB       ASN  71   8.384  -8.465   9.099
  560   1HD2  ASN  71          1HD2      ASN  71   7.579 -11.540   8.051
  561   2HD2  ASN  71          2HD2      ASN  71   6.680 -12.058   9.433
  562    H    LYS  72           H        LYS  72   7.742  -5.899   8.332
  563    HA   LYS  72           HA       LYS  72   6.338  -5.353  10.729
  564   1HB   LYS  72          1HB       LYS  72   8.450  -4.303  10.420
  565   2HB   LYS  72          2HB       LYS  72   7.966  -3.624   8.872
  566   1HG   LYS  72          1HG       LYS  72   8.048  -1.949  10.667
  567   2HG   LYS  72          2HG       LYS  72   6.438  -2.112   9.962
  568   1HD   LYS  72          1HD       LYS  72   5.789  -3.567  11.842
  569   2HD   LYS  72          2HD       LYS  72   7.386  -3.332  12.555
  570   1HE   LYS  72          1HE       LYS  72   5.679  -0.974  11.865
  571   2HE   LYS  72          2HE       LYS  72   5.388  -1.872  13.354
  572   1HZ   LYS  72          1HZ       LYS  72   7.314   0.089  12.879
  573   2HZ   LYS  72          2HZ       LYS  72   8.138  -1.368  13.126
  574   3HZ   LYS  72          3HZ       LYS  72   7.058  -0.798  14.297
  575    H    VAL  73           H        VAL  73   5.888  -4.302   7.380
  576    HA   VAL  73           HA       VAL  73   3.800  -2.474   7.863
  577    HB   VAL  73           HB       VAL  73   4.516  -4.058   5.398
  578   1HG1  VAL  73          1HG1      VAL  73   3.060  -2.188   4.307
  579   2HG1  VAL  73          2HG1      VAL  73   2.291  -3.634   4.965
  580   3HG1  VAL  73          3HG1      VAL  73   2.287  -2.133   5.891
  581   1HG2  VAL  73          1HG2      VAL  73   5.752  -2.258   4.733
  582   2HG2  VAL  73          2HG2      VAL  73   4.752  -1.103   5.614
  583   3HG2  VAL  73          3HG2      VAL  73   5.927  -2.093   6.480
  584    H    LYS  74           H        LYS  74   3.876  -5.926   7.708
  585    HA   LYS  74           HA       LYS  74   1.176  -6.427   7.070
  586   1HB   LYS  74          1HB       LYS  74   3.253  -8.022   8.562
  587   2HB   LYS  74          2HB       LYS  74   1.625  -8.631   8.290
  588   1HG   LYS  74          1HG       LYS  74   2.833  -7.646   5.849
  589   2HG   LYS  74          2HG       LYS  74   3.798  -8.915   6.608
  590   1HD   LYS  74          1HD       LYS  74   1.428 -10.070   6.844
  591   2HD   LYS  74          2HD       LYS  74   1.052  -9.031   5.467
  592   1HE   LYS  74          1HE       LYS  74   1.814 -11.219   4.719
  593   2HE   LYS  74          2HE       LYS  74   2.957  -9.963   4.247
  594   1HZ   LYS  74          1HZ       LYS  74   3.340 -11.501   6.736
  595   2HZ   LYS  74          2HZ       LYS  74   4.487 -10.651   5.828
  596   3HZ   LYS  74          3HZ       LYS  74   3.866 -12.115   5.250
  597    H    TRP  75           H        TRP  75   2.556  -5.017   9.797
  598    HA   TRP  75           HA       TRP  75   0.808  -5.974  11.816
  599   1HB   TRP  75          1HB       TRP  75   1.744  -4.324  13.211
  600   2HB   TRP  75          2HB       TRP  75   3.044  -4.745  12.099
  601    HD1  TRP  75           HD       TRP  75   2.124  -2.928   9.631
  602    HE1  TRP  75           1HE      TRP  75   2.389  -0.373   9.792
  603    HE3  TRP  75           3HE      TRP  75   2.341  -2.453  14.717
  604    HZ2  TRP  75           2HZ      TRP  75   2.657   1.585  11.808
  605    HZ3  TRP  75           3HZ      TRP  75   2.604  -0.204  15.681
  606    HH2  TRP  75           HH       TRP  75   2.758   1.771  14.255
  607    H    TYR  76           H        TYR  76   0.414  -3.745   9.249
  608    HA   TYR  76           HA       TYR  76  -2.064  -2.719  10.470
  609   1HB   TYR  76          1HB       TYR  76   0.042  -1.439   8.889
  610   2HB   TYR  76          2HB       TYR  76  -1.579  -1.099   8.295
  611    HD1  TYR  76           2HD      TYR  76  -3.082  -1.076  10.868
  612    HD2  TYR  76           1HD      TYR  76   0.692   0.599   9.842
  613    HE1  TYR  76           2HE      TYR  76  -3.369   0.627  12.618
  614    HE2  TYR  76           1HE      TYR  76   0.416   2.307  11.590
  615    HH   TYR  76           HH       TYR  76  -2.587   2.673  13.342
  616    H    LEU  77           H        LEU  77  -0.647  -3.671   7.346
  617    HA   LEU  77           HA       LEU  77  -3.170  -3.868   6.033
  618   1HB   LEU  77          1HB       LEU  77  -0.430  -4.895   5.321
  619   2HB   LEU  77          2HB       LEU  77  -1.836  -5.060   4.271
  620    HG   LEU  77           HG       LEU  77  -0.761  -2.402   5.197
  621   1HD1  LEU  77          1HD1      LEU  77   0.584  -2.241   3.351
  622   2HD1  LEU  77          2HD1      LEU  77  -0.330  -3.443   2.441
  623   3HD1  LEU  77          3HD1      LEU  77   0.760  -3.955   3.730
  624   1HD2  LEU  77          1HD2      LEU  77  -3.067  -2.324   4.506
  625   2HD2  LEU  77          2HD2      LEU  77  -2.695  -3.216   3.031
  626   3HD2  LEU  77          3HD2      LEU  77  -2.064  -1.584   3.258
  627    H    GLY  78           H        GLY  78  -1.599  -5.840   8.261
  628   1HA   GLY  78          1HA       GLY  78  -2.155  -7.896   9.127
  629   2HA   GLY  78          2HA       GLY  78  -3.614  -7.835   8.148
  630    H    ALA  79           H        ALA  79  -2.022 -10.153   8.662
  631    HA   ALA  79           HA       ALA  79  -0.400 -10.712   6.369
  632   1HB   ALA  79          1HB       ALA  79  -0.144 -12.901   7.274
  633   2HB   ALA  79          2HB       ALA  79  -0.101 -11.764   8.622
  634   3HB   ALA  79          3HB       ALA  79  -1.559 -12.703   8.308
  635    H    ARG  80           H        ARG  80  -3.757 -11.079   7.193
  636    HA   ARG  80           HA       ARG  80  -4.572 -13.081   5.469
  637   1HB   ARG  80          1HB       ARG  80  -6.060 -10.535   6.137
  638   2HB   ARG  80          2HB       ARG  80  -6.778 -12.004   5.490
  639   1HG   ARG  80          1HG       ARG  80  -5.304 -12.657   7.841
  640   2HG   ARG  80          2HG       ARG  80  -6.376 -11.298   8.185
  641   1HD   ARG  80          1HD       ARG  80  -7.598 -13.286   8.639
  642   2HD   ARG  80          2HD       ARG  80  -8.231 -12.618   7.135
  643    HE   ARG  80           HE       ARG  80  -6.271 -14.423   6.412
  644   1HH1  ARG  80          1HH1      ARG  80  -9.293 -14.496   8.139
  645   2HH1  ARG  80          2HH1      ARG  80  -9.662 -16.127   7.687
  646   1HH2  ARG  80          1HH2      ARG  80  -6.745 -16.571   5.810
  647   2HH2  ARG  80          2HH2      ARG  80  -8.211 -17.307   6.363
  648    H    CYS  81           H        CYS  81  -4.035  -9.650   4.793
  649    HA   CYS  81           HA       CYS  81  -4.670 -10.066   1.975
  650   1HB   CYS  81          1HB       CYS  81  -3.811  -7.489   3.294
  651   2HB   CYS  81          2HB       CYS  81  -4.639  -7.686   1.754
  652    HG   CYS  81           HG       CYS  81  -6.271  -6.592   3.895
  653    H    HIS  82           H        HIS  82  -3.182 -10.292   0.430
  654    HA   HIS  82           HA       HIS  82  -0.425 -10.555   1.129
  655   1HB   HIS  82          1HB       HIS  82  -1.746 -11.830  -0.687
  656   2HB   HIS  82          2HB       HIS  82  -1.465 -10.411  -1.692
  657    HD1  HIS  82           1HD      HIS  82   0.720 -12.668   0.473
  658    HD2  HIS  82           2HD      HIS  82   0.732 -10.747  -3.211
  659    HE1  HIS  82           1HE      HIS  82   2.906 -13.291  -0.603
  660    H    ILE  83           H        ILE  83   1.122  -9.063   1.105
  661    HA   ILE  83           HA       ILE  83   0.562  -6.503  -0.241
  662    HB   ILE  83           HB       ILE  83   2.050  -5.430   1.352
  663   1HG1  ILE  83          1HG1      ILE  83   2.285  -8.134   2.687
  664   2HG1  ILE  83          2HG1      ILE  83   3.541  -7.404   1.693
  665   1HG2  ILE  83          1HG2      ILE  83  -0.157  -7.113   2.494
  666   2HG2  ILE  83          2HG2      ILE  83   0.719  -5.933   3.467
  667   3HG2  ILE  83          3HG2      ILE  83  -0.189  -5.407   2.050
  668   1HD1  ILE  83          1HD1      ILE  83   2.474  -6.375   4.308
  669   2HD1  ILE  83          2HD1      ILE  83   4.071  -7.053   3.993
  670   3HD1  ILE  83          3HD1      ILE  83   3.615  -5.505   3.283
  671    H    GLU  84           H        GLU  84   2.235  -5.464  -1.373
  672    HA   GLU  84           HA       GLU  84   4.747  -6.874  -1.759
  673   1HB   GLU  84          1HB       GLU  84   2.562  -6.927  -3.690
  674   2HB   GLU  84          2HB       GLU  84   4.049  -6.288  -4.375
  675   1HG   GLU  84          1HG       GLU  84   5.207  -8.333  -3.469
  676   2HG   GLU  84          2HG       GLU  84   3.604  -8.977  -3.116
  677    H    LYS  85           H        LYS  85   6.258  -5.610  -3.145
  678    HA   LYS  85           HA       LYS  85   6.168  -2.842  -2.370
  679   1HB   LYS  85          1HB       LYS  85   8.381  -2.706  -3.447
  680   2HB   LYS  85          2HB       LYS  85   8.283  -4.043  -2.308
  681   1HG   LYS  85          1HG       LYS  85   7.893  -5.578  -4.206
  682   2HG   LYS  85          2HG       LYS  85   8.119  -4.219  -5.310
  683   1HD   LYS  85          1HD       LYS  85  10.337  -4.390  -5.173
  684   2HD   LYS  85          2HD       LYS  85  10.286  -4.384  -3.409
  685   1HE   LYS  85          1HE       LYS  85   9.760  -6.802  -5.132
  686   2HE   LYS  85          2HE       LYS  85  11.310  -6.431  -4.379
  687   1HZ   LYS  85          1HZ       LYS  85   9.791  -6.311  -2.250
  688   2HZ   LYS  85          2HZ       LYS  85  10.427  -7.779  -2.801
  689   3HZ   LYS  85          3HZ       LYS  85   8.825  -7.364  -3.155
  690    H    ALA  86           H        ALA  86   5.632  -1.119  -3.573
  691    HA   ALA  86           HA       ALA  86   4.469  -1.579  -6.184
  692   1HB   ALA  86          1HB       ALA  86   3.115   0.012  -5.429
  693   2HB   ALA  86          2HB       ALA  86   4.210   0.394  -4.099
  694   3HB   ALA  86          3HB       ALA  86   4.430   1.161  -5.672
  695    H    LYS  87           H        LYS  87   5.030  -0.347  -8.069
  696    HA   LYS  87           HA       LYS  87   7.749   0.762  -8.068
  697   1HB   LYS  87          1HB       LYS  87   8.384  -0.447 -10.011
  698   2HB   LYS  87          2HB       LYS  87   7.704  -1.626  -8.897
  699   1HG   LYS  87          1HG       LYS  87   5.523  -0.841 -10.375
  700   2HG   LYS  87          2HG       LYS  87   6.833  -0.852 -11.558
  701   1HD   LYS  87          1HD       LYS  87   7.172  -3.108 -11.364
  702   2HD   LYS  87          2HD       LYS  87   6.605  -3.159  -9.693
  703   1HE   LYS  87          1HE       LYS  87   4.355  -3.136 -10.338
  704   2HE   LYS  87          2HE       LYS  87   4.734  -2.566 -11.963
  705   1HZ   LYS  87          1HZ       LYS  87   4.143  -5.050 -11.539
  706   2HZ   LYS  87          2HZ       LYS  87   5.771  -5.171 -11.094
  707   3HZ   LYS  87          3HZ       LYS  87   5.356  -4.643 -12.646
  708    H    GLY  88           H        GLY  88   8.099   2.462  -9.465
  709   1HA   GLY  88          1HA       GLY  88   7.466   3.732 -11.437
  710   2HA   GLY  88          2HA       GLY  88   5.793   3.314 -11.098
  711    H    THR  89           H        THR  89   5.222   5.526 -11.176
  712    HA   THR  89           HA       THR  89   6.184   7.123  -8.894
  713    HB   THR  89           HB       THR  89   5.686   9.112 -10.093
  714    HG1  THR  89           1HG      THR  89   4.382   7.396 -11.955
  715   1HG2  THR  89          1HG2      THR  89   7.231   9.021 -11.836
  716   2HG2  THR  89          2HG2      THR  89   6.777   7.376 -12.282
  717   3HG2  THR  89          3HG2      THR  89   7.708   7.667 -10.813
  718    H    ASP  90           H        ASP  90   4.454   8.828  -8.239
  719    HA   ASP  90           HA       ASP  90   2.321   7.503  -7.041
  720   1HB   ASP  90          1HB       ASP  90   3.139   9.640  -6.212
  721   2HB   ASP  90          2HB       ASP  90   2.613  10.444  -7.688
  722    H    GLN  91           H        GLN  91   2.457   9.308 -10.074
  723    HA   GLN  91           HA       GLN  91  -0.305   9.263 -10.631
  724   1HB   GLN  91          1HB       GLN  91   1.688  10.575 -11.748
  725   2HB   GLN  91          2HB       GLN  91   1.714   9.192 -12.834
  726   1HG   GLN  91          1HG       GLN  91   0.362  10.754 -13.905
  727   2HG   GLN  91          2HG       GLN  91  -0.771   9.620 -13.173
  728   1HE2  GLN  91          1HE2      GLN  91  -2.160  10.316 -11.627
  729   2HE2  GLN  91          2HE2      GLN  91  -2.297  11.963 -11.126
  730    H    GLN  92           H        GLN  92   2.288   6.979 -11.268
  731    HA   GLN  92           HA       GLN  92   0.845   5.301 -13.032
  732   1HB   GLN  92          1HB       GLN  92   3.359   5.101 -11.464
  733   2HB   GLN  92          2HB       GLN  92   2.627   3.591 -11.991
  734   1HG   GLN  92          1HG       GLN  92   2.539   5.074 -14.272
  735   2HG   GLN  92          2HG       GLN  92   4.032   5.640 -13.527
  736   1HE2  GLN  92          1HE2      GLN  92   5.792   4.362 -13.551
  737   2HE2  GLN  92          2HE2      GLN  92   5.843   2.782 -14.246
  738    H    ASN  93           H        ASN  93   1.295   5.297  -9.526
  739    HA   ASN  93           HA       ASN  93  -0.161   2.862  -9.127
  740   1HB   ASN  93          1HB       ASN  93   0.862   5.010  -7.279
  741   2HB   ASN  93          2HB       ASN  93  -0.131   3.681  -6.687
  742   1HD2  ASN  93          1HD2      ASN  93   2.515   3.910  -9.040
  743   2HD2  ASN  93          2HD2      ASN  93   3.498   2.694  -8.306
  744    H    LYS  94           H        LYS  94  -0.895   6.308  -8.891
  745    HA   LYS  94           HA       LYS  94  -3.460   6.081  -7.771
  746   1HB   LYS  94          1HB       LYS  94  -2.129   8.190  -7.960
  747   2HB   LYS  94          2HB       LYS  94  -2.494   8.215  -9.681
  748   1HG   LYS  94          1HG       LYS  94  -4.589   8.958  -9.361
  749   2HG   LYS  94          2HG       LYS  94  -4.828   7.980  -7.911
  750   1HD   LYS  94          1HD       LYS  94  -4.746   9.992  -6.883
  751   2HD   LYS  94          2HD       LYS  94  -3.003   9.734  -6.994
  752   1HE   LYS  94          1HE       LYS  94  -2.946  11.709  -8.039
  753   2HE   LYS  94          2HE       LYS  94  -3.602  10.846  -9.429
  754   1HZ   LYS  94          1HZ       LYS  94  -4.798  12.940  -8.651
  755   2HZ   LYS  94          2HZ       LYS  94  -5.377  12.000  -7.370
  756   3HZ   LYS  94          3HZ       LYS  94  -5.745  11.574  -8.965
  757    H    GLU  95           H        GLU  95  -2.412   6.247 -11.161
  758    HA   GLU  95           HA       GLU  95  -5.046   6.063 -12.226
  759   1HB   GLU  95          1HB       GLU  95  -2.310   5.671 -13.428
  760   2HB   GLU  95          2HB       GLU  95  -3.785   5.473 -14.365
  761   1HG   GLU  95          1HG       GLU  95  -4.343   7.855 -13.487
  762   2HG   GLU  95          2HG       GLU  95  -2.608   7.947 -13.190
  763    H    TYR  96           H        TYR  96  -2.539   3.733 -11.435
  764    HA   TYR  96           HA       TYR  96  -3.621   1.495 -12.734
  765   1HB   TYR  96          1HB       TYR  96  -1.332   1.569 -11.817
  766   2HB   TYR  96          2HB       TYR  96  -1.992   1.576 -10.185
  767    HD1  TYR  96           2HD      TYR  96  -1.769  -0.455 -13.284
  768    HD2  TYR  96           1HD      TYR  96  -2.528  -0.438  -9.098
  769    HE1  TYR  96           2HE      TYR  96  -1.764  -2.915 -13.279
  770    HE2  TYR  96           1HE      TYR  96  -2.523  -2.898  -9.081
  771    HH   TYR  96           HH       TYR  96  -1.440  -4.751 -11.747
  772    H    CYS  97           H        CYS  97  -4.106   2.734  -9.448
  773    HA   CYS  97           HA       CYS  97  -5.816   0.647  -8.598
  774   1HB   CYS  97          1HB       CYS  97  -5.450   3.476  -7.601
  775   2HB   CYS  97          2HB       CYS  97  -6.480   2.293  -6.804
  776    HG   CYS  97           HG       CYS  97  -4.241   0.488  -6.471
  777    H    SER  98           H        SER  98  -6.369   3.703 -10.229
  778    HA   SER  98           HA       SER  98  -9.240   3.527  -9.990
  779   1HB   SER  98          1HB       SER  98  -7.916   5.695 -10.110
  780   2HB   SER  98          2HB       SER  98  -7.685   5.355 -11.825
  781    HG   SER  98           HG       SER  98  -9.545   6.712 -11.233
  782    H    LYS  99           H        LYS  99  -6.875   2.231 -12.040
  783    HA   LYS  99           HA       LYS  99  -8.163   2.162 -14.517
  784   1HB   LYS  99          1HB       LYS  99  -5.817   1.523 -14.210
  785   2HB   LYS  99          2HB       LYS  99  -6.312   0.109 -13.288
  786   1HG   LYS  99          1HG       LYS  99  -7.515  -0.698 -15.321
  787   2HG   LYS  99          2HG       LYS  99  -6.786   0.641 -16.211
  788   1HD   LYS  99          1HD       LYS  99  -5.468  -1.352 -16.550
  789   2HD   LYS  99          2HD       LYS  99  -4.549  -0.208 -15.569
  790   1HE   LYS  99          1HE       LYS  99  -4.379  -1.684 -13.916
  791   2HE   LYS  99          2HE       LYS  99  -6.127  -1.910 -13.880
  792   1HZ   LYS  99          1HZ       LYS  99  -5.913  -3.528 -15.666
  793   2HZ   LYS  99          2HZ       LYS  99  -4.989  -3.986 -14.326
  794   3HZ   LYS  99          3HZ       LYS  99  -4.234  -3.318 -15.685
  795    H    GLU 100           H        GLU 100  -8.832   0.471 -11.596
  796    HA   GLU 100           HA       GLU 100 -10.227  -1.736 -12.750
  797   1HB   GLU 100          1HB       GLU 100 -10.469  -0.587  -9.965
  798   2HB   GLU 100          2HB       GLU 100 -11.011  -2.177 -10.484
  799   1HG   GLU 100          1HG       GLU 100  -8.875  -3.018 -10.609
  800   2HG   GLU 100          2HG       GLU 100  -8.146  -1.426 -10.812
  801    H    GLY 101           H        GLY 101 -10.985   1.546 -12.301
  802   1HA   GLY 101          1HA       GLY 101 -12.875   2.673 -13.050
  803   2HA   GLY 101          2HA       GLY 101 -13.651   1.122 -13.336
  804    H    ASN 102           H        ASN 102 -12.497   0.872 -10.307
  805    HA   ASN 102           HA       ASN 102 -14.818   2.171  -9.058
  806   1HB   ASN 102          1HB       ASN 102 -14.304  -0.675  -9.280
  807   2HB   ASN 102          2HB       ASN 102 -14.398  -0.176  -7.593
  808   1HD2  ASN 102          1HD2      ASN 102 -16.326   0.478  -6.750
  809   2HD2  ASN 102          2HD2      ASN 102 -17.824   0.366  -7.603
  810    H    LEU 103           H        LEU 103 -14.245   3.410  -7.403
  811    HA   LEU 103           HA       LEU 103 -11.592   3.024  -6.211
  812   1HB   LEU 103          1HB       LEU 103 -13.090   5.310  -7.021
  813   2HB   LEU 103          2HB       LEU 103 -12.808   5.408  -5.285
  814    HG   LEU 103           HG       LEU 103 -11.117   6.584  -6.707
  815   1HD1  LEU 103          1HD1      LEU 103  -9.240   4.923  -5.510
  816   2HD1  LEU 103          2HD1      LEU 103 -10.685   4.755  -4.515
  817   3HD1  LEU 103          3HD1      LEU 103  -9.996   6.352  -4.804
  818   1HD2  LEU 103          1HD2      LEU 103  -9.995   5.558  -8.335
  819   2HD2  LEU 103          2HD2      LEU 103 -11.168   4.249  -8.184
  820   3HD2  LEU 103          3HD2      LEU 103  -9.634   4.165  -7.316
  821    H    LEU 104           H        LEU 104 -11.368   2.350  -4.176
  822    HA   LEU 104           HA       LEU 104 -13.776   1.922  -2.583
  823   1HB   LEU 104          1HB       LEU 104 -11.837   0.220  -3.064
  824   2HB   LEU 104          2HB       LEU 104 -11.056   1.053  -1.721
  825    HG   LEU 104           HG       LEU 104 -12.177  -0.999  -1.001
  826   1HD1  LEU 104          1HD1      LEU 104 -12.799  -0.098   0.962
  827   2HD1  LEU 104          2HD1      LEU 104 -13.928   1.029   0.210
  828   3HD1  LEU 104          3HD1      LEU 104 -12.204   1.399   0.244
  829   1HD2  LEU 104          1HD2      LEU 104 -14.213  -0.111  -2.742
  830   2HD2  LEU 104          2HD2      LEU 104 -14.895  -0.134  -1.116
  831   3HD2  LEU 104          3HD2      LEU 104 -14.163  -1.593  -1.787
  832    H    MET 105           H        MET 105 -10.711   3.646  -2.489
  833    HA   MET 105           HA       MET 105 -11.773   5.444  -0.489
  834   1HB   MET 105          1HB       MET 105 -10.902   4.030   1.121
  835   2HB   MET 105          2HB       MET 105  -9.578   3.501   0.092
  836   1HG   MET 105          1HG       MET 105  -8.242   5.229   0.678
  837   2HG   MET 105          2HG       MET 105  -9.590   6.343   0.895
  838   1HE   MET 105          1HE       MET 105  -8.011   3.005   2.794
  839   2HE   MET 105          2HE       MET 105  -6.973   4.335   2.282
  840   3HE   MET 105          3HE       MET 105  -7.308   4.087   3.996
  841    H    GLU 106           H        GLU 106 -10.953   7.463  -0.687
  842    HA   GLU 106           HA       GLU 106  -8.557   7.816  -2.357
  843   1HB   GLU 106          1HB       GLU 106 -11.032   8.327  -3.319
  844   2HB   GLU 106          2HB       GLU 106 -10.665   9.881  -2.582
  845   1HG   GLU 106          1HG       GLU 106  -8.442   9.710  -3.885
  846   2HG   GLU 106          2HG       GLU 106  -9.287   8.493  -4.840
  847    H    CYS 107           H        CYS 107  -7.103   8.556  -0.938
  848    HA   CYS 107           HA       CYS 107  -7.609  11.092   0.363
  849   1HB   CYS 107          1HB       CYS 107  -7.320   8.526   1.858
  850   2HB   CYS 107          2HB       CYS 107  -6.560   9.965   2.527
  851    HG   CYS 107           HG       CYS 107  -8.886  11.406   2.821
  852    H    GLY 108           H        GLY 108  -5.514  11.647   1.737
  853   1HA   GLY 108          1HA       GLY 108  -3.188  11.776   1.848
  854   2HA   GLY 108          2HA       GLY 108  -3.085  10.543   0.601
  855    H    ALA 109           H        ALA 109  -1.328  12.388   0.217
  856    HA   ALA 109           HA       ALA 109  -2.496  14.337  -1.659
  857   1HB   ALA 109          1HB       ALA 109   0.212  14.972  -1.090
  858   2HB   ALA 109          2HB       ALA 109  -1.243  15.877  -0.673
  859   3HB   ALA 109          3HB       ALA 109  -0.614  14.661   0.437
  860    HA   PRO 110           HA       PRO 110  -0.445  12.511  -5.081
  861   1HB   PRO 110          1HB       PRO 110   0.324  14.683  -6.517
  862   2HB   PRO 110          2HB       PRO 110  -1.361  14.165  -6.386
  863   1HG   PRO 110          1HG       PRO 110   0.080  16.323  -4.892
  864   2HG   PRO 110          2HG       PRO 110  -1.545  16.347  -5.603
  865   1HD   PRO 110          1HD       PRO 110  -1.117  15.952  -2.959
  866   2HD   PRO 110          2HD       PRO 110  -2.475  15.209  -3.828
  867    H    ARG 111           H        ARG 111   1.390  11.473  -4.425
  868    HA   ARG 111           HA       ARG 111   3.726  12.815  -3.509
  869   1HB   ARG 111          1HB       ARG 111   3.048   9.997  -4.253
  870   2HB   ARG 111          2HB       ARG 111   4.736  10.448  -4.055
  871   1HG   ARG 111          1HG       ARG 111   2.838  11.198  -1.901
  872   2HG   ARG 111          2HG       ARG 111   3.296   9.500  -2.057
  873   1HD   ARG 111          1HD       ARG 111   4.746  10.734  -0.493
  874   2HD   ARG 111          2HD       ARG 111   5.635  10.076  -1.866
  875    HE   ARG 111           HE       ARG 111   6.106  12.216  -2.554
  876   1HH1  ARG 111          1HH1      ARG 111   3.653  12.296  -0.086
  877   2HH1  ARG 111          2HH1      ARG 111   3.715  14.017   0.104
  878   1HH2  ARG 111          1HH2      ARG 111   6.198  14.483  -2.314
  879   2HH2  ARG 111          2HH2      ARG 111   5.162  15.260  -1.164
  880    H    SER 112           H        SER 112   5.793  12.894  -4.542
  881    HA   SER 112           HA       SER 112   6.092  12.311  -7.322
  882   1HB   SER 112          1HB       SER 112   4.755  14.632  -6.944
  883   2HB   SER 112          2HB       SER 112   6.415  15.225  -6.887
  884    HG   SER 112           HG       SER 112   6.059  15.235  -8.995
  885    H    GLN 113           H        GLN 113   8.232  12.576  -8.053
  886    HA   GLN 113           HA       GLN 113  10.187  13.504  -6.076
  887   1HB   GLN 113          1HB       GLN 113  10.412  10.880  -7.558
  888   2HB   GLN 113          2HB       GLN 113  11.584  11.540  -6.425
  889   1HG   GLN 113          1HG       GLN 113   9.853  11.412  -4.650
  890   2HG   GLN 113          2HG       GLN 113   8.793  10.605  -5.804
  891   1HE2  GLN 113          1HE2      GLN 113  11.157  10.199  -3.469
  892   2HE2  GLN 113          2HE2      GLN 113  11.535   8.540  -3.767
  893    H    GLY 114           H        GLY 114  12.341  13.876  -7.002
  894   1HA   GLY 114          1HA       GLY 114  13.251  13.754  -9.516
  895   2HA   GLY 114          2HA       GLY 114  12.084  15.063  -9.643
  896    H    GLN 115           H        GLN 115  15.036  14.017  -8.021
  897    HA   GLN 115           HA       GLN 115  15.550  16.563  -6.824
  898   1HB   GLN 115          1HB       GLN 115  17.003  13.980  -7.080
  899   2HB   GLN 115          2HB       GLN 115  17.958  15.416  -6.736
  900   1HG   GLN 115          1HG       GLN 115  15.623  14.441  -5.107
  901   2HG   GLN 115          2HG       GLN 115  17.324  14.214  -4.705
  902   1HE2  GLN 115          1HE2      GLN 115  18.510  15.925  -3.925
  903   2HE2  GLN 115          2HE2      GLN 115  17.790  17.411  -3.417
  904    H    ARG 116           H        ARG 116  17.643  14.837  -9.123
  905    HA   ARG 116           HA       ARG 116  18.332  17.426 -10.319
  906   1HB   ARG 116          1HB       ARG 116  19.940  15.374  -9.452
  907   2HB   ARG 116          2HB       ARG 116  19.859  15.076 -11.183
  908   1HG   ARG 116          1HG       ARG 116  20.788  17.181 -11.691
  909   2HG   ARG 116          2HG       ARG 116  20.558  17.763 -10.041
  910   1HD   ARG 116          1HD       ARG 116  22.772  17.252  -9.931
  911   2HD   ARG 116          2HD       ARG 116  22.105  15.679  -9.496
  912    HE   ARG 116           HE       ARG 116  22.920  14.831 -11.460
  913   1HH1  ARG 116          1HH1      ARG 116  22.931  18.309 -11.626
  914   2HH1  ARG 116          2HH1      ARG 116  23.806  18.364 -13.121
  915   1HH2  ARG 116          1HH2      ARG 116  24.072  14.892 -13.428
  916   2HH2  ARG 116          2HH2      ARG 116  24.453  16.420 -14.145
  Start of MODEL   24
    1    HA   PRO   2           HA       PRO   2  27.208   0.252  22.261
    2   1HB   PRO   2          1HB       PRO   2  25.805   2.475  21.582
    3   2HB   PRO   2          2HB       PRO   2  26.314   2.129  23.239
    4   1HG   PRO   2          1HG       PRO   2  27.567   3.942  21.213
    5   2HG   PRO   2          2HG       PRO   2  27.292   4.218  22.943
    6   1HD   PRO   2          1HD       PRO   2  29.703   3.488  21.949
    7   2HD   PRO   2          2HD       PRO   2  29.146   2.995  23.561
    8    H    SER   3           H        SER   3  28.057  -0.893  20.344
    9    HA   SER   3           HA       SER   3  27.816   0.315  17.757
   10   1HB   SER   3          1HB       SER   3  28.159  -2.067  16.957
   11   2HB   SER   3          2HB       SER   3  29.440  -1.422  17.983
   12    HG   SER   3           HG       SER   3  27.468  -3.334  18.583
   13    H    LYS   4           H        LYS   4  26.223   0.073  16.239
   14    HA   LYS   4           HA       LYS   4  23.631  -0.794  17.259
   15   1HB   LYS   4          1HB       LYS   4  24.570   1.045  15.141
   16   2HB   LYS   4          2HB       LYS   4  23.087   0.168  14.788
   17   1HG   LYS   4          1HG       LYS   4  22.544   1.020  17.281
   18   2HG   LYS   4          2HG       LYS   4  23.602   2.320  16.728
   19   1HD   LYS   4          1HD       LYS   4  22.158   2.956  15.041
   20   2HD   LYS   4          2HD       LYS   4  21.384   1.371  14.965
   21   1HE   LYS   4          1HE       LYS   4  21.133   3.133  17.382
   22   2HE   LYS   4          2HE       LYS   4  20.061   3.314  15.994
   23   1HZ   LYS   4          1HZ       LYS   4  19.401   1.001  16.255
   24   2HZ   LYS   4          2HZ       LYS   4  19.088   1.879  17.666
   25   3HZ   LYS   4          3HZ       LYS   4  20.420   0.838  17.595
   26    H    LYS   5           H        LYS   5  23.161  -2.874  16.989
   27    HA   LYS   5           HA       LYS   5  24.345  -4.515  14.990
   28   1HB   LYS   5          1HB       LYS   5  23.115  -5.012  17.356
   29   2HB   LYS   5          2HB       LYS   5  21.829  -5.436  16.234
   30   1HG   LYS   5          1HG       LYS   5  24.469  -6.531  15.563
   31   2HG   LYS   5          2HG       LYS   5  23.763  -7.131  17.066
   32   1HD   LYS   5          1HD       LYS   5  22.024  -8.160  15.998
   33   2HD   LYS   5          2HD       LYS   5  22.016  -7.003  14.665
   34   1HE   LYS   5          1HE       LYS   5  24.497  -8.392  14.632
   35   2HE   LYS   5          2HE       LYS   5  23.202  -9.580  14.769
   36   1HZ   LYS   5          1HZ       LYS   5  23.840  -7.772  12.577
   37   2HZ   LYS   5          2HZ       LYS   5  22.197  -8.029  12.883
   38   3HZ   LYS   5          3HZ       LYS   5  23.207  -9.341  12.538
   39    H    ASN   6           H        ASN   6  23.513  -5.317  13.094
   40    HA   ASN   6           HA       ASN   6  20.835  -4.965  12.249
   41   1HB   ASN   6          1HB       ASN   6  22.207  -2.621  12.064
   42   2HB   ASN   6          2HB       ASN   6  22.525  -3.317  10.478
   43   1HD2  ASN   6          1HD2      ASN   6  19.979  -2.396  12.718
   44   2HD2  ASN   6          2HD2      ASN   6  18.765  -2.134  11.518
   45    H    GLY   7           H        GLY   7  20.416  -6.438  10.720
   46   1HA   GLY   7          1HA       GLY   7  22.697  -7.821   9.508
   47   2HA   GLY   7          2HA       GLY   7  21.049  -8.427   9.601
   48    H    ARG   8           H        ARG   8  23.122  -7.873   7.376
   49    HA   ARG   8           HA       ARG   8  21.733  -5.990   5.683
   50   1HB   ARG   8          1HB       ARG   8  24.303  -6.591   5.799
   51   2HB   ARG   8          2HB       ARG   8  23.840  -7.834   4.644
   52   1HG   ARG   8          1HG       ARG   8  23.653  -6.368   2.976
   53   2HG   ARG   8          2HG       ARG   8  22.782  -5.205   3.977
   54   1HD   ARG   8          1HD       ARG   8  25.637  -5.525   4.610
   55   2HD   ARG   8          2HD       ARG   8  25.291  -4.833   3.025
   56    HE   ARG   8           HE       ARG   8  24.964  -3.563   5.558
   57   1HH1  ARG   8          1HH1      ARG   8  23.687  -3.736   2.324
   58   2HH1  ARG   8          2HH1      ARG   8  23.047  -2.126   2.351
   59   1HH2  ARG   8          1HH2      ARG   8  24.126  -1.442   5.605
   60   2HH2  ARG   8          2HH2      ARG   8  23.298  -0.822   4.217
   61    H    SER   9           H        SER   9  20.667  -6.472   3.747
   62    HA   SER   9           HA       SER   9  20.145  -9.256   3.087
   63   1HB   SER   9          1HB       SER   9  17.813  -7.401   3.574
   64   2HB   SER   9          2HB       SER   9  17.777  -9.143   3.299
   65    HG   SER   9           HG       SER   9  18.372  -7.713   5.607
   66    H    GLY  10           H        GLY  10  18.752  -9.410   1.080
   67   1HA   GLY  10          1HA       GLY  10  19.902  -7.860  -0.973
   68   2HA   GLY  10          2HA       GLY  10  18.521  -8.932  -1.153
   69    HA   PRO  11           HA       PRO  11  15.765  -5.559  -1.600
   70   1HB   PRO  11          1HB       PRO  11  13.643  -6.224  -0.042
   71   2HB   PRO  11          2HB       PRO  11  14.018  -7.051  -1.559
   72   1HG   PRO  11          1HG       PRO  11  14.623  -7.884   1.252
   73   2HG   PRO  11          2HG       PRO  11  14.020  -8.861  -0.099
   74   1HD   PRO  11          1HD       PRO  11  16.619  -8.871   0.660
   75   2HD   PRO  11          2HD       PRO  11  16.116  -9.098  -1.028
   76    H    GLN  12           H        GLN  12  15.230  -3.581  -0.752
   77    HA   GLN  12           HA       GLN  12  15.843  -3.160   2.100
   78   1HB   GLN  12          1HB       GLN  12  16.824  -1.798  -0.300
   79   2HB   GLN  12          2HB       GLN  12  16.203  -0.697   0.923
   80   1HG   GLN  12          1HG       GLN  12  17.819  -1.255   2.449
   81   2HG   GLN  12          2HG       GLN  12  18.089  -2.848   1.742
   82   1HE2  GLN  12          1HE2      GLN  12  20.261  -2.699   1.481
   83   2HE2  GLN  12          2HE2      GLN  12  21.028  -1.583   0.409
   84    HA   PRO  13           HA       PRO  13  11.907  -1.313   2.668
   85   1HB   PRO  13          1HB       PRO  13  12.460   0.749   4.344
   86   2HB   PRO  13          2HB       PRO  13  12.500  -0.942   4.856
   87   1HG   PRO  13          1HG       PRO  13  14.763   0.854   4.075
   88   2HG   PRO  13          2HG       PRO  13  14.661  -0.297   5.420
   89   1HD   PRO  13          1HD       PRO  13  15.956  -0.865   3.111
   90   2HD   PRO  13          2HD       PRO  13  15.127  -2.107   4.072
   91    H    HIS  14           H        HIS  14  10.563   0.264   1.871
   92    HA   HIS  14           HA       HIS  14  11.787   2.629   0.638
   93   1HB   HIS  14          1HB       HIS  14   9.836   0.756  -0.717
   94   2HB   HIS  14          2HB       HIS  14  10.318   2.326  -1.352
   95    HD1  HIS  14           1HD      HIS  14  11.421  -1.191  -1.068
   96    HD2  HIS  14           2HD      HIS  14  13.012   2.451  -2.278
   97    HE1  HIS  14           1HE      HIS  14  13.524  -1.761  -2.324
   98    H    LYS  15           H        LYS  15   9.852   4.057  -0.261
   99    HA   LYS  15           HA       LYS  15   8.012   4.372   2.004
  100   1HB   LYS  15          1HB       LYS  15   7.685   6.685   1.051
  101   2HB   LYS  15          2HB       LYS  15   9.302   6.341   1.650
  102   1HG   LYS  15          1HG       LYS  15   9.147   5.654  -1.122
  103   2HG   LYS  15          2HG       LYS  15   8.563   7.302  -0.881
  104   1HD   LYS  15          1HD       LYS  15  10.757   7.816  -1.003
  105   2HD   LYS  15          2HD       LYS  15  10.758   7.327   0.693
  106   1HE   LYS  15          1HE       LYS  15  11.621   5.196   0.182
  107   2HE   LYS  15          2HE       LYS  15  11.265   5.376  -1.536
  108   1HZ   LYS  15          1HZ       LYS  15  13.457   6.542   0.037
  109   2HZ   LYS  15          2HZ       LYS  15  12.910   7.354  -1.342
  110   3HZ   LYS  15          3HZ       LYS  15  13.508   5.777  -1.472
  111    H    ARG  16           H        ARG  16   7.838   2.652  -0.574
  112    HA   ARG  16           HA       ARG  16   5.044   3.356  -1.125
  113   1HB   ARG  16          1HB       ARG  16   7.054   2.612  -3.257
  114   2HB   ARG  16          2HB       ARG  16   5.345   2.939  -3.511
  115   1HG   ARG  16          1HG       ARG  16   5.596   5.218  -3.129
  116   2HG   ARG  16          2HG       ARG  16   7.141   5.005  -2.304
  117   1HD   ARG  16          1HD       ARG  16   6.631   4.546  -5.241
  118   2HD   ARG  16          2HD       ARG  16   7.425   5.957  -4.545
  119    HE   ARG  16           HE       ARG  16   8.759   3.614  -3.725
  120   1HH1  ARG  16          1HH1      ARG  16   8.258   5.607  -6.535
  121   2HH1  ARG  16          2HH1      ARG  16   9.775   5.190  -7.262
  122   1HH2  ARG  16          1HH2      ARG  16  10.758   3.057  -4.672
  123   2HH2  ARG  16          2HH2      ARG  16  11.195   3.738  -6.202
  124    H    TRP  17           H        TRP  17   3.726   1.666  -0.941
  125    HA   TRP  17           HA       TRP  17   4.639  -1.011  -1.591
  126   1HB   TRP  17          1HB       TRP  17   3.856  -0.175   1.197
  127   2HB   TRP  17          2HB       TRP  17   3.740  -1.848   0.658
  128    HD1  TRP  17           HD       TRP  17   6.247   0.770   1.759
  129    HE1  TRP  17           1HE      TRP  17   8.567  -0.321   1.979
  130    HE3  TRP  17           3HE      TRP  17   5.217  -3.762  -0.370
  131    HZ2  TRP  17           2HZ      TRP  17   9.799  -2.778   1.334
  132    HZ3  TRP  17           3HZ      TRP  17   7.022  -5.427  -0.531
  133    HH2  TRP  17           HH       TRP  17   9.265  -4.942   0.303
  134    H    VAL  18           H        VAL  18   3.029  -2.267  -2.360
  135    HA   VAL  18           HA       VAL  18   0.308  -1.146  -2.266
  136    HB   VAL  18           HB       VAL  18  -0.142  -2.465  -4.304
  137   1HG1  VAL  18          1HG1      VAL  18   0.537  -0.145  -4.517
  138   2HG1  VAL  18          2HG1      VAL  18   2.237  -0.619  -4.493
  139   3HG1  VAL  18          3HG1      VAL  18   1.205  -1.099  -5.841
  140   1HG2  VAL  18          1HG2      VAL  18   2.672  -2.948  -4.921
  141   2HG2  VAL  18          2HG2      VAL  18   2.063  -3.921  -3.582
  142   3HG2  VAL  18          3HG2      VAL  18   1.266  -3.987  -5.154
  143    H    PHE  19           H        PHE  19  -1.458  -2.493  -1.866
  144    HA   PHE  19           HA       PHE  19  -0.789  -5.128  -0.730
  145   1HB   PHE  19          1HB       PHE  19  -2.810  -4.723   0.776
  146   2HB   PHE  19          2HB       PHE  19  -1.366  -3.778   1.125
  147    HD1  PHE  19           1HD      PHE  19  -1.265  -1.392   0.411
  148    HD2  PHE  19           2HD      PHE  19  -4.842  -3.689   0.189
  149    HE1  PHE  19           1HE      PHE  19  -2.582   0.680   0.249
  150    HE2  PHE  19           2HE      PHE  19  -6.164  -1.620   0.026
  151    HZ   PHE  19           HZ       PHE  19  -5.034   0.568   0.054
  152    H    THR  20           H        THR  20  -2.159  -6.830  -1.159
  153    HA   THR  20           HA       THR  20  -4.584  -6.374  -2.698
  154    HB   THR  20           HB       THR  20  -3.873  -8.082  -4.418
  155    HG1  THR  20           1HG      THR  20  -1.851  -8.784  -4.428
  156   1HG2  THR  20          1HG2      THR  20  -3.881  -5.546  -4.713
  157   2HG2  THR  20          2HG2      THR  20  -2.892  -6.476  -5.838
  158   3HG2  THR  20          3HG2      THR  20  -2.134  -5.628  -4.491
  159    H    LEU  21           H        LEU  21  -6.121  -7.750  -2.079
  160    HA   LEU  21           HA       LEU  21  -5.375 -10.400  -1.085
  161   1HB   LEU  21          1HB       LEU  21  -5.550  -8.935   0.871
  162   2HB   LEU  21          2HB       LEU  21  -7.184  -8.487   0.386
  163    HG   LEU  21           HG       LEU  21  -7.244 -11.264   0.567
  164   1HD1  LEU  21          1HD1      LEU  21  -6.489 -11.406   3.053
  165   2HD1  LEU  21          2HD1      LEU  21  -5.433 -10.064   2.614
  166   3HD1  LEU  21          3HD1      LEU  21  -5.304 -11.601   1.761
  167   1HD2  LEU  21          1HD2      LEU  21  -8.886  -9.401   1.251
  168   2HD2  LEU  21          2HD2      LEU  21  -8.056  -9.444   2.806
  169   3HD2  LEU  21          3HD2      LEU  21  -8.863 -10.890   2.196
  170    H    ASN  22           H        ASN  22  -6.776 -11.984  -1.636
  171    HA   ASN  22           HA       ASN  22  -8.902 -11.305  -3.467
  172   1HB   ASN  22          1HB       ASN  22  -9.014 -13.622  -3.970
  173   2HB   ASN  22          2HB       ASN  22  -7.305 -13.268  -3.736
  174   1HD2  ASN  22          1HD2      ASN  22  -6.200 -14.348  -2.226
  175   2HD2  ASN  22          2HD2      ASN  22  -6.890 -15.484  -1.122
  176    H    ASN  23           H        ASN  23 -11.052 -11.385  -3.105
  177    HA   ASN  23           HA       ASN  23 -12.995 -11.303  -1.917
  178   1HB   ASN  23          1HB       ASN  23 -11.758 -13.829  -0.814
  179   2HB   ASN  23          2HB       ASN  23 -13.407 -13.325  -0.453
  180   1HD2  ASN  23          1HD2      ASN  23 -14.549 -14.850  -1.478
  181   2HD2  ASN  23          2HD2      ASN  23 -14.474 -15.162  -3.176
  182    HA   PRO  24           HA       PRO  24 -10.834  -9.384   1.751
  183   1HB   PRO  24          1HB       PRO  24 -11.723  -6.863   1.279
  184   2HB   PRO  24          2HB       PRO  24 -10.239  -7.507   0.568
  185   1HG   PRO  24          1HG       PRO  24 -12.963  -7.248  -0.646
  186   2HG   PRO  24          2HG       PRO  24 -11.380  -6.894  -1.363
  187   1HD   PRO  24          1HD       PRO  24 -12.732  -9.183  -1.876
  188   2HD   PRO  24          2HD       PRO  24 -10.959  -9.110  -1.838
  189    H    SER  25           H        SER  25 -11.826  -9.240   3.679
  190    HA   SER  25           HA       SER  25 -14.737  -9.381   3.738
  191   1HB   SER  25          1HB       SER  25 -12.543 -10.228   5.507
  192   2HB   SER  25          2HB       SER  25 -13.944  -9.570   6.351
  193    HG   SER  25           HG       SER  25 -14.595 -11.579   6.091
  194    H    GLU  26           H        GLU  26 -15.968  -8.092   5.264
  195    HA   GLU  26           HA       GLU  26 -15.474  -5.348   5.026
  196   1HB   GLU  26          1HB       GLU  26 -17.363  -7.003   6.647
  197   2HB   GLU  26          2HB       GLU  26 -17.219  -5.287   7.000
  198   1HG   GLU  26          1HG       GLU  26 -17.956  -4.683   4.840
  199   2HG   GLU  26          2HG       GLU  26 -17.792  -6.334   4.245
  200    H    ASP  27           H        ASP  27 -14.523  -7.655   7.449
  201    HA   ASP  27           HA       ASP  27 -13.852  -5.769   9.476
  202   1HB   ASP  27          1HB       ASP  27 -13.641  -8.658   9.077
  203   2HB   ASP  27          2HB       ASP  27 -12.276  -7.985   9.964
  204    H    GLU  28           H        GLU  28 -11.974  -7.484   7.001
  205    HA   GLU  28           HA       GLU  28  -9.481  -6.338   7.751
  206   1HB   GLU  28          1HB       GLU  28 -10.409  -8.273   5.881
  207   2HB   GLU  28          2HB       GLU  28  -9.459  -7.085   4.998
  208   1HG   GLU  28          1HG       GLU  28  -8.042  -8.890   5.702
  209   2HG   GLU  28          2HG       GLU  28  -7.607  -7.424   6.580
  210    H    ARG  29           H        ARG  29 -11.817  -5.619   5.175
  211    HA   ARG  29           HA       ARG  29 -10.379  -3.524   3.982
  212   1HB   ARG  29          1HB       ARG  29 -12.332  -3.042   2.774
  213   2HB   ARG  29          2HB       ARG  29 -12.446  -4.766   3.106
  214   1HG   ARG  29          1HG       ARG  29 -14.543  -4.206   3.703
  215   2HG   ARG  29          2HG       ARG  29 -13.760  -3.826   5.238
  216   1HD   ARG  29          1HD       ARG  29 -15.039  -1.932   4.803
  217   2HD   ARG  29          2HD       ARG  29 -13.431  -1.476   4.243
  218    HE   ARG  29           HE       ARG  29 -14.559  -2.428   2.002
  219   1HH1  ARG  29          1HH1      ARG  29 -15.672  -0.150   4.388
  220   2HH1  ARG  29          2HH1      ARG  29 -16.629   0.757   3.264
  221   1HH2  ARG  29          1HH2      ARG  29 -15.816  -1.242   0.514
  222   2HH2  ARG  29          2HH2      ARG  29 -16.711   0.135   1.061
  223    H    LYS  30           H        LYS  30 -12.441  -3.634   6.793
  224    HA   LYS  30           HA       LYS  30 -12.822  -0.821   7.037
  225   1HB   LYS  30          1HB       LYS  30 -13.322  -3.211   8.732
  226   2HB   LYS  30          2HB       LYS  30 -13.219  -1.658   9.550
  227   1HG   LYS  30          1HG       LYS  30 -14.920  -1.656   7.167
  228   2HG   LYS  30          2HG       LYS  30 -15.479  -2.706   8.471
  229   1HD   LYS  30          1HD       LYS  30 -15.200  -0.753  10.027
  230   2HD   LYS  30          2HD       LYS  30 -14.907   0.250   8.604
  231   1HE   LYS  30          1HE       LYS  30 -17.079   0.283   8.033
  232   2HE   LYS  30          2HE       LYS  30 -17.309  -1.419   8.431
  233   1HZ   LYS  30          1HZ       LYS  30 -18.094   0.811   9.910
  234   2HZ   LYS  30          2HZ       LYS  30 -16.895   0.021  10.805
  235   3HZ   LYS  30          3HZ       LYS  30 -18.277  -0.822  10.313
  236    H    LYS  31           H        LYS  31 -10.490  -3.122   8.346
  237    HA   LYS  31           HA       LYS  31  -9.218  -1.390  10.157
  238   1HB   LYS  31          1HB       LYS  31  -8.814  -3.737  10.334
  239   2HB   LYS  31          2HB       LYS  31  -8.240  -3.829   8.675
  240   1HG   LYS  31          1HG       LYS  31  -6.263  -2.567   9.247
  241   2HG   LYS  31          2HG       LYS  31  -6.853  -2.341  10.895
  242   1HD   LYS  31          1HD       LYS  31  -6.197  -4.392  11.531
  243   2HD   LYS  31          2HD       LYS  31  -6.767  -5.138  10.037
  244   1HE   LYS  31          1HE       LYS  31  -4.438  -5.442  10.022
  245   2HE   LYS  31          2HE       LYS  31  -4.730  -4.093   8.926
  246   1HZ   LYS  31          1HZ       LYS  31  -4.287  -2.647  10.963
  247   2HZ   LYS  31          2HZ       LYS  31  -2.959  -3.397  10.232
  248   3HZ   LYS  31          3HZ       LYS  31  -3.610  -4.034  11.657
  249    H    ILE  32           H        ILE  32  -8.325  -2.275   6.823
  250    HA   ILE  32           HA       ILE  32  -6.118  -0.535   6.642
  251    HB   ILE  32           HB       ILE  32  -7.838  -1.887   4.591
  252   1HG1  ILE  32          1HG1      ILE  32  -4.889  -2.083   5.241
  253   2HG1  ILE  32          2HG1      ILE  32  -6.128  -3.176   5.848
  254   1HG2  ILE  32          1HG2      ILE  32  -7.342   0.143   3.490
  255   2HG2  ILE  32          2HG2      ILE  32  -5.688   0.156   4.101
  256   3HG2  ILE  32          3HG2      ILE  32  -6.172  -1.031   2.890
  257   1HD1  ILE  32          1HD1      ILE  32  -4.651  -3.371   3.468
  258   2HD1  ILE  32          2HD1      ILE  32  -5.953  -4.419   4.032
  259   3HD1  ILE  32          3HD1      ILE  32  -6.319  -3.032   3.007
  260    H    ARG  33           H        ARG  33  -9.534  -0.119   5.841
  261    HA   ARG  33           HA       ARG  33  -9.211   2.468   4.684
  262   1HB   ARG  33          1HB       ARG  33 -11.123   1.102   4.090
  263   2HB   ARG  33          2HB       ARG  33 -11.654   1.056   5.766
  264   1HG   ARG  33          1HG       ARG  33 -12.683   3.029   5.612
  265   2HG   ARG  33          2HG       ARG  33 -11.347   3.761   4.721
  266   1HD   ARG  33          1HD       ARG  33 -12.203   2.313   2.748
  267   2HD   ARG  33          2HD       ARG  33 -13.692   2.214   3.688
  268    HE   ARG  33           HE       ARG  33 -12.720   4.478   2.231
  269   1HH1  ARG  33          1HH1      ARG  33 -14.644   3.475   4.953
  270   2HH1  ARG  33          2HH1      ARG  33 -15.614   4.911   4.963
  271   1HH2  ARG  33          1HH2      ARG  33 -13.990   6.373   2.233
  272   2HH2  ARG  33          2HH2      ARG  33 -15.241   6.558   3.415
  273    H    ASP  34           H        ASP  34  -9.422   1.287   7.898
  274    HA   ASP  34           HA       ASP  34 -10.102   3.929   8.962
  275   1HB   ASP  34          1HB       ASP  34  -9.933   1.193  10.221
  276   2HB   ASP  34          2HB       ASP  34 -10.100   2.661  11.179
  277    H    LEU  35           H        LEU  35  -7.425   2.667   7.833
  278    HA   LEU  35           HA       LEU  35  -5.569   2.864   9.971
  279   1HB   LEU  35          1HB       LEU  35  -5.375   2.764   6.995
  280   2HB   LEU  35          2HB       LEU  35  -3.952   3.200   7.939
  281    HG   LEU  35           HG       LEU  35  -5.496   0.627   8.253
  282   1HD1  LEU  35          1HD1      LEU  35  -4.155   1.120   6.059
  283   2HD1  LEU  35          2HD1      LEU  35  -4.007  -0.438   6.872
  284   3HD1  LEU  35          3HD1      LEU  35  -2.759   0.789   7.085
  285   1HD2  LEU  35          1HD2      LEU  35  -2.837   1.521   9.361
  286   2HD2  LEU  35          2HD2      LEU  35  -3.554  -0.078   9.560
  287   3HD2  LEU  35          3HD2      LEU  35  -4.333   1.334  10.276
  288    HA   PRO  36           HA       PRO  36  -4.787   7.167  10.312
  289   1HB   PRO  36          1HB       PRO  36  -2.092   7.249  10.629
  290   2HB   PRO  36          2HB       PRO  36  -3.189   6.657  11.882
  291   1HG   PRO  36          1HG       PRO  36  -1.556   5.108   9.908
  292   2HG   PRO  36          2HG       PRO  36  -1.815   4.797  11.635
  293   1HD   PRO  36          1HD       PRO  36  -3.152   3.459   9.697
  294   2HD   PRO  36          2HD       PRO  36  -3.872   3.820  11.279
  295    H    ILE  37           H        ILE  37  -5.023   8.522   8.651
  296    HA   ILE  37           HA       ILE  37  -3.796   8.144   6.116
  297    HB   ILE  37           HB       ILE  37  -4.685  10.443   5.619
  298   1HG1  ILE  37          1HG1      ILE  37  -5.859  10.203   8.397
  299   2HG1  ILE  37          2HG1      ILE  37  -4.537  11.280   7.960
  300   1HG2  ILE  37          1HG2      ILE  37  -7.096   9.267   6.623
  301   2HG2  ILE  37          2HG2      ILE  37  -6.506   9.358   4.965
  302   3HG2  ILE  37          3HG2      ILE  37  -6.032   8.008   5.995
  303   1HD1  ILE  37          1HD1      ILE  37  -6.192  12.771   7.721
  304   2HD1  ILE  37          2HD1      ILE  37  -6.383  12.012   6.141
  305   3HD1  ILE  37          3HD1      ILE  37  -7.421  11.529   7.482
  306    H    SER  38           H        SER  38  -3.011  10.052   8.943
  307    HA   SER  38           HA       SER  38  -1.077  11.723   7.704
  308   1HB   SER  38          1HB       SER  38  -0.738  12.611   9.794
  309   2HB   SER  38          2HB       SER  38  -2.299  11.839  10.076
  310    HG   SER  38           HG       SER  38  -0.496  11.419  11.624
  311    H    LEU  39           H        LEU  39  -1.048   8.456   8.733
  312    HA   LEU  39           HA       LEU  39   1.757   8.211   9.199
  313   1HB   LEU  39          1HB       LEU  39  -0.338   6.664   9.796
  314   2HB   LEU  39          2HB       LEU  39   0.186   5.860   8.318
  315    HG   LEU  39           HG       LEU  39   2.274   6.381  10.348
  316   1HD1  LEU  39          1HD1      LEU  39   1.646   4.455  11.686
  317   2HD1  LEU  39          2HD1      LEU  39   0.175   4.251  10.734
  318   3HD1  LEU  39          3HD1      LEU  39   0.383   5.685  11.740
  319   1HD2  LEU  39          1HD2      LEU  39   1.555   4.064   8.557
  320   2HD2  LEU  39          2HD2      LEU  39   2.948   4.106   9.639
  321   3HD2  LEU  39          3HD2      LEU  39   2.838   5.248   8.299
  322    H    PHE  40           H        PHE  40  -0.303   8.046   6.397
  323    HA   PHE  40           HA       PHE  40   2.058   7.423   4.747
  324   1HB   PHE  40          1HB       PHE  40  -0.763   6.866   3.865
  325   2HB   PHE  40          2HB       PHE  40   0.738   6.189   3.243
  326    HD1  PHE  40           2HD      PHE  40  -1.718   6.063   5.965
  327    HD2  PHE  40           1HD      PHE  40   1.786   4.314   4.296
  328    HE1  PHE  40           2HE      PHE  40  -1.995   4.111   7.437
  329    HE2  PHE  40           1HE      PHE  40   1.514   2.359   5.765
  330    HZ   PHE  40           HZ       PHE  40  -0.378   2.257   7.339
  331    H    ASP  41           H        ASP  41   2.675   8.987   3.418
  332    HA   ASP  41           HA       ASP  41   1.384  11.470   3.256
  333   1HB   ASP  41          1HB       ASP  41   3.855  10.513   2.554
  334   2HB   ASP  41          2HB       ASP  41   3.123  10.815   0.980
  335    H    TYR  42           H        TYR  42   0.799   8.547   1.601
  336    HA   TYR  42           HA       TYR  42  -1.297   9.805   0.045
  337   1HB   TYR  42          1HB       TYR  42   0.612   9.966  -1.472
  338   2HB   TYR  42          2HB       TYR  42   0.925   8.243  -1.289
  339    HD1  TYR  42           1HD      TYR  42  -2.423   9.774  -1.654
  340    HD2  TYR  42           2HD      TYR  42   0.691   7.584  -3.556
  341    HE1  TYR  42           1HE      TYR  42  -3.918   9.306  -3.550
  342    HE2  TYR  42           2HE      TYR  42  -0.796   7.111  -5.457
  343    HH   TYR  42           HH       TYR  42  -4.076   8.449  -5.603
  344    H    PHE  43           H        PHE  43  -3.049   8.575   0.157
  345    HA   PHE  43           HA       PHE  43  -2.736   5.662   0.371
  346   1HB   PHE  43          1HB       PHE  43  -3.340   7.110   2.557
  347   2HB   PHE  43          2HB       PHE  43  -4.960   6.890   1.903
  348    HD1  PHE  43           1HD      PHE  43  -4.011   4.111   0.643
  349    HD2  PHE  43           2HD      PHE  43  -4.026   5.823   4.539
  350    HE1  PHE  43           1HE      PHE  43  -4.103   1.858   1.629
  351    HE2  PHE  43           2HE      PHE  43  -4.117   3.574   5.532
  352    HZ   PHE  43           HZ       PHE  43  -4.155   1.588   4.077
  353    H    ILE  44           H        ILE  44  -3.713   4.783  -1.320
  354    HA   ILE  44           HA       ILE  44  -6.357   5.781  -2.105
  355    HB   ILE  44           HB       ILE  44  -5.022   6.805  -3.751
  356   1HG1  ILE  44          1HG1      ILE  44  -5.521   4.368  -5.345
  357   2HG1  ILE  44          2HG1      ILE  44  -6.901   4.965  -4.429
  358   1HG2  ILE  44          1HG2      ILE  44  -3.375   5.361  -5.098
  359   2HG2  ILE  44          2HG2      ILE  44  -2.898   5.890  -3.486
  360   3HG2  ILE  44          3HG2      ILE  44  -3.471   4.242  -3.739
  361   1HD1  ILE  44          1HD1      ILE  44  -7.194   6.703  -5.794
  362   2HD1  ILE  44          2HD1      ILE  44  -5.465   7.041  -5.895
  363   3HD1  ILE  44          3HD1      ILE  44  -6.182   5.794  -6.916
  364    H    VAL  45           H        VAL  45  -7.745   4.158  -1.979
  365    HA   VAL  45           HA       VAL  45  -6.829   1.455  -2.716
  366    HB   VAL  45           HB       VAL  45  -9.024   1.833  -0.719
  367   1HG1  VAL  45          1HG1      VAL  45  -8.706  -0.385  -1.568
  368   2HG1  VAL  45          2HG1      VAL  45  -6.973  -0.312  -1.246
  369   3HG1  VAL  45          3HG1      VAL  45  -8.120  -0.341   0.094
  370   1HG2  VAL  45          1HG2      VAL  45  -7.479   3.094   0.433
  371   2HG2  VAL  45          2HG2      VAL  45  -7.087   1.471   1.000
  372   3HG2  VAL  45          3HG2      VAL  45  -6.103   2.229  -0.251
  373    H    GLY  46           H        GLY  46  -8.354   0.094  -3.727
  374   1HA   GLY  46          1HA       GLY  46 -10.933   1.253  -4.467
  375   2HA   GLY  46          2HA       GLY  46  -9.813   0.903  -5.776
  376    H    GLU  47           H        GLU  47 -12.499  -0.225  -4.897
  377    HA   GLU  47           HA       GLU  47 -11.789  -3.017  -4.423
  378   1HB   GLU  47          1HB       GLU  47 -13.590  -2.217  -3.065
  379   2HB   GLU  47          2HB       GLU  47 -14.429  -1.556  -4.461
  380   1HG   GLU  47          1HG       GLU  47 -15.452  -3.623  -3.631
  381   2HG   GLU  47          2HG       GLU  47 -14.886  -3.768  -5.294
  382    H    GLU  48           H        GLU  48 -11.924  -4.588  -5.920
  383    HA   GLU  48           HA       GLU  48 -13.084  -3.898  -8.538
  384   1HB   GLU  48          1HB       GLU  48 -10.505  -3.973  -8.366
  385   2HB   GLU  48          2HB       GLU  48 -10.707  -5.716  -8.251
  386   1HG   GLU  48          1HG       GLU  48 -12.137  -5.398 -10.412
  387   2HG   GLU  48          2HG       GLU  48 -11.226  -3.896 -10.548
  388    H    GLY  49           H        GLY  49 -14.897  -5.068  -8.665
  389   1HA   GLY  49          1HA       GLY  49 -14.730  -7.934  -8.694
  390   2HA   GLY  49          2HA       GLY  49 -15.617  -7.326  -7.304
  391    H    ASN  50           H        ASN  50 -15.696  -5.588 -10.307
  392    HA   ASN  50           HA       ASN  50 -18.554  -6.104 -10.503
  393   1HB   ASN  50          1HB       ASN  50 -16.779  -3.935 -11.219
  394   2HB   ASN  50          2HB       ASN  50 -17.783  -4.394 -12.590
  395   1HD2  ASN  50          1HD2      ASN  50 -17.985  -3.683  -9.129
  396   2HD2  ASN  50          2HD2      ASN  50 -19.521  -2.894  -9.205
  397    H    GLU  51           H        GLU  51 -18.526  -8.254 -11.259
  398    HA   GLU  51           HA       GLU  51 -18.662  -8.571 -14.029
  399   1HB   GLU  51          1HB       GLU  51 -15.998  -8.820 -12.953
  400   2HB   GLU  51          2HB       GLU  51 -16.524 -10.353 -13.634
  401   1HG   GLU  51          1HG       GLU  51 -16.114  -9.615 -15.673
  402   2HG   GLU  51          2HG       GLU  51 -17.238  -8.278 -15.439
  403    H    GLU  52           H        GLU  52 -19.638 -10.481 -14.571
  404    HA   GLU  52           HA       GLU  52 -20.716 -12.031 -12.420
  405   1HB   GLU  52          1HB       GLU  52 -22.107 -11.594 -14.334
  406   2HB   GLU  52          2HB       GLU  52 -20.923 -12.308 -15.419
  407   1HG   GLU  52          1HG       GLU  52 -21.704 -14.362 -15.091
  408   2HG   GLU  52          2HG       GLU  52 -21.771 -14.148 -13.342
  409    H    GLY  53           H        GLY  53 -20.105 -13.978 -11.668
  410   1HA   GLY  53          1HA       GLY  53 -19.069 -16.071 -11.667
  411   2HA   GLY  53          2HA       GLY  53 -18.340 -15.684 -13.219
  412    H    ARG  54           H        ARG  54 -17.673 -13.030 -11.561
  413    HA   ARG  54           HA       ARG  54 -15.070 -14.066 -10.688
  414   1HB   ARG  54          1HB       ARG  54 -15.292 -12.178 -12.409
  415   2HB   ARG  54          2HB       ARG  54 -15.788 -11.165 -11.060
  416   1HG   ARG  54          1HG       ARG  54 -13.692 -11.334 -10.019
  417   2HG   ARG  54          2HG       ARG  54 -13.210 -12.697 -11.030
  418   1HD   ARG  54          1HD       ARG  54 -13.790 -10.682 -12.841
  419   2HD   ARG  54          2HD       ARG  54 -12.978  -9.847 -11.517
  420    HE   ARG  54           HE       ARG  54 -11.776 -11.561 -13.427
  421   1HH1  ARG  54          1HH1      ARG  54 -11.645 -10.660 -10.067
  422   2HH1  ARG  54          2HH1      ARG  54  -9.969 -11.061  -9.890
  423   1HH2  ARG  54          1HH2      ARG  54  -9.569 -12.093 -13.207
  424   2HH2  ARG  54          2HH2      ARG  54  -8.789 -11.876 -11.677
  425    H    THR  55           H        THR  55 -14.084 -12.959  -8.780
  426    HA   THR  55           HA       THR  55 -16.132 -12.510  -6.709
  427    HB   THR  55           HB       THR  55 -13.825 -13.103  -5.327
  428    HG1  THR  55           1HG      THR  55 -13.247 -15.169  -6.443
  429   1HG2  THR  55          1HG2      THR  55 -15.032 -15.526  -5.442
  430   2HG2  THR  55          2HG2      THR  55 -16.333 -14.485  -6.020
  431   3HG2  THR  55          3HG2      THR  55 -15.599 -14.188  -4.444
  432    HA   PRO  56           HA       PRO  56 -14.517  -8.528  -5.819
  433   1HB   PRO  56          1HB       PRO  56 -14.706  -8.422  -3.112
  434   2HB   PRO  56          2HB       PRO  56 -16.115  -8.355  -4.177
  435   1HG   PRO  56          1HG       PRO  56 -14.997 -10.680  -2.660
  436   2HG   PRO  56          2HG       PRO  56 -16.688 -10.185  -2.862
  437   1HD   PRO  56          1HD       PRO  56 -15.573 -12.187  -4.305
  438   2HD   PRO  56          2HD       PRO  56 -16.846 -11.136  -4.956
  439    H    HIS  57           H        HIS  57 -12.584  -7.559  -5.502
  440    HA   HIS  57           HA       HIS  57 -10.583  -8.871  -3.815
  441   1HB   HIS  57          1HB       HIS  57 -10.071  -9.716  -6.010
  442   2HB   HIS  57          2HB       HIS  57 -10.184  -8.104  -6.711
  443    HD1  HIS  57           1HD      HIS  57  -7.884 -10.358  -4.862
  444    HD2  HIS  57           2HD      HIS  57  -7.954  -6.433  -6.220
  445    HE1  HIS  57           1HE      HIS  57  -5.512  -9.543  -4.682
  446    H    LEU  58           H        LEU  58  -9.231  -7.491  -2.762
  447    HA   LEU  58           HA       LEU  58  -9.800  -4.634  -3.087
  448   1HB   LEU  58          1HB       LEU  58  -9.551  -6.285  -0.849
  449   2HB   LEU  58          2HB       LEU  58  -8.095  -5.293  -0.853
  450    HG   LEU  58           HG       LEU  58 -10.953  -4.339  -0.749
  451   1HD1  LEU  58          1HD1      LEU  58  -9.712  -3.217   1.343
  452   2HD1  LEU  58          2HD1      LEU  58  -8.776  -4.705   1.212
  453   3HD1  LEU  58          3HD1      LEU  58 -10.525  -4.781   1.424
  454   1HD2  LEU  58          1HD2      LEU  58  -9.213  -2.199  -0.312
  455   2HD2  LEU  58          2HD2      LEU  58 -10.266  -2.454  -1.703
  456   3HD2  LEU  58          3HD2      LEU  58  -8.595  -3.019  -1.746
  457    H    GLN  59           H        GLN  59  -8.431  -3.515  -4.295
  458    HA   GLN  59           HA       GLN  59  -5.560  -4.126  -4.098
  459   1HB   GLN  59          1HB       GLN  59  -6.134  -5.004  -6.210
  460   2HB   GLN  59          2HB       GLN  59  -7.208  -3.659  -6.571
  461   1HG   GLN  59          1HG       GLN  59  -5.174  -3.531  -7.884
  462   2HG   GLN  59          2HG       GLN  59  -5.294  -2.169  -6.770
  463   1HE2  GLN  59          1HE2      GLN  59  -3.219  -4.329  -8.036
  464   2HE2  GLN  59          2HE2      GLN  59  -2.034  -4.387  -6.781
  465    H    GLY  60           H        GLY  60  -4.595  -2.443  -3.180
  466   1HA   GLY  60          1HA       GLY  60  -5.161   0.238  -4.201
  467   2HA   GLY  60          2HA       GLY  60  -5.394  -0.030  -2.480
  468    H    PHE  61           H        PHE  61  -3.625   1.871  -3.342
  469    HA   PHE  61           HA       PHE  61  -1.031   0.648  -2.667
  470   1HB   PHE  61          1HB       PHE  61  -0.785   1.288  -4.924
  471   2HB   PHE  61          2HB       PHE  61  -1.670   2.791  -4.682
  472    HD1  PHE  61           2HD      PHE  61   1.336   1.136  -3.205
  473    HD2  PHE  61           1HD      PHE  61  -0.394   4.682  -4.801
  474    HE1  PHE  61           2HE      PHE  61   3.462   2.325  -2.858
  475    HE2  PHE  61           1HE      PHE  61   1.729   5.877  -4.458
  476    HZ   PHE  61           HZ       PHE  61   3.660   4.699  -3.484
  477    H    ALA  62           H        ALA  62   0.214   1.672  -1.157
  478    HA   ALA  62           HA       ALA  62  -0.763   4.217  -0.064
  479   1HB   ALA  62          1HB       ALA  62  -0.698   1.625   1.288
  480   2HB   ALA  62          2HB       ALA  62   0.083   2.925   2.189
  481   3HB   ALA  62          3HB       ALA  62  -1.598   3.091   1.681
  482    H    ASN  63           H        ASN  63   0.817   5.660   0.134
  483    HA   ASN  63           HA       ASN  63   3.584   4.764  -0.118
  484   1HB   ASN  63          1HB       ASN  63   2.762   6.565  -1.604
  485   2HB   ASN  63          2HB       ASN  63   2.446   7.567  -0.190
  486   1HD2  ASN  63          1HD2      ASN  63   4.468   7.303  -2.623
  487   2HD2  ASN  63          2HD2      ASN  63   5.948   7.819  -1.895
  488    H    PHE  64           H        PHE  64   4.669   4.368   1.687
  489    HA   PHE  64           HA       PHE  64   3.858   5.306   4.243
  490   1HB   PHE  64          1HB       PHE  64   5.880   3.514   3.164
  491   2HB   PHE  64          2HB       PHE  64   6.501   4.472   4.504
  492    HD1  PHE  64           2HD      PHE  64   5.146   4.484   6.671
  493    HD2  PHE  64           1HD      PHE  64   4.575   1.636   3.559
  494    HE1  PHE  64           2HE      PHE  64   4.046   2.967   8.265
  495    HE2  PHE  64           1HE      PHE  64   3.473   0.115   5.149
  496    HZ   PHE  64           HZ       PHE  64   3.208   0.779   7.505
  497    H    VAL  65           H        VAL  65   4.403   7.089   5.330
  498    HA   VAL  65           HA       VAL  65   5.685   9.251   4.093
  499    HB   VAL  65           HB       VAL  65   5.143   8.742   7.020
  500   1HG1  VAL  65          1HG1      VAL  65   6.444  11.012   5.624
  501   2HG1  VAL  65          2HG1      VAL  65   5.299  11.395   6.911
  502   3HG1  VAL  65          3HG1      VAL  65   6.702  10.382   7.250
  503   1HG2  VAL  65          1HG2      VAL  65   3.698  10.589   5.135
  504   2HG2  VAL  65          2HG2      VAL  65   3.210   8.914   5.391
  505   3HG2  VAL  65          3HG2      VAL  65   3.194  10.052   6.738
  506    H    LYS  66           H        LYS  66   6.947   6.574   5.868
  507    HA   LYS  66           HA       LYS  66   9.638   7.752   5.680
  508   1HB   LYS  66          1HB       LYS  66  10.179   6.385   7.757
  509   2HB   LYS  66          2HB       LYS  66   9.177   7.810   7.996
  510   1HG   LYS  66          1HG       LYS  66   7.753   5.269   7.517
  511   2HG   LYS  66          2HG       LYS  66   8.613   5.422   9.051
  512   1HD   LYS  66          1HD       LYS  66   6.924   7.705   8.188
  513   2HD   LYS  66          2HD       LYS  66   6.102   6.244   8.739
  514   1HE   LYS  66          1HE       LYS  66   6.993   6.399  10.876
  515   2HE   LYS  66          2HE       LYS  66   8.328   7.424  10.353
  516   1HZ   LYS  66          1HZ       LYS  66   5.525   8.357  10.249
  517   2HZ   LYS  66          2HZ       LYS  66   6.942   9.279  10.221
  518   3HZ   LYS  66          3HZ       LYS  66   6.459   8.515  11.651
  519    H    LYS  67           H        LYS  67  11.219   5.708   6.302
  520    HA   LYS  67           HA       LYS  67  10.799   3.879   4.090
  521   1HB   LYS  67          1HB       LYS  67  13.075   4.805   5.688
  522   2HB   LYS  67          2HB       LYS  67  13.130   3.086   5.320
  523   1HG   LYS  67          1HG       LYS  67  14.230   3.911   3.509
  524   2HG   LYS  67          2HG       LYS  67  12.577   3.934   2.889
  525   1HD   LYS  67          1HD       LYS  67  12.796   6.113   2.509
  526   2HD   LYS  67          2HD       LYS  67  12.950   6.369   4.249
  527   1HE   LYS  67          1HE       LYS  67  15.252   6.446   4.167
  528   2HE   LYS  67          2HE       LYS  67  15.336   5.494   2.686
  529   1HZ   LYS  67          1HZ       LYS  67  14.870   8.363   3.028
  530   2HZ   LYS  67          2HZ       LYS  67  14.121   7.592   1.722
  531   3HZ   LYS  67          3HZ       LYS  67  15.806   7.552   1.875
  532    H    GLN  68           H        GLN  68   9.969   1.910   4.281
  533    HA   GLN  68           HA       GLN  68  10.186   0.512   6.852
  534   1HB   GLN  68          1HB       GLN  68   7.658   0.695   5.206
  535   2HB   GLN  68          2HB       GLN  68   7.861  -0.238   6.682
  536   1HG   GLN  68          1HG       GLN  68   8.097   2.756   6.489
  537   2HG   GLN  68          2HG       GLN  68   6.666   1.882   7.032
  538   1HE2  GLN  68          1HE2      GLN  68   7.446   3.580   8.789
  539   2HE2  GLN  68          2HE2      GLN  68   8.346   2.870  10.081
  540    H    THR  69           H        THR  69  10.152  -1.763   6.727
  541    HA   THR  69           HA       THR  69  11.032  -2.781   4.141
  542    HB   THR  69           HB       THR  69  11.900  -4.673   5.290
  543    HG1  THR  69           1HG      THR  69  11.344  -5.162   7.406
  544   1HG2  THR  69          1HG2      THR  69  13.226  -2.650   5.589
  545   2HG2  THR  69          2HG2      THR  69  13.320  -3.663   7.030
  546   3HG2  THR  69          3HG2      THR  69  12.291  -2.231   7.023
  547    H    PHE  70           H        PHE  70  10.333  -5.096   3.632
  548    HA   PHE  70           HA       PHE  70   7.568  -5.129   3.155
  549   1HB   PHE  70          1HB       PHE  70   8.898  -6.376   1.661
  550   2HB   PHE  70          2HB       PHE  70   9.708  -7.237   2.966
  551    HD1  PHE  70           1HD      PHE  70   6.197  -6.711   1.803
  552    HD2  PHE  70           2HD      PHE  70   9.164  -9.447   3.155
  553    HE1  PHE  70           1HE      PHE  70   4.591  -8.560   1.572
  554    HE2  PHE  70           2HE      PHE  70   7.563 -11.301   2.926
  555    HZ   PHE  70           HZ       PHE  70   5.273 -10.860   2.133
  556    H    ASN  71           H        ASN  71   9.502  -7.115   5.396
  557    HA   ASN  71           HA       ASN  71   7.330  -8.442   6.580
  558   1HB   ASN  71          1HB       ASN  71   9.978  -8.771   6.740
  559   2HB   ASN  71          2HB       ASN  71   9.738  -7.872   8.235
  560   1HD2  ASN  71          1HD2      ASN  71   8.735 -10.727   6.447
  561   2HD2  ASN  71          2HD2      ASN  71   8.289 -11.661   7.830
  562    H    LYS  72           H        LYS  72   8.972  -5.428   7.413
  563    HA   LYS  72           HA       LYS  72   7.628  -4.971   9.854
  564   1HB   LYS  72          1HB       LYS  72   9.639  -3.761   9.418
  565   2HB   LYS  72          2HB       LYS  72   8.999  -3.111   7.914
  566   1HG   LYS  72          1HG       LYS  72   9.059  -1.451   9.723
  567   2HG   LYS  72          2HG       LYS  72   7.425  -1.743   9.122
  568   1HD   LYS  72          1HD       LYS  72   7.012  -3.248  11.020
  569   2HD   LYS  72          2HD       LYS  72   8.637  -2.919  11.624
  570   1HE   LYS  72          1HE       LYS  72   6.894  -0.586  11.077
  571   2HE   LYS  72          2HE       LYS  72   6.480  -1.589  12.466
  572   1HZ   LYS  72          1HZ       LYS  72   8.549   0.322  12.209
  573   2HZ   LYS  72          2HZ       LYS  72   9.213  -1.187  12.582
  574   3HZ   LYS  72          3HZ       LYS  72   8.035  -0.509  13.590
  575    H    VAL  73           H        VAL  73   7.025  -3.725   6.574
  576    HA   VAL  73           HA       VAL  73   4.812  -2.148   7.121
  577    HB   VAL  73           HB       VAL  73   5.492  -3.734   4.649
  578   1HG1  VAL  73          1HG1      VAL  73   3.853  -1.991   3.608
  579   2HG1  VAL  73          2HG1      VAL  73   3.222  -3.471   4.334
  580   3HG1  VAL  73          3HG1      VAL  73   3.166  -1.954   5.232
  581   1HG2  VAL  73          1HG2      VAL  73   6.528  -1.847   3.862
  582   2HG2  VAL  73          2HG2      VAL  73   5.543  -0.761   4.842
  583   3HG2  VAL  73          3HG2      VAL  73   6.848  -1.684   5.588
  584    H    LYS  74           H        LYS  74   5.091  -5.593   7.006
  585    HA   LYS  74           HA       LYS  74   2.386  -6.256   6.550
  586   1HB   LYS  74          1HB       LYS  74   4.500  -7.788   8.077
  587   2HB   LYS  74          2HB       LYS  74   2.974  -8.451   7.506
  588   1HG   LYS  74          1HG       LYS  74   4.103  -7.352   5.236
  589   2HG   LYS  74          2HG       LYS  74   5.472  -8.061   6.096
  590   1HD   LYS  74          1HD       LYS  74   4.804  -9.919   4.978
  591   2HD   LYS  74          2HD       LYS  74   3.718 -10.064   6.361
  592   1HE   LYS  74          1HE       LYS  74   1.914  -9.092   5.135
  593   2HE   LYS  74          2HE       LYS  74   2.983  -8.653   3.803
  594   1HZ   LYS  74          1HZ       LYS  74   1.501 -10.772   3.666
  595   2HZ   LYS  74          2HZ       LYS  74   2.749 -11.479   4.562
  596   3HZ   LYS  74          3HZ       LYS  74   3.076 -10.796   3.050
  597    H    TRP  75           H        TRP  75   3.871  -4.754   9.172
  598    HA   TRP  75           HA       TRP  75   2.319  -5.799  11.307
  599   1HB   TRP  75          1HB       TRP  75   3.261  -4.098  12.636
  600   2HB   TRP  75          2HB       TRP  75   4.503  -4.457  11.440
  601    HD1  TRP  75           HD       TRP  75   3.377  -2.701   9.035
  602    HE1  TRP  75           1HE      TRP  75   3.506  -0.134   9.178
  603    HE3  TRP  75           3HE      TRP  75   3.796  -2.191  14.105
  604    HZ2  TRP  75           2HZ      TRP  75   3.753   1.845  11.176
  605    HZ3  TRP  75           3HZ      TRP  75   3.974   0.073  15.051
  606    HH2  TRP  75           HH       TRP  75   3.953   2.048  13.616
  607    H    TYR  76           H        TYR  76   1.637  -3.597   8.777
  608    HA   TYR  76           HA       TYR  76  -0.795  -2.689  10.168
  609   1HB   TYR  76          1HB       TYR  76   1.123  -1.324   8.427
  610   2HB   TYR  76          2HB       TYR  76  -0.552  -1.071   7.949
  611    HD1  TYR  76           2HD      TYR  76  -1.873  -1.084  10.614
  612    HD2  TYR  76           1HD      TYR  76   1.745   0.746   9.324
  613    HE1  TYR  76           2HE      TYR  76  -2.119   0.623  12.367
  614    HE2  TYR  76           1HE      TYR  76   1.510   2.458  11.074
  615    HH   TYR  76           HH       TYR  76   0.302   2.560  13.398
  616    H    LEU  77           H        LEU  77   0.437  -3.623   6.962
  617    HA   LEU  77           HA       LEU  77  -2.168  -3.955   5.843
  618   1HB   LEU  77          1HB       LEU  77   0.543  -4.888   4.915
  619   2HB   LEU  77          2HB       LEU  77  -0.938  -5.049   3.973
  620    HG   LEU  77           HG       LEU  77   0.372  -2.461   4.805
  621   1HD1  LEU  77          1HD1      LEU  77   0.442  -2.319   2.197
  622   2HD1  LEU  77          2HD1      LEU  77   0.366  -4.078   2.300
  623   3HD1  LEU  77          3HD1      LEU  77   1.688  -3.207   3.076
  624   1HD2  LEU  77          1HD2      LEU  77  -1.325  -1.432   3.322
  625   2HD2  LEU  77          2HD2      LEU  77  -2.018  -2.182   4.760
  626   3HD2  LEU  77          3HD2      LEU  77  -2.123  -3.000   3.201
  627    H    GLY  78           H        GLY  78  -0.323  -5.821   7.951
  628   1HA   GLY  78          1HA       GLY  78  -0.705  -7.893   8.871
  629   2HA   GLY  78          2HA       GLY  78  -2.231  -7.923   7.999
  630    H    ALA  79           H        ALA  79  -0.452 -10.134   8.419
  631    HA   ALA  79           HA       ALA  79   1.013 -10.627   6.008
  632   1HB   ALA  79          1HB       ALA  79   1.967 -11.911   7.591
  633   2HB   ALA  79          2HB       ALA  79   0.473 -12.064   8.516
  634   3HB   ALA  79          3HB       ALA  79   0.742 -13.082   7.102
  635    H    ARG  80           H        ARG  80  -2.229 -11.241   7.129
  636    HA   ARG  80           HA       ARG  80  -3.034 -13.297   5.465
  637   1HB   ARG  80          1HB       ARG  80  -5.322 -12.222   5.607
  638   2HB   ARG  80          2HB       ARG  80  -4.537 -12.559   7.144
  639   1HG   ARG  80          1HG       ARG  80  -3.910  -9.905   6.179
  640   2HG   ARG  80          2HG       ARG  80  -5.648 -10.159   6.342
  641   1HD   ARG  80          1HD       ARG  80  -3.570 -10.636   8.475
  642   2HD   ARG  80          2HD       ARG  80  -4.693  -9.279   8.405
  643    HE   ARG  80           HE       ARG  80  -6.221 -11.591   8.358
  644   1HH1  ARG  80          1HH1      ARG  80  -3.991 -10.014  10.517
  645   2HH1  ARG  80          2HH1      ARG  80  -4.731 -10.644  11.951
  646   1HH2  ARG  80          1HH2      ARG  80  -7.204 -12.427  10.239
  647   2HH2  ARG  80          2HH2      ARG  80  -6.558 -12.018  11.792
  648    H    CYS  81           H        CYS  81  -2.519  -9.916   4.733
  649    HA   CYS  81           HA       CYS  81  -3.499 -10.326   1.998
  650   1HB   CYS  81          1HB       CYS  81  -4.435  -8.381   3.072
  651   2HB   CYS  81          2HB       CYS  81  -2.837  -7.809   3.534
  652    HG   CYS  81           HG       CYS  81  -2.064  -6.927   1.121
  653    H    HIS  82           H        HIS  82  -2.199 -10.086   0.223
  654    HA   HIS  82           HA       HIS  82   0.634 -10.393   0.670
  655   1HB   HIS  82          1HB       HIS  82  -0.754 -11.632  -1.085
  656   2HB   HIS  82          2HB       HIS  82  -0.729 -10.132  -2.007
  657    HD1  HIS  82           1HD      HIS  82   1.714 -12.633  -0.527
  658    HD2  HIS  82           2HD      HIS  82   1.463  -9.831  -3.584
  659    HE1  HIS  82           1HE      HIS  82   3.835 -12.893  -1.853
  660    H    ILE  83           H        ILE  83   2.212  -8.927   0.328
  661    HA   ILE  83           HA       ILE  83   1.371  -6.240  -0.539
  662    HB   ILE  83           HB       ILE  83   3.839  -6.786   1.084
  663   1HG1  ILE  83          1HG1      ILE  83   1.047  -6.257   2.122
  664   2HG1  ILE  83          2HG1      ILE  83   1.975  -7.737   2.341
  665   1HG2  ILE  83          1HG2      ILE  83   3.417  -4.595  -0.128
  666   2HG2  ILE  83          2HG2      ILE  83   2.110  -4.330   1.025
  667   3HG2  ILE  83          3HG2      ILE  83   3.771  -4.490   1.596
  668   1HD1  ILE  83          1HD1      ILE  83   2.419  -6.785   4.331
  669   2HD1  ILE  83          2HD1      ILE  83   3.691  -5.989   3.404
  670   3HD1  ILE  83          3HD1      ILE  83   2.176  -5.146   3.728
  671    H    GLU  84           H        GLU  84   2.459  -5.219  -2.145
  672    HA   GLU  84           HA       GLU  84   4.831  -6.554  -3.260
  673   1HB   GLU  84          1HB       GLU  84   2.270  -6.338  -4.484
  674   2HB   GLU  84          2HB       GLU  84   3.375  -5.293  -5.366
  675   1HG   GLU  84          1HG       GLU  84   4.882  -7.141  -5.744
  676   2HG   GLU  84          2HG       GLU  84   3.864  -8.202  -4.772
  677    H    LYS  85           H        LYS  85   6.066  -5.114  -4.756
  678    HA   LYS  85           HA       LYS  85   6.361  -2.509  -3.518
  679   1HB   LYS  85          1HB       LYS  85   7.967  -3.871  -5.689
  680   2HB   LYS  85          2HB       LYS  85   8.384  -2.335  -4.941
  681   1HG   LYS  85          1HG       LYS  85   8.206  -3.806  -2.735
  682   2HG   LYS  85          2HG       LYS  85   8.606  -5.089  -3.879
  683   1HD   LYS  85          1HD       LYS  85  10.182  -2.533  -3.721
  684   2HD   LYS  85          2HD       LYS  85  10.550  -3.928  -2.705
  685   1HE   LYS  85          1HE       LYS  85  10.250  -4.390  -5.620
  686   2HE   LYS  85          2HE       LYS  85  11.696  -3.542  -5.076
  687   1HZ   LYS  85          1HZ       LYS  85  12.317  -5.755  -5.032
  688   2HZ   LYS  85          2HZ       LYS  85  10.821  -6.286  -4.448
  689   3HZ   LYS  85          3HZ       LYS  85  11.889  -5.472  -3.420
  690    H    ALA  86           H        ALA  86   5.784  -0.603  -4.377
  691    HA   ALA  86           HA       ALA  86   4.306  -0.637  -6.889
  692   1HB   ALA  86          1HB       ALA  86   4.269   1.956  -5.858
  693   2HB   ALA  86          2HB       ALA  86   2.995   0.742  -5.744
  694   3HB   ALA  86          3HB       ALA  86   4.188   0.893  -4.453
  695    H    LYS  87           H        LYS  87   4.702   0.867  -8.580
  696    HA   LYS  87           HA       LYS  87   7.201   2.346  -8.558
  697   1HB   LYS  87          1HB       LYS  87   8.101   1.292 -10.540
  698   2HB   LYS  87          2HB       LYS  87   7.831   0.068  -9.306
  699   1HG   LYS  87          1HG       LYS  87   5.904  -0.752 -10.414
  700   2HG   LYS  87          2HG       LYS  87   5.875   0.623 -11.520
  701   1HD   LYS  87          1HD       LYS  87   7.773  -0.134 -12.681
  702   2HD   LYS  87          2HD       LYS  87   8.209  -1.265 -11.399
  703   1HE   LYS  87          1HE       LYS  87   6.559  -2.779 -12.001
  704   2HE   LYS  87          2HE       LYS  87   5.605  -1.558 -12.841
  705   1HZ   LYS  87          1HZ       LYS  87   7.682  -3.245 -13.845
  706   2HZ   LYS  87          2HZ       LYS  87   7.971  -1.616 -14.198
  707   3HZ   LYS  87          3HZ       LYS  87   6.525  -2.344 -14.689
  708    H    GLY  88           H        GLY  88   7.235   4.055  -9.987
  709   1HA   GLY  88          1HA       GLY  88   6.369   4.989 -12.112
  710   2HA   GLY  88          2HA       GLY  88   4.790   4.404 -11.612
  711    H    THR  89           H        THR  89   4.539   6.839 -12.210
  712    HA   THR  89           HA       THR  89   5.280   8.648 -10.069
  713    HB   THR  89           HB       THR  89   4.383  10.407 -11.394
  714    HG1  THR  89           1HG      THR  89   2.790  10.109 -12.779
  715   1HG2  THR  89          1HG2      THR  89   5.708  10.281 -13.311
  716   2HG2  THR  89          2HG2      THR  89   5.435   8.549 -13.501
  717   3HG2  THR  89          3HG2      THR  89   6.482   9.141 -12.212
  718    H    ASP  90           H        ASP  90   3.436  10.226  -9.384
  719    HA   ASP  90           HA       ASP  90   1.669   8.856  -7.742
  720   1HB   ASP  90          1HB       ASP  90   0.626  10.975  -7.298
  721   2HB   ASP  90          2HB       ASP  90   2.352  11.257  -7.506
  722    H    GLN  91           H        GLN  91   1.174  10.158 -10.986
  723    HA   GLN  91           HA       GLN  91  -1.609   9.605 -11.098
  724   1HB   GLN  91          1HB       GLN  91  -0.097  11.148 -12.592
  725   2HB   GLN  91          2HB       GLN  91   0.093   9.691 -13.557
  726   1HG   GLN  91          1HG       GLN  91  -1.768  10.279 -14.601
  727   2HG   GLN  91          2HG       GLN  91  -2.629   9.839 -13.127
  728   1HE2  GLN  91          1HE2      GLN  91  -3.875  11.341 -12.284
  729   2HE2  GLN  91          2HE2      GLN  91  -3.735  13.044 -12.539
  730    H    GLN  92           H        GLN  92   1.277   7.788 -11.941
  731    HA   GLN  92           HA       GLN  92   0.033   5.712 -13.373
  732   1HB   GLN  92          1HB       GLN  92   2.653   6.211 -12.167
  733   2HB   GLN  92          2HB       GLN  92   2.199   4.512 -12.169
  734   1HG   GLN  92          1HG       GLN  92   1.549   5.286 -14.707
  735   2HG   GLN  92          2HG       GLN  92   2.988   6.248 -14.373
  736   1HE2  GLN  92          1HE2      GLN  92   4.946   5.274 -14.282
  737   2HE2  GLN  92          2HE2      GLN  92   5.206   3.595 -14.596
  738    H    ASN  93           H        ASN  93   0.713   6.124  -9.929
  739    HA   ASN  93           HA       ASN  93  -0.314   3.528  -9.234
  740   1HB   ASN  93          1HB       ASN  93   0.638   5.910  -7.665
  741   2HB   ASN  93          2HB       ASN  93  -0.173   4.569  -6.860
  742   1HD2  ASN  93          1HD2      ASN  93   2.153   4.685  -9.530
  743   2HD2  ASN  93          2HD2      ASN  93   3.327   3.665  -8.778
  744    H    LYS  94           H        LYS  94  -1.452   6.876  -8.964
  745    HA   LYS  94           HA       LYS  94  -3.867   6.329  -7.641
  746   1HB   LYS  94          1HB       LYS  94  -2.897   8.586  -7.845
  747   2HB   LYS  94          2HB       LYS  94  -3.242   8.574  -9.569
  748   1HG   LYS  94          1HG       LYS  94  -5.689   8.185  -8.840
  749   2HG   LYS  94          2HG       LYS  94  -5.139   8.765  -7.267
  750   1HD   LYS  94          1HD       LYS  94  -4.705  10.279  -9.835
  751   2HD   LYS  94          2HD       LYS  94  -6.109  10.519  -8.793
  752   1HE   LYS  94          1HE       LYS  94  -4.353  10.870  -6.923
  753   2HE   LYS  94          2HE       LYS  94  -3.224  11.121  -8.253
  754   1HZ   LYS  94          1HZ       LYS  94  -4.820  12.835  -9.092
  755   2HZ   LYS  94          2HZ       LYS  94  -4.053  13.229  -7.637
  756   3HZ   LYS  94          3HZ       LYS  94  -5.658  12.694  -7.629
  757    H    GLU  95           H        GLU  95  -3.101   6.558 -11.095
  758    HA   GLU  95           HA       GLU  95  -5.762   6.135 -11.988
  759   1HB   GLU  95          1HB       GLU  95  -3.089   5.840 -13.355
  760   2HB   GLU  95          2HB       GLU  95  -4.618   5.577 -14.182
  761   1HG   GLU  95          1HG       GLU  95  -4.291   8.130 -12.723
  762   2HG   GLU  95          2HG       GLU  95  -3.355   7.911 -14.201
  763    H    TYR  96           H        TYR  96  -3.065   4.004 -11.268
  764    HA   TYR  96           HA       TYR  96  -3.982   1.652 -12.438
  765   1HB   TYR  96          1HB       TYR  96  -1.727   1.947 -11.454
  766   2HB   TYR  96          2HB       TYR  96  -2.442   1.921  -9.846
  767    HD1  TYR  96           1HD      TYR  96  -3.550  -0.179  -9.036
  768    HD2  TYR  96           2HD      TYR  96  -1.251  -0.061 -12.614
  769    HE1  TYR  96           1HE      TYR  96  -3.351  -2.630  -8.982
  770    HE2  TYR  96           2HE      TYR  96  -1.046  -2.512 -12.570
  771    HH   TYR  96           HH       TYR  96  -2.663  -4.473 -11.398
  772    H    CYS  97           H        CYS  97  -4.443   2.758  -9.079
  773    HA   CYS  97           HA       CYS  97  -6.125   0.650  -8.298
  774   1HB   CYS  97          1HB       CYS  97  -5.974   3.475  -7.226
  775   2HB   CYS  97          2HB       CYS  97  -6.773   2.130  -6.422
  776    HG   CYS  97           HG       CYS  97  -3.469   2.782  -6.726
  777    H    SER  98           H        SER  98  -6.784   3.722  -9.859
  778    HA   SER  98           HA       SER  98  -9.636   3.508  -9.588
  779   1HB   SER  98          1HB       SER  98  -8.274   5.669  -9.837
  780   2HB   SER  98          2HB       SER  98  -8.188   5.278 -11.555
  781    HG   SER  98           HG       SER  98 -10.148   5.982 -11.753
  782    H    LYS  99           H        LYS  99  -7.339   2.091 -11.604
  783    HA   LYS  99           HA       LYS  99  -8.640   1.956 -14.072
  784   1HB   LYS  99          1HB       LYS  99  -6.269   1.220 -13.486
  785   2HB   LYS  99          2HB       LYS  99  -6.985  -0.276 -12.902
  786   1HG   LYS  99          1HG       LYS  99  -7.869  -0.748 -15.107
  787   2HG   LYS  99          2HG       LYS  99  -7.241   0.788 -15.709
  788   1HD   LYS  99          1HD       LYS  99  -5.672  -0.830 -16.386
  789   2HD   LYS  99          2HD       LYS  99  -4.948  -0.047 -14.979
  790   1HE   LYS  99          1HE       LYS  99  -4.844  -1.984 -13.895
  791   2HE   LYS  99          2HE       LYS  99  -6.567  -2.261 -14.141
  792   1HZ   LYS  99          1HZ       LYS  99  -4.441  -3.610 -15.318
  793   2HZ   LYS  99          2HZ       LYS  99  -5.192  -2.731 -16.552
  794   3HZ   LYS  99          3HZ       LYS  99  -6.092  -3.819 -15.620
  795    H    GLU 100           H        GLU 100  -9.378   0.447 -11.080
  796    HA   GLU 100           HA       GLU 100 -10.813  -1.791 -12.114
  797   1HB   GLU 100          1HB       GLU 100 -11.072  -0.460  -9.412
  798   2HB   GLU 100          2HB       GLU 100 -11.640  -2.068  -9.838
  799   1HG   GLU 100          1HG       GLU 100  -9.510  -2.953  -9.898
  800   2HG   GLU 100          2HG       GLU 100  -8.752  -1.380 -10.139
  801    H    GLY 101           H        GLY 101 -11.502   1.536 -11.843
  802   1HA   GLY 101          1HA       GLY 101 -13.349   2.652 -12.716
  803   2HA   GLY 101          2HA       GLY 101 -14.163   1.106 -12.903
  804    H    ASN 102           H        ASN 102 -13.088   0.971  -9.861
  805    HA   ASN 102           HA       ASN 102 -15.335   2.475  -8.715
  806   1HB   ASN 102          1HB       ASN 102 -15.252  -0.326  -8.965
  807   2HB   ASN 102          2HB       ASN 102 -14.909   0.012  -7.271
  808   1HD2  ASN 102          1HD2      ASN 102 -16.792  -0.613  -6.382
  809   2HD2  ASN 102          2HD2      ASN 102 -18.321   0.116  -6.723
  810    H    LEU 103           H        LEU 103 -14.697   3.742  -7.107
  811    HA   LEU 103           HA       LEU 103 -12.058   3.328  -5.933
  812   1HB   LEU 103          1HB       LEU 103 -13.570   5.586  -6.667
  813   2HB   LEU 103          2HB       LEU 103 -13.427   5.631  -4.911
  814    HG   LEU 103           HG       LEU 103 -11.680   6.931  -6.101
  815   1HD1  LEU 103          1HD1      LEU 103  -9.752   5.897  -4.859
  816   2HD1  LEU 103          2HD1      LEU 103 -10.848   4.593  -4.402
  817   3HD1  LEU 103          3HD1      LEU 103 -11.184   6.247  -3.889
  818   1HD2  LEU 103          1HD2      LEU 103  -9.992   4.738  -6.826
  819   2HD2  LEU 103          2HD2      LEU 103 -10.558   6.083  -7.817
  820   3HD2  LEU 103          3HD2      LEU 103 -11.525   4.613  -7.689
  821    H    LEU 104           H        LEU 104 -11.688   2.916  -3.803
  822    HA   LEU 104           HA       LEU 104 -14.057   2.302  -2.169
  823   1HB   LEU 104          1HB       LEU 104 -12.880   0.317  -2.413
  824   2HB   LEU 104          2HB       LEU 104 -11.314   1.120  -2.318
  825    HG   LEU 104           HG       LEU 104 -11.514   1.368   0.057
  826   1HD1  LEU 104          1HD1      LEU 104 -13.696   0.009   0.937
  827   2HD1  LEU 104          2HD1      LEU 104 -14.341   0.820  -0.489
  828   3HD1  LEU 104          3HD1      LEU 104 -13.592   1.764   0.798
  829   1HD2  LEU 104          1HD2      LEU 104 -11.985  -1.308  -1.144
  830   2HD2  LEU 104          2HD2      LEU 104 -12.062  -1.163   0.612
  831   3HD2  LEU 104          3HD2      LEU 104 -10.594  -0.696  -0.248
  832    H    MET 105           H        MET 105 -10.772   3.644  -1.991
  833    HA   MET 105           HA       MET 105 -11.685   5.441   0.126
  834   1HB   MET 105          1HB       MET 105 -10.708   3.835   1.505
  835   2HB   MET 105          2HB       MET 105  -9.440   3.466   0.343
  836   1HG   MET 105          1HG       MET 105  -8.097   5.107   1.082
  837   2HG   MET 105          2HG       MET 105  -9.436   6.212   1.385
  838   1HE   MET 105          1HE       MET 105  -7.737   2.814   3.379
  839   2HE   MET 105          2HE       MET 105  -6.890   4.052   2.450
  840   3HE   MET 105          3HE       MET 105  -6.907   4.129   4.212
  841    H    GLU 106           H        GLU 106 -10.841   7.456  -0.003
  842    HA   GLU 106           HA       GLU 106  -8.567   7.894  -1.812
  843   1HB   GLU 106          1HB       GLU 106 -11.192   8.529  -2.463
  844   2HB   GLU 106          2HB       GLU 106 -10.517  10.054  -1.907
  845   1HG   GLU 106          1HG       GLU 106  -8.731   8.644  -3.707
  846   2HG   GLU 106          2HG       GLU 106 -10.298   8.989  -4.437
  847    H    CYS 107           H        CYS 107  -7.039   8.582  -0.447
  848    HA   CYS 107           HA       CYS 107  -7.499  11.043   1.015
  849   1HB   CYS 107          1HB       CYS 107  -7.003   8.408   2.341
  850   2HB   CYS 107          2HB       CYS 107  -6.302   9.860   3.046
  851    HG   CYS 107           HG       CYS 107  -8.571  11.029   3.813
  852    H    GLY 108           H        GLY 108  -5.329  11.589   2.255
  853   1HA   GLY 108          1HA       GLY 108  -3.049  11.942   2.165
  854   2HA   GLY 108          2HA       GLY 108  -2.924  10.568   1.077
  855    H    ALA 109           H        ALA 109  -1.266  12.272   0.278
  856    HA   ALA 109           HA       ALA 109  -2.576  14.064  -1.658
  857   1HB   ALA 109          1HB       ALA 109  -1.169  15.625  -0.955
  858   2HB   ALA 109          2HB       ALA 109  -0.413  14.475   0.149
  859   3HB   ALA 109          3HB       ALA 109   0.187  14.639  -1.502
  860    HA   PRO 110           HA       PRO 110  -1.019  11.817  -5.090
  861   1HB   PRO 110          1HB       PRO 110  -0.314  13.796  -6.811
  862   2HB   PRO 110          2HB       PRO 110  -1.997  13.395  -6.444
  863   1HG   PRO 110          1HG       PRO 110  -0.289  15.592  -5.340
  864   2HG   PRO 110          2HG       PRO 110  -1.981  15.648  -5.866
  865   1HD   PRO 110          1HD       PRO 110  -1.271  15.475  -3.259
  866   2HD   PRO 110          2HD       PRO 110  -2.755  14.737  -3.895
  867    H    ARG 111           H        ARG 111   0.849  11.134  -3.676
  868    HA   ARG 111           HA       ARG 111   3.358  12.496  -4.042
  869   1HB   ARG 111          1HB       ARG 111   2.424  10.855  -2.107
  870   2HB   ARG 111          2HB       ARG 111   3.350   9.705  -3.062
  871   1HG   ARG 111          1HG       ARG 111   4.717  10.591  -1.288
  872   2HG   ARG 111          2HG       ARG 111   5.329  11.148  -2.846
  873   1HD   ARG 111          1HD       ARG 111   3.416  13.032  -1.926
  874   2HD   ARG 111          2HD       ARG 111   4.521  12.687  -0.597
  875    HE   ARG 111           HE       ARG 111   5.111  14.125  -2.999
  876   1HH1  ARG 111          1HH1      ARG 111   6.466  12.113  -0.502
  877   2HH1  ARG 111          2HH1      ARG 111   8.072  12.734  -0.692
  878   1HH2  ARG 111          1HH2      ARG 111   7.221  14.950  -3.259
  879   2HH2  ARG 111          2HH2      ARG 111   8.501  14.348  -2.260
  880    H    SER 112           H        SER 112   4.801  12.183  -5.608
  881    HA   SER 112           HA       SER 112   4.376   9.925  -7.446
  882   1HB   SER 112          1HB       SER 112   5.298  11.242  -9.192
  883   2HB   SER 112          2HB       SER 112   4.221  12.325  -8.311
  884    HG   SER 112           HG       SER 112   6.264  13.279  -8.750
  885    H    GLN 113           H        GLN 113   6.748   9.838  -8.758
  886    HA   GLN 113           HA       GLN 113   8.411   8.465  -6.884
  887   1HB   GLN 113          1HB       GLN 113   8.247   7.594  -9.114
  888   2HB   GLN 113          2HB       GLN 113   8.761   9.126  -9.808
  889   1HG   GLN 113          1HG       GLN 113  10.971   8.821  -9.167
  890   2HG   GLN 113          2HG       GLN 113  10.553   7.608  -7.958
  891   1HE2  GLN 113          1HE2      GLN 113  12.374   7.677 -10.376
  892   2HE2  GLN 113          2HE2      GLN 113  11.966   6.244 -11.249
  893    H    GLY 114           H        GLY 114   9.405  10.976  -9.209
  894   1HA   GLY 114          1HA       GLY 114  10.635  12.537  -7.096
  895   2HA   GLY 114          2HA       GLY 114  11.765  11.750  -8.188
  896    H    GLN 115           H        GLN 115  12.575  13.294  -9.453
  897    HA   GLN 115           HA       GLN 115  10.695  14.908 -11.013
  898   1HB   GLN 115          1HB       GLN 115  12.585  15.903  -9.023
  899   2HB   GLN 115          2HB       GLN 115  12.804  16.647 -10.601
  900   1HG   GLN 115          1HG       GLN 115  10.348  17.153 -10.593
  901   2HG   GLN 115          2HG       GLN 115  10.320  16.621  -8.912
  902   1HE2  GLN 115          1HE2      GLN 115  11.888  17.727  -7.463
  903   2HE2  GLN 115          2HE2      GLN 115  12.139  19.420  -7.699
  904    H    ARG 116           H        ARG 116  14.185  14.316 -10.560
  905    HA   ARG 116           HA       ARG 116  14.710  14.652 -13.367
  906   1HB   ARG 116          1HB       ARG 116  16.251  14.470 -10.933
  907   2HB   ARG 116          2HB       ARG 116  16.924  13.408 -12.164
  908   1HG   ARG 116          1HG       ARG 116  16.952  15.347 -13.725
  909   2HG   ARG 116          2HG       ARG 116  16.456  16.372 -12.377
  910   1HD   ARG 116          1HD       ARG 116  18.781  16.598 -12.447
  911   2HD   ARG 116          2HD       ARG 116  18.497  15.434 -11.154
  912    HE   ARG 116           HE       ARG 116  18.866  13.950 -13.449
  913   1HH1  ARG 116          1HH1      ARG 116  20.701  16.244 -11.580
  914   2HH1  ARG 116          2HH1      ARG 116  22.235  15.559 -12.003
  915   1HH2  ARG 116          1HH2      ARG 116  20.880  13.039 -14.013
  916   2HH2  ARG 116          2HH2      ARG 116  22.336  13.737 -13.387
  Start of MODEL   25
    1    HA   PRO   2           HA       PRO   2  27.424  -3.392  20.337
    2   1HB   PRO   2          1HB       PRO   2  29.999  -2.643  20.757
    3   2HB   PRO   2          2HB       PRO   2  28.625  -1.822  21.507
    4   1HG   PRO   2          1HG       PRO   2  30.455  -3.891  22.661
    5   2HG   PRO   2          2HG       PRO   2  29.834  -2.406  23.406
    6   1HD   PRO   2          1HD       PRO   2  28.780  -4.847  23.921
    7   2HD   PRO   2          2HD       PRO   2  27.802  -3.365  23.919
    8    H    SER   3           H        SER   3  28.067  -4.104  18.389
    9    HA   SER   3           HA       SER   3  30.446  -5.461  17.822
   10   1HB   SER   3          1HB       SER   3  28.899  -7.646  17.183
   11   2HB   SER   3          2HB       SER   3  29.956  -7.527  18.590
   12    HG   SER   3           HG       SER   3  27.419  -7.944  18.653
   13    H    LYS   4           H        LYS   4  27.018  -5.261  16.933
   14    HA   LYS   4           HA       LYS   4  25.977  -4.773  14.971
   15   1HB   LYS   4          1HB       LYS   4  28.646  -3.740  14.012
   16   2HB   LYS   4          2HB       LYS   4  27.050  -3.280  13.433
   17   1HG   LYS   4          1HG       LYS   4  27.041  -2.745  16.179
   18   2HG   LYS   4          2HG       LYS   4  28.600  -2.176  15.579
   19   1HD   LYS   4          1HD       LYS   4  27.280  -1.038  13.718
   20   2HD   LYS   4          2HD       LYS   4  25.844  -1.366  14.689
   21   1HE   LYS   4          1HE       LYS   4  27.370  -0.261  16.575
   22   2HE   LYS   4          2HE       LYS   4  28.079   0.525  15.165
   23   1HZ   LYS   4          1HZ       LYS   4  26.403   1.951  15.262
   24   2HZ   LYS   4          2HZ       LYS   4  25.607   1.054  16.455
   25   3HZ   LYS   4          3HZ       LYS   4  25.354   0.699  14.820
   26    H    LYS   5           H        LYS   5  26.335  -7.306  15.045
   27    HA   LYS   5           HA       LYS   5  27.951  -8.256  12.821
   28   1HB   LYS   5          1HB       LYS   5  27.574  -9.411  15.142
   29   2HB   LYS   5          2HB       LYS   5  26.090  -9.995  14.400
   30   1HG   LYS   5          1HG       LYS   5  27.244 -11.240  12.795
   31   2HG   LYS   5          2HG       LYS   5  28.753 -10.369  13.077
   32   1HD   LYS   5          1HD       LYS   5  28.718 -11.343  15.415
   33   2HD   LYS   5          2HD       LYS   5  27.412 -12.392  14.859
   34   1HE   LYS   5          1HE       LYS   5  29.593 -12.440  12.989
   35   2HE   LYS   5          2HE       LYS   5  30.177 -12.808  14.612
   36   1HZ   LYS   5          1HZ       LYS   5  28.089 -14.359  14.616
   37   2HZ   LYS   5          2HZ       LYS   5  29.541 -14.867  13.913
   38   3HZ   LYS   5          3HZ       LYS   5  28.285 -14.292  12.937
   39    H    ASN   6           H        ASN   6  27.000  -7.603  10.941
   40    HA   ASN   6           HA       ASN   6  24.276  -8.610  10.443
   41   1HB   ASN   6          1HB       ASN   6  25.542  -5.994   9.707
   42   2HB   ASN   6          2HB       ASN   6  24.281  -6.669   8.680
   43   1HD2  ASN   6          1HD2      ASN   6  24.787  -4.543  11.047
   44   2HD2  ASN   6          2HD2      ASN   6  23.254  -4.582  11.843
   45    H    GLY   7           H        GLY   7  24.267 -10.206   9.012
   46   1HA   GLY   7          1HA       GLY   7  26.471 -10.364   7.066
   47   2HA   GLY   7          2HA       GLY   7  25.493 -11.721   7.604
   48    H    ARG   8           H        ARG   8  22.945 -10.784   7.281
   49    HA   ARG   8           HA       ARG   8  22.690 -10.892   4.407
   50   1HB   ARG   8          1HB       ARG   8  20.325 -11.169   4.803
   51   2HB   ARG   8          2HB       ARG   8  21.214 -12.198   5.919
   52   1HG   ARG   8          1HG       ARG   8  20.869 -10.582   7.707
   53   2HG   ARG   8          2HG       ARG   8  20.004  -9.523   6.590
   54   1HD   ARG   8          1HD       ARG   8  18.665 -11.868   6.262
   55   2HD   ARG   8          2HD       ARG   8  19.113 -11.959   7.964
   56    HE   ARG   8           HE       ARG   8  17.623 -10.278   8.414
   57   1HH1  ARG   8          1HH1      ARG   8  18.193 -10.421   4.982
   58   2HH1  ARG   8          2HH1      ARG   8  16.938  -9.291   4.595
   59   1HH2  ARG   8          1HH2      ARG   8  15.968  -8.790   7.917
   60   2HH2  ARG   8          2HH2      ARG   8  15.673  -8.363   6.265
   61    H    SER   9           H        SER   9  21.838  -9.333   3.070
   62    HA   SER   9           HA       SER   9  20.676  -6.913   3.958
   63   1HB   SER   9          1HB       SER   9  22.582  -5.861   4.590
   64   2HB   SER   9          2HB       SER   9  23.612  -6.986   3.704
   65    HG   SER   9           HG       SER   9  23.721  -5.576   2.164
   66    H    GLY  10           H        GLY  10  19.585  -5.994   2.315
   67   1HA   GLY  10          1HA       GLY  10  20.464  -5.966  -0.381
   68   2HA   GLY  10          2HA       GLY  10  19.301  -7.262  -0.142
   69    HA   PRO  11           HA       PRO  11  15.939  -4.492  -0.580
   70   1HB   PRO  11          1HB       PRO  11  14.196  -5.307   1.336
   71   2HB   PRO  11          2HB       PRO  11  14.527  -6.246  -0.124
   72   1HG   PRO  11          1HG       PRO  11  15.629  -6.588   2.638
   73   2HG   PRO  11          2HG       PRO  11  15.058  -7.823   1.501
   74   1HD   PRO  11          1HD       PRO  11  17.686  -7.281   1.863
   75   2HD   PRO  11          2HD       PRO  11  17.026  -7.810   0.302
   76    H    GLN  12           H        GLN  12  15.261  -2.507   0.078
   77    HA   GLN  12           HA       GLN  12  15.909  -1.678   2.826
   78   1HB   GLN  12          1HB       GLN  12  16.758  -0.488   0.253
   79   2HB   GLN  12          2HB       GLN  12  16.225   0.646   1.487
   80   1HG   GLN  12          1HG       GLN  12  17.844  -0.641   3.033
   81   2HG   GLN  12          2HG       GLN  12  18.545  -1.233   1.528
   82   1HE2  GLN  12          1HE2      GLN  12  18.775   0.684  -0.129
   83   2HE2  GLN  12          2HE2      GLN  12  19.597   2.065   0.504
   84    HA   PRO  13           HA       PRO  13  11.875   0.017   3.109
   85   1HB   PRO  13          1HB       PRO  13  12.292   2.296   4.525
   86   2HB   PRO  13          2HB       PRO  13  12.405   0.685   5.242
   87   1HG   PRO  13          1HG       PRO  13  14.592   2.486   4.275
   88   2HG   PRO  13          2HG       PRO  13  14.521   1.506   5.751
   89   1HD   PRO  13          1HD       PRO  13  15.888   0.726   3.547
   90   2HD   PRO  13          2HD       PRO  13  15.102  -0.430   4.643
   91    H    HIS  14           H        HIS  14  10.468   1.422   2.115
   92    HA   HIS  14           HA       HIS  14  11.599   3.673   0.611
   93   1HB   HIS  14          1HB       HIS  14   9.764   1.554  -0.525
   94   2HB   HIS  14          2HB       HIS  14  10.183   3.055  -1.344
   95    HD1  HIS  14           1HD      HIS  14  11.508  -0.316  -0.508
   96    HD2  HIS  14           2HD      HIS  14  12.821   3.169  -2.349
   97    HE1  HIS  14           1HE      HIS  14  13.641  -0.940  -1.685
   98    H    LYS  15           H        LYS  15   9.608   4.875  -0.485
   99    HA   LYS  15           HA       LYS  15   7.707   5.363   1.701
  100   1HB   LYS  15          1HB       LYS  15   7.298   7.535   0.466
  101   2HB   LYS  15          2HB       LYS  15   8.900   7.344   1.167
  102   1HG   LYS  15          1HG       LYS  15   8.872   6.344  -1.524
  103   2HG   LYS  15          2HG       LYS  15   8.254   7.997  -1.473
  104   1HD   LYS  15          1HD       LYS  15  10.758   7.272   0.000
  105   2HD   LYS  15          2HD       LYS  15  10.807   7.593  -1.735
  106   1HE   LYS  15          1HE       LYS  15  10.083   9.807  -1.455
  107   2HE   LYS  15          2HE       LYS  15   9.521   9.506   0.189
  108   1HZ   LYS  15          1HZ       LYS  15  12.289   9.829  -0.782
  109   2HZ   LYS  15          2HZ       LYS  15  11.971   9.034   0.677
  110   3HZ   LYS  15          3HZ       LYS  15  11.503  10.647   0.474
  111    H    ARG  16           H        ARG  16   7.760   3.475  -0.853
  112    HA   ARG  16           HA       ARG  16   4.932   3.967  -1.504
  113   1HB   ARG  16          1HB       ARG  16   7.108   3.092  -3.413
  114   2HB   ARG  16          2HB       ARG  16   5.394   3.152  -3.802
  115   1HG   ARG  16          1HG       ARG  16   5.444   5.597  -3.307
  116   2HG   ARG  16          2HG       ARG  16   7.196   5.468  -3.146
  117   1HD   ARG  16          1HD       ARG  16   5.688   4.613  -5.607
  118   2HD   ARG  16          2HD       ARG  16   6.361   6.229  -5.396
  119    HE   ARG  16           HE       ARG  16   7.792   3.838  -6.046
  120   1HH1  ARG  16          1HH1      ARG  16   8.032   6.952  -4.509
  121   2HH1  ARG  16          2HH1      ARG  16   9.744   7.081  -4.743
  122   1HH2  ARG  16          1HH2      ARG  16  10.046   3.995  -6.360
  123   2HH2  ARG  16          2HH2      ARG  16  10.888   5.399  -5.797
  124    H    TRP  17           H        TRP  17   3.670   2.303  -1.021
  125    HA   TRP  17           HA       TRP  17   4.670  -0.421  -1.302
  126   1HB   TRP  17          1HB       TRP  17   3.677   0.765   1.287
  127   2HB   TRP  17          2HB       TRP  17   3.669  -0.970   0.984
  128    HD1  TRP  17           HD       TRP  17   5.918   1.838   2.048
  129    HE1  TRP  17           1HE      TRP  17   8.287   0.932   2.489
  130    HE3  TRP  17           3HE      TRP  17   5.380  -2.844   0.065
  131    HZ2  TRP  17           2HZ      TRP  17   9.736  -1.451   2.053
  132    HZ3  TRP  17           3HZ      TRP  17   7.305  -4.375   0.117
  133    HH2  TRP  17           HH       TRP  17   9.437  -3.691   1.090
  134    H    VAL  18           H        VAL  18   3.140  -1.826  -1.974
  135    HA   VAL  18           HA       VAL  18   0.378  -0.812  -2.138
  136    HB   VAL  18           HB       VAL  18   0.078  -2.285  -4.084
  137   1HG1  VAL  18          1HG1      VAL  18   2.417  -0.392  -4.291
  138   2HG1  VAL  18          2HG1      VAL  18   1.499  -1.024  -5.659
  139   3HG1  VAL  18          3HG1      VAL  18   0.712   0.017  -4.472
  140   1HG2  VAL  18          1HG2      VAL  18   2.341  -3.568  -3.131
  141   2HG2  VAL  18          2HG2      VAL  18   1.523  -3.882  -4.661
  142   3HG2  VAL  18          3HG2      VAL  18   2.888  -2.768  -4.604
  143    H    PHE  19           H        PHE  19  -1.340  -2.410  -2.014
  144    HA   PHE  19           HA       PHE  19  -0.606  -4.861  -0.573
  145   1HB   PHE  19          1HB       PHE  19  -2.636  -4.470   0.893
  146   2HB   PHE  19          2HB       PHE  19  -1.271  -3.396   1.183
  147    HD1  PHE  19           1HD      PHE  19  -1.339  -1.066   0.290
  148    HD2  PHE  19           2HD      PHE  19  -4.735  -3.632   0.239
  149    HE1  PHE  19           1HE      PHE  19  -2.805   0.885  -0.024
  150    HE2  PHE  19           2HE      PHE  19  -6.206  -1.685  -0.076
  151    HZ   PHE  19           HZ       PHE  19  -5.241   0.577  -0.209
  152    H    THR  20           H        THR  20  -1.937  -6.624  -0.913
  153    HA   THR  20           HA       THR  20  -4.317  -6.322  -2.559
  154    HB   THR  20           HB       THR  20  -3.614  -7.904  -4.255
  155    HG1  THR  20           1HG      THR  20  -0.971  -7.855  -3.259
  156   1HG2  THR  20          1HG2      THR  20  -3.084  -5.464  -4.522
  157   2HG2  THR  20          2HG2      THR  20  -2.057  -6.547  -5.461
  158   3HG2  THR  20          3HG2      THR  20  -1.448  -5.825  -3.972
  159    H    LEU  21           H        LEU  21  -5.851  -7.689  -1.909
  160    HA   LEU  21           HA       LEU  21  -5.092 -10.243  -0.698
  161   1HB   LEU  21          1HB       LEU  21  -5.405  -8.564   1.107
  162   2HB   LEU  21          2HB       LEU  21  -7.064  -8.340   0.557
  163    HG   LEU  21           HG       LEU  21  -7.067 -11.002   0.980
  164   1HD1  LEU  21          1HD1      LEU  21  -5.919 -11.359   3.169
  165   2HD1  LEU  21          2HD1      LEU  21  -5.077  -9.832   2.913
  166   3HD1  LEU  21          3HD1      LEU  21  -4.832 -11.172   1.793
  167   1HD2  LEU  21          1HD2      LEU  21  -7.464  -9.100   3.267
  168   2HD2  LEU  21          2HD2      LEU  21  -8.373 -10.558   2.867
  169   3HD2  LEU  21          3HD2      LEU  21  -8.544  -9.111   1.873
  170    H    ASN  22           H        ASN  22  -6.417 -11.895  -1.219
  171    HA   ASN  22           HA       ASN  22  -8.524 -11.368  -3.133
  172   1HB   ASN  22          1HB       ASN  22  -6.760 -13.288  -3.182
  173   2HB   ASN  22          2HB       ASN  22  -7.859 -14.095  -2.068
  174   1HD2  ASN  22          1HD2      ASN  22  -7.166 -13.378  -5.290
  175   2HD2  ASN  22          2HD2      ASN  22  -8.606 -14.017  -6.001
  176    H    ASN  23           H        ASN  23 -10.649 -11.388  -2.744
  177    HA   ASN  23           HA       ASN  23 -12.600 -11.347  -1.565
  178   1HB   ASN  23          1HB       ASN  23 -12.434 -13.754  -1.911
  179   2HB   ASN  23          2HB       ASN  23 -11.426 -13.915  -0.475
  180   1HD2  ASN  23          1HD2      ASN  23 -14.365 -12.025  -1.014
  181   2HD2  ASN  23          2HD2      ASN  23 -15.296 -12.794   0.223
  182    HA   PRO  24           HA       PRO  24 -10.441  -9.647   2.217
  183   1HB   PRO  24          1HB       PRO  24 -11.265  -7.086   1.854
  184   2HB   PRO  24          2HB       PRO  24  -9.785  -7.729   1.135
  185   1HG   PRO  24          1HG       PRO  24 -12.483  -7.349  -0.105
  186   2HG   PRO  24          2HG       PRO  24 -10.881  -6.997  -0.781
  187   1HD   PRO  24          1HD       PRO  24 -12.277  -9.227  -1.424
  188   2HD   PRO  24          2HD       PRO  24 -10.503  -9.197  -1.356
  189    H    SER  25           H        SER  25 -11.426  -9.181   4.160
  190    HA   SER  25           HA       SER  25 -14.297  -9.625   4.250
  191   1HB   SER  25          1HB       SER  25 -12.155 -10.319   5.920
  192   2HB   SER  25          2HB       SER  25 -13.078  -9.123   6.830
  193    HG   SER  25           HG       SER  25 -13.748 -11.694   6.099
  194    H    GLU  26           H        GLU  26 -15.705  -8.274   5.552
  195    HA   GLU  26           HA       GLU  26 -15.532  -5.556   4.882
  196   1HB   GLU  26          1HB       GLU  26 -17.362  -7.280   6.348
  197   2HB   GLU  26          2HB       GLU  26 -17.260  -5.674   7.056
  198   1HG   GLU  26          1HG       GLU  26 -18.260  -4.679   5.295
  199   2HG   GLU  26          2HG       GLU  26 -17.562  -5.796   4.125
  200    H    ASP  27           H        ASP  27 -14.434  -7.335   7.668
  201    HA   ASP  27           HA       ASP  27 -14.008  -5.034   9.324
  202   1HB   ASP  27          1HB       ASP  27 -13.876  -7.877   9.621
  203   2HB   ASP  27          2HB       ASP  27 -12.356  -7.180  10.175
  204    H    GLU  28           H        GLU  28 -11.957  -7.098   7.303
  205    HA   GLU  28           HA       GLU  28  -9.533  -5.755   7.934
  206   1HB   GLU  28          1HB       GLU  28 -10.259  -8.054   6.522
  207   2HB   GLU  28          2HB       GLU  28  -9.522  -7.005   5.319
  208   1HG   GLU  28          1HG       GLU  28  -8.179  -7.513   7.942
  209   2HG   GLU  28          2HG       GLU  28  -8.035  -8.656   6.607
  210    H    ARG  29           H        ARG  29 -11.728  -5.595   5.141
  211    HA   ARG  29           HA       ARG  29 -10.310  -3.672   3.684
  212   1HB   ARG  29          1HB       ARG  29 -12.082  -4.949   2.652
  213   2HB   ARG  29          2HB       ARG  29 -13.268  -4.277   3.762
  214   1HG   ARG  29          1HG       ARG  29 -12.023  -2.095   2.493
  215   2HG   ARG  29          2HG       ARG  29 -12.396  -3.279   1.238
  216   1HD   ARG  29          1HD       ARG  29 -14.523  -2.822   3.220
  217   2HD   ARG  29          2HD       ARG  29 -14.150  -1.446   2.183
  218    HE   ARG  29           HE       ARG  29 -14.466  -3.873   0.707
  219   1HH1  ARG  29          1HH1      ARG  29 -16.183  -1.257   2.232
  220   2HH1  ARG  29          2HH1      ARG  29 -17.579  -1.408   1.216
  221   1HH2  ARG  29          1HH2      ARG  29 -16.298  -4.082  -0.636
  222   2HH2  ARG  29          2HH2      ARG  29 -17.643  -3.016  -0.414
  223    H    LYS  30           H        LYS  30 -12.655  -3.352   6.282
  224    HA   LYS  30           HA       LYS  30 -13.004  -0.540   6.041
  225   1HB   LYS  30          1HB       LYS  30 -13.668  -2.605   8.092
  226   2HB   LYS  30          2HB       LYS  30 -13.716  -0.912   8.565
  227   1HG   LYS  30          1HG       LYS  30 -15.116  -1.630   6.064
  228   2HG   LYS  30          2HG       LYS  30 -15.823  -2.210   7.574
  229   1HD   LYS  30          1HD       LYS  30 -15.065   0.497   7.954
  230   2HD   LYS  30          2HD       LYS  30 -15.949   0.395   6.430
  231   1HE   LYS  30          1HE       LYS  30 -17.758   0.568   7.760
  232   2HE   LYS  30          2HE       LYS  30 -17.499  -1.158   8.007
  233   1HZ   LYS  30          1HZ       LYS  30 -17.456  -0.606  10.157
  234   2HZ   LYS  30          2HZ       LYS  30 -17.170   1.032   9.852
  235   3HZ   LYS  30          3HZ       LYS  30 -15.881  -0.064   9.858
  236    H    LYS  31           H        LYS  31 -10.784  -2.594   7.827
  237    HA   LYS  31           HA       LYS  31  -9.709  -0.661   9.552
  238   1HB   LYS  31          1HB       LYS  31  -9.236  -2.956   9.979
  239   2HB   LYS  31          2HB       LYS  31  -8.549  -3.184   8.377
  240   1HG   LYS  31          1HG       LYS  31  -6.670  -1.751   8.965
  241   2HG   LYS  31          2HG       LYS  31  -7.365  -1.487  10.566
  242   1HD   LYS  31          1HD       LYS  31  -6.646  -3.473  11.329
  243   2HD   LYS  31          2HD       LYS  31  -7.087  -4.309   9.838
  244   1HE   LYS  31          1HE       LYS  31  -4.755  -4.492   9.949
  245   2HE   LYS  31          2HE       LYS  31  -5.041  -3.179   8.809
  246   1HZ   LYS  31          1HZ       LYS  31  -4.457  -2.764  11.688
  247   2HZ   LYS  31          2HZ       LYS  31  -4.527  -1.583  10.479
  248   3HZ   LYS  31          3HZ       LYS  31  -3.279  -2.725  10.474
  249    H    ILE  32           H        ILE  32  -8.529  -1.791   6.385
  250    HA   ILE  32           HA       ILE  32  -6.383   0.037   6.229
  251    HB   ILE  32           HB       ILE  32  -7.833  -1.613   4.187
  252   1HG1  ILE  32          1HG1      ILE  32  -4.949  -1.571   5.100
  253   2HG1  ILE  32          2HG1      ILE  32  -6.183  -2.657   5.729
  254   1HG2  ILE  32          1HG2      ILE  32  -6.053  -0.838   2.563
  255   2HG2  ILE  32          2HG2      ILE  32  -7.336   0.316   2.923
  256   3HG2  ILE  32          3HG2      ILE  32  -5.752   0.495   3.677
  257   1HD1  ILE  32          1HD1      ILE  32  -4.493  -3.070   3.548
  258   2HD1  ILE  32          2HD1      ILE  32  -5.845  -4.076   4.069
  259   3HD1  ILE  32          3HD1      ILE  32  -6.099  -2.810   2.868
  260    H    ARG  33           H        ARG  33  -9.717   0.160   5.056
  261    HA   ARG  33           HA       ARG  33  -9.423   2.625   3.666
  262   1HB   ARG  33          1HB       ARG  33 -11.215   1.166   3.036
  263   2HB   ARG  33          2HB       ARG  33 -11.847   1.140   4.677
  264   1HG   ARG  33          1HG       ARG  33 -12.813   3.205   4.488
  265   2HG   ARG  33          2HG       ARG  33 -11.668   3.748   3.260
  266   1HD   ARG  33          1HD       ARG  33 -13.276   3.339   1.770
  267   2HD   ARG  33          2HD       ARG  33 -12.954   1.628   2.051
  268    HE   ARG  33           HE       ARG  33 -14.932   1.473   3.204
  269   1HH1  ARG  33          1HH1      ARG  33 -14.122   4.826   2.733
  270   2HH1  ARG  33          2HH1      ARG  33 -15.653   5.410   3.297
  271   1HH2  ARG  33          1HH2      ARG  33 -16.951   2.230   3.948
  272   2HH2  ARG  33          2HH2      ARG  33 -17.261   3.932   3.989
  273    H    ASP  34           H        ASP  34  -9.848   1.793   6.967
  274    HA   ASP  34           HA       ASP  34 -10.734   4.496   7.667
  275   1HB   ASP  34          1HB       ASP  34 -11.877   2.513   8.680
  276   2HB   ASP  34          2HB       ASP  34 -10.363   2.107   9.484
  277    H    LEU  35           H        LEU  35  -7.916   3.249   6.913
  278    HA   LEU  35           HA       LEU  35  -6.241   3.730   9.132
  279   1HB   LEU  35          1HB       LEU  35  -5.824   3.482   6.187
  280   2HB   LEU  35          2HB       LEU  35  -4.502   4.055   7.202
  281    HG   LEU  35           HG       LEU  35  -5.915   1.419   7.590
  282   1HD1  LEU  35          1HD1      LEU  35  -4.819   1.284   5.490
  283   2HD1  LEU  35          2HD1      LEU  35  -3.782   0.473   6.663
  284   3HD1  LEU  35          3HD1      LEU  35  -3.384   2.100   6.112
  285   1HD2  LEU  35          1HD2      LEU  35  -4.877   2.298   9.606
  286   2HD2  LEU  35          2HD2      LEU  35  -3.361   2.542   8.739
  287   3HD2  LEU  35          3HD2      LEU  35  -3.975   0.909   9.000
  288    HA   PRO  36           HA       PRO  36  -5.743   8.087   9.270
  289   1HB   PRO  36          1HB       PRO  36  -3.087   8.358   9.765
  290   2HB   PRO  36          2HB       PRO  36  -4.234   7.766  10.973
  291   1HG   PRO  36          1HG       PRO  36  -2.374   6.219   9.210
  292   2HG   PRO  36          2HG       PRO  36  -2.737   5.987  10.930
  293   1HD   PRO  36          1HD       PRO  36  -3.849   4.463   8.988
  294   2HD   PRO  36          2HD       PRO  36  -4.701   4.863  10.493
  295    H    ILE  37           H        ILE  37  -5.916   9.363   7.542
  296    HA   ILE  37           HA       ILE  37  -4.524   8.916   5.107
  297    HB   ILE  37           HB       ILE  37  -5.464  11.156   4.449
  298   1HG1  ILE  37          1HG1      ILE  37  -6.791  10.984   7.163
  299   2HG1  ILE  37          2HG1      ILE  37  -5.503  12.108   6.744
  300   1HG2  ILE  37          1HG2      ILE  37  -6.729   8.685   4.838
  301   2HG2  ILE  37          2HG2      ILE  37  -7.882   9.911   5.364
  302   3HG2  ILE  37          3HG2      ILE  37  -7.205   9.977   3.736
  303   1HD1  ILE  37          1HD1      ILE  37  -7.278  12.656   4.795
  304   2HD1  ILE  37          2HD1      ILE  37  -8.364  12.185   6.103
  305   3HD1  ILE  37          3HD1      ILE  37  -7.211  13.498   6.342
  306    H    SER  38           H        SER  38  -4.016  11.042   7.853
  307    HA   SER  38           HA       SER  38  -2.080  12.724   6.665
  308   1HB   SER  38          1HB       SER  38  -3.271  13.302   8.750
  309   2HB   SER  38          2HB       SER  38  -2.425  12.001   9.586
  310    HG   SER  38           HG       SER  38  -1.276  14.312   8.407
  311    H    LEU  39           H        LEU  39  -1.951   9.497   7.813
  312    HA   LEU  39           HA       LEU  39   0.856   9.419   8.373
  313   1HB   LEU  39          1HB       LEU  39  -1.231   7.802   8.970
  314   2HB   LEU  39          2HB       LEU  39  -0.504   6.916   7.631
  315    HG   LEU  39           HG       LEU  39   1.331   7.793   9.779
  316   1HD1  LEU  39          1HD1      LEU  39  -0.612   7.076  11.071
  317   2HD1  LEU  39          2HD1      LEU  39   0.721   5.933  11.229
  318   3HD1  LEU  39          3HD1      LEU  39  -0.646   5.553  10.183
  319   1HD2  LEU  39          1HD2      LEU  39   0.975   5.201   8.277
  320   2HD2  LEU  39          2HD2      LEU  39   2.322   5.620   9.336
  321   3HD2  LEU  39          3HD2      LEU  39   2.077   6.503   7.829
  322    H    PHE  40           H        PHE  40  -1.138   8.990   5.556
  323    HA   PHE  40           HA       PHE  40   1.287   8.426   3.981
  324   1HB   PHE  40          1HB       PHE  40  -1.438   7.496   3.120
  325   2HB   PHE  40          2HB       PHE  40   0.141   6.919   2.597
  326    HD1  PHE  40           2HD      PHE  40  -2.396   6.772   5.231
  327    HD2  PHE  40           1HD      PHE  40   1.363   5.299   3.884
  328    HE1  PHE  40           2HE      PHE  40  -2.523   4.950   6.880
  329    HE2  PHE  40           1HE      PHE  40   1.241   3.473   5.529
  330    HZ   PHE  40           HZ       PHE  40  -0.703   3.298   7.031
  331    H    ASP  41           H        ASP  41   1.779  10.124   2.775
  332    HA   ASP  41           HA       ASP  41   0.205  12.350   2.320
  333   1HB   ASP  41          1HB       ASP  41   2.689  11.253   1.159
  334   2HB   ASP  41          2HB       ASP  41   1.827  12.402   0.139
  335    H    TYR  42           H        TYR  42   0.281   9.318   0.617
  336    HA   TYR  42           HA       TYR  42  -1.971  10.230  -1.023
  337   1HB   TYR  42          1HB       TYR  42   0.004  10.396  -2.455
  338   2HB   TYR  42          2HB       TYR  42   0.432   8.729  -2.086
  339    HD1  TYR  42           1HD      TYR  42  -2.989   9.962  -2.770
  340    HD2  TYR  42           2HD      TYR  42   0.369   7.828  -4.277
  341    HE1  TYR  42           1HE      TYR  42  -4.338   9.199  -4.680
  342    HE2  TYR  42           2HE      TYR  42  -0.970   7.060  -6.192
  343    HH   TYR  42           HH       TYR  42  -4.223   8.256  -6.756
  344    H    PHE  43           H        PHE  43  -3.629   8.880  -0.870
  345    HA   PHE  43           HA       PHE  43  -3.112   6.034  -0.359
  346   1HB   PHE  43          1HB       PHE  43  -3.937   7.635   1.645
  347   2HB   PHE  43          2HB       PHE  43  -5.498   7.212   0.949
  348    HD1  PHE  43           1HD      PHE  43  -4.332   4.414   0.013
  349    HD2  PHE  43           2HD      PHE  43  -4.540   6.495   3.720
  350    HE1  PHE  43           1HE      PHE  43  -4.287   2.268   1.216
  351    HE2  PHE  43           2HE      PHE  43  -4.494   4.352   4.929
  352    HZ   PHE  43           HZ       PHE  43  -4.367   2.235   3.677
  353    H    ILE  44           H        ILE  44  -3.939   4.923  -1.991
  354    HA   ILE  44           HA       ILE  44  -6.603   5.641  -2.989
  355    HB   ILE  44           HB       ILE  44  -5.266   6.591  -4.674
  356   1HG1  ILE  44          1HG1      ILE  44  -5.542   3.918  -5.950
  357   2HG1  ILE  44          2HG1      ILE  44  -6.997   4.638  -5.271
  358   1HG2  ILE  44          1HG2      ILE  44  -3.095   5.889  -4.223
  359   2HG2  ILE  44          2HG2      ILE  44  -3.526   4.182  -4.308
  360   3HG2  ILE  44          3HG2      ILE  44  -3.445   5.144  -5.783
  361   1HD1  ILE  44          1HD1      ILE  44  -7.219   5.714  -7.192
  362   2HD1  ILE  44          2HD1      ILE  44  -5.828   6.689  -6.718
  363   3HD1  ILE  44          3HD1      ILE  44  -5.599   5.253  -7.716
  364    H    VAL  45           H        VAL  45  -7.879   3.941  -2.744
  365    HA   VAL  45           HA       VAL  45  -6.733   1.250  -3.123
  366    HB   VAL  45           HB       VAL  45  -9.112   1.713  -1.361
  367   1HG1  VAL  45          1HG1      VAL  45  -8.927  -0.523  -1.430
  368   2HG1  VAL  45          2HG1      VAL  45  -7.256  -0.467  -1.994
  369   3HG1  VAL  45          3HG1      VAL  45  -7.615  -0.283  -0.277
  370   1HG2  VAL  45          1HG2      VAL  45  -7.346   1.639   0.538
  371   2HG2  VAL  45          2HG2      VAL  45  -6.241   2.238  -0.699
  372   3HG2  VAL  45          3HG2      VAL  45  -7.677   3.170  -0.272
  373    H    GLY  46           H        GLY  46  -7.805  -0.136  -4.436
  374   1HA   GLY  46          1HA       GLY  46 -10.386   0.794  -5.537
  375   2HA   GLY  46          2HA       GLY  46  -9.133   0.087  -6.546
  376    H    GLU  47           H        GLU  47 -12.017  -0.630  -5.614
  377    HA   GLU  47           HA       GLU  47 -11.508  -3.312  -4.569
  378   1HB   GLU  47          1HB       GLU  47 -13.257  -2.152  -3.426
  379   2HB   GLU  47          2HB       GLU  47 -14.035  -1.707  -4.938
  380   1HG   GLU  47          1HG       GLU  47 -15.063  -3.696  -5.155
  381   2HG   GLU  47          2HG       GLU  47 -13.711  -4.594  -4.468
  382    H    GLU  48           H        GLU  48 -11.733  -5.131  -5.737
  383    HA   GLU  48           HA       GLU  48 -12.665  -4.844  -8.518
  384   1HB   GLU  48          1HB       GLU  48 -10.180  -5.437  -7.971
  385   2HB   GLU  48          2HB       GLU  48 -10.823  -7.039  -7.638
  386   1HG   GLU  48          1HG       GLU  48 -11.739  -5.925 -10.171
  387   2HG   GLU  48          2HG       GLU  48  -9.990  -6.125 -10.074
  388    H    GLY  49           H        GLY  49 -13.878  -6.550  -9.432
  389   1HA   GLY  49          1HA       GLY  49 -14.653  -8.939  -8.818
  390   2HA   GLY  49          2HA       GLY  49 -15.322  -8.127  -7.410
  391    H    ASN  50           H        ASN  50 -15.301  -7.756 -10.959
  392    HA   ASN  50           HA       ASN  50 -18.150  -7.029 -10.791
  393   1HB   ASN  50          1HB       ASN  50 -16.066  -5.635 -11.975
  394   2HB   ASN  50          2HB       ASN  50 -16.842  -6.444 -13.334
  395   1HD2  ASN  50          1HD2      ASN  50 -17.362  -4.272 -10.631
  396   2HD2  ASN  50          2HD2      ASN  50 -18.761  -3.495 -11.282
  397    H    GLU  51           H        GLU  51 -17.137  -9.741 -10.816
  398    HA   GLU  51           HA       GLU  51 -18.459 -10.661 -13.272
  399   1HB   GLU  51          1HB       GLU  51 -15.700 -11.001 -12.635
  400   2HB   GLU  51          2HB       GLU  51 -16.479 -12.574 -12.542
  401   1HG   GLU  51          1HG       GLU  51 -17.387 -12.217 -14.811
  402   2HG   GLU  51          2HG       GLU  51 -16.491 -10.701 -14.897
  403    H    GLU  52           H        GLU  52 -20.267 -11.589 -12.565
  404    HA   GLU  52           HA       GLU  52 -20.787 -12.556 -10.027
  405   1HB   GLU  52          1HB       GLU  52 -22.176 -12.374 -12.450
  406   2HB   GLU  52          2HB       GLU  52 -22.230 -14.078 -12.022
  407   1HG   GLU  52          1HG       GLU  52 -23.783 -13.706 -10.495
  408   2HG   GLU  52          2HG       GLU  52 -22.789 -12.478  -9.713
  409    H    GLY  53           H        GLY  53 -20.780 -14.585  -9.067
  410   1HA   GLY  53          1HA       GLY  53 -20.362 -16.900  -8.950
  411   2HA   GLY  53          2HA       GLY  53 -19.614 -16.822 -10.538
  412    H    ARG  54           H        ARG  54 -18.093 -14.375  -9.466
  413    HA   ARG  54           HA       ARG  54 -16.006 -15.935  -8.094
  414   1HB   ARG  54          1HB       ARG  54 -15.484 -15.010 -10.387
  415   2HB   ARG  54          2HB       ARG  54 -15.610 -13.402  -9.687
  416   1HG   ARG  54          1HG       ARG  54 -13.649 -13.589  -8.547
  417   2HG   ARG  54          2HG       ARG  54 -13.788 -15.341  -8.377
  418   1HD   ARG  54          1HD       ARG  54 -13.378 -15.490 -10.863
  419   2HD   ARG  54          2HD       ARG  54 -12.969 -13.775 -10.814
  420    HE   ARG  54           HE       ARG  54 -11.478 -15.245  -8.894
  421   1HH1  ARG  54          1HH1      ARG  54 -11.680 -14.534 -12.296
  422   2HH1  ARG  54          2HH1      ARG  54  -9.992 -14.795 -12.584
  423   1HH2  ARG  54          1HH2      ARG  54  -9.253 -15.592  -9.260
  424   2HH2  ARG  54          2HH2      ARG  54  -8.612 -15.398 -10.857
  425    H    THR  55           H        THR  55 -14.667 -14.764  -6.544
  426    HA   THR  55           HA       THR  55 -16.309 -13.007  -4.900
  427    HB   THR  55           HB       THR  55 -13.926 -13.328  -3.547
  428    HG1  THR  55           1HG      THR  55 -14.536 -15.891  -4.566
  429   1HG2  THR  55          1HG2      THR  55 -15.930 -15.457  -3.144
  430   2HG2  THR  55          2HG2      THR  55 -16.542 -13.804  -3.079
  431   3HG2  THR  55          3HG2      THR  55 -15.248 -14.309  -1.993
  432    HA   PRO  56           HA       PRO  56 -14.211  -9.256  -5.789
  433   1HB   PRO  56          1HB       PRO  56 -14.114  -8.065  -3.351
  434   2HB   PRO  56          2HB       PRO  56 -15.609  -8.234  -4.279
  435   1HG   PRO  56          1HG       PRO  56 -14.590  -9.899  -2.010
  436   2HG   PRO  56          2HG       PRO  56 -16.232  -9.300  -2.309
  437   1HD   PRO  56          1HD       PRO  56 -15.482 -11.840  -2.873
  438   2HD   PRO  56          2HD       PRO  56 -16.699 -10.969  -3.829
  439    H    HIS  57           H        HIS  57 -12.273  -7.991  -5.396
  440    HA   HIS  57           HA       HIS  57 -10.200  -9.311  -3.805
  441   1HB   HIS  57          1HB       HIS  57  -9.785 -10.245  -5.954
  442   2HB   HIS  57          2HB       HIS  57 -10.025  -8.694  -6.753
  443    HD1  HIS  57           1HD      HIS  57  -7.917  -7.622  -7.440
  444    HD2  HIS  57           2HD      HIS  57  -7.394 -10.031  -4.095
  445    HE1  HIS  57           1HE      HIS  57  -5.464  -7.502  -6.902
  446    H    LEU  58           H        LEU  58  -8.756  -7.937  -2.875
  447    HA   LEU  58           HA       LEU  58  -9.303  -5.083  -3.194
  448   1HB   LEU  58          1HB       LEU  58  -8.773  -6.730  -0.989
  449   2HB   LEU  58          2HB       LEU  58  -7.352  -5.703  -1.172
  450    HG   LEU  58           HG       LEU  58 -10.200  -4.831  -0.712
  451   1HD1  LEU  58          1HD1      LEU  58  -9.236  -5.451   1.333
  452   2HD1  LEU  58          2HD1      LEU  58  -9.042  -3.701   1.255
  453   3HD1  LEU  58          3HD1      LEU  58  -7.672  -4.756   0.907
  454   1HD2  LEU  58          1HD2      LEU  58  -8.010  -3.441  -2.003
  455   2HD2  LEU  58          2HD2      LEU  58  -8.555  -2.606  -0.548
  456   3HD2  LEU  58          3HD2      LEU  58  -9.703  -2.974  -1.835
  457    H    GLN  59           H        GLN  59  -7.897  -3.684  -4.067
  458    HA   GLN  59           HA       GLN  59  -5.082  -4.304  -4.272
  459   1HB   GLN  59          1HB       GLN  59  -5.763  -5.455  -6.235
  460   2HB   GLN  59          2HB       GLN  59  -6.864  -4.165  -6.698
  461   1HG   GLN  59          1HG       GLN  59  -4.933  -4.110  -8.115
  462   2HG   GLN  59          2HG       GLN  59  -4.930  -2.688  -7.074
  463   1HE2  GLN  59          1HE2      GLN  59  -3.429  -2.563  -5.380
  464   2HE2  GLN  59          2HE2      GLN  59  -1.998  -3.530  -5.368
  465    H    GLY  60           H        GLY  60  -4.217  -2.473  -3.552
  466   1HA   GLY  60          1HA       GLY  60  -4.880   0.025  -4.891
  467   2HA   GLY  60          2HA       GLY  60  -5.215  -0.031  -3.167
  468    H    PHE  61           H        PHE  61  -3.560   1.877  -3.810
  469    HA   PHE  61           HA       PHE  61  -0.929   0.859  -2.983
  470   1HB   PHE  61          1HB       PHE  61  -0.553   1.329  -5.260
  471   2HB   PHE  61          2HB       PHE  61  -1.548   2.781  -5.214
  472    HD1  PHE  61           2HD      PHE  61   1.414   1.496  -3.334
  473    HD2  PHE  61           1HD      PHE  61  -0.364   4.716  -5.477
  474    HE1  PHE  61           2HE      PHE  61   3.428   2.857  -2.953
  475    HE2  PHE  61           1HE      PHE  61   1.648   6.082  -5.099
  476    HZ   PHE  61           HZ       PHE  61   3.546   5.154  -3.835
  477    H    ALA  62           H        ALA  62   0.146   2.070  -1.482
  478    HA   ALA  62           HA       ALA  62  -1.068   4.617  -0.656
  479   1HB   ALA  62          1HB       ALA  62  -0.193   3.540   1.716
  480   2HB   ALA  62          2HB       ALA  62  -1.867   3.598   1.162
  481   3HB   ALA  62          3HB       ALA  62  -0.896   2.152   0.885
  482    H    ASN  63           H        ASN  63   0.374   6.202  -0.511
  483    HA   ASN  63           HA       ASN  63   3.213   5.543  -0.615
  484   1HB   ASN  63          1HB       ASN  63   2.213   7.210  -2.194
  485   2HB   ASN  63          2HB       ASN  63   1.896   8.259  -0.814
  486   1HD2  ASN  63          1HD2      ASN  63   3.674   8.431  -3.246
  487   2HD2  ASN  63          2HD2      ASN  63   5.221   8.864  -2.608
  488    H    PHE  64           H        PHE  64   4.265   5.323   1.239
  489    HA   PHE  64           HA       PHE  64   3.293   6.336   3.716
  490   1HB   PHE  64          1HB       PHE  64   5.360   4.544   2.831
  491   2HB   PHE  64          2HB       PHE  64   6.024   5.676   4.005
  492    HD1  PHE  64           2HD      PHE  64   4.683   5.973   6.198
  493    HD2  PHE  64           1HD      PHE  64   4.225   2.668   3.554
  494    HE1  PHE  64           2HE      PHE  64   3.705   4.649   8.027
  495    HE2  PHE  64           1HE      PHE  64   3.246   1.340   5.379
  496    HZ   PHE  64           HZ       PHE  64   2.986   2.329   7.619
  497    H    VAL  65           H        VAL  65   3.690   8.208   4.715
  498    HA   VAL  65           HA       VAL  65   4.891  10.370   3.398
  499    HB   VAL  65           HB       VAL  65   4.263   9.998   6.328
  500   1HG1  VAL  65          1HG1      VAL  65   5.472  12.265   4.843
  501   2HG1  VAL  65          2HG1      VAL  65   4.267  12.642   6.076
  502   3HG1  VAL  65          3HG1      VAL  65   5.720  11.739   6.508
  503   1HG2  VAL  65          1HG2      VAL  65   2.252  11.156   5.901
  504   2HG2  VAL  65          2HG2      VAL  65   2.785  11.650   4.294
  505   3HG2  VAL  65          3HG2      VAL  65   2.394   9.960   4.612
  506    H    LYS  66           H        LYS  66   6.235   7.878   5.368
  507    HA   LYS  66           HA       LYS  66   8.859   9.204   5.210
  508   1HB   LYS  66          1HB       LYS  66   9.395   7.998   7.385
  509   2HB   LYS  66          2HB       LYS  66   8.302   9.370   7.500
  510   1HG   LYS  66          1HG       LYS  66   7.052   6.722   7.126
  511   2HG   LYS  66          2HG       LYS  66   7.838   7.018   8.678
  512   1HD   LYS  66          1HD       LYS  66   6.063   9.147   7.624
  513   2HD   LYS  66          2HD       LYS  66   5.294   7.669   8.208
  514   1HE   LYS  66          1HE       LYS  66   7.351   8.579  10.024
  515   2HE   LYS  66          2HE       LYS  66   6.152   9.838   9.733
  516   1HZ   LYS  66          1HZ       LYS  66   5.472   7.060  10.521
  517   2HZ   LYS  66          2HZ       LYS  66   4.418   8.379  10.422
  518   3HZ   LYS  66          3HZ       LYS  66   5.617   8.342  11.615
  519    H    LYS  67           H        LYS  67  10.522   7.288   6.028
  520    HA   LYS  67           HA       LYS  67  10.232   5.266   3.948
  521   1HB   LYS  67          1HB       LYS  67  12.463   6.534   5.368
  522   2HB   LYS  67          2HB       LYS  67  12.663   4.801   5.143
  523   1HG   LYS  67          1HG       LYS  67  13.335   5.167   3.071
  524   2HG   LYS  67          2HG       LYS  67  11.754   5.852   2.688
  525   1HD   LYS  67          1HD       LYS  67  12.467   8.035   3.097
  526   2HD   LYS  67          2HD       LYS  67  13.859   7.503   4.043
  527   1HE   LYS  67          1HE       LYS  67  13.767   6.619   1.225
  528   2HE   LYS  67          2HE       LYS  67  14.025   8.342   1.495
  529   1HZ   LYS  67          1HZ       LYS  67  15.687   6.090   2.466
  530   2HZ   LYS  67          2HZ       LYS  67  15.850   7.668   3.053
  531   3HZ   LYS  67          3HZ       LYS  67  16.142   7.339   1.419
  532    H    GLN  68           H        GLN  68   9.492   3.303   4.379
  533    HA   GLN  68           HA       GLN  68   9.952   2.168   7.051
  534   1HB   GLN  68          1HB       GLN  68   7.571   3.081   6.618
  535   2HB   GLN  68          2HB       GLN  68   7.386   1.686   5.563
  536   1HG   GLN  68          1HG       GLN  68   6.501   1.349   7.850
  537   2HG   GLN  68          2HG       GLN  68   7.731   0.177   7.377
  538   1HE2  GLN  68          1HE2      GLN  68   6.877   2.708   9.533
  539   2HE2  GLN  68          2HE2      GLN  68   8.279   2.626  10.538
  540    H    THR  69           H        THR  69   9.796  -0.190   7.119
  541    HA   THR  69           HA       THR  69  10.855  -1.352   4.651
  542    HB   THR  69           HB       THR  69  11.814  -3.067   5.945
  543    HG1  THR  69           1HG      THR  69  11.208  -3.284   8.221
  544   1HG2  THR  69          1HG2      THR  69  11.884  -0.562   7.633
  545   2HG2  THR  69          2HG2      THR  69  12.945  -0.931   6.273
  546   3HG2  THR  69          3HG2      THR  69  13.024  -1.903   7.743
  547    H    PHE  70           H        PHE  70  10.251  -3.718   4.296
  548    HA   PHE  70           HA       PHE  70   7.493  -3.885   3.776
  549   1HB   PHE  70          1HB       PHE  70   8.856  -5.165   2.360
  550   2HB   PHE  70          2HB       PHE  70   9.740  -5.880   3.705
  551    HD1  PHE  70           1HD      PHE  70   6.343  -5.770   2.190
  552    HD2  PHE  70           2HD      PHE  70   9.190  -8.001   4.434
  553    HE1  PHE  70           1HE      PHE  70   4.861  -7.733   2.111
  554    HE2  PHE  70           2HE      PHE  70   7.713  -9.968   4.358
  555    HZ   PHE  70           HZ       PHE  70   5.546  -9.835   3.195
  556    H    ASN  71           H        ASN  71   9.479  -5.671   6.139
  557    HA   ASN  71           HA       ASN  71   7.384  -7.049   7.370
  558   1HB   ASN  71          1HB       ASN  71  10.197  -6.514   7.921
  559   2HB   ASN  71          2HB       ASN  71   9.238  -6.625   9.394
  560   1HD2  ASN  71          1HD2      ASN  71  10.565  -8.312   6.715
  561   2HD2  ASN  71          2HD2      ASN  71  10.089  -9.901   7.198
  562    H    LYS  72           H        LYS  72   8.835  -3.910   8.151
  563    HA   LYS  72           HA       LYS  72   7.300  -3.408  10.463
  564   1HB   LYS  72          1HB       LYS  72   9.424  -2.201   9.420
  565   2HB   LYS  72          2HB       LYS  72   8.194  -1.145   8.739
  566   1HG   LYS  72          1HG       LYS  72   8.598  -1.734  11.664
  567   2HG   LYS  72          2HG       LYS  72   9.059  -0.252  10.823
  568   1HD   LYS  72          1HD       LYS  72   6.626   0.008  10.202
  569   2HD   LYS  72          2HD       LYS  72   6.283  -1.310  11.325
  570   1HE   LYS  72          1HE       LYS  72   7.557   1.344  11.980
  571   2HE   LYS  72          2HE       LYS  72   5.939   0.810  12.430
  572   1HZ   LYS  72          1HZ       LYS  72   6.899  -0.904  13.806
  573   2HZ   LYS  72          2HZ       LYS  72   7.529   0.600  14.257
  574   3HZ   LYS  72          3HZ       LYS  72   8.464  -0.466  13.334
  575    H    VAL  73           H        VAL  73   6.854  -2.414   7.080
  576    HA   VAL  73           HA       VAL  73   4.580  -0.859   7.367
  577    HB   VAL  73           HB       VAL  73   5.540  -2.590   5.107
  578   1HG1  VAL  73          1HG1      VAL  73   3.764  -1.363   3.742
  579   2HG1  VAL  73          2HG1      VAL  73   3.224  -2.700   4.758
  580   3HG1  VAL  73          3HG1      VAL  73   2.978  -1.035   5.286
  581   1HG2  VAL  73          1HG2      VAL  73   6.581  -0.341   5.835
  582   2HG2  VAL  73          2HG2      VAL  73   6.244  -0.604   4.124
  583   3HG2  VAL  73          3HG2      VAL  73   5.151   0.380   5.097
  584    H    LYS  74           H        LYS  74   4.936  -4.301   7.554
  585    HA   LYS  74           HA       LYS  74   2.265  -5.056   7.047
  586   1HB   LYS  74          1HB       LYS  74   4.282  -6.443   8.822
  587   2HB   LYS  74          2HB       LYS  74   2.845  -7.168   8.113
  588   1HG   LYS  74          1HG       LYS  74   4.139  -6.196   5.913
  589   2HG   LYS  74          2HG       LYS  74   5.478  -6.691   6.951
  590   1HD   LYS  74          1HD       LYS  74   5.110  -8.708   6.005
  591   2HD   LYS  74          2HD       LYS  74   3.845  -8.819   7.231
  592   1HE   LYS  74          1HE       LYS  74   2.182  -8.091   5.659
  593   2HE   LYS  74          2HE       LYS  74   3.414  -7.749   4.445
  594   1HZ   LYS  74          1HZ       LYS  74   3.050 -10.466   5.548
  595   2HZ   LYS  74          2HZ       LYS  74   3.813 -10.006   4.111
  596   3HZ   LYS  74          3HZ       LYS  74   2.128  -9.916   4.240
  597    H    TRP  75           H        TRP  75   3.610  -3.315   9.593
  598    HA   TRP  75           HA       TRP  75   1.999  -4.225  11.745
  599   1HB   TRP  75          1HB       TRP  75   2.859  -2.412  12.971
  600   2HB   TRP  75          2HB       TRP  75   4.148  -2.816  11.841
  601    HD1  TRP  75           HD       TRP  75   3.078  -1.271   9.282
  602    HE1  TRP  75           1HE      TRP  75   3.117   1.302   9.245
  603    HE3  TRP  75           3HE      TRP  75   3.255  -0.389  14.315
  604    HZ2  TRP  75           2HZ      TRP  75   3.212   3.425  11.103
  605    HZ3  TRP  75           3HZ      TRP  75   3.318   1.941  15.102
  606    HH2  TRP  75           HH       TRP  75   3.298   3.808  13.528
  607    H    TYR  76           H        TYR  76   1.377  -2.235   9.027
  608    HA   TYR  76           HA       TYR  76  -1.137  -1.297  10.242
  609   1HB   TYR  76          1HB       TYR  76   0.832   0.004   8.513
  610   2HB   TYR  76          2HB       TYR  76  -0.819   0.171   7.926
  611    HD1  TYR  76           2HD      TYR  76  -2.285   0.293  10.516
  612    HD2  TYR  76           1HD      TYR  76   1.338   2.155   9.287
  613    HE1  TYR  76           2HE      TYR  76  -2.678   2.109  12.129
  614    HE2  TYR  76           1HE      TYR  76   0.956   3.975  10.897
  615    HH   TYR  76           HH       TYR  76  -1.841   3.939  13.079
  616    H    LEU  77           H        LEU  77   0.266  -2.400   7.162
  617    HA   LEU  77           HA       LEU  77  -2.242  -2.843   5.907
  618   1HB   LEU  77          1HB       LEU  77   0.526  -3.855   5.296
  619   2HB   LEU  77          2HB       LEU  77  -0.874  -4.175   4.275
  620    HG   LEU  77           HG       LEU  77   0.365  -1.485   4.850
  621   1HD1  LEU  77          1HD1      LEU  77   0.202  -2.019   2.106
  622   2HD1  LEU  77          2HD1      LEU  77   0.825  -3.491   2.850
  623   3HD1  LEU  77          3HD1      LEU  77   1.652  -1.955   3.108
  624   1HD2  LEU  77          1HD2      LEU  77  -2.018  -1.213   4.701
  625   2HD2  LEU  77          2HD2      LEU  77  -2.085  -2.219   3.254
  626   3HD2  LEU  77          3HD2      LEU  77  -1.286  -0.647   3.200
  627    H    GLY  78           H        GLY  78  -0.050  -4.869   7.772
  628   1HA   GLY  78          1HA       GLY  78  -0.735  -6.735   9.039
  629   2HA   GLY  78          2HA       GLY  78  -2.195  -6.831   8.065
  630    H    ALA  79           H        ALA  79  -0.368  -8.968   8.785
  631    HA   ALA  79           HA       ALA  79   1.207  -9.625   6.486
  632   1HB   ALA  79          1HB       ALA  79   0.539 -10.922   9.062
  633   2HB   ALA  79          2HB       ALA  79   1.037 -11.974   7.736
  634   3HB   ALA  79          3HB       ALA  79   2.103 -10.680   8.284
  635    H    ARG  80           H        ARG  80  -2.074 -10.168   7.485
  636    HA   ARG  80           HA       ARG  80  -2.781 -12.409   6.033
  637   1HB   ARG  80          1HB       ARG  80  -4.488  -9.938   6.373
  638   2HB   ARG  80          2HB       ARG  80  -5.053 -11.578   6.080
  639   1HG   ARG  80          1HG       ARG  80  -3.891 -12.167   8.286
  640   2HG   ARG  80          2HG       ARG  80  -3.850 -10.426   8.567
  641   1HD   ARG  80          1HD       ARG  80  -5.811 -11.302   9.619
  642   2HD   ARG  80          2HD       ARG  80  -6.315 -10.380   8.203
  643    HE   ARG  80           HE       ARG  80  -6.100 -12.945   7.301
  644   1HH1  ARG  80          1HH1      ARG  80  -7.840 -11.385   9.881
  645   2HH1  ARG  80          2HH1      ARG  80  -9.159 -12.508   9.846
  646   1HH2  ARG  80          1HH2      ARG  80  -7.830 -14.429   7.244
  647   2HH2  ARG  80          2HH2      ARG  80  -9.152 -14.240   8.346
  648    H    CYS  81           H        CYS  81  -2.413  -9.078   4.941
  649    HA   CYS  81           HA       CYS  81  -3.090  -9.889   2.207
  650   1HB   CYS  81          1HB       CYS  81  -3.355  -7.570   1.699
  651   2HB   CYS  81          2HB       CYS  81  -4.165  -7.854   3.234
  652    HG   CYS  81           HG       CYS  81  -2.715  -6.279   4.710
  653    H    HIS  82           H        HIS  82  -1.663  -9.715   0.516
  654    HA   HIS  82           HA       HIS  82   1.125  -9.824   1.196
  655   1HB   HIS  82          1HB       HIS  82  -0.111 -11.163  -0.634
  656   2HB   HIS  82          2HB       HIS  82   0.039  -9.704  -1.609
  657    HD1  HIS  82           1HD      HIS  82   2.481 -11.706   0.533
  658    HD2  HIS  82           2HD      HIS  82   2.186  -9.937  -3.215
  659    HE1  HIS  82           1HE      HIS  82   4.684 -12.151  -0.597
  660    H    ILE  83           H        ILE  83   2.625  -8.271   1.026
  661    HA   ILE  83           HA       ILE  83   1.780  -5.685  -0.106
  662    HB   ILE  83           HB       ILE  83   4.062  -5.946   1.816
  663   1HG1  ILE  83          1HG1      ILE  83   1.132  -5.746   2.543
  664   2HG1  ILE  83          2HG1      ILE  83   2.212  -7.084   2.919
  665   1HG2  ILE  83          1HG2      ILE  83   2.085  -3.742   1.242
  666   2HG2  ILE  83          2HG2      ILE  83   3.439  -3.648   2.367
  667   3HG2  ILE  83          3HG2      ILE  83   3.740  -3.834   0.639
  668   1HD1  ILE  83          1HD1      ILE  83   2.138  -4.339   4.095
  669   2HD1  ILE  83          2HD1      ILE  83   2.085  -5.905   4.905
  670   3HD1  ILE  83          3HD1      ILE  83   3.592  -5.332   4.191
  671    H    GLU  84           H        GLU  84   3.031  -4.683  -1.605
  672    HA   GLU  84           HA       GLU  84   5.666  -5.788  -2.227
  673   1HB   GLU  84          1HB       GLU  84   3.453  -6.512  -3.710
  674   2HB   GLU  84          2HB       GLU  84   4.126  -5.179  -4.637
  675   1HG   GLU  84          1HG       GLU  84   6.343  -6.374  -4.513
  676   2HG   GLU  84          2HG       GLU  84   5.458  -7.760  -3.879
  677    H    LYS  85           H        LYS  85   6.860  -4.397  -3.795
  678    HA   LYS  85           HA       LYS  85   6.519  -1.625  -3.045
  679   1HB   LYS  85          1HB       LYS  85   8.620  -3.113  -4.612
  680   2HB   LYS  85          2HB       LYS  85   8.631  -1.360  -4.465
  681   1HG   LYS  85          1HG       LYS  85   8.994  -1.450  -2.145
  682   2HG   LYS  85          2HG       LYS  85   8.580  -3.164  -2.067
  683   1HD   LYS  85          1HD       LYS  85  10.948  -2.089  -3.590
  684   2HD   LYS  85          2HD       LYS  85  11.036  -2.646  -1.917
  685   1HE   LYS  85          1HE       LYS  85   9.705  -4.656  -3.376
  686   2HE   LYS  85          2HE       LYS  85  11.100  -4.171  -4.340
  687   1HZ   LYS  85          1HZ       LYS  85  11.065  -5.236  -1.581
  688   2HZ   LYS  85          2HZ       LYS  85  12.411  -4.425  -2.205
  689   3HZ   LYS  85          3HZ       LYS  85  11.872  -5.852  -2.934
  690    H    ALA  86           H        ALA  86   5.735  -0.024  -4.281
  691    HA   ALA  86           HA       ALA  86   4.529  -0.721  -6.822
  692   1HB   ALA  86          1HB       ALA  86   3.018   0.722  -6.069
  693   2HB   ALA  86          2HB       ALA  86   4.098   1.270  -4.787
  694   3HB   ALA  86          3HB       ALA  86   4.176   2.014  -6.384
  695    H    LYS  87           H        LYS  87   4.823   0.589  -8.746
  696    HA   LYS  87           HA       LYS  87   7.320   2.093  -8.907
  697   1HB   LYS  87          1HB       LYS  87   8.215   0.839 -10.713
  698   2HB   LYS  87          2HB       LYS  87   7.769  -0.330  -9.477
  699   1HG   LYS  87          1HG       LYS  87   5.508  -0.070 -11.092
  700   2HG   LYS  87          2HG       LYS  87   6.881  -0.117 -12.201
  701   1HD   LYS  87          1HD       LYS  87   7.453  -2.249 -11.620
  702   2HD   LYS  87          2HD       LYS  87   6.842  -2.079  -9.973
  703   1HE   LYS  87          1HE       LYS  87   4.730  -2.685 -10.550
  704   2HE   LYS  87          2HE       LYS  87   4.847  -1.967 -12.156
  705   1HZ   LYS  87          1HZ       LYS  87   4.752  -4.298 -12.434
  706   2HZ   LYS  87          2HZ       LYS  87   5.939  -4.573 -11.262
  707   3HZ   LYS  87          3HZ       LYS  87   6.356  -3.854 -12.735
  708    H    GLY  88           H        GLY  88   7.408   3.576 -10.618
  709   1HA   GLY  88          1HA       GLY  88   6.485   4.396 -12.723
  710   2HA   GLY  88          2HA       GLY  88   4.909   3.854 -12.166
  711    H    THR  89           H        THR  89   4.711   6.255 -12.973
  712    HA   THR  89           HA       THR  89   5.450   8.215 -10.975
  713    HB   THR  89           HB       THR  89   4.554   9.870 -12.431
  714    HG1  THR  89           1HG      THR  89   3.374   9.122 -14.367
  715   1HG2  THR  89          1HG2      THR  89   6.645   8.525 -13.151
  716   2HG2  THR  89          2HG2      THR  89   5.880   9.593 -14.328
  717   3HG2  THR  89          3HG2      THR  89   5.590   7.855 -14.395
  718    H    ASP  90           H        ASP  90   3.621   9.849 -10.402
  719    HA   ASP  90           HA       ASP  90   1.848   8.616  -8.658
  720   1HB   ASP  90          1HB       ASP  90   0.624  10.867  -8.737
  721   2HB   ASP  90          2HB       ASP  90   2.319  10.890  -8.256
  722    H    GLN  91           H        GLN  91   1.351   9.691 -11.985
  723    HA   GLN  91           HA       GLN  91  -1.437   9.156 -12.049
  724   1HB   GLN  91          1HB       GLN  91   0.619  10.030 -13.912
  725   2HB   GLN  91          2HB       GLN  91  -0.527   8.930 -14.667
  726   1HG   GLN  91          1HG       GLN  91  -1.206  11.474 -13.209
  727   2HG   GLN  91          2HG       GLN  91  -1.208  11.238 -14.956
  728   1HE2  GLN  91          1HE2      GLN  91  -2.985  11.001 -12.087
  729   2HE2  GLN  91          2HE2      GLN  91  -4.396  10.245 -12.735
  730    H    GLN  92           H        GLN  92   1.431   7.259 -12.775
  731    HA   GLN  92           HA       GLN  92   0.139   5.094 -14.036
  732   1HB   GLN  92          1HB       GLN  92   2.797   5.659 -12.937
  733   2HB   GLN  92          2HB       GLN  92   2.335   3.966 -12.833
  734   1HG   GLN  92          1HG       GLN  92   1.620   4.628 -15.395
  735   2HG   GLN  92          2HG       GLN  92   3.092   5.564 -15.143
  736   1HE2  GLN  92          1HE2      GLN  92   5.033   4.518 -14.901
  737   2HE2  GLN  92          2HE2      GLN  92   5.236   2.828 -15.197
  738    H    ASN  93           H        ASN  93   0.809   5.830 -10.662
  739    HA   ASN  93           HA       ASN  93  -0.071   3.272  -9.700
  740   1HB   ASN  93          1HB       ASN  93   0.644   5.878  -8.374
  741   2HB   ASN  93          2HB       ASN  93  -0.044   4.544  -7.454
  742   1HD2  ASN  93          1HD2      ASN  93   2.296   4.627 -10.111
  743   2HD2  ASN  93          2HD2      ASN  93   3.555   3.809  -9.256
  744    H    LYS  94           H        LYS  94  -1.439   6.546  -9.777
  745    HA   LYS  94           HA       LYS  94  -3.852   5.940  -8.470
  746   1HB   LYS  94          1HB       LYS  94  -3.004   8.236  -8.837
  747   2HB   LYS  94          2HB       LYS  94  -3.339   8.069 -10.555
  748   1HG   LYS  94          1HG       LYS  94  -5.676   7.991 -10.186
  749   2HG   LYS  94          2HG       LYS  94  -5.461   7.805  -8.444
  750   1HD   LYS  94          1HD       LYS  94  -4.219  10.097  -8.648
  751   2HD   LYS  94          2HD       LYS  94  -5.134  10.236 -10.152
  752   1HE   LYS  94          1HE       LYS  94  -7.180   9.641  -8.711
  753   2HE   LYS  94          2HE       LYS  94  -6.151  10.036  -7.336
  754   1HZ   LYS  94          1HZ       LYS  94  -5.824  12.130  -9.060
  755   2HZ   LYS  94          2HZ       LYS  94  -6.777  12.127  -7.663
  756   3HZ   LYS  94          3HZ       LYS  94  -7.477  11.782  -9.164
  757    H    GLU  95           H        GLU  95  -2.959   5.897 -11.894
  758    HA   GLU  95           HA       GLU  95  -5.569   5.253 -12.832
  759   1HB   GLU  95          1HB       GLU  95  -2.834   5.058 -14.087
  760   2HB   GLU  95          2HB       GLU  95  -4.299   4.587 -14.937
  761   1HG   GLU  95          1HG       GLU  95  -4.496   7.229 -13.747
  762   2HG   GLU  95          2HG       GLU  95  -3.171   7.092 -14.902
  763    H    TYR  96           H        TYR  96  -2.766   3.373 -11.864
  764    HA   TYR  96           HA       TYR  96  -3.480   0.880 -12.870
  765   1HB   TYR  96          1HB       TYR  96  -1.290   1.307 -11.889
  766   2HB   TYR  96          2HB       TYR  96  -2.019   1.542 -10.304
  767    HD1  TYR  96           1HD      TYR  96  -2.819  -0.356  -9.007
  768    HD2  TYR  96           2HD      TYR  96  -1.028  -0.916 -12.826
  769    HE1  TYR  96           1HE      TYR  96  -2.565  -2.756  -8.530
  770    HE2  TYR  96           2HE      TYR  96  -0.770  -3.317 -12.360
  771    HH   TYR  96           HH       TYR  96  -0.749  -4.864 -10.632
  772    H    CYS  97           H        CYS  97  -4.137   2.198  -9.622
  773    HA   CYS  97           HA       CYS  97  -5.735   0.041  -8.768
  774   1HB   CYS  97          1HB       CYS  97  -5.908   2.900  -7.802
  775   2HB   CYS  97          2HB       CYS  97  -6.379   1.451  -6.922
  776    HG   CYS  97           HG       CYS  97  -3.543   2.998  -6.840
  777    H    SER  98           H        SER  98  -6.475   3.003 -10.497
  778    HA   SER  98           HA       SER  98  -9.318   2.719 -10.274
  779   1HB   SER  98          1HB       SER  98  -8.453   4.935 -10.583
  780   2HB   SER  98          2HB       SER  98  -7.571   4.451 -12.031
  781    HG   SER  98           HG       SER  98  -9.453   5.481 -12.656
  782    H    LYS  99           H        LYS  99  -6.955   1.202 -12.133
  783    HA   LYS  99           HA       LYS  99  -8.164   0.841 -14.612
  784   1HB   LYS  99          1HB       LYS  99  -5.852   0.156 -14.071
  785   2HB   LYS  99          2HB       LYS  99  -6.483  -1.151 -13.078
  786   1HG   LYS  99          1HG       LYS  99  -7.521  -2.149 -15.057
  787   2HG   LYS  99          2HG       LYS  99  -6.865  -0.844 -16.050
  788   1HD   LYS  99          1HD       LYS  99  -5.474  -2.839 -16.211
  789   2HD   LYS  99          2HD       LYS  99  -4.593  -1.523 -15.431
  790   1HE   LYS  99          1HE       LYS  99  -4.397  -2.648 -13.502
  791   2HE   LYS  99          2HE       LYS  99  -6.061  -3.227 -13.564
  792   1HZ   LYS  99          1HZ       LYS  99  -5.326  -5.196 -14.209
  793   2HZ   LYS  99          2HZ       LYS  99  -3.727  -4.652 -14.111
  794   3HZ   LYS  99          3HZ       LYS  99  -4.578  -4.517 -15.567
  795    H    GLU 100           H        GLU 100  -8.973  -0.487 -11.528
  796    HA   GLU 100           HA       GLU 100 -10.449  -2.736 -12.479
  797   1HB   GLU 100          1HB       GLU 100 -10.022  -1.386  -9.878
  798   2HB   GLU 100          2HB       GLU 100 -11.520  -2.291 -10.041
  799   1HG   GLU 100          1HG       GLU 100  -9.985  -3.789  -9.110
  800   2HG   GLU 100          2HG       GLU 100 -10.101  -4.239 -10.810
  801    H    GLY 101           H        GLY 101 -11.119   0.633 -12.106
  802   1HA   GLY 101          1HA       GLY 101 -12.929   1.737 -13.127
  803   2HA   GLY 101          2HA       GLY 101 -13.783   0.204 -13.221
  804    H    ASN 102           H        ASN 102 -12.759   0.067 -10.213
  805    HA   ASN 102           HA       ASN 102 -14.859   1.782  -9.085
  806   1HB   ASN 102          1HB       ASN 102 -15.122  -0.971  -9.354
  807   2HB   ASN 102          2HB       ASN 102 -14.613  -0.760  -7.681
  808   1HD2  ASN 102          1HD2      ASN 102 -16.111  -0.275  -6.240
  809   2HD2  ASN 102          2HD2      ASN 102 -17.706   0.287  -6.593
  810    H    LEU 103           H        LEU 103 -14.109   2.995  -7.484
  811    HA   LEU 103           HA       LEU 103 -11.571   2.247  -6.220
  812   1HB   LEU 103          1HB       LEU 103 -13.028   4.886  -6.210
  813   2HB   LEU 103          2HB       LEU 103 -11.436   4.580  -5.519
  814    HG   LEU 103           HG       LEU 103 -12.200   4.617  -8.433
  815   1HD1  LEU 103          1HD1      LEU 103 -10.928   6.536  -8.605
  816   2HD1  LEU 103          2HD1      LEU 103 -10.025   6.197  -7.129
  817   3HD1  LEU 103          3HD1      LEU 103 -11.699   6.742  -7.032
  818   1HD2  LEU 103          1HD2      LEU 103  -9.597   3.791  -7.152
  819   2HD2  LEU 103          2HD2      LEU 103  -9.829   4.097  -8.874
  820   3HD2  LEU 103          3HD2      LEU 103 -10.683   2.767  -8.091
  821    H    LEU 104           H        LEU 104 -11.481   1.622  -4.161
  822    HA   LEU 104           HA       LEU 104 -13.935   1.519  -2.616
  823   1HB   LEU 104          1HB       LEU 104 -12.494  -0.444  -2.719
  824   2HB   LEU 104          2HB       LEU 104 -11.167   0.482  -2.022
  825    HG   LEU 104           HG       LEU 104 -12.882   0.793  -0.039
  826   1HD1  LEU 104          1HD1      LEU 104 -14.486  -0.672  -1.604
  827   2HD1  LEU 104          2HD1      LEU 104 -14.562  -0.704   0.157
  828   3HD1  LEU 104          3HD1      LEU 104 -13.689  -1.967  -0.710
  829   1HD2  LEU 104          1HD2      LEU 104 -11.685  -1.920  -0.147
  830   2HD2  LEU 104          2HD2      LEU 104 -11.605  -0.694   1.118
  831   3HD2  LEU 104          3HD2      LEU 104 -10.605  -0.537  -0.327
  832    H    MET 105           H        MET 105 -10.989   3.339  -2.729
  833    HA   MET 105           HA       MET 105 -12.001   5.173  -0.752
  834   1HB   MET 105          1HB       MET 105 -10.991   3.850   0.870
  835   2HB   MET 105          2HB       MET 105  -9.669   3.382  -0.190
  836   1HG   MET 105          1HG       MET 105  -8.434   5.199   0.314
  837   2HG   MET 105          2HG       MET 105  -9.842   6.245   0.485
  838   1HE   MET 105          1HE       MET 105  -7.054   4.682   1.924
  839   2HE   MET 105          2HE       MET 105  -7.301   4.575   3.667
  840   3HE   MET 105          3HE       MET 105  -7.846   3.266   2.617
  841    H    GLU 106           H        GLU 106 -11.275   7.211  -1.097
  842    HA   GLU 106           HA       GLU 106  -8.967   7.571  -2.881
  843   1HB   GLU 106          1HB       GLU 106 -11.204   7.783  -4.074
  844   2HB   GLU 106          2HB       GLU 106 -11.481   9.221  -3.101
  845   1HG   GLU 106          1HG       GLU 106  -9.093   9.860  -4.068
  846   2HG   GLU 106          2HG       GLU 106  -9.622   8.784  -5.360
  847    H    CYS 107           H        CYS 107  -7.518   8.491  -1.566
  848    HA   CYS 107           HA       CYS 107  -8.197  11.047  -0.352
  849   1HB   CYS 107          1HB       CYS 107  -7.194   8.664   1.202
  850   2HB   CYS 107          2HB       CYS 107  -7.012  10.314   1.785
  851    HG   CYS 107           HG       CYS 107  -9.884  10.726   1.610
  852    H    GLY 108           H        GLY 108  -6.078  11.924   0.773
  853   1HA   GLY 108          1HA       GLY 108  -3.899  12.613   0.528
  854   2HA   GLY 108          2HA       GLY 108  -3.573  11.064  -0.235
  855    H    ALA 109           H        ALA 109  -2.137  12.860  -1.334
  856    HA   ALA 109           HA       ALA 109  -3.604  13.922  -3.656
  857   1HB   ALA 109          1HB       ALA 109  -2.390  15.790  -3.536
  858   2HB   ALA 109          2HB       ALA 109  -1.911  15.238  -1.931
  859   3HB   ALA 109          3HB       ALA 109  -0.883  14.898  -3.323
  860    HA   PRO 110           HA       PRO 110  -1.490  11.259  -6.430
  861   1HB   PRO 110          1HB       PRO 110  -1.122  12.873  -8.582
  862   2HB   PRO 110          2HB       PRO 110  -2.704  12.232  -8.121
  863   1HG   PRO 110          1HG       PRO 110  -1.525  14.932  -7.590
  864   2HG   PRO 110          2HG       PRO 110  -3.168  14.511  -8.106
  865   1HD   PRO 110          1HD       PRO 110  -2.557  15.114  -5.538
  866   2HD   PRO 110          2HD       PRO 110  -3.832  13.956  -5.969
  867    H    ARG 111           H        ARG 111   0.430  11.218  -4.998
  868    HA   ARG 111           HA       ARG 111   2.701  12.642  -6.224
  869   1HB   ARG 111          1HB       ARG 111   3.794  12.682  -4.060
  870   2HB   ARG 111          2HB       ARG 111   2.210  13.433  -3.934
  871   1HG   ARG 111          1HG       ARG 111   1.396  11.819  -2.572
  872   2HG   ARG 111          2HG       ARG 111   2.371  10.548  -3.313
  873   1HD   ARG 111          1HD       ARG 111   3.365  12.682  -1.426
  874   2HD   ARG 111          2HD       ARG 111   3.089  10.988  -1.023
  875    HE   ARG 111           HE       ARG 111   4.847  10.955  -3.130
  876   1HH1  ARG 111          1HH1      ARG 111   4.792  12.330   0.068
  877   2HH1  ARG 111          2HH1      ARG 111   6.510  12.245   0.276
  878   1HH2  ARG 111          1HH2      ARG 111   7.110  10.837  -2.868
  879   2HH2  ARG 111          2HH2      ARG 111   7.828  11.396  -1.395
  880    H    SER 112           H        SER 112   4.715  11.511  -6.286
  881    HA   SER 112           HA       SER 112   4.764   8.693  -5.642
  882   1HB   SER 112          1HB       SER 112   3.772   8.360  -7.741
  883   2HB   SER 112          2HB       SER 112   4.660   9.695  -8.477
  884    HG   SER 112           HG       SER 112   5.318   7.304  -8.781
  885    H    GLN 113           H        GLN 113   6.528  10.729  -7.972
  886    HA   GLN 113           HA       GLN 113   9.010  10.052  -6.562
  887   1HB   GLN 113          1HB       GLN 113  10.178  10.559  -8.589
  888   2HB   GLN 113          2HB       GLN 113   8.812   9.530  -9.003
  889   1HG   GLN 113          1HG       GLN 113   7.656  11.896  -9.373
  890   2HG   GLN 113          2HG       GLN 113   9.330  12.363  -9.671
  891   1HE2  GLN 113          1HE2      GLN 113   9.882  12.289 -11.715
  892   2HE2  GLN 113          2HE2      GLN 113   9.267  11.199 -12.905
  893    H    GLY 114           H        GLY 114  10.690  12.029  -7.305
  894   1HA   GLY 114          1HA       GLY 114   9.917  14.659  -7.248
  895   2HA   GLY 114          2HA       GLY 114   9.905  14.164  -5.562
  896    H    GLN 115           H        GLN 115  11.643  16.002  -7.283
  897    HA   GLN 115           HA       GLN 115  14.112  15.339  -5.967
  898   1HB   GLN 115          1HB       GLN 115  13.706  14.416  -8.620
  899   2HB   GLN 115          2HB       GLN 115  14.861  15.740  -8.697
  900   1HG   GLN 115          1HG       GLN 115  15.455  13.918  -6.530
  901   2HG   GLN 115          2HG       GLN 115  15.404  13.100  -8.091
  902   1HE2  GLN 115          1HE2      GLN 115  17.315  12.959  -8.995
  903   2HE2  GLN 115          2HE2      GLN 115  18.580  14.133  -8.908
  904    H    ARG 116           H        ARG 116  15.311  17.124  -5.574
  905    HA   ARG 116           HA       ARG 116  14.690  19.575  -7.069
  906   1HB   ARG 116          1HB       ARG 116  14.607  20.878  -5.028
  907   2HB   ARG 116          2HB       ARG 116  13.419  19.584  -4.946
  908   1HG   ARG 116          1HG       ARG 116  15.217  18.280  -3.665
  909   2HG   ARG 116          2HG       ARG 116  16.015  19.843  -3.480
  910   1HD   ARG 116          1HD       ARG 116  13.247  19.089  -2.555
  911   2HD   ARG 116          2HD       ARG 116  14.652  19.423  -1.543
  912    HE   ARG 116           HE       ARG 116  12.903  21.344  -2.770
  913   1HH1  ARG 116          1HH1      ARG 116  16.099  20.784  -1.507
  914   2HH1  ARG 116          2HH1      ARG 116  16.400  22.456  -1.167
  915   1HH2  ARG 116          1HH2      ARG 116  13.287  23.548  -2.326
  916   2HH2  ARG 116          2HH2      ARG 116  14.799  24.027  -1.633
  Start of MODEL   26
    1    HA   PRO   2           HA       PRO   2  28.158  -3.248  22.931
    2   1HB   PRO   2          1HB       PRO   2  27.300  -0.683  23.169
    3   2HB   PRO   2          2HB       PRO   2  27.312  -1.821  24.522
    4   1HG   PRO   2          1HG       PRO   2  29.283   0.324  23.834
    5   2HG   PRO   2          2HG       PRO   2  28.614  -0.115  25.416
    6   1HD   PRO   2          1HD       PRO   2  31.074  -0.904  24.605
    7   2HD   PRO   2          2HD       PRO   2  30.059  -1.892  25.674
    8    H    SER   3           H        SER   3  28.738  -3.653  20.799
    9    HA   SER   3           HA       SER   3  29.213  -1.292  19.103
   10   1HB   SER   3          1HB       SER   3  29.953  -4.196  18.700
   11   2HB   SER   3          2HB       SER   3  30.095  -2.973  17.437
   12    HG   SER   3           HG       SER   3  31.763  -2.109  18.437
   13    H    LYS   4           H        LYS   4  27.789  -4.546  18.754
   14    HA   LYS   4           HA       LYS   4  25.945  -5.286  17.644
   15   1HB   LYS   4          1HB       LYS   4  25.121  -2.732  18.897
   16   2HB   LYS   4          2HB       LYS   4  24.062  -3.352  17.637
   17   1HG   LYS   4          1HG       LYS   4  23.260  -4.959  18.953
   18   2HG   LYS   4          2HG       LYS   4  24.863  -5.392  19.552
   19   1HD   LYS   4          1HD       LYS   4  24.746  -3.929  21.319
   20   2HD   LYS   4          2HD       LYS   4  23.627  -2.847  20.487
   21   1HE   LYS   4          1HE       LYS   4  22.270  -5.280  20.751
   22   2HE   LYS   4          2HE       LYS   4  23.077  -5.020  22.297
   23   1HZ   LYS   4          1HZ       LYS   4  21.423  -2.950  20.967
   24   2HZ   LYS   4          2HZ       LYS   4  22.003  -2.945  22.556
   25   3HZ   LYS   4          3HZ       LYS   4  20.800  -4.043  22.098
   26    H    LYS   5           H        LYS   5  27.045  -5.358  15.628
   27    HA   LYS   5           HA       LYS   5  26.922  -3.110  13.833
   28   1HB   LYS   5          1HB       LYS   5  28.324  -5.602  13.965
   29   2HB   LYS   5          2HB       LYS   5  27.503  -5.499  12.413
   30   1HG   LYS   5          1HG       LYS   5  28.629  -3.493  11.849
   31   2HG   LYS   5          2HG       LYS   5  29.252  -3.304  13.490
   32   1HD   LYS   5          1HD       LYS   5  29.944  -5.819  12.094
   33   2HD   LYS   5          2HD       LYS   5  30.693  -4.344  11.478
   34   1HE   LYS   5          1HE       LYS   5  31.774  -3.909  13.501
   35   2HE   LYS   5          2HE       LYS   5  30.707  -4.980  14.408
   36   1HZ   LYS   5          1HZ       LYS   5  33.173  -5.574  13.168
   37   2HZ   LYS   5          2HZ       LYS   5  31.961  -6.542  12.495
   38   3HZ   LYS   5          3HZ       LYS   5  32.223  -6.556  14.166
   39    H    ASN   6           H        ASN   6  25.990  -3.388  11.611
   40    HA   ASN   6           HA       ASN   6  23.641  -5.116  11.502
   41   1HB   ASN   6          1HB       ASN   6  23.447  -2.139  11.002
   42   2HB   ASN   6          2HB       ASN   6  22.133  -3.309  10.933
   43   1HD2  ASN   6          1HD2      ASN   6  21.395  -4.254  12.877
   44   2HD2  ASN   6          2HD2      ASN   6  21.648  -3.470  14.396
   45    H    GLY   7           H        GLY   7  25.264  -6.062   9.970
   46   1HA   GLY   7          1HA       GLY   7  25.234  -4.644   7.381
   47   2HA   GLY   7          2HA       GLY   7  26.463  -5.803   7.864
   48    H    ARG   8           H        ARG   8  23.177  -5.396   6.740
   49    HA   ARG   8           HA       ARG   8  23.144  -8.253   6.018
   50   1HB   ARG   8          1HB       ARG   8  21.367  -6.926   7.732
   51   2HB   ARG   8          2HB       ARG   8  20.493  -7.114   6.217
   52   1HG   ARG   8          1HG       ARG   8  21.928  -9.503   7.164
   53   2HG   ARG   8          2HG       ARG   8  20.566  -8.975   8.155
   54   1HD   ARG   8          1HD       ARG   8  19.197  -8.909   6.048
   55   2HD   ARG   8          2HD       ARG   8  20.550  -9.687   5.229
   56    HE   ARG   8           HE       ARG   8  18.678 -10.912   7.040
   57   1HH1  ARG   8          1HH1      ARG   8  21.847 -11.108   5.611
   58   2HH1  ARG   8          2HH1      ARG   8  21.989 -12.819   5.845
   59   1HH2  ARG   8          1HH2      ARG   8  18.854 -13.164   7.354
   60   2HH2  ARG   8          2HH2      ARG   8  20.285 -13.988   6.836
   61    H    SER   9           H        SER   9  21.883  -8.775   4.104
   62    HA   SER   9           HA       SER   9  21.808  -6.533   2.193
   63   1HB   SER   9          1HB       SER   9  22.737  -9.361   1.916
   64   2HB   SER   9          2HB       SER   9  22.039  -8.560   0.509
   65    HG   SER   9           HG       SER   9  24.290  -7.747   2.029
   66    H    GLY  10           H        GLY  10  20.279  -6.899   0.339
   67   1HA   GLY  10          1HA       GLY  10  18.292  -8.342  -0.285
   68   2HA   GLY  10          2HA       GLY  10  17.786  -8.091   1.379
   69    HA   PRO  11           HA       PRO  11  15.761  -4.866  -1.270
   70   1HB   PRO  11          1HB       PRO  11  13.289  -5.199  -0.199
   71   2HB   PRO  11          2HB       PRO  11  13.887  -6.163  -1.555
   72   1HG   PRO  11          1HG       PRO  11  13.765  -6.857   1.355
   73   2HG   PRO  11          2HG       PRO  11  13.362  -7.858  -0.052
   74   1HD   PRO  11          1HD       PRO  11  15.715  -8.082   1.270
   75   2HD   PRO  11          2HD       PRO  11  15.569  -8.373  -0.475
   76    H    GLN  12           H        GLN  12  15.779  -2.805  -0.624
   77    HA   GLN  12           HA       GLN  12  15.899  -2.223   2.229
   78   1HB   GLN  12          1HB       GLN  12  16.900  -0.977  -0.214
   79   2HB   GLN  12          2HB       GLN  12  16.175   0.182   0.892
   80   1HG   GLN  12          1HG       GLN  12  17.777  -1.464   2.481
   81   2HG   GLN  12          2HG       GLN  12  18.723  -1.129   1.031
   82   1HE2  GLN  12          1HE2      GLN  12  18.317  -0.131   4.040
   83   2HE2  GLN  12          2HE2      GLN  12  18.636   1.558   3.876
   84    HA   PRO  13           HA       PRO  13  11.884  -0.506   2.628
   85   1HB   PRO  13          1HB       PRO  13  12.325   1.662   4.202
   86   2HB   PRO  13          2HB       PRO  13  12.419   0.003   4.804
   87   1HG   PRO  13          1HG       PRO  13  14.628   1.843   3.968
   88   2HG   PRO  13          2HG       PRO  13  14.543   0.761   5.371
   89   1HD   PRO  13          1HD       PRO  13  15.904   0.123   3.119
   90   2HD   PRO  13          2HD       PRO  13  15.104  -1.098   4.129
   91    H    HIS  14           H        HIS  14  10.486   1.064   1.835
   92    HA   HIS  14           HA       HIS  14  11.656   3.364   0.449
   93   1HB   HIS  14          1HB       HIS  14   9.823   1.311  -0.796
   94   2HB   HIS  14          2HB       HIS  14  10.109   2.902  -1.496
   95    HD1  HIS  14           1HD      HIS  14  11.760  -0.403  -0.909
   96    HD2  HIS  14           2HD      HIS  14  12.588   3.232  -2.742
   97    HE1  HIS  14           1HE      HIS  14  13.835  -0.796  -2.273
   98    H    LYS  15           H        LYS  15   9.684   4.693  -0.526
   99    HA   LYS  15           HA       LYS  15   7.824   5.067   1.716
  100   1HB   LYS  15          1HB       LYS  15   7.455   7.333   0.640
  101   2HB   LYS  15          2HB       LYS  15   9.055   7.053   1.316
  102   1HG   LYS  15          1HG       LYS  15   8.973   6.254  -1.446
  103   2HG   LYS  15          2HG       LYS  15   8.426   7.922  -1.257
  104   1HD   LYS  15          1HD       LYS  15  10.458   8.650  -0.538
  105   2HD   LYS  15          2HD       LYS  15  10.850   7.119   0.247
  106   1HE   LYS  15          1HE       LYS  15  11.406   6.108  -1.841
  107   2HE   LYS  15          2HE       LYS  15  10.774   7.486  -2.742
  108   1HZ   LYS  15          1HZ       LYS  15  13.360   7.130  -2.067
  109   2HZ   LYS  15          2HZ       LYS  15  12.830   8.176  -0.849
  110   3HZ   LYS  15          3HZ       LYS  15  12.663   8.617  -2.473
  111    H    ARG  16           H        ARG  16   7.663   3.188  -0.700
  112    HA   ARG  16           HA       ARG  16   4.875   3.818  -1.323
  113   1HB   ARG  16          1HB       ARG  16   6.919   3.093  -3.430
  114   2HB   ARG  16          2HB       ARG  16   5.197   3.331  -3.699
  115   1HG   ARG  16          1HG       ARG  16   5.388   5.666  -3.125
  116   2HG   ARG  16          2HG       ARG  16   7.091   5.454  -2.714
  117   1HD   ARG  16          1HD       ARG  16   6.200   4.637  -5.427
  118   2HD   ARG  16          2HD       ARG  16   6.310   6.363  -5.082
  119    HE   ARG  16           HE       ARG  16   8.665   4.987  -4.276
  120   1HH1  ARG  16          1HH1      ARG  16   6.998   6.256  -7.057
  121   2HH1  ARG  16          2HH1      ARG  16   8.445   6.491  -7.980
  122   1HH2  ARG  16          1HH2      ARG  16  10.577   5.292  -5.481
  123   2HH2  ARG  16          2HH2      ARG  16  10.480   5.942  -7.083
  124    H    TRP  17           H        TRP  17   3.616   2.093  -1.075
  125    HA   TRP  17           HA       TRP  17   4.608  -0.570  -1.664
  126   1HB   TRP  17          1HB       TRP  17   3.810   0.305   1.109
  127   2HB   TRP  17          2HB       TRP  17   3.772  -1.384   0.609
  128    HD1  TRP  17           HD       TRP  17   6.155   1.376   1.636
  129    HE1  TRP  17           1HE      TRP  17   8.526   0.402   1.868
  130    HE3  TRP  17           3HE      TRP  17   5.334  -3.249  -0.381
  131    HZ2  TRP  17           2HZ      TRP  17   9.871  -2.007   1.275
  132    HZ3  TRP  17           3HZ      TRP  17   7.216  -4.829  -0.513
  133    HH2  TRP  17           HH       TRP  17   9.437  -4.219   0.298
  134    H    VAL  18           H        VAL  18   3.029  -1.902  -2.374
  135    HA   VAL  18           HA       VAL  18   0.287  -0.839  -2.342
  136    HB   VAL  18           HB       VAL  18  -0.150  -2.262  -4.278
  137   1HG1  VAL  18          1HG1      VAL  18   1.726  -1.200  -5.794
  138   2HG1  VAL  18          2HG1      VAL  18   0.480  -0.199  -5.045
  139   3HG1  VAL  18          3HG1      VAL  18   2.086  -0.299  -4.321
  140   1HG2  VAL  18          1HG2      VAL  18   2.074  -3.688  -3.388
  141   2HG2  VAL  18          2HG2      VAL  18   1.132  -3.990  -4.848
  142   3HG2  VAL  18          3HG2      VAL  18   2.571  -2.972  -4.921
  143    H    PHE  19           H        PHE  19  -1.476  -2.427  -2.224
  144    HA   PHE  19           HA       PHE  19  -0.775  -4.874  -0.763
  145   1HB   PHE  19          1HB       PHE  19  -2.774  -4.412   0.738
  146   2HB   PHE  19          2HB       PHE  19  -1.359  -3.399   1.005
  147    HD1  PHE  19           1HD      PHE  19  -1.346  -1.063   0.155
  148    HD2  PHE  19           2HD      PHE  19  -4.843  -3.488   0.084
  149    HE1  PHE  19           1HE      PHE  19  -2.732   0.950  -0.131
  150    HE2  PHE  19           2HE      PHE  19  -6.234  -1.479  -0.203
  151    HZ   PHE  19           HZ       PHE  19  -5.179   0.744  -0.311
  152    H    THR  20           H        THR  20  -2.113  -6.612  -1.112
  153    HA   THR  20           HA       THR  20  -4.566  -6.275  -2.631
  154    HB   THR  20           HB       THR  20  -3.935  -7.822  -4.406
  155    HG1  THR  20           1HG      THR  20  -2.136  -8.942  -4.300
  156   1HG2  THR  20          1HG2      THR  20  -3.546  -5.378  -4.694
  157   2HG2  THR  20          2HG2      THR  20  -2.469  -6.382  -5.665
  158   3HG2  THR  20          3HG2      THR  20  -1.876  -5.625  -4.186
  159    H    LEU  21           H        LEU  21  -6.052  -7.682  -1.955
  160    HA   LEU  21           HA       LEU  21  -5.209 -10.271  -0.882
  161   1HB   LEU  21          1HB       LEU  21  -5.398  -8.784   1.038
  162   2HB   LEU  21          2HB       LEU  21  -7.031  -8.340   0.547
  163    HG   LEU  21           HG       LEU  21  -7.078 -11.121   0.803
  164   1HD1  LEU  21          1HD1      LEU  21  -5.307  -9.831   2.827
  165   2HD1  LEU  21          2HD1      LEU  21  -5.167 -11.407   2.048
  166   3HD1  LEU  21          3HD1      LEU  21  -6.369 -11.153   3.313
  167   1HD2  LEU  21          1HD2      LEU  21  -7.953  -9.340   3.025
  168   2HD2  LEU  21          2HD2      LEU  21  -8.785 -10.702   2.276
  169   3HD2  LEU  21          3HD2      LEU  21  -8.695  -9.153   1.436
  170    H    ASN  22           H        ASN  22  -6.574 -11.918  -1.344
  171    HA   ASN  22           HA       ASN  22  -8.746 -11.365  -3.168
  172   1HB   ASN  22          1HB       ASN  22  -7.399 -13.224  -3.770
  173   2HB   ASN  22          2HB       ASN  22  -7.483 -13.906  -2.149
  174   1HD2  ASN  22          1HD2      ASN  22  -8.951 -15.412  -1.770
  175   2HD2  ASN  22          2HD2      ASN  22 -10.288 -15.795  -2.795
  176    H    ASN  23           H        ASN  23 -10.896 -11.594  -2.792
  177    HA   ASN  23           HA       ASN  23 -12.824 -11.553  -1.578
  178   1HB   ASN  23          1HB       ASN  23 -11.395 -13.987  -0.552
  179   2HB   ASN  23          2HB       ASN  23 -12.955 -13.523   0.121
  180   1HD2  ASN  23          1HD2      ASN  23 -14.381 -14.895  -0.677
  181   2HD2  ASN  23          2HD2      ASN  23 -14.571 -15.296  -2.347
  182    HA   PRO  24           HA       PRO  24 -10.718  -9.340   1.960
  183   1HB   PRO  24          1HB       PRO  24 -11.710  -6.886   1.357
  184   2HB   PRO  24          2HB       PRO  24 -10.203  -7.507   0.674
  185   1HG   PRO  24          1HG       PRO  24 -12.939  -7.425  -0.538
  186   2HG   PRO  24          2HG       PRO  24 -11.374  -7.047  -1.281
  187   1HD   PRO  24          1HD       PRO  24 -12.634  -9.413  -1.662
  188   2HD   PRO  24          2HD       PRO  24 -10.865  -9.266  -1.638
  189    H    SER  25           H        SER  25 -11.706  -9.107   3.883
  190    HA   SER  25           HA       SER  25 -14.607  -9.383   3.971
  191   1HB   SER  25          1HB       SER  25 -12.369  -9.870   5.873
  192   2HB   SER  25          2HB       SER  25 -13.936  -9.444   6.561
  193    HG   SER  25           HG       SER  25 -14.832 -11.228   5.628
  194    H    GLU  26           H        GLU  26 -15.894  -8.058   5.418
  195    HA   GLU  26           HA       GLU  26 -15.560  -5.319   4.989
  196   1HB   GLU  26          1HB       GLU  26 -17.453  -7.035   6.325
  197   2HB   GLU  26          2HB       GLU  26 -17.161  -5.592   7.286
  198   1HG   GLU  26          1HG       GLU  26 -17.811  -4.172   5.483
  199   2HG   GLU  26          2HG       GLU  26 -17.893  -5.537   4.370
  200    H    ASP  27           H        ASP  27 -14.445  -7.384   7.564
  201    HA   ASP  27           HA       ASP  27 -13.817  -5.308   9.412
  202   1HB   ASP  27          1HB       ASP  27 -13.483  -8.211   9.247
  203   2HB   ASP  27          2HB       ASP  27 -12.140  -7.404  10.053
  204    H    GLU  28           H        GLU  28 -11.859  -7.218   7.137
  205    HA   GLU  28           HA       GLU  28  -9.422  -5.901   7.703
  206   1HB   GLU  28          1HB       GLU  28 -10.247  -8.055   6.115
  207   2HB   GLU  28          2HB       GLU  28  -9.558  -6.895   4.988
  208   1HG   GLU  28          1HG       GLU  28  -7.818  -8.354   5.648
  209   2HG   GLU  28          2HG       GLU  28  -7.531  -6.808   6.444
  210    H    ARG  29           H        ARG  29 -11.809  -5.470   5.106
  211    HA   ARG  29           HA       ARG  29 -10.479  -3.431   3.726
  212   1HB   ARG  29          1HB       ARG  29 -13.245  -4.471   3.847
  213   2HB   ARG  29          2HB       ARG  29 -13.074  -2.826   3.251
  214   1HG   ARG  29          1HG       ARG  29 -11.778  -3.496   1.426
  215   2HG   ARG  29          2HG       ARG  29 -11.430  -5.071   2.141
  216   1HD   ARG  29          1HD       ARG  29 -13.026  -5.611   0.566
  217   2HD   ARG  29          2HD       ARG  29 -14.007  -5.397   2.015
  218    HE   ARG  29           HE       ARG  29 -13.846  -2.947   0.660
  219   1HH1  ARG  29          1HH1      ARG  29 -15.237  -6.118   0.294
  220   2HH1  ARG  29          2HH1      ARG  29 -16.570  -5.565  -0.665
  221   1HH2  ARG  29          1HH2      ARG  29 -15.596  -2.207  -0.602
  222   2HH2  ARG  29          2HH2      ARG  29 -16.773  -3.341  -1.175
  223    H    LYS  30           H        LYS  30 -12.618  -3.335   6.514
  224    HA   LYS  30           HA       LYS  30 -12.935  -0.509   6.564
  225   1HB   LYS  30          1HB       LYS  30 -14.553  -1.860   7.701
  226   2HB   LYS  30          2HB       LYS  30 -13.310  -2.636   8.673
  227   1HG   LYS  30          1HG       LYS  30 -12.874  -0.525   9.814
  228   2HG   LYS  30          2HG       LYS  30 -14.108   0.265   8.830
  229   1HD   LYS  30          1HD       LYS  30 -14.604  -2.056  10.695
  230   2HD   LYS  30          2HD       LYS  30 -14.922  -0.363  11.080
  231   1HE   LYS  30          1HE       LYS  30 -16.282  -0.511   8.800
  232   2HE   LYS  30          2HE       LYS  30 -16.367  -2.211   9.260
  233   1HZ   LYS  30          1HZ       LYS  30 -18.250  -1.207  10.190
  234   2HZ   LYS  30          2HZ       LYS  30 -17.386   0.135  10.748
  235   3HZ   LYS  30          3HZ       LYS  30 -17.176  -1.372  11.486
  236    H    LYS  31           H        LYS  31 -10.634  -2.747   7.999
  237    HA   LYS  31           HA       LYS  31  -9.396  -0.966   9.786
  238   1HB   LYS  31          1HB       LYS  31  -8.998  -3.326   9.988
  239   2HB   LYS  31          2HB       LYS  31  -8.345  -3.410   8.357
  240   1HG   LYS  31          1HG       LYS  31  -6.842  -1.501   9.840
  241   2HG   LYS  31          2HG       LYS  31  -6.963  -2.990  10.780
  242   1HD   LYS  31          1HD       LYS  31  -6.436  -3.959   8.290
  243   2HD   LYS  31          2HD       LYS  31  -5.529  -2.444   8.277
  244   1HE   LYS  31          1HE       LYS  31  -5.315  -4.622  10.354
  245   2HE   LYS  31          2HE       LYS  31  -4.154  -4.306   9.065
  246   1HZ   LYS  31          1HZ       LYS  31  -3.205  -3.192  10.801
  247   2HZ   LYS  31          2HZ       LYS  31  -4.683  -2.769  11.507
  248   3HZ   LYS  31          3HZ       LYS  31  -4.135  -1.945  10.135
  249    H    ILE  32           H        ILE  32  -8.461  -1.911   6.480
  250    HA   ILE  32           HA       ILE  32  -6.280  -0.121   6.306
  251    HB   ILE  32           HB       ILE  32  -7.881  -1.624   4.262
  252   1HG1  ILE  32          1HG1      ILE  32  -4.952  -1.686   5.019
  253   2HG1  ILE  32          2HG1      ILE  32  -6.173  -2.794   5.633
  254   1HG2  ILE  32          1HG2      ILE  32  -6.188  -0.787   2.580
  255   2HG2  ILE  32          2HG2      ILE  32  -7.415   0.371   3.088
  256   3HG2  ILE  32          3HG2      ILE  32  -5.784   0.469   3.749
  257   1HD1  ILE  32          1HD1      ILE  32  -4.605  -3.053   3.324
  258   2HD1  ILE  32          2HD1      ILE  32  -5.906  -4.108   3.878
  259   3HD1  ILE  32          3HD1      ILE  32  -6.259  -2.775   2.779
  260    H    ARG  33           H        ARG  33  -9.681   0.140   5.397
  261    HA   ARG  33           HA       ARG  33  -9.422   2.668   4.109
  262   1HB   ARG  33          1HB       ARG  33 -11.285   1.131   3.637
  263   2HB   ARG  33          2HB       ARG  33 -11.870   1.337   5.282
  264   1HG   ARG  33          1HG       ARG  33 -12.616   3.485   4.892
  265   2HG   ARG  33          2HG       ARG  33 -11.535   3.719   3.516
  266   1HD   ARG  33          1HD       ARG  33 -13.696   3.486   2.601
  267   2HD   ARG  33          2HD       ARG  33 -12.889   1.942   2.325
  268    HE   ARG  33           HE       ARG  33 -14.404   0.935   3.723
  269   1HH1  ARG  33          1HH1      ARG  33 -14.597   4.390   4.106
  270   2HH1  ARG  33          2HH1      ARG  33 -16.021   4.332   5.090
  271   1HH2  ARG  33          1HH2      ARG  33 -16.280   0.846   5.017
  272   2HH2  ARG  33          2HH2      ARG  33 -16.977   2.315   5.608
  273    H    ASP  34           H        ASP  34  -9.640   1.666   7.383
  274    HA   ASP  34           HA       ASP  34 -10.394   4.351   8.282
  275   1HB   ASP  34          1HB       ASP  34 -11.546   2.355   9.257
  276   2HB   ASP  34          2HB       ASP  34 -10.002   1.853   9.941
  277    H    LEU  35           H        LEU  35  -7.675   3.058   7.287
  278    HA   LEU  35           HA       LEU  35  -5.856   3.370   9.427
  279   1HB   LEU  35          1HB       LEU  35  -5.622   3.226   6.456
  280   2HB   LEU  35          2HB       LEU  35  -4.221   3.714   7.408
  281    HG   LEU  35           HG       LEU  35  -5.703   1.109   7.755
  282   1HD1  LEU  35          1HD1      LEU  35  -3.663   0.131   6.705
  283   2HD1  LEU  35          2HD1      LEU  35  -3.177   1.764   6.251
  284   3HD1  LEU  35          3HD1      LEU  35  -4.667   1.076   5.605
  285   1HD2  LEU  35          1HD2      LEU  35  -4.568   1.890   9.771
  286   2HD2  LEU  35          2HD2      LEU  35  -3.070   2.085   8.859
  287   3HD2  LEU  35          3HD2      LEU  35  -3.759   0.478   9.091
  288    HA   PRO  36           HA       PRO  36  -5.178   7.695   9.709
  289   1HB   PRO  36          1HB       PRO  36  -2.490   7.846  10.054
  290   2HB   PRO  36          2HB       PRO  36  -3.587   7.248  11.304
  291   1HG   PRO  36          1HG       PRO  36  -1.895   5.708   9.373
  292   2HG   PRO  36          2HG       PRO  36  -2.166   5.418  11.101
  293   1HD   PRO  36          1HD       PRO  36  -3.449   4.019   9.170
  294   2HD   PRO  36          2HD       PRO  36  -4.196   4.387  10.738
  295    H    ILE  37           H        ILE  37  -5.414   9.035   8.036
  296    HA   ILE  37           HA       ILE  37  -4.175   8.644   5.512
  297    HB   ILE  37           HB       ILE  37  -5.066  10.949   5.005
  298   1HG1  ILE  37          1HG1      ILE  37  -6.304  10.677   7.752
  299   2HG1  ILE  37          2HG1      ILE  37  -4.964  11.753   7.370
  300   1HG2  ILE  37          1HG2      ILE  37  -6.875   9.861   4.319
  301   2HG2  ILE  37          2HG2      ILE  37  -6.382   8.498   5.322
  302   3HG2  ILE  37          3HG2      ILE  37  -7.473   9.721   5.972
  303   1HD1  ILE  37          1HD1      ILE  37  -6.585  13.265   7.077
  304   2HD1  ILE  37          2HD1      ILE  37  -6.773  12.496   5.500
  305   3HD1  ILE  37          3HD1      ILE  37  -7.828  12.038   6.837
  306    H    SER  38           H        SER  38  -3.425  10.618   8.310
  307    HA   SER  38           HA       SER  38  -1.502  12.285   7.072
  308   1HB   SER  38          1HB       SER  38  -1.952  11.496   9.953
  309   2HB   SER  38          2HB       SER  38  -0.707  12.643   9.459
  310    HG   SER  38           HG       SER  38  -2.275  14.037   9.618
  311    H    LEU  39           H        LEU  39  -1.427   9.021   8.135
  312    HA   LEU  39           HA       LEU  39   1.392   8.816   8.541
  313   1HB   LEU  39          1HB       LEU  39  -0.702   7.253   9.186
  314   2HB   LEU  39          2HB       LEU  39  -0.127   6.412   7.748
  315    HG   LEU  39           HG       LEU  39   1.904   7.070   9.798
  316   1HD1  LEU  39          1HD1      LEU  39  -0.023   6.348  11.152
  317   2HD1  LEU  39          2HD1      LEU  39   1.313   5.199  11.206
  318   3HD1  LEU  39          3HD1      LEU  39  -0.103   4.859  10.211
  319   1HD2  LEU  39          1HD2      LEU  39   1.546   5.303   7.565
  320   2HD2  LEU  39          2HD2      LEU  39   1.954   4.379   9.011
  321   3HD2  LEU  39          3HD2      LEU  39   3.013   5.682   8.468
  322    H    PHE  40           H        PHE  40  -0.732   8.586   5.796
  323    HA   PHE  40           HA       PHE  40   1.603   8.013   4.095
  324   1HB   PHE  40          1HB       PHE  40  -1.193   7.218   3.325
  325   2HB   PHE  40          2HB       PHE  40   0.336   6.624   2.686
  326    HD1  PHE  40           2HD      PHE  40  -2.036   6.431   5.474
  327    HD2  PHE  40           1HD      PHE  40   1.550   4.879   3.788
  328    HE1  PHE  40           2HE      PHE  40  -2.133   4.527   7.030
  329    HE2  PHE  40           1HE      PHE  40   1.459   2.972   5.340
  330    HZ   PHE  40           HZ       PHE  40  -0.383   2.795   6.964
  331    H    ASP  41           H        ASP  41   2.109   9.756   2.962
  332    HA   ASP  41           HA       ASP  41   0.591  12.049   2.669
  333   1HB   ASP  41          1HB       ASP  41   2.908  10.915   1.143
  334   2HB   ASP  41          2HB       ASP  41   2.117  12.379   0.564
  335    H    TYR  42           H        TYR  42   0.514   9.101   0.826
  336    HA   TYR  42           HA       TYR  42  -1.756  10.159  -0.696
  337   1HB   TYR  42          1HB       TYR  42   0.148  10.341  -2.199
  338   2HB   TYR  42          2HB       TYR  42   0.584   8.664  -1.895
  339    HD1  TYR  42           1HD      TYR  42  -2.879   9.842  -2.381
  340    HD2  TYR  42           2HD      TYR  42   0.469   7.906  -4.155
  341    HE1  TYR  42           1HE      TYR  42  -4.293   9.138  -4.266
  342    HE2  TYR  42           2HE      TYR  42  -0.936   7.197  -6.045
  343    HH   TYR  42           HH       TYR  42  -3.024   7.063  -6.839
  344    H    PHE  43           H        PHE  43  -3.452   8.857  -0.549
  345    HA   PHE  43           HA       PHE  43  -3.010   5.976  -0.178
  346   1HB   PHE  43          1HB       PHE  43  -3.739   7.512   1.910
  347   2HB   PHE  43          2HB       PHE  43  -5.328   7.170   1.233
  348    HD1  PHE  43           1HD      PHE  43  -4.238   4.380   0.153
  349    HD2  PHE  43           2HD      PHE  43  -4.375   6.303   3.947
  350    HE1  PHE  43           1HE      PHE  43  -4.238   2.183   1.262
  351    HE2  PHE  43           2HE      PHE  43  -4.374   4.110   5.063
  352    HZ   PHE  43           HZ       PHE  43  -4.305   2.047   3.720
  353    H    ILE  44           H        ILE  44  -3.908   4.956  -1.832
  354    HA   ILE  44           HA       ILE  44  -6.567   5.799  -2.741
  355    HB   ILE  44           HB       ILE  44  -5.162   6.768  -4.394
  356   1HG1  ILE  44          1HG1      ILE  44  -5.662   4.328  -5.945
  357   2HG1  ILE  44          2HG1      ILE  44  -7.044   4.853  -4.990
  358   1HG2  ILE  44          1HG2      ILE  44  -3.396   5.581  -5.549
  359   2HG2  ILE  44          2HG2      ILE  44  -3.115   5.534  -3.810
  360   3HG2  ILE  44          3HG2      ILE  44  -3.753   4.114  -4.639
  361   1HD1  ILE  44          1HD1      ILE  44  -6.479   5.731  -7.476
  362   2HD1  ILE  44          2HD1      ILE  44  -7.419   6.638  -6.290
  363   3HD1  ILE  44          3HD1      ILE  44  -5.701   6.978  -6.501
  364    H    VAL  45           H        VAL  45  -7.897   4.135  -2.537
  365    HA   VAL  45           HA       VAL  45  -6.856   1.424  -3.053
  366    HB   VAL  45           HB       VAL  45  -9.158   1.885  -1.192
  367   1HG1  VAL  45          1HG1      VAL  45  -7.082  -0.267  -1.546
  368   2HG1  VAL  45          2HG1      VAL  45  -8.208  -0.215  -0.187
  369   3HG1  VAL  45          3HG1      VAL  45  -8.818  -0.378  -1.835
  370   1HG2  VAL  45          1HG2      VAL  45  -7.699   3.225  -0.035
  371   2HG2  VAL  45          2HG2      VAL  45  -7.264   1.644   0.617
  372   3HG2  VAL  45          3HG2      VAL  45  -6.272   2.384  -0.640
  373    H    GLY  46           H        GLY  46  -8.152   0.016  -4.202
  374   1HA   GLY  46          1HA       GLY  46 -10.736   1.052  -5.159
  375   2HA   GLY  46          2HA       GLY  46  -9.533   0.510  -6.320
  376    H    GLU  47           H        GLU  47 -12.318  -0.426  -5.355
  377    HA   GLU  47           HA       GLU  47 -11.665  -3.173  -4.598
  378   1HB   GLU  47          1HB       GLU  47 -13.448  -1.953  -3.371
  379   2HB   GLU  47          2HB       GLU  47 -14.369  -1.849  -4.864
  380   1HG   GLU  47          1HG       GLU  47 -15.250  -3.638  -3.563
  381   2HG   GLU  47          2HG       GLU  47 -14.409  -4.327  -4.951
  382    H    GLU  48           H        GLU  48 -11.873  -4.880  -5.928
  383    HA   GLU  48           HA       GLU  48 -13.058  -4.412  -8.584
  384   1HB   GLU  48          1HB       GLU  48 -10.691  -4.486  -8.908
  385   2HB   GLU  48          2HB       GLU  48 -10.532  -5.901  -7.876
  386   1HG   GLU  48          1HG       GLU  48 -11.416  -7.328  -9.481
  387   2HG   GLU  48          2HG       GLU  48 -12.160  -6.009 -10.382
  388    H    GLY  49           H        GLY  49 -14.925  -5.503  -8.565
  389   1HA   GLY  49          1HA       GLY  49 -15.097  -8.252  -8.690
  390   2HA   GLY  49          2HA       GLY  49 -15.359  -7.849  -7.000
  391    H    ASN  50           H        ASN  50 -16.353  -5.892  -9.755
  392    HA   ASN  50           HA       ASN  50 -19.130  -6.179  -8.856
  393   1HB   ASN  50          1HB       ASN  50 -17.696  -3.920  -9.401
  394   2HB   ASN  50          2HB       ASN  50 -18.526  -4.178 -10.933
  395   1HD2  ASN  50          1HD2      ASN  50 -19.171  -4.178  -7.447
  396   2HD2  ASN  50          2HD2      ASN  50 -20.716  -3.411  -7.560
  397    H    GLU  51           H        GLU  51 -17.881  -8.258 -10.387
  398    HA   GLU  51           HA       GLU  51 -19.661  -8.218 -12.719
  399   1HB   GLU  51          1HB       GLU  51 -16.766  -8.279 -12.763
  400   2HB   GLU  51          2HB       GLU  51 -17.438  -9.718 -13.517
  401   1HG   GLU  51          1HG       GLU  51 -18.869  -8.204 -14.910
  402   2HG   GLU  51          2HG       GLU  51 -17.941  -6.851 -14.264
  403    H    GLU  52           H        GLU  52 -20.969  -9.914 -12.683
  404    HA   GLU  52           HA       GLU  52 -20.949 -11.921 -10.790
  405   1HB   GLU  52          1HB       GLU  52 -22.743 -11.191 -12.582
  406   2HB   GLU  52          2HB       GLU  52 -22.045 -12.514 -13.506
  407   1HG   GLU  52          1HG       GLU  52 -23.103 -14.041 -12.296
  408   2HG   GLU  52          2HG       GLU  52 -22.610 -13.292 -10.779
  409    H    GLY  53           H        GLY  53 -20.260 -14.051 -10.724
  410   1HA   GLY  53          1HA       GLY  53 -19.194 -15.987 -11.531
  411   2HA   GLY  53          2HA       GLY  53 -18.677 -15.085 -12.948
  412    H    ARG  54           H        ARG  54 -17.807 -12.906 -10.947
  413    HA   ARG  54           HA       ARG  54 -15.240 -14.176 -10.252
  414   1HB   ARG  54          1HB       ARG  54 -15.001 -12.500 -12.012
  415   2HB   ARG  54          2HB       ARG  54 -15.804 -11.303 -11.005
  416   1HG   ARG  54          1HG       ARG  54 -13.972 -10.948  -9.719
  417   2HG   ARG  54          2HG       ARG  54 -13.397 -12.608  -9.886
  418   1HD   ARG  54          1HD       ARG  54 -11.847 -11.361 -11.099
  419   2HD   ARG  54          2HD       ARG  54 -12.938 -11.988 -12.334
  420    HE   ARG  54           HE       ARG  54 -13.926  -9.513 -11.594
  421   1HH1  ARG  54          1HH1      ARG  54 -11.016 -10.795 -13.011
  422   2HH1  ARG  54          2HH1      ARG  54 -10.672  -9.362 -13.921
  423   1HH2  ARG  54          1HH2      ARG  54 -13.484  -7.621 -12.787
  424   2HH2  ARG  54          2HH2      ARG  54 -12.076  -7.556 -13.792
  425    H    THR  55           H        THR  55 -14.257 -13.636  -8.287
  426    HA   THR  55           HA       THR  55 -16.139 -12.797  -6.224
  427    HB   THR  55           HB       THR  55 -13.776 -13.389  -4.926
  428    HG1  THR  55           1HG      THR  55 -14.100 -15.276  -7.036
  429   1HG2  THR  55          1HG2      THR  55 -16.376 -14.635  -5.375
  430   2HG2  THR  55          2HG2      THR  55 -15.438 -14.479  -3.889
  431   3HG2  THR  55          3HG2      THR  55 -15.105 -15.801  -5.007
  432    HA   PRO  56           HA       PRO  56 -14.438  -8.815  -5.505
  433   1HB   PRO  56          1HB       PRO  56 -14.546  -8.629  -2.799
  434   2HB   PRO  56          2HB       PRO  56 -15.985  -8.569  -3.824
  435   1HG   PRO  56          1HG       PRO  56 -14.859 -10.868  -2.273
  436   2HG   PRO  56          2HG       PRO  56 -16.547 -10.352  -2.441
  437   1HD   PRO  56          1HD       PRO  56 -15.507 -12.412  -3.856
  438   2HD   PRO  56          2HD       PRO  56 -16.782 -11.359  -4.501
  439    H    HIS  57           H        HIS  57 -12.466  -7.911  -5.341
  440    HA   HIS  57           HA       HIS  57 -10.448  -9.160  -3.626
  441   1HB   HIS  57          1HB       HIS  57 -10.023 -10.171  -5.767
  442   2HB   HIS  57          2HB       HIS  57 -10.123  -8.612  -6.581
  443    HD1  HIS  57           1HD      HIS  57  -7.793 -10.835  -4.783
  444    HD2  HIS  57           2HD      HIS  57  -7.862  -6.911  -6.143
  445    HE1  HIS  57           1HE      HIS  57  -5.404 -10.053  -4.702
  446    H    LEU  58           H        LEU  58  -9.007  -7.752  -2.731
  447    HA   LEU  58           HA       LEU  58  -9.578  -4.917  -3.127
  448   1HB   LEU  58          1HB       LEU  58  -9.080  -6.455  -0.885
  449   2HB   LEU  58          2HB       LEU  58  -7.572  -5.576  -1.127
  450    HG   LEU  58           HG       LEU  58 -10.314  -4.404  -0.684
  451   1HD1  LEU  58          1HD1      LEU  58  -7.783  -4.453   0.945
  452   2HD1  LEU  58          2HD1      LEU  58  -9.349  -5.151   1.360
  453   3HD1  LEU  58          3HD1      LEU  58  -9.155  -3.399   1.292
  454   1HD2  LEU  58          1HD2      LEU  58  -9.198  -2.220  -0.783
  455   2HD2  LEU  58          2HD2      LEU  58  -9.130  -3.067  -2.328
  456   3HD2  LEU  58          3HD2      LEU  58  -7.706  -3.014  -1.288
  457    H    GLN  59           H        GLN  59  -8.179  -3.488  -3.990
  458    HA   GLN  59           HA       GLN  59  -5.378  -4.149  -4.310
  459   1HB   GLN  59          1HB       GLN  59  -6.178  -5.191  -6.294
  460   2HB   GLN  59          2HB       GLN  59  -7.248  -3.843  -6.654
  461   1HG   GLN  59          1HG       GLN  59  -5.369  -3.788  -8.140
  462   2HG   GLN  59          2HG       GLN  59  -5.277  -2.417  -7.035
  463   1HE2  GLN  59          1HE2      GLN  59  -3.723  -2.441  -5.376
  464   2HE2  GLN  59          2HE2      GLN  59  -2.323  -3.449  -5.471
  465    H    GLY  60           H        GLY  60  -4.419  -2.376  -3.570
  466   1HA   GLY  60          1HA       GLY  60  -5.073   0.196  -4.757
  467   2HA   GLY  60          2HA       GLY  60  -5.354   0.070  -3.027
  468    H    PHE  61           H        PHE  61  -3.661   1.964  -3.691
  469    HA   PHE  61           HA       PHE  61  -1.040   0.850  -2.962
  470   1HB   PHE  61          1HB       PHE  61  -0.736   1.372  -5.246
  471   2HB   PHE  61          2HB       PHE  61  -1.659   2.865  -5.113
  472    HD1  PHE  61           2HD      PHE  61   1.336   1.349  -3.474
  473    HD2  PHE  61           1HD      PHE  61  -0.427   4.783  -5.267
  474    HE1  PHE  61           2HE      PHE  61   3.424   2.602  -3.120
  475    HE2  PHE  61           1HE      PHE  61   1.658   6.041  -4.917
  476    HZ   PHE  61           HZ       PHE  61   3.587   4.951  -3.841
  477    H    ALA  62           H        ALA  62   0.118   1.994  -1.468
  478    HA   ALA  62           HA       ALA  62  -0.986   4.557  -0.548
  479   1HB   ALA  62          1HB       ALA  62  -1.789   3.538   1.266
  480   2HB   ALA  62          2HB       ALA  62  -0.904   2.051   0.925
  481   3HB   ALA  62          3HB       ALA  62  -0.110   3.373   1.780
  482    H    ASN  63           H        ASN  63   0.522   6.078  -0.374
  483    HA   ASN  63           HA       ASN  63   3.325   5.319  -0.584
  484   1HB   ASN  63          1HB       ASN  63   2.392   7.100  -2.046
  485   2HB   ASN  63          2HB       ASN  63   2.076   8.075  -0.613
  486   1HD2  ASN  63          1HD2      ASN  63   4.019   7.982  -3.089
  487   2HD2  ASN  63          2HD2      ASN  63   5.509   8.507  -2.390
  488    H    PHE  64           H        PHE  64   4.460   4.990   1.202
  489    HA   PHE  64           HA       PHE  64   3.594   5.882   3.769
  490   1HB   PHE  64          1HB       PHE  64   5.600   4.093   2.707
  491   2HB   PHE  64          2HB       PHE  64   6.285   5.105   3.974
  492    HD1  PHE  64           2HD      PHE  64   4.964   5.236   6.187
  493    HD2  PHE  64           1HD      PHE  64   4.397   2.199   3.259
  494    HE1  PHE  64           2HE      PHE  64   3.949   3.784   7.894
  495    HE2  PHE  64           1HE      PHE  64   3.381   0.742   4.962
  496    HZ   PHE  64           HZ       PHE  64   3.157   1.534   7.283
  497    H    VAL  65           H        VAL  65   4.026   7.725   4.787
  498    HA   VAL  65           HA       VAL  65   5.347   9.868   3.550
  499    HB   VAL  65           HB       VAL  65   4.678   9.472   6.469
  500   1HG1  VAL  65          1HG1      VAL  65   5.610  11.900   4.955
  501   2HG1  VAL  65          2HG1      VAL  65   4.794  11.992   6.518
  502   3HG1  VAL  65          3HG1      VAL  65   6.342  11.157   6.377
  503   1HG2  VAL  65          1HG2      VAL  65   2.814   9.455   4.736
  504   2HG2  VAL  65          2HG2      VAL  65   2.667  10.620   6.051
  505   3HG2  VAL  65          3HG2      VAL  65   3.205  11.152   4.459
  506    H    LYS  66           H        LYS  66   6.533   7.267   5.480
  507    HA   LYS  66           HA       LYS  66   9.205   8.508   5.474
  508   1HB   LYS  66          1HB       LYS  66   7.780   7.020   7.647
  509   2HB   LYS  66          2HB       LYS  66   9.534   6.929   7.546
  510   1HG   LYS  66          1HG       LYS  66   9.279   8.688   8.978
  511   2HG   LYS  66          2HG       LYS  66   9.358   9.539   7.434
  512   1HD   LYS  66          1HD       LYS  66   7.533  10.505   8.539
  513   2HD   LYS  66          2HD       LYS  66   6.804   9.356   7.414
  514   1HE   LYS  66          1HE       LYS  66   5.729   8.463   9.143
  515   2HE   LYS  66          2HE       LYS  66   7.286   7.897   9.744
  516   1HZ   LYS  66          1HZ       LYS  66   5.755   9.392  11.211
  517   2HZ   LYS  66          2HZ       LYS  66   6.466  10.651  10.333
  518   3HZ   LYS  66          3HZ       LYS  66   7.434   9.600  11.238
  519    H    LYS  67           H        LYS  67  10.815   6.522   6.135
  520    HA   LYS  67           HA       LYS  67  10.529   4.670   3.908
  521   1HB   LYS  67          1HB       LYS  67  12.846   5.033   5.817
  522   2HB   LYS  67          2HB       LYS  67  12.862   4.105   4.323
  523   1HG   LYS  67          1HG       LYS  67  12.002   6.779   3.779
  524   2HG   LYS  67          2HG       LYS  67  13.517   6.808   4.685
  525   1HD   LYS  67          1HD       LYS  67  13.144   5.015   2.305
  526   2HD   LYS  67          2HD       LYS  67  13.643   6.698   2.122
  527   1HE   LYS  67          1HE       LYS  67  15.206   5.425   4.165
  528   2HE   LYS  67          2HE       LYS  67  15.259   4.468   2.685
  529   1HZ   LYS  67          1HZ       LYS  67  15.995   7.324   3.005
  530   2HZ   LYS  67          2HZ       LYS  67  15.843   6.563   1.502
  531   3HZ   LYS  67          3HZ       LYS  67  17.018   6.038   2.600
  532    H    GLN  68           H        GLN  68   9.695   2.715   4.169
  533    HA   GLN  68           HA       GLN  68  10.077   1.342   6.740
  534   1HB   GLN  68          1HB       GLN  68   7.514   1.223   5.150
  535   2HB   GLN  68          2HB       GLN  68   7.814   0.553   6.749
  536   1HG   GLN  68          1HG       GLN  68   7.599   3.452   5.987
  537   2HG   GLN  68          2HG       GLN  68   6.506   2.519   7.008
  538   1HE2  GLN  68          1HE2      GLN  68   8.018   4.981   7.548
  539   2HE2  GLN  68          2HE2      GLN  68   8.964   4.648   8.954
  540    H    THR  69           H        THR  69  10.061  -0.958   6.636
  541    HA   THR  69           HA       THR  69  11.007  -1.956   4.062
  542    HB   THR  69           HB       THR  69  11.976  -3.770   5.210
  543    HG1  THR  69           1HG      THR  69  11.414  -4.239   7.403
  544   1HG2  THR  69          1HG2      THR  69  12.121  -1.390   7.065
  545   2HG2  THR  69          2HG2      THR  69  13.132  -1.662   5.645
  546   3HG2  THR  69          3HG2      THR  69  13.254  -2.740   7.035
  547    H    PHE  70           H        PHE  70  10.400  -4.339   3.624
  548    HA   PHE  70           HA       PHE  70   7.647  -4.453   3.079
  549   1HB   PHE  70          1HB       PHE  70   8.943  -5.730   1.628
  550   2HB   PHE  70          2HB       PHE  70   9.893  -6.432   2.933
  551    HD1  PHE  70           1HD      PHE  70   6.527  -6.455   1.381
  552    HD2  PHE  70           2HD      PHE  70   9.337  -8.512   3.829
  553    HE1  PHE  70           1HE      PHE  70   5.093  -8.454   1.341
  554    HE2  PHE  70           2HE      PHE  70   7.908 -10.515   3.792
  555    HZ   PHE  70           HZ       PHE  70   5.783 -10.488   2.546
  556    H    ASN  71           H        ASN  71   9.579  -6.346   5.401
  557    HA   ASN  71           HA       ASN  71   7.405  -7.679   6.579
  558   1HB   ASN  71          1HB       ASN  71  10.076  -7.936   6.787
  559   2HB   ASN  71          2HB       ASN  71   9.755  -7.068   8.286
  560   1HD2  ASN  71          1HD2      ASN  71   9.487 -10.034   6.596
  561   2HD2  ASN  71          2HD2      ASN  71   8.796 -10.961   7.879
  562    H    LYS  72           H        LYS  72   9.006  -4.634   7.378
  563    HA   LYS  72           HA       LYS  72   7.619  -4.146   9.790
  564   1HB   LYS  72          1HB       LYS  72   9.738  -3.000   8.777
  565   2HB   LYS  72          2HB       LYS  72   8.573  -1.928   8.011
  566   1HG   LYS  72          1HG       LYS  72   8.387  -2.401  10.944
  567   2HG   LYS  72          2HG       LYS  72   9.638  -1.324  10.320
  568   1HD   LYS  72          1HD       LYS  72   8.082   0.179   9.455
  569   2HD   LYS  72          2HD       LYS  72   6.781  -1.013   9.468
  570   1HE   LYS  72          1HE       LYS  72   6.314   0.462  11.246
  571   2HE   LYS  72          2HE       LYS  72   6.973  -0.992  11.993
  572   1HZ   LYS  72          1HZ       LYS  72   8.443   1.535  11.471
  573   2HZ   LYS  72          2HZ       LYS  72   9.136   0.129  12.106
  574   3HZ   LYS  72          3HZ       LYS  72   7.948   0.956  12.982
  575    H    VAL  73           H        VAL  73   7.038  -3.042   6.461
  576    HA   VAL  73           HA       VAL  73   4.829  -1.427   6.920
  577    HB   VAL  73           HB       VAL  73   5.593  -3.105   4.543
  578   1HG1  VAL  73          1HG1      VAL  73   3.225  -3.006   4.394
  579   2HG1  VAL  73          2HG1      VAL  73   3.201  -1.305   4.866
  580   3HG1  VAL  73          3HG1      VAL  73   3.856  -1.778   3.297
  581   1HG2  VAL  73          1HG2      VAL  73   6.456  -1.167   3.644
  582   2HG2  VAL  73          2HG2      VAL  73   5.416  -0.125   4.614
  583   3HG2  VAL  73          3HG2      VAL  73   6.795  -0.933   5.359
  584    H    LYS  74           H        LYS  74   5.088  -4.891   6.893
  585    HA   LYS  74           HA       LYS  74   2.365  -5.527   6.512
  586   1HB   LYS  74          1HB       LYS  74   4.633  -7.004   7.841
  587   2HB   LYS  74          2HB       LYS  74   3.020  -7.690   7.693
  588   1HG   LYS  74          1HG       LYS  74   3.346  -7.101   5.157
  589   2HG   LYS  74          2HG       LYS  74   5.056  -7.154   5.592
  590   1HD   LYS  74          1HD       LYS  74   5.051  -9.387   5.757
  591   2HD   LYS  74          2HD       LYS  74   3.532  -9.402   6.657
  592   1HE   LYS  74          1HE       LYS  74   2.273  -9.200   4.604
  593   2HE   LYS  74          2HE       LYS  74   3.760  -9.041   3.671
  594   1HZ   LYS  74          1HZ       LYS  74   2.969 -11.439   5.235
  595   2HZ   LYS  74          2HZ       LYS  74   4.364 -11.284   4.291
  596   3HZ   LYS  74          3HZ       LYS  74   2.841 -11.283   3.555
  597    H    TRP  75           H        TRP  75   3.927  -3.999   9.069
  598    HA   TRP  75           HA       TRP  75   2.452  -4.997  11.271
  599   1HB   TRP  75          1HB       TRP  75   3.407  -3.247  12.524
  600   2HB   TRP  75          2HB       TRP  75   4.613  -3.610  11.293
  601    HD1  TRP  75           HD       TRP  75   3.341  -1.934   8.892
  602    HE1  TRP  75           1HE      TRP  75   3.430   0.637   8.969
  603    HE3  TRP  75           3HE      TRP  75   3.989  -1.296  13.923
  604    HZ2  TRP  75           2HZ      TRP  75   3.735   2.667  10.907
  605    HZ3  TRP  75           3HZ      TRP  75   4.171   0.993  14.807
  606    HH2  TRP  75           HH       TRP  75   4.047   2.932  13.329
  607    H    TYR  76           H        TYR  76   1.648  -2.874   8.709
  608    HA   TYR  76           HA       TYR  76  -0.759  -1.979  10.154
  609   1HB   TYR  76          1HB       TYR  76   1.079  -0.616   8.326
  610   2HB   TYR  76          2HB       TYR  76  -0.615  -0.405   7.897
  611    HD1  TYR  76           2HD      TYR  76  -1.844  -0.393  10.611
  612    HD2  TYR  76           1HD      TYR  76   1.682   1.489   9.152
  613    HE1  TYR  76           2HE      TYR  76  -2.066   1.346  12.335
  614    HE2  TYR  76           1HE      TYR  76   1.470   3.233  10.874
  615    HH   TYR  76           HH       TYR  76  -1.067   3.085  13.335
  616    H    LEU  77           H        LEU  77   0.398  -2.960   6.933
  617    HA   LEU  77           HA       LEU  77  -2.235  -3.370   5.904
  618   1HB   LEU  77          1HB       LEU  77   0.479  -4.217   4.913
  619   2HB   LEU  77          2HB       LEU  77  -1.017  -4.499   4.027
  620    HG   LEU  77           HG       LEU  77  -0.049  -1.752   4.793
  621   1HD1  LEU  77          1HD1      LEU  77   0.270  -3.064   2.106
  622   2HD1  LEU  77          2HD1      LEU  77   1.555  -3.011   3.313
  623   3HD1  LEU  77          3HD1      LEU  77   0.911  -1.511   2.644
  624   1HD2  LEU  77          1HD2      LEU  77  -2.443  -1.977   4.309
  625   2HD2  LEU  77          2HD2      LEU  77  -2.055  -2.697   2.747
  626   3HD2  LEU  77          3HD2      LEU  77  -1.612  -1.022   3.081
  627    H    GLY  78           H        GLY  78  -0.281  -5.150   7.986
  628   1HA   GLY  78          1HA       GLY  78  -0.606  -7.206   8.967
  629   2HA   GLY  78          2HA       GLY  78  -2.135  -7.306   8.105
  630    H    ALA  79           H        ALA  79  -0.269  -9.442   8.565
  631    HA   ALA  79           HA       ALA  79   1.186  -9.938   6.147
  632   1HB   ALA  79          1HB       ALA  79   0.902 -12.379   7.405
  633   2HB   ALA  79          2HB       ALA  79   2.231 -11.240   7.624
  634   3HB   ALA  79          3HB       ALA  79   0.859 -11.217   8.732
  635    H    ARG  80           H        ARG  80  -2.014 -10.637   7.326
  636    HA   ARG  80           HA       ARG  80  -2.763 -12.779   5.746
  637   1HB   ARG  80          1HB       ARG  80  -4.493 -10.400   6.446
  638   2HB   ARG  80          2HB       ARG  80  -5.054 -12.009   6.009
  639   1HG   ARG  80          1HG       ARG  80  -3.531 -12.669   8.089
  640   2HG   ARG  80          2HG       ARG  80  -3.931 -11.015   8.557
  641   1HD   ARG  80          1HD       ARG  80  -5.746 -12.009   9.460
  642   2HD   ARG  80          2HD       ARG  80  -6.362 -11.880   7.813
  643    HE   ARG  80           HE       ARG  80  -6.307 -14.155   7.668
  644   1HH1  ARG  80          1HH1      ARG  80  -4.236 -13.151  10.280
  645   2HH1  ARG  80          2HH1      ARG  80  -3.915 -14.766  10.820
  646   1HH2  ARG  80          1HH2      ARG  80  -5.892 -16.286   8.370
  647   2HH2  ARG  80          2HH2      ARG  80  -4.857 -16.548   9.732
  648    H    CYS  81           H        CYS  81  -2.419  -9.397   4.893
  649    HA   CYS  81           HA       CYS  81  -3.414  -9.933   2.191
  650   1HB   CYS  81          1HB       CYS  81  -4.350  -7.962   3.230
  651   2HB   CYS  81          2HB       CYS  81  -2.745  -7.347   3.606
  652    HG   CYS  81           HG       CYS  81  -2.070  -6.583   1.116
  653    H    HIS  82           H        HIS  82  -2.159  -9.726   0.377
  654    HA   HIS  82           HA       HIS  82   0.691  -9.975   0.775
  655   1HB   HIS  82          1HB       HIS  82  -0.742 -11.297  -0.902
  656   2HB   HIS  82          2HB       HIS  82  -0.705  -9.841  -1.891
  657    HD1  HIS  82           1HD      HIS  82   1.275 -12.797  -0.973
  658    HD2  HIS  82           2HD      HIS  82   1.929  -9.133  -2.820
  659    HE1  HIS  82           1HE      HIS  82   3.500 -13.012  -2.124
  660    H    ILE  83           H        ILE  83   2.148  -8.404   0.599
  661    HA   ILE  83           HA       ILE  83   1.322  -5.878  -0.678
  662    HB   ILE  83           HB       ILE  83   2.831  -4.698   0.842
  663   1HG1  ILE  83          1HG1      ILE  83   3.209  -7.390   2.172
  664   2HG1  ILE  83          2HG1      ILE  83   4.424  -6.554   1.212
  665   1HG2  ILE  83          1HG2      ILE  83   0.856  -6.471   2.273
  666   2HG2  ILE  83          2HG2      ILE  83   1.525  -4.964   2.898
  667   3HG2  ILE  83          3HG2      ILE  83   0.493  -4.944   1.468
  668   1HD1  ILE  83          1HD1      ILE  83   3.221  -5.522   3.769
  669   2HD1  ILE  83          2HD1      ILE  83   4.795  -6.305   3.615
  670   3HD1  ILE  83          3HD1      ILE  83   4.499  -4.756   2.826
  671    H    GLU  84           H        GLU  84   2.810  -4.790  -1.962
  672    HA   GLU  84           HA       GLU  84   5.437  -5.962  -2.391
  673   1HB   GLU  84          1HB       GLU  84   3.505  -6.940  -3.955
  674   2HB   GLU  84          2HB       GLU  84   3.865  -5.482  -4.870
  675   1HG   GLU  84          1HG       GLU  84   6.053  -6.151  -5.309
  676   2HG   GLU  84          2HG       GLU  84   6.037  -7.360  -4.026
  677    H    LYS  85           H        LYS  85   6.752  -4.630  -3.910
  678    HA   LYS  85           HA       LYS  85   6.460  -1.858  -3.245
  679   1HB   LYS  85          1HB       LYS  85   8.451  -3.381  -4.920
  680   2HB   LYS  85          2HB       LYS  85   8.519  -1.634  -4.731
  681   1HG   LYS  85          1HG       LYS  85   8.719  -1.931  -2.295
  682   2HG   LYS  85          2HG       LYS  85   8.730  -3.680  -2.531
  683   1HD   LYS  85          1HD       LYS  85  10.726  -1.787  -3.769
  684   2HD   LYS  85          2HD       LYS  85  10.996  -2.669  -2.264
  685   1HE   LYS  85          1HE       LYS  85  11.700  -4.419  -3.434
  686   2HE   LYS  85          2HE       LYS  85  10.112  -4.541  -4.189
  687   1HZ   LYS  85          1HZ       LYS  85  12.503  -3.901  -5.416
  688   2HZ   LYS  85          2HZ       LYS  85  11.615  -2.462  -5.385
  689   3HZ   LYS  85          3HZ       LYS  85  10.956  -3.846  -6.100
  690    H    ALA  86           H        ALA  86   5.674  -0.231  -4.447
  691    HA   ALA  86           HA       ALA  86   4.374  -0.896  -6.957
  692   1HB   ALA  86          1HB       ALA  86   4.141   1.875  -6.301
  693   2HB   ALA  86          2HB       ALA  86   2.895   0.626  -6.310
  694   3HB   ALA  86          3HB       ALA  86   3.852   0.907  -4.855
  695    H    LYS  87           H        LYS  87   4.611   0.456  -8.861
  696    HA   LYS  87           HA       LYS  87   7.115   1.952  -9.055
  697   1HB   LYS  87          1HB       LYS  87   7.805   0.773 -11.071
  698   2HB   LYS  87          2HB       LYS  87   7.660  -0.352  -9.727
  699   1HG   LYS  87          1HG       LYS  87   5.970  -1.490 -10.685
  700   2HG   LYS  87          2HG       LYS  87   5.255  -0.042 -11.399
  701   1HD   LYS  87          1HD       LYS  87   6.004  -1.161 -13.272
  702   2HD   LYS  87          2HD       LYS  87   7.370  -0.098 -12.929
  703   1HE   LYS  87          1HE       LYS  87   8.479  -1.938 -11.737
  704   2HE   LYS  87          2HE       LYS  87   7.121  -2.995 -12.120
  705   1HZ   LYS  87          1HZ       LYS  87   9.084  -3.204 -13.622
  706   2HZ   LYS  87          2HZ       LYS  87   8.762  -1.642 -14.186
  707   3HZ   LYS  87          3HZ       LYS  87   7.627  -2.876 -14.416
  708    H    GLY  88           H        GLY  88   7.165   3.488 -10.722
  709   1HA   GLY  88          1HA       GLY  88   6.173   4.392 -12.762
  710   2HA   GLY  88          2HA       GLY  88   4.611   3.858 -12.158
  711    H    THR  89           H        THR  89   4.422   6.287 -12.879
  712    HA   THR  89           HA       THR  89   5.262   8.156 -10.826
  713    HB   THR  89           HB       THR  89   4.394   9.890 -12.206
  714    HG1  THR  89           1HG      THR  89   3.194   7.921 -13.876
  715   1HG2  THR  89          1HG2      THR  89   6.454   8.594 -12.998
  716   2HG2  THR  89          2HG2      THR  89   5.646   9.624 -14.180
  717   3HG2  THR  89          3HG2      THR  89   5.390   7.880 -14.208
  718    H    ASP  90           H        ASP  90   3.486   9.816 -10.168
  719    HA   ASP  90           HA       ASP  90   1.701   8.566  -8.450
  720   1HB   ASP  90          1HB       ASP  90   0.571  10.819  -8.334
  721   2HB   ASP  90          2HB       ASP  90   2.308  10.840  -8.040
  722    H    GLN  91           H        GLN  91   1.195   9.777 -11.728
  723    HA   GLN  91           HA       GLN  91  -1.607   9.324 -11.777
  724   1HB   GLN  91          1HB       GLN  91   0.470   9.758 -13.907
  725   2HB   GLN  91          2HB       GLN  91  -1.198   9.388 -14.326
  726   1HG   GLN  91          1HG       GLN  91  -0.990  11.523 -12.371
  727   2HG   GLN  91          2HG       GLN  91  -0.141  11.887 -13.872
  728   1HE2  GLN  91          1HE2      GLN  91  -3.212  11.269 -12.388
  729   2HE2  GLN  91          2HE2      GLN  91  -4.190  11.764 -13.723
  730    H    GLN  92           H        GLN  92   1.196   7.370 -12.599
  731    HA   GLN  92           HA       GLN  92  -0.167   5.290 -13.925
  732   1HB   GLN  92          1HB       GLN  92   2.511   5.732 -12.812
  733   2HB   GLN  92          2HB       GLN  92   1.996   4.051 -12.779
  734   1HG   GLN  92          1HG       GLN  92   1.298   4.832 -15.307
  735   2HG   GLN  92          2HG       GLN  92   2.792   5.725 -15.024
  736   1HE2  GLN  92          1HE2      GLN  92   4.709   4.631 -14.852
  737   2HE2  GLN  92          2HE2      GLN  92   4.874   2.949 -15.208
  738    H    ASN  93           H        ASN  93   0.556   5.874 -10.529
  739    HA   ASN  93           HA       ASN  93  -0.426   3.315  -9.665
  740   1HB   ASN  93          1HB       ASN  93   0.453   5.819  -8.247
  741   2HB   ASN  93          2HB       ASN  93  -0.312   4.500  -7.366
  742   1HD2  ASN  93          1HD2      ASN  93   1.954   4.431 -10.079
  743   2HD2  ASN  93          2HD2      ASN  93   3.185   3.542  -9.255
  744    H    LYS  94           H        LYS  94  -1.641   6.646  -9.633
  745    HA   LYS  94           HA       LYS  94  -4.048   6.135  -8.280
  746   1HB   LYS  94          1HB       LYS  94  -3.128   8.395  -8.628
  747   2HB   LYS  94          2HB       LYS  94  -3.461   8.261 -10.350
  748   1HG   LYS  94          1HG       LYS  94  -5.864   8.061  -9.841
  749   2HG   LYS  94          2HG       LYS  94  -5.496   8.286  -8.130
  750   1HD   LYS  94          1HD       LYS  94  -4.860  10.504  -8.432
  751   2HD   LYS  94          2HD       LYS  94  -4.584  10.290 -10.162
  752   1HE   LYS  94          1HE       LYS  94  -7.068   9.897 -10.382
  753   2HE   LYS  94          2HE       LYS  94  -7.218  10.434  -8.710
  754   1HZ   LYS  94          1HZ       LYS  94  -6.919  11.984 -11.073
  755   2HZ   LYS  94          2HZ       LYS  94  -5.701  12.354  -9.960
  756   3HZ   LYS  94          3HZ       LYS  94  -7.326  12.485  -9.509
  757    H    GLU  95           H        GLU  95  -3.279   6.170 -11.743
  758    HA   GLU  95           HA       GLU  95  -5.933   5.600 -12.593
  759   1HB   GLU  95          1HB       GLU  95  -3.253   5.386 -13.960
  760   2HB   GLU  95          2HB       GLU  95  -4.760   4.971 -14.765
  761   1HG   GLU  95          1HG       GLU  95  -4.165   7.660 -13.555
  762   2HG   GLU  95          2HG       GLU  95  -3.947   7.256 -15.257
  763    H    TYR  96           H        TYR  96  -3.132   3.631 -11.804
  764    HA   TYR  96           HA       TYR  96  -3.978   1.185 -12.844
  765   1HB   TYR  96          1HB       TYR  96  -1.714   1.494 -12.035
  766   2HB   TYR  96          2HB       TYR  96  -2.298   1.765 -10.397
  767    HD1  TYR  96           1HD      TYR  96  -3.131  -0.104  -9.048
  768    HD2  TYR  96           2HD      TYR  96  -1.555  -0.731 -12.950
  769    HE1  TYR  96           1HE      TYR  96  -2.938  -2.510  -8.576
  770    HE2  TYR  96           2HE      TYR  96  -1.358  -3.139 -12.489
  771    HH   TYR  96           HH       TYR  96  -2.091  -4.808 -11.066
  772    H    CYS  97           H        CYS  97  -4.493   2.565  -9.609
  773    HA   CYS  97           HA       CYS  97  -6.007   0.388  -8.622
  774   1HB   CYS  97          1HB       CYS  97  -6.075   3.272  -7.709
  775   2HB   CYS  97          2HB       CYS  97  -6.610   1.872  -6.787
  776    HG   CYS  97           HG       CYS  97  -3.730   3.270  -6.696
  777    H    SER  98           H        SER  98  -6.851   3.323 -10.350
  778    HA   SER  98           HA       SER  98  -9.683   2.990  -9.990
  779   1HB   SER  98          1HB       SER  98  -9.929   4.979 -11.180
  780   2HB   SER  98          2HB       SER  98  -8.333   5.178 -10.457
  781    HG   SER  98           HG       SER  98  -9.037   5.029 -13.074
  782    H    LYS  99           H        LYS  99  -7.364   1.576 -11.985
  783    HA   LYS  99           HA       LYS  99  -8.693   1.235 -14.411
  784   1HB   LYS  99          1HB       LYS  99  -6.333   0.636 -14.039
  785   2HB   LYS  99          2HB       LYS  99  -6.836  -0.705 -13.018
  786   1HG   LYS  99          1HG       LYS  99  -7.994  -1.701 -14.957
  787   2HG   LYS  99          2HG       LYS  99  -7.376  -0.389 -15.964
  788   1HD   LYS  99          1HD       LYS  99  -5.974  -2.352 -16.205
  789   2HD   LYS  99          2HD       LYS  99  -5.077  -1.067 -15.394
  790   1HE   LYS  99          1HE       LYS  99  -4.841  -2.267 -13.517
  791   2HE   LYS  99          2HE       LYS  99  -6.513  -2.823 -13.557
  792   1HZ   LYS  99          1HZ       LYS  99  -5.590  -4.791 -14.022
  793   2HZ   LYS  99          2HZ       LYS  99  -4.119  -4.119 -14.517
  794   3HZ   LYS  99          3HZ       LYS  99  -5.421  -4.189 -15.594
  795    H    GLU 100           H        GLU 100  -9.296  -0.170 -11.322
  796    HA   GLU 100           HA       GLU 100 -10.711  -2.474 -12.233
  797   1HB   GLU 100          1HB       GLU 100 -10.920  -1.078  -9.561
  798   2HB   GLU 100          2HB       GLU 100 -11.423  -2.723  -9.925
  799   1HG   GLU 100          1HG       GLU 100  -9.225  -3.482 -10.110
  800   2HG   GLU 100          2HG       GLU 100  -8.581  -1.850 -10.280
  801    H    GLY 101           H        GLY 101 -11.500   0.855 -11.861
  802   1HA   GLY 101          1HA       GLY 101 -13.400   1.914 -12.714
  803   2HA   GLY 101          2HA       GLY 101 -14.171   0.344 -12.884
  804    H    ASN 102           H        ASN 102 -12.963   0.294  -9.867
  805    HA   ASN 102           HA       ASN 102 -15.260   1.670  -8.659
  806   1HB   ASN 102          1HB       ASN 102 -14.720  -1.196  -8.683
  807   2HB   ASN 102          2HB       ASN 102 -14.883  -0.559  -7.049
  808   1HD2  ASN 102          1HD2      ASN 102 -16.835  -1.286  -6.482
  809   2HD2  ASN 102          2HD2      ASN 102 -18.303  -0.933  -7.322
  810    H    LEU 103           H        LEU 103 -14.648   3.002  -7.093
  811    HA   LEU 103           HA       LEU 103 -11.960   2.724  -5.971
  812   1HB   LEU 103          1HB       LEU 103 -13.626   4.925  -6.720
  813   2HB   LEU 103          2HB       LEU 103 -13.217   5.061  -5.011
  814    HG   LEU 103           HG       LEU 103 -11.694   6.295  -6.559
  815   1HD1  LEU 103          1HD1      LEU 103 -11.018   4.514  -4.398
  816   2HD1  LEU 103          2HD1      LEU 103 -10.396   6.122  -4.767
  817   3HD1  LEU 103          3HD1      LEU 103  -9.663   4.701  -5.511
  818   1HD2  LEU 103          1HD2      LEU 103 -11.734   4.573  -8.355
  819   2HD2  LEU 103          2HD2      LEU 103 -10.736   3.542  -7.329
  820   3HD2  LEU 103          3HD2      LEU 103 -10.112   5.091  -7.897
  821    H    LEU 104           H        LEU 104 -11.579   2.255  -3.884
  822    HA   LEU 104           HA       LEU 104 -13.905   1.703  -2.187
  823   1HB   LEU 104          1HB       LEU 104 -12.340  -0.134  -2.567
  824   2HB   LEU 104          2HB       LEU 104 -11.028   0.843  -1.911
  825    HG   LEU 104           HG       LEU 104 -12.141   0.826   0.285
  826   1HD1  LEU 104          1HD1      LEU 104 -13.958  -0.984   0.515
  827   2HD1  LEU 104          2HD1      LEU 104 -14.178  -0.770  -1.222
  828   3HD1  LEU 104          3HD1      LEU 104 -14.415   0.594  -0.129
  829   1HD2  LEU 104          1HD2      LEU 104 -10.456  -0.821  -0.084
  830   2HD2  LEU 104          2HD2      LEU 104 -11.571  -1.845  -0.989
  831   3HD2  LEU 104          3HD2      LEU 104 -11.797  -1.611   0.745
  832    H    MET 105           H        MET 105 -10.946   3.576  -2.339
  833    HA   MET 105           HA       MET 105 -11.931   5.358  -0.302
  834   1HB   MET 105          1HB       MET 105 -10.945   4.007   1.295
  835   2HB   MET 105          2HB       MET 105  -9.662   3.484   0.212
  836   1HG   MET 105          1HG       MET 105  -8.342   5.262   0.684
  837   2HG   MET 105          2HG       MET 105  -9.707   6.343   0.959
  838   1HE   MET 105          1HE       MET 105  -7.092   4.385   3.916
  839   2HE   MET 105          2HE       MET 105  -7.858   3.125   2.949
  840   3HE   MET 105          3HE       MET 105  -6.984   4.436   2.156
  841    H    GLU 106           H        GLU 106 -11.169   7.394  -0.573
  842    HA   GLU 106           HA       GLU 106  -8.882   7.769  -2.386
  843   1HB   GLU 106          1HB       GLU 106 -11.444   8.246  -3.161
  844   2HB   GLU 106          2HB       GLU 106 -11.002   9.817  -2.507
  845   1HG   GLU 106          1HG       GLU 106  -8.960   9.724  -3.979
  846   2HG   GLU 106          2HG       GLU 106  -9.690   8.319  -4.753
  847    H    CYS 107           H        CYS 107  -7.351   8.552  -1.077
  848    HA   CYS 107           HA       CYS 107  -7.908  11.035   0.348
  849   1HB   CYS 107          1HB       CYS 107  -6.715   8.583   1.655
  850   2HB   CYS 107          2HB       CYS 107  -6.693  10.193   2.367
  851    HG   CYS 107           HG       CYS 107  -9.144   7.938   2.285
  852    H    GLY 108           H        GLY 108  -5.711  11.813   1.383
  853   1HA   GLY 108          1HA       GLY 108  -3.571  12.558   1.011
  854   2HA   GLY 108          2HA       GLY 108  -3.273  11.023   0.209
  855    H    ALA 109           H        ALA 109  -1.888  12.745  -0.983
  856    HA   ALA 109           HA       ALA 109  -3.475  13.909  -3.174
  857   1HB   ALA 109          1HB       ALA 109  -1.863  15.295  -1.614
  858   2HB   ALA 109          2HB       ALA 109  -0.640  14.692  -2.733
  859   3HB   ALA 109          3HB       ALA 109  -1.996  15.643  -3.338
  860    HA   PRO 110           HA       PRO 110  -1.688  11.168  -6.101
  861   1HB   PRO 110          1HB       PRO 110  -1.543  12.760  -8.295
  862   2HB   PRO 110          2HB       PRO 110  -3.070  12.128  -7.665
  863   1HG   PRO 110          1HG       PRO 110  -1.837  14.830  -7.286
  864   2HG   PRO 110          2HG       PRO 110  -3.526  14.408  -7.623
  865   1HD   PRO 110          1HD       PRO 110  -2.649  15.034  -5.139
  866   2HD   PRO 110          2HD       PRO 110  -3.964  13.876  -5.424
  867    H    ARG 111           H        ARG 111   0.359  11.287  -4.752
  868    HA   ARG 111           HA       ARG 111   2.503  12.558  -6.325
  869   1HB   ARG 111          1HB       ARG 111   3.742  12.985  -4.351
  870   2HB   ARG 111          2HB       ARG 111   2.102  13.521  -4.015
  871   1HG   ARG 111          1HG       ARG 111   1.662  11.510  -2.751
  872   2HG   ARG 111          2HG       ARG 111   3.259  10.878  -3.157
  873   1HD   ARG 111          1HD       ARG 111   2.600  13.273  -1.455
  874   2HD   ARG 111          2HD       ARG 111   3.370  11.771  -0.947
  875    HE   ARG 111           HE       ARG 111   5.066  12.726  -2.822
  876   1HH1  ARG 111          1HH1      ARG 111   3.619  14.119   0.022
  877   2HH1  ARG 111          2HH1      ARG 111   4.948  15.186   0.334
  878   1HH2  ARG 111          1HH2      ARG 111   6.822  14.126  -2.421
  879   2HH2  ARG 111          2HH2      ARG 111   6.769  15.190  -1.057
  880    H    SER 112           H        SER 112   4.511  11.420  -6.438
  881    HA   SER 112           HA       SER 112   4.332   8.556  -5.785
  882   1HB   SER 112          1HB       SER 112   4.034   8.348  -8.053
  883   2HB   SER 112          2HB       SER 112   4.877   9.855  -8.410
  884    HG   SER 112           HG       SER 112   5.841   7.308  -8.287
  885    H    GLN 113           H        GLN 113   6.793  10.607  -7.331
  886    HA   GLN 113           HA       GLN 113   8.851   9.460  -5.672
  887   1HB   GLN 113          1HB       GLN 113   8.804  11.433  -7.930
  888   2HB   GLN 113          2HB       GLN 113  10.250  11.258  -6.944
  889   1HG   GLN 113          1HG       GLN 113  10.759   9.235  -7.799
  890   2HG   GLN 113          2HG       GLN 113   9.070   8.764  -7.980
  891   1HE2  GLN 113          1HE2      GLN 113  11.835  10.033  -9.506
  892   2HE2  GLN 113          2HE2      GLN 113  11.142  10.296 -11.066
  893    H    GLY 114           H        GLY 114  10.553  11.131  -4.808
  894   1HA   GLY 114          1HA       GLY 114   9.470  13.579  -3.758
  895   2HA   GLY 114          2HA       GLY 114   9.610  12.319  -2.541
  896    H    GLN 115           H        GLN 115  11.883  12.448  -5.158
  897    HA   GLN 115           HA       GLN 115  13.980  13.149  -3.236
  898   1HB   GLN 115          1HB       GLN 115  14.205  11.035  -4.513
  899   2HB   GLN 115          2HB       GLN 115  14.240  11.966  -6.005
  900   1HG   GLN 115          1HG       GLN 115  16.437  12.081  -5.804
  901   2HG   GLN 115          2HG       GLN 115  16.205  13.102  -4.386
  902   1HE2  GLN 115          1HE2      GLN 115  16.314  12.172  -2.327
  903   2HE2  GLN 115          2HE2      GLN 115  17.072  10.642  -2.061
  904    H    ARG 116           H        ARG 116  12.708  14.045  -6.408
  905    HA   ARG 116           HA       ARG 116  14.213  16.569  -6.205
  906   1HB   ARG 116          1HB       ARG 116  15.000  14.924  -8.001
  907   2HB   ARG 116          2HB       ARG 116  13.481  15.264  -8.819
  908   1HG   ARG 116          1HG       ARG 116  14.106  17.678  -8.821
  909   2HG   ARG 116          2HG       ARG 116  15.686  17.209  -8.191
  910   1HD   ARG 116          1HD       ARG 116  16.220  17.164 -10.387
  911   2HD   ARG 116          2HD       ARG 116  15.533  15.543 -10.283
  912    HE   ARG 116           HE       ARG 116  13.490  17.377 -10.883
  913   1HH1  ARG 116          1HH1      ARG 116  16.303  15.918 -12.325
  914   2HH1  ARG 116          2HH1      ARG 116  15.693  16.032 -13.943
  915   1HH2  ARG 116          1HH2      ARG 116  12.677  17.533 -13.008
  916   2HH2  ARG 116          2HH2      ARG 116  13.631  16.952 -14.331
  Start of MODEL   27
    1    HA   PRO   2           HA       PRO   2  31.590   6.764  14.440
    2   1HB   PRO   2          1HB       PRO   2  31.082   7.908  12.032
    3   2HB   PRO   2          2HB       PRO   2  31.338   8.848  13.507
    4   1HG   PRO   2          1HG       PRO   2  33.260   8.234  11.295
    5   2HG   PRO   2          2HG       PRO   2  32.991   9.764  12.152
    6   1HD   PRO   2          1HD       PRO   2  35.060   8.115  12.728
    7   2HD   PRO   2          2HD       PRO   2  34.270   9.122  13.959
    8    H    SER   3           H        SER   3  30.027   5.855  12.741
    9    HA   SER   3           HA       SER   3  29.377   4.101  11.446
   10   1HB   SER   3          1HB       SER   3  30.734   5.328   9.740
   11   2HB   SER   3          2HB       SER   3  32.121   4.336  10.188
   12    HG   SER   3           HG       SER   3  29.993   3.730   8.602
   13    H    LYS   4           H        LYS   4  29.221   2.530  13.005
   14    HA   LYS   4           HA       LYS   4  31.560   0.764  13.312
   15   1HB   LYS   4          1HB       LYS   4  29.486   1.681  15.252
   16   2HB   LYS   4          2HB       LYS   4  30.148   0.063  15.445
   17   1HG   LYS   4          1HG       LYS   4  32.439   1.160  15.381
   18   2HG   LYS   4          2HG       LYS   4  31.587   2.693  15.577
   19   1HD   LYS   4          1HD       LYS   4  30.850   0.529  17.452
   20   2HD   LYS   4          2HD       LYS   4  32.466   1.214  17.641
   21   1HE   LYS   4          1HE       LYS   4  31.332   2.672  18.959
   22   2HE   LYS   4          2HE       LYS   4  31.086   3.483  17.413
   23   1HZ   LYS   4          1HZ       LYS   4  29.150   1.478  18.374
   24   2HZ   LYS   4          2HZ       LYS   4  28.915   2.742  17.275
   25   3HZ   LYS   4          3HZ       LYS   4  29.072   3.076  18.926
   26    H    LYS   5           H        LYS   5  28.003   0.803  13.269
   27    HA   LYS   5           HA       LYS   5  27.904  -2.041  12.720
   28   1HB   LYS   5          1HB       LYS   5  25.849   0.098  13.179
   29   2HB   LYS   5          2HB       LYS   5  25.375  -1.452  12.498
   30   1HG   LYS   5          1HG       LYS   5  27.041  -1.673  14.887
   31   2HG   LYS   5          2HG       LYS   5  25.495  -0.864  15.156
   32   1HD   LYS   5          1HD       LYS   5  24.346  -2.771  14.094
   33   2HD   LYS   5          2HD       LYS   5  25.902  -3.582  13.906
   34   1HE   LYS   5          1HE       LYS   5  24.805  -4.452  15.859
   35   2HE   LYS   5          2HE       LYS   5  26.190  -3.487  16.368
   36   1HZ   LYS   5          1HZ       LYS   5  24.032  -3.152  17.619
   37   2HZ   LYS   5          2HZ       LYS   5  23.459  -2.357  16.241
   38   3HZ   LYS   5          3HZ       LYS   5  24.807  -1.753  17.067
   39    H    ASN   6           H        ASN   6  27.144  -2.988  10.823
   40    HA   ASN   6           HA       ASN   6  26.587  -1.284   8.529
   41   1HB   ASN   6          1HB       ASN   6  28.285  -2.259   7.123
   42   2HB   ASN   6          2HB       ASN   6  29.066  -1.626   8.569
   43   1HD2  ASN   6          1HD2      ASN   6  28.813  -4.231   6.538
   44   2HD2  ASN   6          2HD2      ASN   6  29.513  -5.440   7.554
   45    H    GLY   7           H        GLY   7  25.551  -2.374   6.799
   46   1HA   GLY   7          1HA       GLY   7  25.106  -5.113   6.593
   47   2HA   GLY   7          2HA       GLY   7  23.829  -4.472   7.615
   48    H    ARG   8           H        ARG   8  24.965  -4.876   4.423
   49    HA   ARG   8           HA       ARG   8  22.545  -3.568   3.412
   50   1HB   ARG   8          1HB       ARG   8  24.515  -2.031   3.160
   51   2HB   ARG   8          2HB       ARG   8  25.252  -3.237   2.114
   52   1HG   ARG   8          1HG       ARG   8  23.808  -2.831   0.390
   53   2HG   ARG   8          2HG       ARG   8  22.516  -2.279   1.459
   54   1HD   ARG   8          1HD       ARG   8  23.632  -0.191   1.829
   55   2HD   ARG   8          2HD       ARG   8  25.066  -0.750   0.970
   56    HE   ARG   8           HE       ARG   8  24.026  -0.274  -1.021
   57   1HH1  ARG   8          1HH1      ARG   8  21.693  -0.189   1.561
   58   2HH1  ARG   8          2HH1      ARG   8  20.436   0.486   0.578
   59   1HH2  ARG   8          1HH2      ARG   8  22.380   0.614  -2.326
   60   2HH2  ARG   8          2HH2      ARG   8  20.827   0.942  -1.633
   61    H    SER   9           H        SER   9  21.896  -5.852   3.380
   62    HA   SER   9           HA       SER   9  22.296  -6.977   0.774
   63   1HB   SER   9          1HB       SER   9  24.294  -7.787   2.130
   64   2HB   SER   9          2HB       SER   9  23.144  -8.708   3.099
   65    HG   SER   9           HG       SER   9  23.837 -10.056   1.495
   66    H    GLY  10           H        GLY  10  20.572  -8.181   0.160
   67   1HA   GLY  10          1HA       GLY  10  18.710  -9.587   0.450
   68   2HA   GLY  10          2HA       GLY  10  18.803  -9.316   2.184
   69    HA   PRO  11           HA       PRO  11  15.259  -6.857   0.412
   70   1HB   PRO  11          1HB       PRO  11  13.398  -7.802   2.148
   71   2HB   PRO  11          2HB       PRO  11  13.783  -8.605   0.621
   72   1HG   PRO  11          1HG       PRO  11  14.729  -9.244   3.388
   73   2HG   PRO  11          2HG       PRO  11  14.188 -10.346   2.108
   74   1HD   PRO  11          1HD       PRO  11  16.806  -9.919   2.654
   75   2HD   PRO  11          2HD       PRO  11  16.218 -10.275   1.018
   76    H    GLN  12           H        GLN  12  14.825  -4.870   1.167
   77    HA   GLN  12           HA       GLN  12  15.209  -4.355   4.041
   78   1HB   GLN  12          1HB       GLN  12  16.415  -3.037   1.692
   79   2HB   GLN  12          2HB       GLN  12  15.800  -1.949   2.930
   80   1HG   GLN  12          1HG       GLN  12  17.875  -2.209   3.758
   81   2HG   GLN  12          2HG       GLN  12  17.151  -3.640   4.490
   82   1HE2  GLN  12          1HE2      GLN  12  19.090  -4.742   4.588
   83   2HE2  GLN  12          2HE2      GLN  12  19.876  -5.369   3.183
   84    HA   PRO  13           HA       PRO  13  11.294  -2.381   4.120
   85   1HB   PRO  13          1HB       PRO  13  11.729  -0.276   5.779
   86   2HB   PRO  13          2HB       PRO  13  11.660  -1.949   6.347
   87   1HG   PRO  13          1HG       PRO  13  14.050  -0.245   5.758
   88   2HG   PRO  13          2HG       PRO  13  13.768  -1.344   7.120
   89   1HD   PRO  13          1HD       PRO  13  15.285  -2.030   4.985
   90   2HD   PRO  13          2HD       PRO  13  14.319  -3.213   5.889
   91    H    HIS  14           H        HIS  14  10.079  -0.710   3.240
   92    HA   HIS  14           HA       HIS  14  11.522   1.526   2.011
   93   1HB   HIS  14          1HB       HIS  14   9.609  -0.320   0.571
   94   2HB   HIS  14          2HB       HIS  14  10.167   1.221  -0.073
   95    HD1  HIS  14           1HD      HIS  14  11.305  -2.273   0.623
   96    HD2  HIS  14           2HD      HIS  14  12.785   1.229  -1.054
   97    HE1  HIS  14           1HE      HIS  14  13.441  -2.930  -0.530
   98    H    LYS  15           H        LYS  15   9.732   3.007   0.904
   99    HA   LYS  15           HA       LYS  15   7.731   3.486   3.000
  100   1HB   LYS  15          1HB       LYS  15   7.622   5.792   1.990
  101   2HB   LYS  15          2HB       LYS  15   9.165   5.370   2.723
  102   1HG   LYS  15          1HG       LYS  15   9.217   4.629  -0.030
  103   2HG   LYS  15          2HG       LYS  15   8.667   6.300   0.112
  104   1HD   LYS  15          1HD       LYS  15  10.956   6.573   0.033
  105   2HD   LYS  15          2HD       LYS  15  10.670   6.516   1.774
  106   1HE   LYS  15          1HE       LYS  15  12.567   5.126   1.199
  107   2HE   LYS  15          2HE       LYS  15  11.235   4.121   1.765
  108   1HZ   LYS  15          1HZ       LYS  15  11.003   4.398  -1.007
  109   2HZ   LYS  15          2HZ       LYS  15  11.335   2.996  -0.121
  110   3HZ   LYS  15          3HZ       LYS  15  12.605   3.970  -0.671
  111    H    ARG  16           H        ARG  16   7.676   1.705   0.470
  112    HA   ARG  16           HA       ARG  16   5.004   2.577  -0.373
  113   1HB   ARG  16          1HB       ARG  16   6.970   1.437  -2.346
  114   2HB   ARG  16          2HB       ARG  16   5.448   2.258  -2.669
  115   1HG   ARG  16          1HG       ARG  16   6.719   4.039  -3.092
  116   2HG   ARG  16          2HG       ARG  16   6.854   4.180  -1.338
  117   1HD   ARG  16          1HD       ARG  16   8.949   3.115  -1.307
  118   2HD   ARG  16          2HD       ARG  16   8.748   2.492  -2.944
  119    HE   ARG  16           HE       ARG  16   9.682   5.108  -2.180
  120   1HH1  ARG  16          1HH1      ARG  16   8.268   3.176  -4.707
  121   2HH1  ARG  16          2HH1      ARG  16   8.812   4.213  -5.983
  122   1HH2  ARG  16          1HH2      ARG  16  10.404   6.482  -3.852
  123   2HH2  ARG  16          2HH2      ARG  16  10.028   6.093  -5.496
  124    H    TRP  17           H        TRP  17   3.559   1.003  -0.166
  125    HA   TRP  17           HA       TRP  17   4.297  -1.762  -0.660
  126   1HB   TRP  17          1HB       TRP  17   3.382  -0.755   2.032
  127   2HB   TRP  17          2HB       TRP  17   3.200  -2.439   1.547
  128    HD1  TRP  17           HD       TRP  17   5.758   0.043   2.797
  129    HE1  TRP  17           1HE      TRP  17   7.992  -1.167   3.204
  130    HE3  TRP  17           3HE      TRP  17   4.657  -4.448   0.617
  131    HZ2  TRP  17           2HZ      TRP  17   9.137  -3.692   2.672
  132    HZ3  TRP  17           3HZ      TRP  17   6.377  -6.208   0.608
  133    HH2  TRP  17           HH       TRP  17   8.570  -5.835   1.614
  134    H    VAL  18           H        VAL  18   2.645  -2.928  -1.484
  135    HA   VAL  18           HA       VAL  18   0.008  -1.616  -1.582
  136    HB   VAL  18           HB       VAL  18  -0.411  -2.765  -3.668
  137   1HG1  VAL  18          1HG1      VAL  18   2.190  -1.272  -3.501
  138   2HG1  VAL  18          2HG1      VAL  18   1.503  -1.791  -5.042
  139   3HG1  VAL  18          3HG1      VAL  18   0.609  -0.677  -4.007
  140   1HG2  VAL  18          1HG2      VAL  18   1.606  -4.514  -2.770
  141   2HG2  VAL  18          2HG2      VAL  18   0.638  -4.638  -4.240
  142   3HG2  VAL  18          3HG2      VAL  18   2.187  -3.796  -4.273
  143    H    PHE  19           H        PHE  19  -1.865  -3.079  -1.719
  144    HA   PHE  19           HA       PHE  19  -1.435  -5.697  -0.473
  145   1HB   PHE  19          1HB       PHE  19  -3.347  -5.268   1.070
  146   2HB   PHE  19          2HB       PHE  19  -1.950  -4.245   1.387
  147    HD1  PHE  19           1HD      PHE  19  -1.976  -1.872   0.540
  148    HD2  PHE  19           2HD      PHE  19  -5.442  -4.342   0.602
  149    HE1  PHE  19           1HE      PHE  19  -3.400   0.128   0.370
  150    HE2  PHE  19           2HE      PHE  19  -6.871  -2.347   0.431
  151    HZ   PHE  19           HZ       PHE  19  -5.851  -0.109   0.314
  152    H    THR  20           H        THR  20  -2.947  -7.257  -0.995
  153    HA   THR  20           HA       THR  20  -5.260  -6.529  -2.602
  154    HB   THR  20           HB       THR  20  -4.661  -8.195  -4.375
  155    HG1  THR  20           1HG      THR  20  -2.557  -8.931  -4.484
  156   1HG2  THR  20          1HG2      THR  20  -4.282  -5.657  -4.494
  157   2HG2  THR  20          2HG2      THR  20  -3.433  -6.668  -5.662
  158   3HG2  THR  20          3HG2      THR  20  -2.577  -6.035  -4.257
  159    H    LEU  21           H        LEU  21  -6.941  -7.787  -2.112
  160    HA   LEU  21           HA       LEU  21  -6.462 -10.505  -1.126
  161   1HB   LEU  21          1HB       LEU  21  -6.698  -9.008   0.818
  162   2HB   LEU  21          2HB       LEU  21  -8.277  -8.507   0.217
  163    HG   LEU  21           HG       LEU  21  -8.462 -11.271   0.386
  164   1HD1  LEU  21          1HD1      LEU  21  -7.846 -11.526   2.873
  165   2HD1  LEU  21          2HD1      LEU  21  -6.763 -10.163   2.588
  166   3HD1  LEU  21          3HD1      LEU  21  -6.565 -11.654   1.667
  167   1HD2  LEU  21          1HD2      LEU  21  -9.998  -9.253   1.047
  168   2HD2  LEU  21          2HD2      LEU  21  -9.323  -9.536   2.652
  169   3HD2  LEU  21          3HD2      LEU  21 -10.196 -10.825   1.823
  170    H    ASN  22           H        ASN  22  -7.933 -11.985  -1.788
  171    HA   ASN  22           HA       ASN  22  -9.851 -11.144  -3.779
  172   1HB   ASN  22          1HB       ASN  22  -8.490 -13.608  -3.053
  173   2HB   ASN  22          2HB       ASN  22 -10.205 -13.876  -3.350
  174   1HD2  ASN  22          1HD2      ASN  22  -7.412 -14.171  -4.793
  175   2HD2  ASN  22          2HD2      ASN  22  -7.811 -13.746  -6.420
  176    H    ASN  23           H        ASN  23 -12.029 -11.105  -3.597
  177    HA   ASN  23           HA       ASN  23 -14.049 -10.896  -2.562
  178   1HB   ASN  23          1HB       ASN  23 -13.596 -13.458  -2.702
  179   2HB   ASN  23          2HB       ASN  23 -13.379 -13.345  -0.958
  180   1HD2  ASN  23          1HD2      ASN  23 -15.632 -11.897  -3.288
  181   2HD2  ASN  23          2HD2      ASN  23 -17.066 -12.368  -2.449
  182    HA   PRO  24           HA       PRO  24 -12.051  -9.158   1.291
  183   1HB   PRO  24          1HB       PRO  24 -12.679  -6.570   0.763
  184   2HB   PRO  24          2HB       PRO  24 -11.197  -7.337   0.181
  185   1HG   PRO  24          1HG       PRO  24 -13.771  -6.847  -1.267
  186   2HG   PRO  24          2HG       PRO  24 -12.106  -6.628  -1.838
  187   1HD   PRO  24          1HD       PRO  24 -13.595  -8.794  -2.488
  188   2HD   PRO  24          2HD       PRO  24 -11.833  -8.871  -2.292
  189    H    SER  25           H        SER  25 -13.159  -8.722   3.140
  190    HA   SER  25           HA       SER  25 -16.069  -8.787   2.972
  191   1HB   SER  25          1HB       SER  25 -14.050  -9.386   5.079
  192   2HB   SER  25          2HB       SER  25 -15.643  -8.847   5.609
  193    HG   SER  25           HG       SER  25 -15.267 -11.205   5.259
  194    H    GLU  26           H        GLU  26 -17.376  -7.343   4.281
  195    HA   GLU  26           HA       GLU  26 -16.795  -4.643   3.846
  196   1HB   GLU  26          1HB       GLU  26 -18.790  -4.149   5.031
  197   2HB   GLU  26          2HB       GLU  26 -19.070  -5.682   4.216
  198   1HG   GLU  26          1HG       GLU  26 -18.165  -6.589   6.568
  199   2HG   GLU  26          2HG       GLU  26 -18.883  -5.067   7.092
  200    H    ASP  27           H        ASP  27 -16.092  -6.737   6.540
  201    HA   ASP  27           HA       ASP  27 -15.453  -4.643   8.385
  202   1HB   ASP  27          1HB       ASP  27 -15.921  -7.345   8.611
  203   2HB   ASP  27          2HB       ASP  27 -14.182  -7.240   8.866
  204    H    GLU  28           H        GLU  28 -13.537  -6.855   6.369
  205    HA   GLU  28           HA       GLU  28 -11.008  -5.929   7.164
  206   1HB   GLU  28          1HB       GLU  28 -11.924  -7.920   5.521
  207   2HB   GLU  28          2HB       GLU  28 -11.215  -6.800   4.366
  208   1HG   GLU  28          1HG       GLU  28  -9.498  -7.237   6.658
  209   2HG   GLU  28          2HG       GLU  28  -9.887  -8.736   5.816
  210    H    ARG  29           H        ARG  29 -13.021  -5.032   4.371
  211    HA   ARG  29           HA       ARG  29 -11.269  -3.141   3.276
  212   1HB   ARG  29          1HB       ARG  29 -14.238  -3.555   3.108
  213   2HB   ARG  29          2HB       ARG  29 -13.491  -2.156   2.348
  214   1HG   ARG  29          1HG       ARG  29 -12.379  -3.427   0.786
  215   2HG   ARG  29          2HG       ARG  29 -12.413  -4.879   1.789
  216   1HD   ARG  29          1HD       ARG  29 -13.934  -4.933  -0.201
  217   2HD   ARG  29          2HD       ARG  29 -14.725  -5.225   1.347
  218    HE   ARG  29           HE       ARG  29 -14.789  -2.478   0.481
  219   1HH1  ARG  29          1HH1      ARG  29 -16.379  -5.573   0.378
  220   2HH1  ARG  29          2HH1      ARG  29 -17.937  -4.907   0.014
  221   1HH2  ARG  29          1HH2      ARG  29 -16.834  -1.588   0.002
  222   2HH2  ARG  29          2HH2      ARG  29 -18.194  -2.640  -0.200
  223    H    LYS  30           H        LYS  30 -13.630  -2.904   5.853
  224    HA   LYS  30           HA       LYS  30 -13.646  -0.065   6.025
  225   1HB   LYS  30          1HB       LYS  30 -14.669  -2.326   7.638
  226   2HB   LYS  30          2HB       LYS  30 -14.373  -0.830   8.515
  227   1HG   LYS  30          1HG       LYS  30 -15.902   0.371   7.157
  228   2HG   LYS  30          2HG       LYS  30 -16.034  -0.968   6.013
  229   1HD   LYS  30          1HD       LYS  30 -16.840  -2.283   8.140
  230   2HD   LYS  30          2HD       LYS  30 -17.216  -0.665   8.736
  231   1HE   LYS  30          1HE       LYS  30 -18.302  -0.482   6.302
  232   2HE   LYS  30          2HE       LYS  30 -18.447  -2.223   6.536
  233   1HZ   LYS  30          1HZ       LYS  30 -20.313  -1.712   7.617
  234   2HZ   LYS  30          2HZ       LYS  30 -19.901  -0.081   7.785
  235   3HZ   LYS  30          3HZ       LYS  30 -19.315  -1.218   8.892
  236    H    LYS  31           H        LYS  31 -11.727  -2.604   7.520
  237    HA   LYS  31           HA       LYS  31 -10.453  -1.032   9.477
  238   1HB   LYS  31          1HB       LYS  31 -10.328  -3.404   9.671
  239   2HB   LYS  31          2HB       LYS  31  -9.632  -3.567   8.064
  240   1HG   LYS  31          1HG       LYS  31  -7.591  -2.465   8.835
  241   2HG   LYS  31          2HG       LYS  31  -8.289  -2.308  10.449
  242   1HD   LYS  31          1HD       LYS  31  -7.973  -4.496  10.942
  243   2HD   LYS  31          2HD       LYS  31  -8.288  -5.024   9.288
  244   1HE   LYS  31          1HE       LYS  31  -6.006  -5.478   9.697
  245   2HE   LYS  31          2HE       LYS  31  -6.041  -4.037   8.683
  246   1HZ   LYS  31          1HZ       LYS  31  -5.807  -2.710  10.745
  247   2HZ   LYS  31          2HZ       LYS  31  -4.472  -3.698  10.424
  248   3HZ   LYS  31          3HZ       LYS  31  -5.589  -4.145  11.613
  249    H    ILE  32           H        ILE  32  -9.454  -1.917   6.181
  250    HA   ILE  32           HA       ILE  32  -7.051  -0.377   6.278
  251    HB   ILE  32           HB       ILE  32  -8.444  -1.231   3.752
  252   1HG1  ILE  32          1HG1      ILE  32  -6.720  -2.905   5.589
  253   2HG1  ILE  32          2HG1      ILE  32  -8.415  -3.179   5.204
  254   1HG2  ILE  32          1HG2      ILE  32  -6.566  -0.600   2.746
  255   2HG2  ILE  32          2HG2      ILE  32  -6.041   0.088   4.282
  256   3HG2  ILE  32          3HG2      ILE  32  -5.587  -1.562   3.854
  257   1HD1  ILE  32          1HD1      ILE  32  -7.183  -3.138   2.737
  258   2HD1  ILE  32          2HD1      ILE  32  -6.035  -3.984   3.775
  259   3HD1  ILE  32          3HD1      ILE  32  -7.694  -4.567   3.635
  260    H    ARG  33           H        ARG  33 -10.332   0.196   5.160
  261    HA   ARG  33           HA       ARG  33  -9.737   2.666   3.848
  262   1HB   ARG  33          1HB       ARG  33 -11.692   1.269   3.259
  263   2HB   ARG  33          2HB       ARG  33 -12.391   1.608   4.836
  264   1HG   ARG  33          1HG       ARG  33 -11.746   4.086   3.624
  265   2HG   ARG  33          2HG       ARG  33 -12.610   3.103   2.440
  266   1HD   ARG  33          1HD       ARG  33 -14.319   4.203   3.568
  267   2HD   ARG  33          2HD       ARG  33 -14.258   2.629   4.360
  268    HE   ARG  33           HE       ARG  33 -12.603   4.485   5.711
  269   1HH1  ARG  33          1HH1      ARG  33 -15.944   3.643   5.212
  270   2HH1  ARG  33          2HH1      ARG  33 -16.467   4.281   6.735
  271   1HH2  ARG  33          1HH2      ARG  33 -13.280   5.328   7.719
  272   2HH2  ARG  33          2HH2      ARG  33 -14.952   5.240   8.160
  273    H    ASP  34           H        ASP  34 -10.295   1.724   7.098
  274    HA   ASP  34           HA       ASP  34 -10.862   4.480   7.921
  275   1HB   ASP  34          1HB       ASP  34 -12.259   2.546   8.778
  276   2HB   ASP  34          2HB       ASP  34 -10.836   2.022   9.675
  277    H    LEU  35           H        LEU  35  -8.213   2.899   7.175
  278    HA   LEU  35           HA       LEU  35  -6.554   3.012   9.444
  279   1HB   LEU  35          1HB       LEU  35  -6.097   2.932   6.499
  280   2HB   LEU  35          2HB       LEU  35  -4.739   3.277   7.567
  281    HG   LEU  35           HG       LEU  35  -6.452   0.800   7.742
  282   1HD1  LEU  35          1HD1      LEU  35  -3.649   0.874   6.699
  283   2HD1  LEU  35          2HD1      LEU  35  -5.017   1.156   5.623
  284   3HD1  LEU  35          3HD1      LEU  35  -4.885  -0.368   6.500
  285   1HD2  LEU  35          1HD2      LEU  35  -5.363   1.444   9.835
  286   2HD2  LEU  35          2HD2      LEU  35  -3.806   1.510   9.008
  287   3HD2  LEU  35          3HD2      LEU  35  -4.656  -0.028   9.168
  288    HA   PRO  36           HA       PRO  36  -5.523   7.247   9.948
  289   1HB   PRO  36          1HB       PRO  36  -2.871   7.139  10.519
  290   2HB   PRO  36          2HB       PRO  36  -4.120   6.605  11.650
  291   1HG   PRO  36          1HG       PRO  36  -2.414   4.977   9.806
  292   2HG   PRO  36          2HG       PRO  36  -2.856   4.659  11.494
  293   1HD   PRO  36          1HD       PRO  36  -4.089   3.445   9.411
  294   2HD   PRO  36          2HD       PRO  36  -4.931   3.831  10.926
  295    H    ILE  37           H        ILE  37  -5.468   8.679   8.340
  296    HA   ILE  37           HA       ILE  37  -4.063   8.245   5.904
  297    HB   ILE  37           HB       ILE  37  -4.700  10.646   5.426
  298   1HG1  ILE  37          1HG1      ILE  37  -6.252  10.375   8.006
  299   2HG1  ILE  37          2HG1      ILE  37  -4.768  11.309   7.849
  300   1HG2  ILE  37          1HG2      ILE  37  -6.190   8.318   5.398
  301   2HG2  ILE  37          2HG2      ILE  37  -7.261   9.497   6.153
  302   3HG2  ILE  37          3HG2      ILE  37  -6.579   9.819   4.559
  303   1HD1  ILE  37          1HD1      ILE  37  -6.112  13.024   7.409
  304   2HD1  ILE  37          2HD1      ILE  37  -6.311  12.294   5.815
  305   3HD1  ILE  37          3HD1      ILE  37  -7.492  11.976   7.085
  306    H    SER  38           H        SER  38  -3.391  10.044   8.835
  307    HA   SER  38           HA       SER  38  -1.221  11.563   7.820
  308   1HB   SER  38          1HB       SER  38  -1.021  12.393   9.946
  309   2HB   SER  38          2HB       SER  38  -2.642  11.713  10.087
  310    HG   SER  38           HG       SER  38  -0.231  10.822  11.163
  311    H    LEU  39           H        LEU  39  -1.551   8.281   8.670
  312    HA   LEU  39           HA       LEU  39   1.187   7.806   9.386
  313   1HB   LEU  39          1HB       LEU  39  -1.088   6.432   9.787
  314   2HB   LEU  39          2HB       LEU  39  -0.471   5.580   8.373
  315    HG   LEU  39           HG       LEU  39   1.457   5.970  10.570
  316   1HD1  LEU  39          1HD1      LEU  39   0.553   4.208  11.944
  317   2HD1  LEU  39          2HD1      LEU  39  -0.825   4.022  10.859
  318   3HD1  LEU  39          3HD1      LEU  39  -0.635   5.503  11.796
  319   1HD2  LEU  39          1HD2      LEU  39   2.467   4.380   9.402
  320   2HD2  LEU  39          2HD2      LEU  39   1.099   4.325   8.290
  321   3HD2  LEU  39          3HD2      LEU  39   1.122   3.281   9.712
  322    H    PHE  40           H        PHE  40  -0.667   7.862   6.447
  323    HA   PHE  40           HA       PHE  40   1.757   7.104   4.955
  324   1HB   PHE  40          1HB       PHE  40  -1.012   6.603   3.895
  325   2HB   PHE  40          2HB       PHE  40   0.509   5.879   3.385
  326    HD1  PHE  40           2HD      PHE  40  -2.135   5.848   5.924
  327    HD2  PHE  40           1HD      PHE  40   1.440   3.999   4.540
  328    HE1  PHE  40           2HE      PHE  40  -2.563   3.925   7.397
  329    HE2  PHE  40           1HE      PHE  40   1.017   2.072   6.010
  330    HZ   PHE  40           HZ       PHE  40  -0.986   2.033   7.442
  331    H    ASP  41           H        ASP  41   2.519   8.735   3.801
  332    HA   ASP  41           HA       ASP  41   1.302  11.211   3.498
  333   1HB   ASP  41          1HB       ASP  41   3.778  10.378   3.074
  334   2HB   ASP  41          2HB       ASP  41   3.220  10.277   1.407
  335    H    TYR  42           H        TYR  42   0.914   8.310   1.655
  336    HA   TYR  42           HA       TYR  42  -1.140   9.616   0.052
  337   1HB   TYR  42          1HB       TYR  42   0.833   9.780  -1.362
  338   2HB   TYR  42          2HB       TYR  42   1.157   8.062  -1.157
  339    HD1  TYR  42           1HD      TYR  42  -2.103   9.725  -1.823
  340    HD2  TYR  42           2HD      TYR  42   0.988   7.220  -3.333
  341    HE1  TYR  42           1HE      TYR  42  -3.476   9.235  -3.804
  342    HE2  TYR  42           2HE      TYR  42  -0.376   6.725  -5.319
  343    HH   TYR  42           HH       TYR  42  -2.463   6.863  -6.200
  344    H    PHE  43           H        PHE  43  -2.913   8.416   0.086
  345    HA   PHE  43           HA       PHE  43  -2.657   5.493   0.237
  346   1HB   PHE  43          1HB       PHE  43  -3.330   6.908   2.432
  347   2HB   PHE  43          2HB       PHE  43  -4.924   6.707   1.711
  348    HD1  PHE  43           1HD      PHE  43  -4.031   3.954   0.430
  349    HD2  PHE  43           2HD      PHE  43  -3.999   5.581   4.363
  350    HE1  PHE  43           1HE      PHE  43  -4.168   1.683   1.367
  351    HE2  PHE  43           2HE      PHE  43  -4.135   3.313   5.306
  352    HZ   PHE  43           HZ       PHE  43  -4.219   1.360   3.808
  353    H    ILE  44           H        ILE  44  -3.608   4.649  -1.484
  354    HA   ILE  44           HA       ILE  44  -6.178   5.753  -2.372
  355    HB   ILE  44           HB       ILE  44  -4.739   6.713  -3.966
  356   1HG1  ILE  44          1HG1      ILE  44  -5.263   4.283  -5.566
  357   2HG1  ILE  44          2HG1      ILE  44  -6.656   4.946  -4.719
  358   1HG2  ILE  44          1HG2      ILE  44  -3.080   5.225  -5.228
  359   2HG2  ILE  44          2HG2      ILE  44  -2.668   5.702  -3.582
  360   3HG2  ILE  44          3HG2      ILE  44  -3.295   4.085  -3.900
  361   1HD1  ILE  44          1HD1      ILE  44  -5.468   5.811  -7.142
  362   2HD1  ILE  44          2HD1      ILE  44  -6.896   6.443  -6.322
  363   3HD1  ILE  44          3HD1      ILE  44  -5.302   7.099  -5.950
  364    H    VAL  45           H        VAL  45  -7.637   4.190  -2.279
  365    HA   VAL  45           HA       VAL  45  -6.799   1.438  -2.928
  366    HB   VAL  45           HB       VAL  45  -9.099   2.065  -1.097
  367   1HG1  VAL  45          1HG1      VAL  45  -9.355  -0.139  -1.242
  368   2HG1  VAL  45          2HG1      VAL  45  -7.855  -0.307  -2.157
  369   3HG1  VAL  45          3HG1      VAL  45  -7.819  -0.315  -0.393
  370   1HG2  VAL  45          1HG2      VAL  45  -7.542   2.999   0.259
  371   2HG2  VAL  45          2HG2      VAL  45  -7.216   1.311   0.650
  372   3HG2  VAL  45          3HG2      VAL  45  -6.200   2.158  -0.516
  373    H    GLY  46           H        GLY  46  -8.331   0.106  -4.001
  374   1HA   GLY  46          1HA       GLY  46 -10.732   1.410  -5.047
  375   2HA   GLY  46          2HA       GLY  46  -9.529   0.882  -6.215
  376    H    GLU  47           H        GLU  47 -12.335   0.017  -5.737
  377    HA   GLU  47           HA       GLU  47 -11.958  -2.767  -4.920
  378   1HB   GLU  47          1HB       GLU  47 -13.973  -1.042  -4.363
  379   2HB   GLU  47          2HB       GLU  47 -14.631  -1.847  -5.781
  380   1HG   GLU  47          1HG       GLU  47 -15.374  -2.950  -3.769
  381   2HG   GLU  47          2HG       GLU  47 -14.315  -4.015  -4.692
  382    H    GLU  48           H        GLU  48 -12.015  -4.445  -6.301
  383    HA   GLU  48           HA       GLU  48 -12.291  -3.817  -9.153
  384   1HB   GLU  48          1HB       GLU  48 -10.240  -5.028  -8.025
  385   2HB   GLU  48          2HB       GLU  48 -11.272  -6.445  -8.158
  386   1HG   GLU  48          1HG       GLU  48 -11.082  -4.854 -10.607
  387   2HG   GLU  48          2HG       GLU  48  -9.562  -5.572 -10.076
  388    H    GLY  49           H        GLY  49 -13.928  -4.589 -10.339
  389   1HA   GLY  49          1HA       GLY  49 -15.367  -6.973  -9.519
  390   2HA   GLY  49          2HA       GLY  49 -16.293  -5.481  -9.445
  391    H    ASN  50           H        ASN  50 -14.465  -7.593 -11.607
  392    HA   ASN  50           HA       ASN  50 -15.096  -6.314 -14.019
  393   1HB   ASN  50          1HB       ASN  50 -13.661  -8.576 -13.259
  394   2HB   ASN  50          2HB       ASN  50 -14.950  -9.209 -14.277
  395   1HD2  ASN  50          1HD2      ASN  50 -12.434  -6.734 -14.159
  396   2HD2  ASN  50          2HD2      ASN  50 -12.107  -6.734 -15.855
  397    H    GLU  51           H        GLU  51 -16.304  -8.048 -15.702
  398    HA   GLU  51           HA       GLU  51 -19.008  -7.546 -15.386
  399   1HB   GLU  51          1HB       GLU  51 -19.357  -9.270 -17.146
  400   2HB   GLU  51          2HB       GLU  51 -18.106  -8.102 -17.548
  401   1HG   GLU  51          1HG       GLU  51 -16.491  -9.872 -16.561
  402   2HG   GLU  51          2HG       GLU  51 -17.837 -10.982 -16.813
  403    H    GLU  52           H        GLU  52 -20.721  -9.367 -15.396
  404    HA   GLU  52           HA       GLU  52 -20.901 -10.466 -12.867
  405   1HB   GLU  52          1HB       GLU  52 -22.680 -10.179 -14.771
  406   2HB   GLU  52          2HB       GLU  52 -22.231 -11.829 -15.178
  407   1HG   GLU  52          1HG       GLU  52 -23.628 -12.562 -13.636
  408   2HG   GLU  52          2HG       GLU  52 -22.648 -11.777 -12.399
  409    H    GLY  53           H        GLY  53 -20.813 -12.656 -12.110
  410   1HA   GLY  53          1HA       GLY  53 -20.116 -14.907 -12.227
  411   2HA   GLY  53          2HA       GLY  53 -19.283 -14.547 -13.732
  412    H    ARG  54           H        ARG  54 -18.070 -12.113 -12.443
  413    HA   ARG  54           HA       ARG  54 -15.838 -13.532 -11.199
  414   1HB   ARG  54          1HB       ARG  54 -15.393 -11.997 -13.094
  415   2HB   ARG  54          2HB       ARG  54 -16.016 -10.663 -12.133
  416   1HG   ARG  54          1HG       ARG  54 -13.653 -10.569 -12.021
  417   2HG   ARG  54          2HG       ARG  54 -14.223 -11.151 -10.456
  418   1HD   ARG  54          1HD       ARG  54 -12.993 -12.988 -10.664
  419   2HD   ARG  54          2HD       ARG  54 -13.813 -13.388 -12.173
  420    HE   ARG  54           HE       ARG  54 -11.988 -12.625 -13.328
  421   1HH1  ARG  54          1HH1      ARG  54 -11.801 -11.524 -10.030
  422   2HH1  ARG  54          2HH1      ARG  54 -10.191 -10.905 -10.191
  423   1HH2  ARG  54          1HH2      ARG  54  -9.867 -11.814 -13.552
  424   2HH2  ARG  54          2HH2      ARG  54  -9.092 -11.070 -12.194
  425    H    THR  55           H        THR  55 -15.221 -13.254  -9.124
  426    HA   THR  55           HA       THR  55 -17.065 -11.940  -7.338
  427    HB   THR  55           HB       THR  55 -14.923 -12.701  -5.778
  428    HG1  THR  55           1HG      THR  55 -14.069 -14.524  -6.614
  429   1HG2  THR  55          1HG2      THR  55 -17.564 -13.268  -5.931
  430   2HG2  THR  55          2HG2      THR  55 -16.446 -14.082  -4.836
  431   3HG2  THR  55          3HG2      THR  55 -16.874 -14.828  -6.376
  432    HA   PRO  56           HA       PRO  56 -14.976  -8.136  -6.686
  433   1HB   PRO  56          1HB       PRO  56 -15.295  -7.757  -4.017
  434   2HB   PRO  56          2HB       PRO  56 -16.623  -7.605  -5.174
  435   1HG   PRO  56          1HG       PRO  56 -15.913  -9.907  -3.396
  436   2HG   PRO  56          2HG       PRO  56 -17.508  -9.217  -3.750
  437   1HD   PRO  56          1HD       PRO  56 -16.598 -11.471  -4.943
  438   2HD   PRO  56          2HD       PRO  56 -17.680 -10.328  -5.763
  439    H    HIS  57           H        HIS  57 -13.003  -7.282  -6.137
  440    HA   HIS  57           HA       HIS  57 -11.262  -8.812  -4.347
  441   1HB   HIS  57          1HB       HIS  57 -10.649  -9.684  -6.488
  442   2HB   HIS  57          2HB       HIS  57 -10.623  -8.076  -7.205
  443    HD1  HIS  57           1HD      HIS  57  -8.493  -6.710  -6.951
  444    HD2  HIS  57           2HD      HIS  57  -8.401 -10.299  -4.861
  445    HE1  HIS  57           1HE      HIS  57  -6.108  -6.993  -6.206
  446    H    LEU  58           H        LEU  58  -9.867  -7.587  -3.170
  447    HA   LEU  58           HA       LEU  58 -10.179  -4.692  -3.403
  448   1HB   LEU  58          1HB       LEU  58 -10.223  -6.329  -1.243
  449   2HB   LEU  58          2HB       LEU  58  -8.544  -5.794  -1.221
  450    HG   LEU  58           HG       LEU  58 -11.020  -4.093  -1.001
  451   1HD1  LEU  58          1HD1      LEU  58  -8.794  -4.869   0.848
  452   2HD1  LEU  58          2HD1      LEU  58 -10.536  -4.965   1.102
  453   3HD1  LEU  58          3HD1      LEU  58  -9.730  -3.396   1.108
  454   1HD2  LEU  58          1HD2      LEU  58  -9.327  -2.221  -0.736
  455   2HD2  LEU  58          2HD2      LEU  58  -9.591  -2.821  -2.374
  456   3HD2  LEU  58          3HD2      LEU  58  -8.156  -3.314  -1.474
  457    H    GLN  59           H        GLN  59  -8.582  -3.335  -3.982
  458    HA   GLN  59           HA       GLN  59  -5.817  -4.213  -3.987
  459   1HB   GLN  59          1HB       GLN  59  -6.378  -5.013  -6.139
  460   2HB   GLN  59          2HB       GLN  59  -7.352  -3.595  -6.501
  461   1HG   GLN  59          1HG       GLN  59  -5.256  -3.577  -7.732
  462   2HG   GLN  59          2HG       GLN  59  -5.356  -2.222  -6.609
  463   1HE2  GLN  59          1HE2      GLN  59  -3.350  -4.497  -7.799
  464   2HE2  GLN  59          2HE2      GLN  59  -2.224  -4.621  -6.494
  465    H    GLY  60           H        GLY  60  -4.858  -2.598  -2.940
  466   1HA   GLY  60          1HA       GLY  60  -5.226   0.126  -3.938
  467   2HA   GLY  60          2HA       GLY  60  -5.583  -0.163  -2.242
  468    H    PHE  61           H        PHE  61  -3.590   1.609  -3.274
  469    HA   PHE  61           HA       PHE  61  -1.162   0.290  -2.248
  470   1HB   PHE  61          1HB       PHE  61  -0.731   0.707  -4.538
  471   2HB   PHE  61          2HB       PHE  61  -1.481   2.298  -4.472
  472    HD1  PHE  61           2HD      PHE  61   1.194   0.572  -2.519
  473    HD2  PHE  61           1HD      PHE  61   0.034   3.979  -4.791
  474    HE1  PHE  61           2HE      PHE  61   3.397   1.589  -2.113
  475    HE2  PHE  61           1HE      PHE  61   2.236   5.001  -4.389
  476    HZ   PHE  61           HZ       PHE  61   3.921   3.806  -3.048
  477    H    ALA  62           H        ALA  62   0.035   1.354  -0.730
  478    HA   ALA  62           HA       ALA  62  -0.784   4.065   0.035
  479   1HB   ALA  62          1HB       ALA  62  -0.194   2.411   2.351
  480   2HB   ALA  62          2HB       ALA  62  -1.545   3.507   2.056
  481   3HB   ALA  62          3HB       ALA  62  -1.606   1.850   1.455
  482    H    ASN  63           H        ASN  63   0.869   5.371   0.585
  483    HA   ASN  63           HA       ASN  63   3.559   4.229   0.500
  484   1HB   ASN  63          1HB       ASN  63   2.372   6.877  -0.101
  485   2HB   ASN  63          2HB       ASN  63   3.991   6.895   0.592
  486   1HD2  ASN  63          1HD2      ASN  63   2.570   7.212  -2.192
  487   2HD2  ASN  63          2HD2      ASN  63   3.670   6.402  -3.250
  488    H    PHE  64           H        PHE  64   4.447   3.691   2.374
  489    HA   PHE  64           HA       PHE  64   3.519   4.658   4.882
  490   1HB   PHE  64          1HB       PHE  64   5.395   2.666   3.926
  491   2HB   PHE  64          2HB       PHE  64   6.053   3.548   5.301
  492    HD1  PHE  64           2HD      PHE  64   4.508   3.773   7.365
  493    HD2  PHE  64           1HD      PHE  64   3.955   0.897   4.276
  494    HE1  PHE  64           2HE      PHE  64   3.160   2.395   8.894
  495    HE2  PHE  64           1HE      PHE  64   2.605  -0.485   5.800
  496    HZ   PHE  64           HZ       PHE  64   2.208   0.262   8.113
  497    H    VAL  65           H        VAL  65   4.071   6.434   5.955
  498    HA   VAL  65           HA       VAL  65   5.813   8.372   4.882
  499    HB   VAL  65           HB       VAL  65   4.719   8.145   7.689
  500   1HG1  VAL  65          1HG1      VAL  65   6.541  10.044   6.447
  501   2HG1  VAL  65          2HG1      VAL  65   5.112  10.814   7.140
  502   3HG1  VAL  65          3HG1      VAL  65   6.146   9.800   8.148
  503   1HG2  VAL  65          1HG2      VAL  65   2.865   9.327   7.009
  504   2HG2  VAL  65          2HG2      VAL  65   3.687  10.027   5.615
  505   3HG2  VAL  65          3HG2      VAL  65   3.176   8.339   5.582
  506    H    LYS  66           H        LYS  66   6.335   5.694   7.001
  507    HA   LYS  66           HA       LYS  66   9.133   6.550   7.354
  508   1HB   LYS  66          1HB       LYS  66   7.182   5.489   9.325
  509   2HB   LYS  66          2HB       LYS  66   8.834   4.899   9.450
  510   1HG   LYS  66          1HG       LYS  66   8.778   6.729  10.879
  511   2HG   LYS  66          2HG       LYS  66   9.518   7.366   9.408
  512   1HD   LYS  66          1HD       LYS  66   6.981   7.907   8.831
  513   2HD   LYS  66          2HD       LYS  66   6.847   7.911  10.591
  514   1HE   LYS  66          1HE       LYS  66   9.148   9.370  10.079
  515   2HE   LYS  66          2HE       LYS  66   8.033   9.871   8.809
  516   1HZ   LYS  66          1HZ       LYS  66   6.772   9.735  11.371
  517   2HZ   LYS  66          2HZ       LYS  66   6.818  11.010  10.261
  518   3HZ   LYS  66          3HZ       LYS  66   8.080  10.808  11.369
  519    H    LYS  67           H        LYS  67  10.706   4.858   7.422
  520    HA   LYS  67           HA       LYS  67  10.341   2.869   5.479
  521   1HB   LYS  67          1HB       LYS  67  12.433   3.196   7.630
  522   2HB   LYS  67          2HB       LYS  67  12.508   1.940   6.402
  523   1HG   LYS  67          1HG       LYS  67  12.092   4.587   5.275
  524   2HG   LYS  67          2HG       LYS  67  13.582   4.461   6.213
  525   1HD   LYS  67          1HD       LYS  67  14.080   2.358   4.903
  526   2HD   LYS  67          2HD       LYS  67  12.730   2.795   3.853
  527   1HE   LYS  67          1HE       LYS  67  14.248   3.938   2.672
  528   2HE   LYS  67          2HE       LYS  67  14.166   5.125   3.972
  529   1HZ   LYS  67          1HZ       LYS  67  16.269   3.241   3.317
  530   2HZ   LYS  67          2HZ       LYS  67  15.937   3.402   4.967
  531   3HZ   LYS  67          3HZ       LYS  67  16.367   4.760   4.055
  532    H    GLN  68           H        GLN  68   9.319   0.988   5.577
  533    HA   GLN  68           HA       GLN  68   9.205  -0.438   8.142
  534   1HB   GLN  68          1HB       GLN  68   6.883   0.004   6.259
  535   2HB   GLN  68          2HB       GLN  68   6.857  -1.077   7.645
  536   1HG   GLN  68          1HG       GLN  68   7.012   1.914   7.611
  537   2HG   GLN  68          2HG       GLN  68   5.800   0.879   8.364
  538   1HE2  GLN  68          1HE2      GLN  68   7.610   3.022   9.407
  539   2HE2  GLN  68          2HE2      GLN  68   8.407   2.301  10.760
  540    H    THR  69           H        THR  69   8.947  -2.719   7.975
  541    HA   THR  69           HA       THR  69  10.026  -3.780   5.471
  542    HB   THR  69           HB       THR  69  10.758  -5.672   6.665
  543    HG1  THR  69           1HG      THR  69  10.006  -6.094   8.817
  544   1HG2  THR  69          1HG2      THR  69  11.965  -4.758   8.613
  545   2HG2  THR  69          2HG2      THR  69  10.968  -3.305   8.530
  546   3HG2  THR  69          3HG2      THR  69  12.068  -3.697   7.209
  547    H    PHE  70           H        PHE  70   9.243  -6.072   4.932
  548    HA   PHE  70           HA       PHE  70   6.535  -5.952   4.216
  549   1HB   PHE  70          1HB       PHE  70   7.807  -7.328   2.837
  550   2HB   PHE  70          2HB       PHE  70   8.608  -8.115   4.193
  551    HD1  PHE  70           1HD      PHE  70   5.426  -7.893   2.330
  552    HD2  PHE  70           2HD      PHE  70   7.758 -10.099   5.126
  553    HE1  PHE  70           1HE      PHE  70   3.835  -9.764   2.176
  554    HE2  PHE  70           2HE      PHE  70   6.172 -11.973   4.975
  555    HZ   PHE  70           HZ       PHE  70   4.208 -11.808   3.498
  556    H    ASN  71           H        ASN  71   8.134  -8.027   6.636
  557    HA   ASN  71           HA       ASN  71   5.791  -9.188   7.647
  558   1HB   ASN  71          1HB       ASN  71   8.550  -9.344   8.179
  559   2HB   ASN  71          2HB       ASN  71   7.793  -8.901   9.707
  560   1HD2  ASN  71          1HD2      ASN  71   7.550 -11.190   7.027
  561   2HD2  ASN  71          2HD2      ASN  71   6.971 -12.512   7.977
  562    H    LYS  72           H        LYS  72   7.550  -6.275   8.605
  563    HA   LYS  72           HA       LYS  72   6.019  -5.689  10.900
  564   1HB   LYS  72          1HB       LYS  72   8.283  -4.688  10.013
  565   2HB   LYS  72          2HB       LYS  72   7.228  -3.518   9.231
  566   1HG   LYS  72          1HG       LYS  72   7.002  -4.090  12.162
  567   2HG   LYS  72          2HG       LYS  72   8.191  -2.947  11.535
  568   1HD   LYS  72          1HD       LYS  72   6.420  -1.639  10.503
  569   2HD   LYS  72          2HD       LYS  72   5.215  -2.807  11.049
  570   1HE   LYS  72          1HE       LYS  72   4.991  -1.449  12.818
  571   2HE   LYS  72          2HE       LYS  72   6.492  -2.186  13.379
  572   1HZ   LYS  72          1HZ       LYS  72   6.468   0.290  13.393
  573   2HZ   LYS  72          2HZ       LYS  72   6.400   0.260  11.703
  574   3HZ   LYS  72          3HZ       LYS  72   7.741  -0.386  12.507
  575    H    VAL  73           H        VAL  73   5.782  -4.496   7.556
  576    HA   VAL  73           HA       VAL  73   3.656  -2.750   7.862
  577    HB   VAL  73           HB       VAL  73   4.430  -4.482   5.520
  578   1HG1  VAL  73          1HG1      VAL  73   2.960  -2.890   4.200
  579   2HG1  VAL  73          2HG1      VAL  73   2.128  -4.110   5.167
  580   3HG1  VAL  73          3HG1      VAL  73   2.229  -2.446   5.742
  581   1HG2  VAL  73          1HG2      VAL  73   5.791  -2.442   6.484
  582   2HG2  VAL  73          2HG2      VAL  73   5.620  -2.683   4.745
  583   3HG2  VAL  73          3HG2      VAL  73   4.599  -1.510   5.577
  584    H    LYS  74           H        LYS  74   3.677  -6.215   7.870
  585    HA   LYS  74           HA       LYS  74   0.968  -6.685   7.243
  586   1HB   LYS  74          1HB       LYS  74   2.798  -8.334   8.997
  587   2HB   LYS  74          2HB       LYS  74   1.308  -8.889   8.246
  588   1HG   LYS  74          1HG       LYS  74   2.699  -7.979   6.091
  589   2HG   LYS  74          2HG       LYS  74   3.992  -8.597   7.121
  590   1HD   LYS  74          1HD       LYS  74   3.502 -10.620   6.321
  591   2HD   LYS  74          2HD       LYS  74   2.018 -10.539   7.273
  592   1HE   LYS  74          1HE       LYS  74   0.821  -9.604   5.391
  593   2HE   LYS  74          2HE       LYS  74   2.304  -9.543   4.440
  594   1HZ   LYS  74          1HZ       LYS  74   2.337 -11.819   4.184
  595   2HZ   LYS  74          2HZ       LYS  74   0.678 -11.495   4.111
  596   3HZ   LYS  74          3HZ       LYS  74   1.358 -12.109   5.533
  597    H    TRP  75           H        TRP  75   2.372  -5.199   9.914
  598    HA   TRP  75           HA       TRP  75   0.578  -6.050  11.952
  599   1HB   TRP  75          1HB       TRP  75   1.585  -4.423  13.321
  600   2HB   TRP  75          2HB       TRP  75   2.870  -4.919  12.222
  601    HD1  TRP  75           HD       TRP  75   2.079  -3.111   9.720
  602    HE1  TRP  75           1HE      TRP  75   2.439  -0.566   9.840
  603    HE3  TRP  75           3HE      TRP  75   2.203  -2.548  14.800
  604    HZ2  TRP  75           2HZ      TRP  75   2.737   1.419  11.825
  605    HZ3  TRP  75           3HZ      TRP  75   2.530  -0.293  15.728
  606    HH2  TRP  75           HH       TRP  75   2.792   1.648  14.270
  607    H    TYR  76           H        TYR  76   0.319  -3.852   9.339
  608    HA   TYR  76           HA       TYR  76  -2.121  -2.689  10.511
  609   1HB   TYR  76          1HB       TYR  76   0.063  -1.538   8.938
  610   2HB   TYR  76          2HB       TYR  76  -1.531  -1.137   8.309
  611    HD1  TYR  76           2HD      TYR  76  -3.074  -0.993  10.855
  612    HD2  TYR  76           1HD      TYR  76   0.789   0.488   9.860
  613    HE1  TYR  76           2HE      TYR  76  -3.311   0.758  12.566
  614    HE2  TYR  76           1HE      TYR  76   0.563   2.243  11.568
  615    HH   TYR  76           HH       TYR  76  -0.732   2.602  13.678
  616    H    LEU  77           H        LEU  77  -0.717  -3.770   7.424
  617    HA   LEU  77           HA       LEU  77  -3.216  -3.855   6.066
  618   1HB   LEU  77          1HB       LEU  77  -0.535  -5.079   5.456
  619   2HB   LEU  77          2HB       LEU  77  -1.924  -5.204   4.380
  620    HG   LEU  77           HG       LEU  77  -0.683  -2.589   5.224
  621   1HD1  LEU  77          1HD1      LEU  77   0.673  -2.593   3.386
  622   2HD1  LEU  77          2HD1      LEU  77  -0.345  -3.724   2.496
  623   3HD1  LEU  77          3HD1      LEU  77   0.700  -4.309   3.791
  624   1HD2  LEU  77          1HD2      LEU  77  -2.611  -3.282   3.009
  625   2HD2  LEU  77          2HD2      LEU  77  -1.959  -1.682   3.362
  626   3HD2  LEU  77          3HD2      LEU  77  -3.029  -2.474   4.520
  627    H    GLY  78           H        GLY  78  -1.302  -6.205   7.851
  628   1HA   GLY  78          1HA       GLY  78  -2.187  -8.088   8.946
  629   2HA   GLY  78          2HA       GLY  78  -3.631  -7.960   7.952
  630    H    ALA  79           H        ALA  79  -2.025 -10.316   8.532
  631    HA   ALA  79           HA       ALA  79  -0.505 -10.956   6.189
  632   1HB   ALA  79          1HB       ALA  79  -1.118 -13.357   7.412
  633   2HB   ALA  79          2HB       ALA  79   0.315 -12.370   7.703
  634   3HB   ALA  79          3HB       ALA  79  -1.100 -12.199   8.743
  635    H    ARG  80           H        ARG  80  -3.824 -11.250   7.155
  636    HA   ARG  80           HA       ARG  80  -4.740 -13.317   5.572
  637   1HB   ARG  80          1HB       ARG  80  -6.907 -11.991   5.486
  638   2HB   ARG  80          2HB       ARG  80  -6.266 -12.336   7.087
  639   1HG   ARG  80          1HG       ARG  80  -5.387 -10.090   7.257
  640   2HG   ARG  80          2HG       ARG  80  -5.922  -9.733   5.613
  641   1HD   ARG  80          1HD       ARG  80  -7.467  -8.824   7.276
  642   2HD   ARG  80          2HD       ARG  80  -8.240 -10.059   6.282
  643    HE   ARG  80           HE       ARG  80  -7.405 -11.469   8.416
  644   1HH1  ARG  80          1HH1      ARG  80  -9.201  -8.502   8.114
  645   2HH1  ARG  80          2HH1      ARG  80 -10.094  -8.741   9.579
  646   1HH2  ARG  80          1HH2      ARG  80  -8.574 -11.795  10.347
  647   2HH2  ARG  80          2HH2      ARG  80  -9.736 -10.614  10.849
  648    H    CYS  81           H        CYS  81  -3.987 -10.000   4.672
  649    HA   CYS  81           HA       CYS  81  -4.732 -10.578   1.893
  650   1HB   CYS  81          1HB       CYS  81  -4.759  -8.217   1.517
  651   2HB   CYS  81          2HB       CYS  81  -5.619  -8.510   3.023
  652    HG   CYS  81           HG       CYS  81  -4.125  -6.154   3.268
  653    H    HIS  82           H        HIS  82  -3.274 -10.485   0.231
  654    HA   HIS  82           HA       HIS  82  -0.515 -10.874   0.926
  655   1HB   HIS  82          1HB       HIS  82  -1.756 -12.082  -0.928
  656   2HB   HIS  82          2HB       HIS  82  -1.660 -10.586  -1.853
  657    HD1  HIS  82           1HD      HIS  82   0.610 -13.183  -0.290
  658    HD2  HIS  82           2HD      HIS  82   0.687 -10.223  -3.204
  659    HE1  HIS  82           1HE      HIS  82   2.824 -13.443  -1.454
  660    H    ILE  83           H        ILE  83   1.047  -9.398   0.990
  661    HA   ILE  83           HA       ILE  83   0.535  -6.776  -0.256
  662    HB   ILE  83           HB       ILE  83   1.977  -5.778   1.457
  663   1HG1  ILE  83          1HG1      ILE  83   1.956  -8.504   2.768
  664   2HG1  ILE  83          2HG1      ILE  83   3.325  -7.848   1.876
  665   1HG2  ILE  83          1HG2      ILE  83  -0.308  -5.651   1.963
  666   2HG2  ILE  83          2HG2      ILE  83  -0.403  -7.365   2.363
  667   3HG2  ILE  83          3HG2      ILE  83   0.443  -6.255   3.440
  668   1HD1  ILE  83          1HD1      ILE  83   3.424  -5.978   3.479
  669   2HD1  ILE  83          2HD1      ILE  83   2.124  -6.738   4.399
  670   3HD1  ILE  83          3HD1      ILE  83   3.678  -7.554   4.230
  671    H    GLU  84           H        GLU  84   2.183  -5.776  -1.384
  672    HA   GLU  84           HA       GLU  84   4.776  -7.076  -1.581
  673   1HB   GLU  84          1HB       GLU  84   2.919  -7.889  -3.357
  674   2HB   GLU  84          2HB       GLU  84   3.537  -6.479  -4.206
  675   1HG   GLU  84          1HG       GLU  84   5.759  -7.369  -4.198
  676   2HG   GLU  84          2HG       GLU  84   5.264  -8.711  -3.168
  677    H    LYS  85           H        LYS  85   6.297  -5.794  -2.941
  678    HA   LYS  85           HA       LYS  85   6.088  -3.022  -2.254
  679   1HB   LYS  85          1HB       LYS  85   8.145  -4.396  -3.992
  680   2HB   LYS  85          2HB       LYS  85   8.298  -2.808  -3.252
  681   1HG   LYS  85          1HG       LYS  85   8.334  -3.782  -1.052
  682   2HG   LYS  85          2HG       LYS  85   8.023  -5.386  -1.721
  683   1HD   LYS  85          1HD       LYS  85  10.343  -4.036  -2.890
  684   2HD   LYS  85          2HD       LYS  85  10.495  -4.357  -1.161
  685   1HE   LYS  85          1HE       LYS  85  10.520  -6.612  -1.445
  686   2HE   LYS  85          2HE       LYS  85   9.456  -6.556  -2.849
  687   1HZ   LYS  85          1HZ       LYS  85  11.576  -5.394  -3.879
  688   2HZ   LYS  85          2HZ       LYS  85  11.388  -7.075  -3.877
  689   3HZ   LYS  85          3HZ       LYS  85  12.362  -6.332  -2.710
  690    H    ALA  86           H        ALA  86   5.494  -1.336  -3.485
  691    HA   ALA  86           HA       ALA  86   4.353  -1.881  -6.092
  692   1HB   ALA  86          1HB       ALA  86   2.961  -0.250  -5.529
  693   2HB   ALA  86          2HB       ALA  86   3.849  -0.031  -4.021
  694   3HB   ALA  86          3HB       ALA  86   4.298   0.898  -5.451
  695    H    LYS  87           H        LYS  87   4.837  -0.558  -7.968
  696    HA   LYS  87           HA       LYS  87   7.509   0.652  -7.973
  697   1HB   LYS  87          1HB       LYS  87   8.219  -0.546  -9.898
  698   2HB   LYS  87          2HB       LYS  87   7.599  -1.745  -8.771
  699   1HG   LYS  87          1HG       LYS  87   5.386  -1.096 -10.274
  700   2HG   LYS  87          2HG       LYS  87   6.704  -1.062 -11.448
  701   1HD   LYS  87          1HD       LYS  87   6.111  -3.280 -11.530
  702   2HD   LYS  87          2HD       LYS  87   7.372  -3.323 -10.295
  703   1HE   LYS  87          1HE       LYS  87   5.056  -2.762  -8.881
  704   2HE   LYS  87          2HE       LYS  87   4.543  -3.938 -10.089
  705   1HZ   LYS  87          1HZ       LYS  87   5.253  -5.300  -8.416
  706   2HZ   LYS  87          2HZ       LYS  87   6.470  -4.246  -7.899
  707   3HZ   LYS  87          3HZ       LYS  87   6.687  -5.164  -9.303
  708    H    GLY  88           H        GLY  88   7.777   2.350  -9.390
  709   1HA   GLY  88          1HA       GLY  88   7.065   3.520 -11.415
  710   2HA   GLY  88          2HA       GLY  88   5.414   3.079 -11.005
  711    H    THR  89           H        THR  89   5.068   5.418 -11.317
  712    HA   THR  89           HA       THR  89   5.971   7.043  -9.044
  713    HB   THR  89           HB       THR  89   5.450   8.990 -10.307
  714    HG1  THR  89           1HG      THR  89   3.955   8.981 -11.809
  715   1HG2  THR  89          1HG2      THR  89   6.995   8.843 -12.037
  716   2HG2  THR  89          2HG2      THR  89   6.519   7.197 -12.456
  717   3HG2  THR  89          3HG2      THR  89   7.463   7.498 -10.997
  718    H    ASP  90           H        ASP  90   4.257   8.778  -8.425
  719    HA   ASP  90           HA       ASP  90   2.136   7.501  -7.151
  720   1HB   ASP  90          1HB       ASP  90   3.009   9.671  -6.424
  721   2HB   ASP  90          2HB       ASP  90   2.397  10.422  -7.895
  722    H    GLN  91           H        GLN  91   2.244   9.206 -10.240
  723    HA   GLN  91           HA       GLN  91  -0.537   9.142 -10.746
  724   1HB   GLN  91          1HB       GLN  91   1.849   9.396 -12.573
  725   2HB   GLN  91          2HB       GLN  91   0.191   9.476 -13.154
  726   1HG   GLN  91          1HG       GLN  91   1.476  11.334 -11.166
  727   2HG   GLN  91          2HG       GLN  91   1.097  11.696 -12.849
  728   1HE2  GLN  91          1HE2      GLN  91  -1.229  11.457 -13.441
  729   2HE2  GLN  91          2HE2      GLN  91  -2.401  11.990 -12.290
  730    H    GLN  92           H        GLN  92   2.076   6.886 -11.396
  731    HA   GLN  92           HA       GLN  92   0.622   5.168 -13.116
  732   1HB   GLN  92          1HB       GLN  92   3.184   5.055 -11.635
  733   2HB   GLN  92          2HB       GLN  92   2.465   3.507 -12.056
  734   1HG   GLN  92          1HG       GLN  92   2.257   4.894 -14.400
  735   2HG   GLN  92          2HG       GLN  92   3.780   5.490 -13.742
  736   1HE2  GLN  92          1HE2      GLN  92   5.533   4.175 -13.698
  737   2HE2  GLN  92          2HE2      GLN  92   5.559   2.581 -14.363
  738    H    ASN  93           H        ASN  93   1.153   5.207  -9.622
  739    HA   ASN  93           HA       ASN  93  -0.277   2.759  -9.178
  740   1HB   ASN  93          1HB       ASN  93   0.831   4.896  -7.369
  741   2HB   ASN  93          2HB       ASN  93  -0.163   3.587  -6.737
  742   1HD2  ASN  93          1HD2      ASN  93   2.392   3.747  -9.192
  743   2HD2  ASN  93          2HD2      ASN  93   3.385   2.524  -8.483
  744    H    LYS  94           H        LYS  94  -0.998   6.204  -8.926
  745    HA   LYS  94           HA       LYS  94  -3.516   5.989  -7.703
  746   1HB   LYS  94          1HB       LYS  94  -2.179   8.094  -7.977
  747   2HB   LYS  94          2HB       LYS  94  -2.645   8.109  -9.672
  748   1HG   LYS  94          1HG       LYS  94  -5.069   7.996  -8.702
  749   2HG   LYS  94          2HG       LYS  94  -4.294   8.627  -7.247
  750   1HD   LYS  94          1HD       LYS  94  -3.634   9.954  -9.814
  751   2HD   LYS  94          2HD       LYS  94  -5.259  10.208  -9.172
  752   1HE   LYS  94          1HE       LYS  94  -3.096  10.469  -7.203
  753   2HE   LYS  94          2HE       LYS  94  -3.071  11.673  -8.490
  754   1HZ   LYS  94          1HZ       LYS  94  -5.165  12.457  -7.899
  755   2HZ   LYS  94          2HZ       LYS  94  -4.412  12.192  -6.408
  756   3HZ   LYS  94          3HZ       LYS  94  -5.547  11.081  -6.991
  757    H    GLU  95           H        GLU  95  -2.613   6.151 -11.137
  758    HA   GLU  95           HA       GLU  95  -5.292   5.939 -12.081
  759   1HB   GLU  95          1HB       GLU  95  -2.579   5.885 -13.294
  760   2HB   GLU  95          2HB       GLU  95  -3.886   5.163 -14.222
  761   1HG   GLU  95          1HG       GLU  95  -5.086   7.204 -14.291
  762   2HG   GLU  95          2HG       GLU  95  -4.016   7.947 -13.103
  763    H    TYR  96           H        TYR  96  -2.633   3.629 -11.690
  764    HA   TYR  96           HA       TYR  96  -3.833   1.400 -12.845
  765   1HB   TYR  96          1HB       TYR  96  -1.466   1.476 -12.191
  766   2HB   TYR  96          2HB       TYR  96  -1.930   1.482 -10.493
  767    HD1  TYR  96           2HD      TYR  96  -1.858  -0.554 -13.572
  768    HD2  TYR  96           1HD      TYR  96  -2.513  -0.536  -9.368
  769    HE1  TYR  96           2HE      TYR  96  -1.830  -3.013 -13.563
  770    HE2  TYR  96           1HE      TYR  96  -2.485  -2.995  -9.347
  771    HH   TYR  96           HH       TYR  96  -3.027  -4.858 -11.284
  772    H    CYS  97           H        CYS  97  -4.060   2.649  -9.546
  773    HA   CYS  97           HA       CYS  97  -5.596   0.494  -8.523
  774   1HB   CYS  97          1HB       CYS  97  -4.287   2.120  -7.136
  775   2HB   CYS  97          2HB       CYS  97  -5.505   3.337  -7.499
  776    HG   CYS  97           HG       CYS  97  -7.370   2.502  -5.863
  777    H    SER  98           H        SER  98  -6.397   3.511 -10.117
  778    HA   SER  98           HA       SER  98  -9.220   3.280  -9.584
  779   1HB   SER  98          1HB       SER  98  -9.366   5.403 -10.368
  780   2HB   SER  98          2HB       SER  98  -7.610   5.388 -10.213
  781    HG   SER  98           HG       SER  98  -7.506   5.592 -12.290
  782    H    LYS  99           H        LYS  99  -7.084   1.873 -11.766
  783    HA   LYS  99           HA       LYS  99  -8.527   1.735 -14.142
  784   1HB   LYS  99          1HB       LYS  99  -7.009   0.150 -14.809
  785   2HB   LYS  99          2HB       LYS  99  -6.132   0.850 -13.454
  786   1HG   LYS  99          1HG       LYS  99  -5.878  -1.328 -12.918
  787   2HG   LYS  99          2HG       LYS  99  -7.441  -1.061 -12.141
  788   1HD   LYS  99          1HD       LYS  99  -8.572  -2.288 -13.688
  789   2HD   LYS  99          2HD       LYS  99  -7.470  -1.853 -14.997
  790   1HE   LYS  99          1HE       LYS  99  -6.118  -3.414 -12.984
  791   2HE   LYS  99          2HE       LYS  99  -7.550  -4.256 -13.574
  792   1HZ   LYS  99          1HZ       LYS  99  -5.648  -4.820 -14.912
  793   2HZ   LYS  99          2HZ       LYS  99  -5.332  -3.190 -15.237
  794   3HZ   LYS  99          3HZ       LYS  99  -6.734  -3.917 -15.845
  795    H    GLU 100           H        GLU 100  -9.138   0.259 -11.103
  796    HA   GLU 100           HA       GLU 100 -10.691  -1.941 -12.041
  797   1HB   GLU 100          1HB       GLU 100 -10.622  -0.573  -9.347
  798   2HB   GLU 100          2HB       GLU 100 -11.480  -2.070  -9.683
  799   1HG   GLU 100          1HG       GLU 100  -9.532  -3.289  -9.926
  800   2HG   GLU 100          2HG       GLU 100  -8.557  -1.857 -10.252
  801    H    GLY 101           H        GLY 101 -11.286   1.415 -11.645
  802   1HA   GLY 101          1HA       GLY 101 -13.140   2.593 -12.428
  803   2HA   GLY 101          2HA       GLY 101 -13.995   1.070 -12.621
  804    H    ASN 102           H        ASN 102 -12.808   0.815  -9.635
  805    HA   ASN 102           HA       ASN 102 -15.048   2.260  -8.383
  806   1HB   ASN 102          1HB       ASN 102 -14.882  -0.492  -8.622
  807   2HB   ASN 102          2HB       ASN 102 -14.276  -0.193  -6.995
  808   1HD2  ASN 102          1HD2      ASN 102 -15.667   0.333  -5.415
  809   2HD2  ASN 102          2HD2      ASN 102 -17.371   0.521  -5.634
  810    H    LEU 103           H        LEU 103 -14.478   3.545  -6.754
  811    HA   LEU 103           HA       LEU 103 -11.781   3.233  -5.621
  812   1HB   LEU 103          1HB       LEU 103 -13.225   5.484  -6.616
  813   2HB   LEU 103          2HB       LEU 103 -12.901   5.729  -4.901
  814    HG   LEU 103           HG       LEU 103 -11.206   6.717  -6.450
  815   1HD1  LEU 103          1HD1      LEU 103  -9.288   5.272  -5.196
  816   2HD1  LEU 103          2HD1      LEU 103 -10.693   4.910  -4.195
  817   3HD1  LEU 103          3HD1      LEU 103 -10.200   6.584  -4.449
  818   1HD2  LEU 103          1HD2      LEU 103 -10.211   5.521  -8.038
  819   2HD2  LEU 103          2HD2      LEU 103 -11.356   4.226  -7.686
  820   3HD2  LEU 103          3HD2      LEU 103  -9.778   4.248  -6.896
  821    H    LEU 104           H        LEU 104 -11.728   2.342  -3.675
  822    HA   LEU 104           HA       LEU 104 -14.076   2.368  -1.972
  823   1HB   LEU 104          1HB       LEU 104 -12.397   0.416  -2.420
  824   2HB   LEU 104          2HB       LEU 104 -11.448   1.206  -1.162
  825    HG   LEU 104           HG       LEU 104 -12.780  -0.643  -0.276
  826   1HD1  LEU 104          1HD1      LEU 104 -14.128   1.759   0.827
  827   2HD1  LEU 104          2HD1      LEU 104 -12.368   1.693   0.895
  828   3HD1  LEU 104          3HD1      LEU 104 -13.327   0.425   1.657
  829   1HD2  LEU 104          1HD2      LEU 104 -15.167  -0.615  -0.270
  830   2HD2  LEU 104          2HD2      LEU 104 -14.631  -0.421  -1.939
  831   3HD2  LEU 104          3HD2      LEU 104 -15.206   0.977  -1.028
  832    H    MET 105           H        MET 105 -10.785   3.643  -1.973
  833    HA   MET 105           HA       MET 105 -11.582   5.598   0.034
  834   1HB   MET 105          1HB       MET 105 -10.650   4.133   1.563
  835   2HB   MET 105          2HB       MET 105  -9.468   3.520   0.414
  836   1HG   MET 105          1HG       MET 105  -7.972   5.151   0.865
  837   2HG   MET 105          2HG       MET 105  -9.216   6.359   1.178
  838   1HE   MET 105          1HE       MET 105  -6.665   4.125   2.356
  839   2HE   MET 105          2HE       MET 105  -6.849   3.950   4.102
  840   3HE   MET 105          3HE       MET 105  -7.769   2.915   3.009
  841    H    GLU 106           H        GLU 106 -10.663   7.560  -0.270
  842    HA   GLU 106           HA       GLU 106  -8.363   7.765  -2.079
  843   1HB   GLU 106          1HB       GLU 106 -10.758   8.195  -3.117
  844   2HB   GLU 106          2HB       GLU 106 -10.562   9.765  -2.350
  845   1HG   GLU 106          1HG       GLU 106  -8.346   9.927  -3.558
  846   2HG   GLU 106          2HG       GLU 106  -8.864   8.522  -4.489
  847    H    CYS 107           H        CYS 107  -6.870   8.555  -0.723
  848    HA   CYS 107           HA       CYS 107  -7.291  11.189   0.400
  849   1HB   CYS 107          1HB       CYS 107  -7.066   8.729   2.071
  850   2HB   CYS 107          2HB       CYS 107  -6.244  10.182   2.628
  851    HG   CYS 107           HG       CYS 107  -8.376  11.606   3.249
  852    H    GLY 108           H        GLY 108  -5.165  11.775   1.716
  853   1HA   GLY 108          1HA       GLY 108  -2.815  11.730   1.824
  854   2HA   GLY 108          2HA       GLY 108  -2.799  10.553   0.519
  855    H    ALA 109           H        ALA 109  -0.978  12.314   0.134
  856    HA   ALA 109           HA       ALA 109  -2.114  14.417  -1.588
  857   1HB   ALA 109          1HB       ALA 109  -0.623  15.858  -0.774
  858   2HB   ALA 109          2HB       ALA 109  -0.290  14.657   0.475
  859   3HB   ALA 109          3HB       ALA 109   0.707  14.716  -0.979
  860    HA   PRO 110           HA       PRO 110  -0.330  12.657  -5.189
  861   1HB   PRO 110          1HB       PRO 110   0.495  14.854  -6.555
  862   2HB   PRO 110          2HB       PRO 110  -1.209  14.423  -6.367
  863   1HG   PRO 110          1HG       PRO 110   0.418  16.420  -4.843
  864   2HG   PRO 110          2HG       PRO 110  -1.233  16.569  -5.472
  865   1HD   PRO 110          1HD       PRO 110  -0.708  16.017  -2.873
  866   2HD   PRO 110          2HD       PRO 110  -2.144  15.394  -3.710
  867    H    ARG 111           H        ARG 111   1.467  11.494  -4.599
  868    HA   ARG 111           HA       ARG 111   3.920  12.684  -3.785
  869   1HB   ARG 111          1HB       ARG 111   2.988   9.936  -4.448
  870   2HB   ARG 111          2HB       ARG 111   4.720  10.238  -4.485
  871   1HG   ARG 111          1HG       ARG 111   2.948  10.832  -2.127
  872   2HG   ARG 111          2HG       ARG 111   3.890   9.353  -2.324
  873   1HD   ARG 111          1HD       ARG 111   4.971  12.164  -2.164
  874   2HD   ARG 111          2HD       ARG 111   5.074  10.930  -0.909
  875    HE   ARG 111           HE       ARG 111   6.261   9.802  -3.101
  876   1HH1  ARG 111          1HH1      ARG 111   6.742  12.702  -1.236
  877   2HH1  ARG 111          2HH1      ARG 111   8.447  12.769  -1.537
  878   1HH2  ARG 111          1HH2      ARG 111   8.505   9.879  -3.504
  879   2HH2  ARG 111          2HH2      ARG 111   9.449  11.164  -2.828
  880    H    SER 112           H        SER 112   5.935  12.657  -4.918
  881    HA   SER 112           HA       SER 112   6.213  12.008  -7.640
  882   1HB   SER 112          1HB       SER 112   5.200  14.727  -7.026
  883   2HB   SER 112          2HB       SER 112   6.509  14.630  -8.204
  884    HG   SER 112           HG       SER 112   3.975  14.206  -8.646
  885    H    GLN 113           H        GLN 113   8.275  11.421  -7.558
  886    HA   GLN 113           HA       GLN 113  10.174  13.115  -6.084
  887   1HB   GLN 113          1HB       GLN 113  10.047  10.816  -5.273
  888   2HB   GLN 113          2HB       GLN 113  10.384  10.208  -6.888
  889   1HG   GLN 113          1HG       GLN 113  12.594  10.626  -6.736
  890   2HG   GLN 113          2HG       GLN 113  12.364  12.080  -5.767
  891   1HE2  GLN 113          1HE2      GLN 113  12.791  11.968  -3.673
  892   2HE2  GLN 113          2HE2      GLN 113  13.025  10.515  -2.768
  893    H    GLY 114           H        GLY 114  11.979  13.923  -7.066
  894   1HA   GLY 114          1HA       GLY 114  13.435  13.276  -9.172
  895   2HA   GLY 114          2HA       GLY 114  11.978  13.826  -9.987
  896    H    GLN 115           H        GLN 115  14.955  14.781  -9.303
  897    HA   GLN 115           HA       GLN 115  14.170  17.590  -8.881
  898   1HB   GLN 115          1HB       GLN 115  16.168  15.954  -7.571
  899   2HB   GLN 115          2HB       GLN 115  16.898  17.376  -8.303
  900   1HG   GLN 115          1HG       GLN 115  16.365  18.044  -6.140
  901   2HG   GLN 115          2HG       GLN 115  15.068  18.708  -7.133
  902   1HE2  GLN 115          1HE2      GLN 115  13.538  18.800  -5.556
  903   2HE2  GLN 115          2HE2      GLN 115  12.855  17.404  -4.802
  904    H    ARG 116           H        ARG 116  17.079  15.902 -10.063
  905    HA   ARG 116           HA       ARG 116  17.268  17.850 -12.231
  906   1HB   ARG 116          1HB       ARG 116  19.157  16.100 -10.793
  907   2HB   ARG 116          2HB       ARG 116  19.461  16.265 -12.517
  908   1HG   ARG 116          1HG       ARG 116  18.923  18.823 -11.279
  909   2HG   ARG 116          2HG       ARG 116  20.277  17.989 -10.514
  910   1HD   ARG 116          1HD       ARG 116  21.054  17.568 -12.958
  911   2HD   ARG 116          2HD       ARG 116  19.964  18.899 -13.346
  912    HE   ARG 116           HE       ARG 116  21.508  19.841 -11.297
  913   1HH1  ARG 116          1HH1      ARG 116  22.130  18.503 -14.450
  914   2HH1  ARG 116          2HH1      ARG 116  23.589  19.406 -14.689
  915   1HH2  ARG 116          1HH2      ARG 116  23.427  21.036 -11.600
  916   2HH2  ARG 116          2HH2      ARG 116  24.326  20.846 -13.067
  Start of MODEL   28
    1    HA   PRO   2           HA       PRO   2  33.201   4.618  16.447
    2   1HB   PRO   2          1HB       PRO   2  32.777   6.320  14.374
    3   2HB   PRO   2          2HB       PRO   2  32.802   6.848  16.061
    4   1HG   PRO   2          1HG       PRO   2  34.961   7.011  13.993
    5   2HG   PRO   2          2HG       PRO   2  34.455   8.227  15.180
    6   1HD   PRO   2          1HD       PRO   2  36.635   6.662  15.537
    7   2HD   PRO   2          2HD       PRO   2  35.638   7.233  16.890
    8    H    SER   3           H        SER   3  32.645   2.812  15.419
    9    HA   SER   3           HA       SER   3  33.030   2.515  12.591
   10   1HB   SER   3          1HB       SER   3  34.652   0.889  14.531
   11   2HB   SER   3          2HB       SER   3  34.200   0.227  12.961
   12    HG   SER   3           HG       SER   3  35.211   2.081  12.016
   13    H    LYS   4           H        LYS   4  32.001   0.551  11.755
   14    HA   LYS   4           HA       LYS   4  30.085  -0.659  13.627
   15   1HB   LYS   4          1HB       LYS   4  29.526   0.812  11.092
   16   2HB   LYS   4          2HB       LYS   4  28.525  -0.581  11.482
   17   1HG   LYS   4          1HG       LYS   4  27.269   0.920  12.565
   18   2HG   LYS   4          2HG       LYS   4  28.480   0.751  13.838
   19   1HD   LYS   4          1HD       LYS   4  29.735   2.631  12.622
   20   2HD   LYS   4          2HD       LYS   4  28.216   2.910  11.767
   21   1HE   LYS   4          1HE       LYS   4  27.772   2.659  14.605
   22   2HE   LYS   4          2HE       LYS   4  28.969   3.909  14.267
   23   1HZ   LYS   4          1HZ       LYS   4  26.428   3.812  12.771
   24   2HZ   LYS   4          2HZ       LYS   4  27.463   5.126  13.020
   25   3HZ   LYS   4          3HZ       LYS   4  26.505   4.552  14.291
   26    H    LYS   5           H        LYS   5  31.345  -0.827  10.298
   27    HA   LYS   5           HA       LYS   5  31.860  -2.590   8.952
   28   1HB   LYS   5          1HB       LYS   5  32.517  -3.771  11.652
   29   2HB   LYS   5          2HB       LYS   5  32.896  -4.569  10.131
   30   1HG   LYS   5          1HG       LYS   5  34.092  -2.317   9.578
   31   2HG   LYS   5          2HG       LYS   5  34.083  -2.112  11.331
   32   1HD   LYS   5          1HD       LYS   5  35.816  -3.490  11.525
   33   2HD   LYS   5          2HD       LYS   5  34.916  -4.773  10.712
   34   1HE   LYS   5          1HE       LYS   5  35.578  -3.326   8.576
   35   2HE   LYS   5          2HE       LYS   5  36.911  -2.861   9.632
   36   1HZ   LYS   5          1HZ       LYS   5  37.723  -4.993   9.698
   37   2HZ   LYS   5          2HZ       LYS   5  37.134  -4.927   8.113
   38   3HZ   LYS   5          3HZ       LYS   5  36.236  -5.706   9.317
   39    H    ASN   6           H        ASN   6  29.106  -2.324   9.799
   40    HA   ASN   6           HA       ASN   6  28.233  -5.130   9.874
   41   1HB   ASN   6          1HB       ASN   6  27.074  -2.583  10.869
   42   2HB   ASN   6          2HB       ASN   6  25.940  -3.784  10.259
   43   1HD2  ASN   6          1HD2      ASN   6  27.149  -2.670  12.984
   44   2HD2  ASN   6          2HD2      ASN   6  27.191  -4.105  13.946
   45    H    GLY   7           H        GLY   7  26.333  -5.700   8.557
   46   1HA   GLY   7          1HA       GLY   7  25.968  -4.028   6.173
   47   2HA   GLY   7          2HA       GLY   7  26.517  -5.683   5.954
   48    H    ARG   8           H        ARG   8  24.414  -5.480   4.623
   49    HA   ARG   8           HA       ARG   8  22.136  -6.216   6.340
   50   1HB   ARG   8          1HB       ARG   8  22.320  -4.635   3.822
   51   2HB   ARG   8          2HB       ARG   8  20.893  -5.635   4.059
   52   1HG   ARG   8          1HG       ARG   8  20.010  -4.028   5.293
   53   2HG   ARG   8          2HG       ARG   8  21.308  -4.244   6.469
   54   1HD   ARG   8          1HD       ARG   8  21.823  -2.622   4.021
   55   2HD   ARG   8          2HD       ARG   8  20.881  -1.913   5.333
   56    HE   ARG   8           HE       ARG   8  23.294  -3.087   6.285
   57   1HH1  ARG   8          1HH1      ARG   8  21.999  -0.278   4.687
   58   2HH1  ARG   8          2HH1      ARG   8  23.265   0.774   5.227
   59   1HH2  ARG   8          1HH2      ARG   8  24.966  -1.712   7.002
   60   2HH2  ARG   8          2HH2      ARG   8  24.953  -0.043   6.543
   61    H    SER   9           H        SER   9  20.469  -7.516   4.856
   62    HA   SER   9           HA       SER   9  21.626  -9.342   2.989
   63   1HB   SER   9          1HB       SER   9  20.840 -11.278   4.735
   64   2HB   SER   9          2HB       SER   9  22.508 -10.736   4.546
   65    HG   SER   9           HG       SER   9  22.311  -9.483   6.338
   66    H    GLY  10           H        GLY  10  19.855  -8.658   1.751
   67   1HA   GLY  10          1HA       GLY  10  17.788  -9.926   1.075
   68   2HA   GLY  10          2HA       GLY  10  17.228  -9.611   2.711
   69    HA   PRO  11           HA       PRO  11  15.584  -6.291  -0.091
   70   1HB   PRO  11          1HB       PRO  11  13.029  -6.459   0.809
   71   2HB   PRO  11          2HB       PRO  11  13.654  -7.467  -0.502
   72   1HG   PRO  11          1HG       PRO  11  13.290  -8.136   2.394
   73   2HG   PRO  11          2HG       PRO  11  12.920  -9.117   0.964
   74   1HD   PRO  11          1HD       PRO  11  15.159  -9.484   2.443
   75   2HD   PRO  11          2HD       PRO  11  15.113  -9.774   0.692
   76    H    GLN  12           H        GLN  12  15.200  -4.184   0.489
   77    HA   GLN  12           HA       GLN  12  15.333  -3.604   3.367
   78   1HB   GLN  12          1HB       GLN  12  16.394  -2.262   0.940
   79   2HB   GLN  12          2HB       GLN  12  15.875  -1.223   2.261
   80   1HG   GLN  12          1HG       GLN  12  17.496  -2.012   3.699
   81   2HG   GLN  12          2HG       GLN  12  17.701  -3.517   2.805
   82   1HE2  GLN  12          1HE2      GLN  12  18.441  -0.110   2.892
   83   2HE2  GLN  12          2HE2      GLN  12  19.758  -0.166   1.775
   84    HA   PRO  13           HA       PRO  13  11.369  -1.730   3.462
   85   1HB   PRO  13          1HB       PRO  13  11.777   0.430   5.055
   86   2HB   PRO  13          2HB       PRO  13  11.763  -1.227   5.669
   87   1HG   PRO  13          1HG       PRO  13  14.096   0.521   4.990
   88   2HG   PRO  13          2HG       PRO  13  13.867  -0.547   6.387
   89   1HD   PRO  13          1HD       PRO  13  15.364  -1.253   4.244
   90   2HD   PRO  13          2HD       PRO  13  14.445  -2.435   5.198
   91    H    HIS  14           H        HIS  14  10.102  -0.167   2.499
   92    HA   HIS  14           HA       HIS  14  11.467   2.080   1.191
   93   1HB   HIS  14          1HB       HIS  14   9.511   0.198  -0.146
   94   2HB   HIS  14          2HB       HIS  14  10.122   1.689  -0.857
   95    HD1  HIS  14           1HD      HIS  14  11.009  -1.850  -0.233
   96    HD2  HIS  14           2HD      HIS  14  12.858   1.596  -1.635
   97    HE1  HIS  14           1HE      HIS  14  13.144  -2.624  -1.313
   98    H    LYS  15           H        LYS  15   9.630   3.499   0.093
   99    HA   LYS  15           HA       LYS  15   7.663   4.000   2.218
  100   1HB   LYS  15          1HB       LYS  15   7.501   6.279   1.122
  101   2HB   LYS  15          2HB       LYS  15   9.034   5.907   1.899
  102   1HG   LYS  15          1HG       LYS  15   9.090   5.102  -0.859
  103   2HG   LYS  15          2HG       LYS  15   8.618   6.797  -0.713
  104   1HD   LYS  15          1HD       LYS  15  10.593   7.296   0.560
  105   2HD   LYS  15          2HD       LYS  15  11.025   5.587   0.644
  106   1HE   LYS  15          1HE       LYS  15  11.308   5.546  -1.789
  107   2HE   LYS  15          2HE       LYS  15  10.880   7.254  -1.867
  108   1HZ   LYS  15          1HZ       LYS  15  13.372   6.015  -1.110
  109   2HZ   LYS  15          2HZ       LYS  15  12.875   7.248  -0.064
  110   3HZ   LYS  15          3HZ       LYS  15  13.074   7.568  -1.713
  111    H    ARG  16           H        ARG  16   7.583   2.158  -0.263
  112    HA   ARG  16           HA       ARG  16   4.888   2.978  -1.080
  113   1HB   ARG  16          1HB       ARG  16   6.910   1.877  -3.031
  114   2HB   ARG  16          2HB       ARG  16   5.311   2.517  -3.389
  115   1HG   ARG  16          1HG       ARG  16   6.175   4.732  -2.475
  116   2HG   ARG  16          2HG       ARG  16   7.781   4.010  -2.581
  117   1HD   ARG  16          1HD       ARG  16   5.839   4.251  -4.875
  118   2HD   ARG  16          2HD       ARG  16   7.179   5.355  -4.570
  119    HE   ARG  16           HE       ARG  16   7.324   2.783  -5.789
  120   1HH1  ARG  16          1HH1      ARG  16   9.070   5.031  -3.785
  121   2HH1  ARG  16          2HH1      ARG  16  10.629   4.433  -4.247
  122   1HH2  ARG  16          1HH2      ARG  16   9.371   1.987  -6.405
  123   2HH2  ARG  16          2HH2      ARG  16  10.799   2.703  -5.738
  124    H    TRP  17           H        TRP  17   3.476   1.395  -0.771
  125    HA   TRP  17           HA       TRP  17   4.250  -1.374  -1.219
  126   1HB   TRP  17          1HB       TRP  17   3.337  -0.302   1.447
  127   2HB   TRP  17          2HB       TRP  17   3.166  -2.000   1.013
  128    HD1  TRP  17           HD       TRP  17   5.721   0.550   2.143
  129    HE1  TRP  17           1HE      TRP  17   7.964  -0.633   2.584
  130    HE3  TRP  17           3HE      TRP  17   4.619  -4.038   0.174
  131    HZ2  TRP  17           2HZ      TRP  17   9.114  -3.175   2.153
  132    HZ3  TRP  17           3HZ      TRP  17   6.347  -5.790   0.227
  133    HH2  TRP  17           HH       TRP  17   8.547  -5.365   1.196
  134    H    VAL  18           H        VAL  18   2.616  -2.582  -2.015
  135    HA   VAL  18           HA       VAL  18  -0.023  -1.292  -2.197
  136    HB   VAL  18           HB       VAL  18  -0.435  -2.711  -4.153
  137   1HG1  VAL  18          1HG1      VAL  18   1.600  -1.765  -5.542
  138   2HG1  VAL  18          2HG1      VAL  18   0.357  -0.696  -4.889
  139   3HG1  VAL  18          3HG1      VAL  18   1.900  -0.872  -4.052
  140   1HG2  VAL  18          1HG2      VAL  18   0.800  -4.491  -4.677
  141   2HG2  VAL  18          2HG2      VAL  18   2.301  -3.570  -4.577
  142   3HG2  VAL  18          3HG2      VAL  18   1.604  -4.281  -3.121
  143    H    PHE  19           H        PHE  19  -1.911  -2.733  -2.197
  144    HA   PHE  19           HA       PHE  19  -1.503  -5.205  -0.663
  145   1HB   PHE  19          1HB       PHE  19  -3.578  -4.594   0.655
  146   2HB   PHE  19          2HB       PHE  19  -2.143  -3.640   1.014
  147    HD1  PHE  19           1HD      PHE  19  -1.948  -1.331   0.117
  148    HD2  PHE  19           2HD      PHE  19  -5.538  -3.595  -0.199
  149    HE1  PHE  19           1HE      PHE  19  -3.207   0.734  -0.333
  150    HE2  PHE  19           2HE      PHE  19  -6.803  -1.534  -0.650
  151    HZ   PHE  19           HZ       PHE  19  -5.637   0.635  -0.719
  152    H    THR  20           H        THR  20  -2.925  -6.858  -1.098
  153    HA   THR  20           HA       THR  20  -5.197  -6.395  -2.847
  154    HB   THR  20           HB       THR  20  -4.513  -8.032  -4.522
  155    HG1  THR  20           1HG      THR  20  -1.959  -8.047  -3.264
  156   1HG2  THR  20          1HG2      THR  20  -2.884  -6.714  -5.685
  157   2HG2  THR  20          2HG2      THR  20  -2.319  -5.989  -4.180
  158   3HG2  THR  20          3HG2      THR  20  -3.929  -5.610  -4.791
  159    H    LEU  21           H        LEU  21  -6.835  -7.672  -2.272
  160    HA   LEU  21           HA       LEU  21  -6.282 -10.292  -1.093
  161   1HB   LEU  21          1HB       LEU  21  -6.523  -8.677   0.756
  162   2HB   LEU  21          2HB       LEU  21  -8.125  -8.256   0.153
  163    HG   LEU  21           HG       LEU  21  -8.257 -10.998   0.494
  164   1HD1  LEU  21          1HD1      LEU  21  -7.505 -11.307   2.840
  165   2HD1  LEU  21          2HD1      LEU  21  -6.670  -9.757   2.735
  166   3HD1  LEU  21          3HD1      LEU  21  -6.183 -11.093   1.692
  167   1HD2  LEU  21          1HD2      LEU  21  -9.911 -10.503   2.038
  168   2HD2  LEU  21          2HD2      LEU  21  -9.836  -9.028   1.072
  169   3HD2  LEU  21          3HD2      LEU  21  -9.057  -9.088   2.654
  170    H    ASN  22           H        ASN  22  -7.735 -11.839  -1.634
  171    HA   ASN  22           HA       ASN  22  -9.705 -11.157  -3.638
  172   1HB   ASN  22          1HB       ASN  22 -10.019 -13.603  -3.823
  173   2HB   ASN  22          2HB       ASN  22  -8.327 -13.139  -3.972
  174   1HD2  ASN  22          1HD2      ASN  22  -6.878 -13.721  -2.389
  175   2HD2  ASN  22          2HD2      ASN  22  -7.257 -14.861  -1.148
  176    H    ASN  23           H        ASN  23 -11.863 -11.081  -3.386
  177    HA   ASN  23           HA       ASN  23 -13.863 -10.861  -2.315
  178   1HB   ASN  23          1HB       ASN  23 -13.819 -13.290  -2.497
  179   2HB   ASN  23          2HB       ASN  23 -12.889 -13.409  -1.006
  180   1HD2  ASN  23          1HD2      ASN  23 -15.688 -11.404  -1.808
  181   2HD2  ASN  23          2HD2      ASN  23 -16.716 -12.039  -0.573
  182    HA   PRO  24           HA       PRO  24 -11.798  -9.022   1.453
  183   1HB   PRO  24          1HB       PRO  24 -12.478  -6.455   0.890
  184   2HB   PRO  24          2HB       PRO  24 -11.001  -7.212   0.284
  185   1HG   PRO  24          1HG       PRO  24 -13.619  -6.790  -1.105
  186   2HG   PRO  24          2HG       PRO  24 -11.974  -6.558  -1.724
  187   1HD   PRO  24          1HD       PRO  24 -13.447  -8.758  -2.290
  188   2HD   PRO  24          2HD       PRO  24 -11.679  -8.806  -2.140
  189    H    SER  25           H        SER  25 -12.860  -8.532   3.321
  190    HA   SER  25           HA       SER  25 -15.770  -8.669   3.240
  191   1HB   SER  25          1HB       SER  25 -13.719  -9.479   5.101
  192   2HB   SER  25          2HB       SER  25 -14.909  -8.462   5.913
  193    HG   SER  25           HG       SER  25 -16.226 -10.084   5.851
  194    H    GLU  26           H        GLU  26 -17.075  -7.208   4.532
  195    HA   GLU  26           HA       GLU  26 -16.573  -4.514   3.984
  196   1HB   GLU  26          1HB       GLU  26 -18.651  -6.060   5.218
  197   2HB   GLU  26          2HB       GLU  26 -18.337  -4.632   6.194
  198   1HG   GLU  26          1HG       GLU  26 -18.412  -3.491   3.780
  199   2HG   GLU  26          2HG       GLU  26 -19.473  -4.867   3.481
  200    H    ASP  27           H        ASP  27 -15.743  -6.490   6.730
  201    HA   ASP  27           HA       ASP  27 -15.102  -4.315   8.478
  202   1HB   ASP  27          1HB       ASP  27 -14.695  -7.282   8.538
  203   2HB   ASP  27          2HB       ASP  27 -13.815  -6.265   9.676
  204    H    GLU  28           H        GLU  28 -13.171  -6.588   6.540
  205    HA   GLU  28           HA       GLU  28 -10.661  -5.501   7.211
  206   1HB   GLU  28          1HB       GLU  28 -11.671  -7.554   5.497
  207   2HB   GLU  28          2HB       GLU  28 -10.541  -6.568   4.580
  208   1HG   GLU  28          1HG       GLU  28  -9.682  -7.386   7.282
  209   2HG   GLU  28          2HG       GLU  28  -9.800  -8.658   6.067
  210    H    ARG  29           H        ARG  29 -12.784  -4.942   4.416
  211    HA   ARG  29           HA       ARG  29 -11.119  -3.095   3.106
  212   1HB   ARG  29          1HB       ARG  29 -12.963  -4.175   1.953
  213   2HB   ARG  29          2HB       ARG  29 -14.124  -3.407   3.029
  214   1HG   ARG  29          1HG       ARG  29 -12.646  -1.310   1.938
  215   2HG   ARG  29          2HG       ARG  29 -12.945  -2.421   0.600
  216   1HD   ARG  29          1HD       ARG  29 -15.244  -1.898   2.366
  217   2HD   ARG  29          2HD       ARG  29 -14.686  -0.522   1.416
  218    HE   ARG  29           HE       ARG  29 -15.024  -2.934  -0.114
  219   1HH1  ARG  29          1HH1      ARG  29 -16.586  -0.086   1.137
  220   2HH1  ARG  29          2HH1      ARG  29 -17.837  -0.086  -0.062
  221   1HH2  ARG  29          1HH2      ARG  29 -16.665  -2.945  -1.698
  222   2HH2  ARG  29          2HH2      ARG  29 -17.882  -1.714  -1.673
  223    H    LYS  30           H        LYS  30 -13.533  -2.716   5.628
  224    HA   LYS  30           HA       LYS  30 -13.642   0.125   5.535
  225   1HB   LYS  30          1HB       LYS  30 -15.447  -1.164   6.534
  226   2HB   LYS  30          2HB       LYS  30 -14.351  -1.810   7.748
  227   1HG   LYS  30          1HG       LYS  30 -14.164   0.992   7.910
  228   2HG   LYS  30          2HG       LYS  30 -15.881   0.598   7.799
  229   1HD   LYS  30          1HD       LYS  30 -14.056  -0.857   9.687
  230   2HD   LYS  30          2HD       LYS  30 -14.809   0.677  10.131
  231   1HE   LYS  30          1HE       LYS  30 -16.913  -0.221  10.200
  232   2HE   LYS  30          2HE       LYS  30 -16.538  -1.467   9.011
  233   1HZ   LYS  30          1HZ       LYS  30 -15.080  -1.687  11.497
  234   2HZ   LYS  30          2HZ       LYS  30 -15.860  -2.882  10.590
  235   3HZ   LYS  30          3HZ       LYS  30 -16.751  -1.904  11.645
  236    H    LYS  31           H        LYS  31 -11.679  -2.201   7.294
  237    HA   LYS  31           HA       LYS  31 -10.511  -0.436   9.142
  238   1HB   LYS  31          1HB       LYS  31 -10.286  -2.785   9.498
  239   2HB   LYS  31          2HB       LYS  31  -9.534  -3.018   7.925
  240   1HG   LYS  31          1HG       LYS  31  -7.564  -1.804   8.663
  241   2HG   LYS  31          2HG       LYS  31  -8.320  -1.507  10.231
  242   1HD   LYS  31          1HD       LYS  31  -7.838  -3.568  10.979
  243   2HD   LYS  31          2HD       LYS  31  -8.283  -4.327   9.449
  244   1HE   LYS  31          1HE       LYS  31  -5.978  -4.739   9.717
  245   2HE   LYS  31          2HE       LYS  31  -6.092  -3.436   8.535
  246   1HZ   LYS  31          1HZ       LYS  31  -4.726  -3.446  10.979
  247   2HZ   LYS  31          2HZ       LYS  31  -5.956  -2.290  11.081
  248   3HZ   LYS  31          3HZ       LYS  31  -4.816  -2.204   9.834
  249    H    ILE  32           H        ILE  32  -9.304  -1.576   5.989
  250    HA   ILE  32           HA       ILE  32  -6.987   0.038   5.987
  251    HB   ILE  32           HB       ILE  32  -8.498  -1.396   3.828
  252   1HG1  ILE  32          1HG1      ILE  32  -5.667  -1.666   4.863
  253   2HG1  ILE  32          2HG1      ILE  32  -7.028  -2.647   5.397
  254   1HG2  ILE  32          1HG2      ILE  32  -6.582  -0.748   2.307
  255   2HG2  ILE  32          2HG2      ILE  32  -7.760   0.517   2.659
  256   3HG2  ILE  32          3HG2      ILE  32  -6.200   0.511   3.481
  257   1HD1  ILE  32          1HD1      ILE  32  -5.286  -3.146   3.272
  258   2HD1  ILE  32          2HD1      ILE  32  -6.747  -4.037   3.703
  259   3HD1  ILE  32          3HD1      ILE  32  -6.831  -2.714   2.540
  260    H    ARG  33           H        ARG  33 -10.245   0.533   4.714
  261    HA   ARG  33           HA       ARG  33  -9.653   2.997   3.416
  262   1HB   ARG  33          1HB       ARG  33 -11.551   1.742   2.666
  263   2HB   ARG  33          2HB       ARG  33 -12.250   1.727   4.280
  264   1HG   ARG  33          1HG       ARG  33 -12.789   4.026   4.171
  265   2HG   ARG  33          2HG       ARG  33 -11.805   4.258   2.724
  266   1HD   ARG  33          1HD       ARG  33 -13.382   3.373   1.345
  267   2HD   ARG  33          2HD       ARG  33 -13.980   2.255   2.570
  268    HE   ARG  33           HE       ARG  33 -14.962   4.881   2.011
  269   1HH1  ARG  33          1HH1      ARG  33 -14.569   2.486   4.506
  270   2HH1  ARG  33          2HH1      ARG  33 -15.895   3.068   5.456
  271   1HH2  ARG  33          1HH2      ARG  33 -16.711   5.658   3.252
  272   2HH2  ARG  33          2HH2      ARG  33 -17.114   4.872   4.741
  273    H    ASP  34           H        ASP  34 -10.295   2.105   6.666
  274    HA   ASP  34           HA       ASP  34 -10.932   4.861   7.427
  275   1HB   ASP  34          1HB       ASP  34 -11.089   2.241   8.915
  276   2HB   ASP  34          2HB       ASP  34 -11.289   3.797   9.715
  277    H    LEU  35           H        LEU  35  -8.228   3.352   6.748
  278    HA   LEU  35           HA       LEU  35  -6.624   3.592   9.064
  279   1HB   LEU  35          1HB       LEU  35  -6.092   3.342   6.138
  280   2HB   LEU  35          2HB       LEU  35  -4.766   3.753   7.225
  281    HG   LEU  35           HG       LEU  35  -6.473   1.277   7.465
  282   1HD1  LEU  35          1HD1      LEU  35  -3.757   1.694   6.234
  283   2HD1  LEU  35          2HD1      LEU  35  -5.218   1.108   5.440
  284   3HD1  LEU  35          3HD1      LEU  35  -4.419   0.116   6.660
  285   1HD2  LEU  35          1HD2      LEU  35  -4.731   0.541   9.013
  286   2HD2  LEU  35          2HD2      LEU  35  -5.505   2.023   9.576
  287   3HD2  LEU  35          3HD2      LEU  35  -3.908   2.090   8.829
  288    HA   PRO  36           HA       PRO  36  -5.655   7.864   9.317
  289   1HB   PRO  36          1HB       PRO  36  -3.014   7.829   9.945
  290   2HB   PRO  36          2HB       PRO  36  -4.279   7.351  11.084
  291   1HG   PRO  36          1HG       PRO  36  -2.515   5.633   9.381
  292   2HG   PRO  36          2HG       PRO  36  -2.988   5.417  11.076
  293   1HD   PRO  36          1HD       PRO  36  -4.162   4.056   9.051
  294   2HD   PRO  36          2HD       PRO  36  -5.040   4.526  10.521
  295    H    ILE  37           H        ILE  37  -5.583   9.193   7.624
  296    HA   ILE  37           HA       ILE  37  -4.147   8.629   5.240
  297    HB   ILE  37           HB       ILE  37  -4.792  10.943   4.566
  298   1HG1  ILE  37          1HG1      ILE  37  -6.066  10.992   7.311
  299   2HG1  ILE  37          2HG1      ILE  37  -4.718  11.992   6.779
  300   1HG2  ILE  37          1HG2      ILE  37  -7.358  10.016   5.520
  301   2HG2  ILE  37          2HG2      ILE  37  -6.722  10.079   3.877
  302   3HG2  ILE  37          3HG2      ILE  37  -6.375   8.687   4.903
  303   1HD1  ILE  37          1HD1      ILE  37  -7.604  12.225   6.197
  304   2HD1  ILE  37          2HD1      ILE  37  -6.393  13.476   6.478
  305   3HD1  ILE  37          3HD1      ILE  37  -6.482  12.671   4.912
  306    H    SER  38           H        SER  38  -3.519  10.653   8.044
  307    HA   SER  38           HA       SER  38  -1.343  12.103   6.997
  308   1HB   SER  38          1HB       SER  38  -2.657  12.560   9.146
  309   2HB   SER  38          2HB       SER  38  -1.640  11.332   9.900
  310    HG   SER  38           HG       SER  38  -0.412  13.387   8.451
  311    H    LEU  39           H        LEU  39  -1.640   8.845   8.013
  312    HA   LEU  39           HA       LEU  39   1.119   8.416   8.656
  313   1HB   LEU  39          1HB       LEU  39  -1.177   7.040   9.122
  314   2HB   LEU  39          2HB       LEU  39  -0.481   6.106   7.799
  315    HG   LEU  39           HG       LEU  39   1.342   6.730  10.036
  316   1HD1  LEU  39          1HD1      LEU  39   0.445   4.960  11.449
  317   2HD1  LEU  39          2HD1      LEU  39  -0.919   4.760  10.350
  318   3HD1  LEU  39          3HD1      LEU  39  -0.725   6.264  11.249
  319   1HD2  LEU  39          1HD2      LEU  39   0.752   4.098   8.713
  320   2HD2  LEU  39          2HD2      LEU  39   2.223   4.608   9.541
  321   3HD2  LEU  39          3HD2      LEU  39   1.803   5.307   7.977
  322    H    PHE  40           H        PHE  40  -0.827   8.304   5.775
  323    HA   PHE  40           HA       PHE  40   1.563   7.508   4.248
  324   1HB   PHE  40          1HB       PHE  40  -1.228   6.915   3.299
  325   2HB   PHE  40          2HB       PHE  40   0.289   6.186   2.783
  326    HD1  PHE  40           2HD      PHE  40  -2.274   6.256   5.405
  327    HD2  PHE  40           1HD      PHE  40   1.275   4.375   3.996
  328    HE1  PHE  40           2HE      PHE  40  -2.631   4.406   6.987
  329    HE2  PHE  40           1HE      PHE  40   0.923   2.521   5.575
  330    HZ   PHE  40           HZ       PHE  40  -1.031   2.535   7.074
  331    H    ASP  41           H        ASP  41   2.279   9.189   3.132
  332    HA   ASP  41           HA       ASP  41   0.977  11.583   2.695
  333   1HB   ASP  41          1HB       ASP  41   3.245  10.235   1.252
  334   2HB   ASP  41          2HB       ASP  41   2.648  11.808   0.732
  335    H    TYR  42           H        TYR  42   0.789   8.615   0.883
  336    HA   TYR  42           HA       TYR  42  -1.302   9.818  -0.784
  337   1HB   TYR  42          1HB       TYR  42   0.706   9.813  -2.164
  338   2HB   TYR  42          2HB       TYR  42   0.969   8.107  -1.819
  339    HD1  TYR  42           1HD      TYR  42  -2.305   9.657  -2.570
  340    HD2  TYR  42           2HD      TYR  42   0.892   7.260  -4.032
  341    HE1  TYR  42           1HE      TYR  42  -3.661   9.057  -4.533
  342    HE2  TYR  42           2HE      TYR  42  -0.454   6.654  -5.999
  343    HH   TYR  42           HH       TYR  42  -3.661   8.058  -6.535
  344    H    PHE  43           H        PHE  43  -3.103   8.655  -0.733
  345    HA   PHE  43           HA       PHE  43  -2.917   5.757  -0.286
  346   1HB   PHE  43          1HB       PHE  43  -3.649   7.392   1.727
  347   2HB   PHE  43          2HB       PHE  43  -5.216   7.159   0.958
  348    HD1  PHE  43           1HD      PHE  43  -4.313   4.271  -0.007
  349    HD2  PHE  43           2HD      PHE  43  -4.470   6.278   3.743
  350    HE1  PHE  43           1HE      PHE  43  -4.552   2.106   1.137
  351    HE2  PHE  43           2HE      PHE  43  -4.709   4.116   4.894
  352    HZ   PHE  43           HZ       PHE  43  -4.749   2.027   3.591
  353    H    ILE  44           H        ILE  44  -3.799   4.772  -1.968
  354    HA   ILE  44           HA       ILE  44  -6.313   5.815  -3.065
  355    HB   ILE  44           HB       ILE  44  -4.792   6.610  -4.674
  356   1HG1  ILE  44          1HG1      ILE  44  -5.288   4.051  -6.069
  357   2HG1  ILE  44          2HG1      ILE  44  -6.704   4.807  -5.348
  358   1HG2  ILE  44          1HG2      ILE  44  -2.750   5.630  -4.136
  359   2HG2  ILE  44          2HG2      ILE  44  -3.388   3.993  -4.281
  360   3HG2  ILE  44          3HG2      ILE  44  -3.116   4.965  -5.727
  361   1HD1  ILE  44          1HD1      ILE  44  -5.380   6.870  -6.661
  362   2HD1  ILE  44          2HD1      ILE  44  -5.286   5.486  -7.752
  363   3HD1  ILE  44          3HD1      ILE  44  -6.854   6.046  -7.172
  364    H    VAL  45           H        VAL  45  -7.797   4.281  -2.904
  365    HA   VAL  45           HA       VAL  45  -6.973   1.475  -3.277
  366    HB   VAL  45           HB       VAL  45  -9.344   2.209  -1.599
  367   1HG1  VAL  45          1HG1      VAL  45  -9.458  -0.020  -1.605
  368   2HG1  VAL  45          2HG1      VAL  45  -7.830  -0.183  -2.267
  369   3HG1  VAL  45          3HG1      VAL  45  -8.061   0.016  -0.529
  370   1HG2  VAL  45          1HG2      VAL  45  -6.468   2.441  -0.863
  371   2HG2  VAL  45          2HG2      VAL  45  -7.842   3.429  -0.368
  372   3HG2  VAL  45          3HG2      VAL  45  -7.605   1.832   0.340
  373    H    GLY  46           H        GLY  46  -8.235   0.188  -4.559
  374   1HA   GLY  46          1HA       GLY  46 -10.681   1.384  -5.686
  375   2HA   GLY  46          2HA       GLY  46  -9.440   0.747  -6.756
  376    H    GLU  47           H        GLU  47 -12.332   0.004  -6.085
  377    HA   GLU  47           HA       GLU  47 -11.982  -2.739  -5.156
  378   1HB   GLU  47          1HB       GLU  47 -13.899  -1.077  -4.497
  379   2HB   GLU  47          2HB       GLU  47 -14.612  -1.597  -6.017
  380   1HG   GLU  47          1HG       GLU  47 -13.754  -3.507  -3.863
  381   2HG   GLU  47          2HG       GLU  47 -15.377  -2.829  -3.972
  382    H    GLU  48           H        GLU  48 -12.091  -4.498  -6.429
  383    HA   GLU  48           HA       GLU  48 -12.462  -4.043  -9.308
  384   1HB   GLU  48          1HB       GLU  48 -10.349  -5.170  -8.120
  385   2HB   GLU  48          2HB       GLU  48 -11.351  -6.605  -8.287
  386   1HG   GLU  48          1HG       GLU  48 -10.935  -4.842 -10.649
  387   2HG   GLU  48          2HG       GLU  48  -9.650  -5.939 -10.149
  388    H    GLY  49           H        GLY  49 -14.508  -4.419  -9.892
  389   1HA   GLY  49          1HA       GLY  49 -15.627  -7.055  -9.368
  390   2HA   GLY  49          2HA       GLY  49 -16.540  -5.696  -8.730
  391    H    ASN  50           H        ASN  50 -15.012  -6.770 -11.765
  392    HA   ASN  50           HA       ASN  50 -17.365  -5.714 -13.190
  393   1HB   ASN  50          1HB       ASN  50 -14.729  -4.872 -13.483
  394   2HB   ASN  50          2HB       ASN  50 -14.982  -5.962 -14.844
  395   1HD2  ASN  50          1HD2      ASN  50 -17.077  -3.649 -13.159
  396   2HD2  ASN  50          2HD2      ASN  50 -17.511  -2.754 -14.571
  397    H    GLU  51           H        GLU  51 -16.980  -8.379 -12.111
  398    HA   GLU  51           HA       GLU  51 -17.336  -9.871 -14.600
  399   1HB   GLU  51          1HB       GLU  51 -14.982 -10.198 -13.878
  400   2HB   GLU  51          2HB       GLU  51 -15.566 -10.838 -12.348
  401   1HG   GLU  51          1HG       GLU  51 -15.112 -12.747 -13.552
  402   2HG   GLU  51          2HG       GLU  51 -16.844 -12.538 -13.808
  403    H    GLU  52           H        GLU  52 -19.442 -10.349 -14.359
  404    HA   GLU  52           HA       GLU  52 -20.731 -10.849 -11.906
  405   1HB   GLU  52          1HB       GLU  52 -21.746 -10.203 -14.188
  406   2HB   GLU  52          2HB       GLU  52 -21.699 -11.925 -14.542
  407   1HG   GLU  52          1HG       GLU  52 -23.682 -12.085 -13.579
  408   2HG   GLU  52          2HG       GLU  52 -22.884 -11.766 -12.039
  409    H    GLY  53           H        GLY  53 -21.353 -12.742 -10.892
  410   1HA   GLY  53          1HA       GLY  53 -21.513 -15.071 -10.605
  411   2HA   GLY  53          2HA       GLY  53 -20.498 -15.293 -12.022
  412    H    ARG  54           H        ARG  54 -18.674 -13.156 -10.748
  413    HA   ARG  54           HA       ARG  54 -17.253 -15.051  -9.000
  414   1HB   ARG  54          1HB       ARG  54 -16.168 -14.270 -11.169
  415   2HB   ARG  54          2HB       ARG  54 -16.037 -12.685 -10.419
  416   1HG   ARG  54          1HG       ARG  54 -14.555 -13.480  -8.765
  417   2HG   ARG  54          2HG       ARG  54 -14.895 -15.164  -9.169
  418   1HD   ARG  54          1HD       ARG  54 -13.973 -14.560 -11.498
  419   2HD   ARG  54          2HD       ARG  54 -13.296 -13.141 -10.699
  420    HE   ARG  54           HE       ARG  54 -12.656 -15.576  -9.343
  421   1HH1  ARG  54          1HH1      ARG  54 -11.770 -13.505 -11.997
  422   2HH1  ARG  54          2HH1      ARG  54 -10.121 -14.036 -12.031
  423   1HH2  ARG  54          1HH2      ARG  54 -10.488 -16.283  -9.377
  424   2HH2  ARG  54          2HH2      ARG  54  -9.393 -15.617 -10.541
  425    H    THR  55           H        THR  55 -15.910 -14.044  -7.280
  426    HA   THR  55           HA       THR  55 -17.508 -12.108  -5.831
  427    HB   THR  55           HB       THR  55 -15.282 -12.582  -4.272
  428    HG1  THR  55           1HG      THR  55 -15.388 -15.065  -4.511
  429   1HG2  THR  55          1HG2      THR  55 -16.804 -13.446  -2.837
  430   2HG2  THR  55          2HG2      THR  55 -17.453 -14.566  -4.035
  431   3HG2  THR  55          3HG2      THR  55 -17.959 -12.877  -4.041
  432    HA   PRO  56           HA       PRO  56 -15.075  -8.526  -6.551
  433   1HB   PRO  56          1HB       PRO  56 -15.102  -7.320  -4.119
  434   2HB   PRO  56          2HB       PRO  56 -16.520  -7.391  -5.171
  435   1HG   PRO  56          1HG       PRO  56 -15.823  -9.101  -2.816
  436   2HG   PRO  56          2HG       PRO  56 -17.385  -8.389  -3.258
  437   1HD   PRO  56          1HD       PRO  56 -16.775 -10.982  -3.744
  438   2HD   PRO  56          2HD       PRO  56 -17.840 -10.036  -4.805
  439    H    HIS  57           H        HIS  57 -13.080  -7.429  -6.044
  440    HA   HIS  57           HA       HIS  57 -11.259  -8.846  -4.243
  441   1HB   HIS  57          1HB       HIS  57 -10.838  -9.855  -6.405
  442   2HB   HIS  57          2HB       HIS  57 -10.696  -8.269  -7.158
  443    HD1  HIS  57           1HD      HIS  57  -8.770 -10.829  -5.351
  444    HD2  HIS  57           2HD      HIS  57  -8.303  -6.845  -6.434
  445    HE1  HIS  57           1HE      HIS  57  -6.322 -10.335  -5.056
  446    H    LEU  58           H        LEU  58  -9.786  -7.556  -3.238
  447    HA   LEU  58           HA       LEU  58 -10.098  -4.683  -3.651
  448   1HB   LEU  58          1HB       LEU  58  -9.868  -6.269  -1.392
  449   2HB   LEU  58          2HB       LEU  58  -8.292  -5.491  -1.525
  450    HG   LEU  58           HG       LEU  58 -10.975  -4.144  -1.252
  451   1HD1  LEU  58          1HD1      LEU  58  -8.567  -4.397   0.532
  452   2HD1  LEU  58          2HD1      LEU  58 -10.219  -4.927   0.850
  453   3HD1  LEU  58          3HD1      LEU  58  -9.842  -3.205   0.790
  454   1HD2  LEU  58          1HD2      LEU  58  -8.256  -3.009  -1.856
  455   2HD2  LEU  58          2HD2      LEU  58  -9.561  -2.050  -1.159
  456   3HD2  LEU  58          3HD2      LEU  58  -9.758  -2.783  -2.751
  457    H    GLN  59           H        GLN  59  -8.564  -3.403  -4.488
  458    HA   GLN  59           HA       GLN  59  -5.796  -4.264  -4.585
  459   1HB   GLN  59          1HB       GLN  59  -6.534  -5.277  -6.608
  460   2HB   GLN  59          2HB       GLN  59  -7.472  -3.859  -7.057
  461   1HG   GLN  59          1HG       GLN  59  -5.490  -3.977  -8.406
  462   2HG   GLN  59          2HG       GLN  59  -5.384  -2.589  -7.324
  463   1HE2  GLN  59          1HE2      GLN  59  -3.948  -2.663  -5.572
  464   2HE2  GLN  59          2HE2      GLN  59  -2.624  -3.772  -5.535
  465    H    GLY  60           H        GLY  60  -4.784  -2.550  -3.773
  466   1HA   GLY  60          1HA       GLY  60  -5.175   0.047  -5.033
  467   2HA   GLY  60          2HA       GLY  60  -5.548  -0.042  -3.318
  468    H    PHE  61           H        PHE  61  -3.721   1.723  -3.800
  469    HA   PHE  61           HA       PHE  61  -1.216   0.435  -2.975
  470   1HB   PHE  61          1HB       PHE  61  -0.761   0.918  -5.243
  471   2HB   PHE  61          2HB       PHE  61  -1.575   2.477  -5.159
  472    HD1  PHE  61           2HD      PHE  61   1.159   0.799  -3.246
  473    HD2  PHE  61           1HD      PHE  61  -0.146   4.246  -5.374
  474    HE1  PHE  61           2HE      PHE  61   3.314   1.894  -2.786
  475    HE2  PHE  61           1HE      PHE  61   2.008   5.346  -4.919
  476    HZ   PHE  61           HZ       PHE  61   3.740   4.171  -3.622
  477    H    ALA  62           H        ALA  62  -0.063   1.505  -1.424
  478    HA   ALA  62           HA       ALA  62  -1.026   4.148  -0.577
  479   1HB   ALA  62          1HB       ALA  62  -1.224   1.656   0.906
  480   2HB   ALA  62          2HB       ALA  62  -0.376   2.918   1.801
  481   3HB   ALA  62          3HB       ALA  62  -2.005   3.211   1.193
  482    H    ASN  63           H        ASN  63   0.583   5.552  -0.335
  483    HA   ASN  63           HA       ASN  63   3.328   4.572  -0.347
  484   1HB   ASN  63          1HB       ASN  63   2.600   6.382  -1.912
  485   2HB   ASN  63          2HB       ASN  63   2.332   7.424  -0.517
  486   1HD2  ASN  63          1HD2      ASN  63   4.368   6.981  -2.916
  487   2HD2  ASN  63          2HD2      ASN  63   5.868   7.411  -2.174
  488    H    PHE  64           H        PHE  64   4.294   4.202   1.528
  489    HA   PHE  64           HA       PHE  64   3.339   5.236   4.003
  490   1HB   PHE  64          1HB       PHE  64   5.267   3.279   3.125
  491   2HB   PHE  64          2HB       PHE  64   5.963   4.291   4.386
  492    HD1  PHE  64           2HD      PHE  64   4.532   4.617   6.517
  493    HD2  PHE  64           1HD      PHE  64   3.923   1.490   3.694
  494    HE1  PHE  64           2HE      PHE  64   3.333   3.314   8.224
  495    HE2  PHE  64           1HE      PHE  64   2.722   0.182   5.397
  496    HZ   PHE  64           HZ       PHE  64   2.427   1.093   7.666
  497    H    VAL  65           H        VAL  65   3.902   7.016   5.091
  498    HA   VAL  65           HA       VAL  65   5.350   9.089   3.886
  499    HB   VAL  65           HB       VAL  65   4.597   8.674   6.780
  500   1HG1  VAL  65          1HG1      VAL  65   6.102  10.850   5.437
  501   2HG1  VAL  65          2HG1      VAL  65   4.905  11.308   6.651
  502   3HG1  VAL  65          3HG1      VAL  65   6.232  10.229   7.082
  503   1HG2  VAL  65          1HG2      VAL  65   3.385  10.581   4.798
  504   2HG2  VAL  65          2HG2      VAL  65   2.804   8.926   4.988
  505   3HG2  VAL  65          3HG2      VAL  65   2.734  10.047   6.348
  506    H    LYS  66           H        LYS  66   6.378   6.413   5.815
  507    HA   LYS  66           HA       LYS  66   9.125   7.475   5.776
  508   1HB   LYS  66          1HB       LYS  66   9.471   6.106   7.895
  509   2HB   LYS  66          2HB       LYS  66   8.517   7.575   8.056
  510   1HG   LYS  66          1HG       LYS  66   7.024   5.088   7.505
  511   2HG   LYS  66          2HG       LYS  66   7.781   5.228   9.093
  512   1HD   LYS  66          1HD       LYS  66   6.253   7.567   8.090
  513   2HD   LYS  66          2HD       LYS  66   5.333   6.147   8.594
  514   1HE   LYS  66          1HE       LYS  66   6.074   6.291  10.788
  515   2HE   LYS  66          2HE       LYS  66   7.486   7.252  10.353
  516   1HZ   LYS  66          1HZ       LYS  66   4.932   8.485   9.772
  517   2HZ   LYS  66          2HZ       LYS  66   6.327   9.153  10.454
  518   3HZ   LYS  66          3HZ       LYS  66   5.258   8.266  11.418
  519    H    LYS  67           H        LYS  67  10.573   5.370   6.526
  520    HA   LYS  67           HA       LYS  67  10.123   3.474   4.351
  521   1HB   LYS  67          1HB       LYS  67  12.535   3.639   6.155
  522   2HB   LYS  67          2HB       LYS  67  12.419   2.864   4.581
  523   1HG   LYS  67          1HG       LYS  67  11.716   5.524   4.132
  524   2HG   LYS  67          2HG       LYS  67  13.088   5.582   5.242
  525   1HD   LYS  67          1HD       LYS  67  13.077   3.919   2.732
  526   2HD   LYS  67          2HD       LYS  67  13.654   5.587   2.778
  527   1HE   LYS  67          1HE       LYS  67  15.106   4.719   4.770
  528   2HE   LYS  67          2HE       LYS  67  14.806   3.139   4.047
  529   1HZ   LYS  67          1HZ       LYS  67  16.040   5.472   2.684
  530   2HZ   LYS  67          2HZ       LYS  67  15.721   3.977   1.961
  531   3HZ   LYS  67          3HZ       LYS  67  16.852   4.085   3.214
  532    H    GLN  68           H        GLN  68   9.078   1.652   4.769
  533    HA   GLN  68           HA       GLN  68   9.498   0.359   7.381
  534   1HB   GLN  68          1HB       GLN  68   7.178   1.495   6.836
  535   2HB   GLN  68          2HB       GLN  68   6.911   0.012   5.929
  536   1HG   GLN  68          1HG       GLN  68   6.240  -0.933   7.809
  537   2HG   GLN  68          2HG       GLN  68   7.897  -0.817   8.398
  538   1HE2  GLN  68          1HE2      GLN  68   8.486   1.172   9.523
  539   2HE2  GLN  68          2HE2      GLN  68   7.289   1.976  10.474
  540    H    THR  69           H        THR  69   9.121  -1.982   7.371
  541    HA   THR  69           HA       THR  69  10.106  -3.152   4.877
  542    HB   THR  69           HB       THR  69  10.908  -4.975   6.117
  543    HG1  THR  69           1HG      THR  69  10.210  -4.979   8.506
  544   1HG2  THR  69          1HG2      THR  69  12.160  -3.989   7.992
  545   2HG2  THR  69          2HG2      THR  69  11.128  -2.561   7.919
  546   3HG2  THR  69          3HG2      THR  69  12.191  -2.951   6.568
  547    H    PHE  70           H        PHE  70   9.305  -5.466   4.473
  548    HA   PHE  70           HA       PHE  70   6.562  -5.370   3.875
  549   1HB   PHE  70          1HB       PHE  70   7.874  -6.764   2.502
  550   2HB   PHE  70          2HB       PHE  70   8.589  -7.595   3.879
  551    HD1  PHE  70           1HD      PHE  70   5.251  -7.014   2.320
  552    HD2  PHE  70           2HD      PHE  70   7.825  -9.697   4.393
  553    HE1  PHE  70           1HE      PHE  70   3.557  -8.788   2.121
  554    HE2  PHE  70           2HE      PHE  70   6.136 -11.475   4.196
  555    HZ   PHE  70           HZ       PHE  70   3.999 -11.022   3.058
  556    H    ASN  71           H        ASN  71   8.296  -7.329   6.297
  557    HA   ASN  71           HA       ASN  71   6.025  -8.495   7.451
  558   1HB   ASN  71          1HB       ASN  71   8.855  -8.379   7.996
  559   2HB   ASN  71          2HB       ASN  71   7.944  -8.220   9.495
  560   1HD2  ASN  71          1HD2      ASN  71   8.802 -10.262  10.101
  561   2HD2  ASN  71          2HD2      ASN  71   8.113 -11.722   9.484
  562    H    LYS  72           H        LYS  72   7.763  -5.515   8.234
  563    HA   LYS  72           HA       LYS  72   6.286  -4.867  10.551
  564   1HB   LYS  72          1HB       LYS  72   8.513  -3.867   9.488
  565   2HB   LYS  72          2HB       LYS  72   7.379  -2.695   8.830
  566   1HG   LYS  72          1HG       LYS  72   7.826  -3.331  11.738
  567   2HG   LYS  72          2HG       LYS  72   8.303  -1.861  10.886
  568   1HD   LYS  72          1HD       LYS  72   5.888  -1.448  10.402
  569   2HD   LYS  72          2HD       LYS  72   5.498  -2.825  11.436
  570   1HE   LYS  72          1HE       LYS  72   6.848  -0.250  12.226
  571   2HE   LYS  72          2HE       LYS  72   5.268  -0.837  12.741
  572   1HZ   LYS  72          1HZ       LYS  72   6.750  -1.258  14.503
  573   2HZ   LYS  72          2HZ       LYS  72   7.929  -1.909  13.479
  574   3HZ   LYS  72          3HZ       LYS  72   6.494  -2.758  13.763
  575    H    VAL  73           H        VAL  73   5.955  -3.795   7.175
  576    HA   VAL  73           HA       VAL  73   3.815  -2.062   7.478
  577    HB   VAL  73           HB       VAL  73   4.580  -3.843   5.172
  578   1HG1  VAL  73          1HG1      VAL  73   3.039  -2.246   3.866
  579   2HG1  VAL  73          2HG1      VAL  73   2.301  -3.571   4.769
  580   3HG1  VAL  73          3HG1      VAL  73   2.283  -1.934   5.428
  581   1HG2  VAL  73          1HG2      VAL  73   5.668  -2.013   4.298
  582   2HG2  VAL  73          2HG2      VAL  73   4.667  -0.860   5.181
  583   3HG2  VAL  73          3HG2      VAL  73   5.923  -1.764   6.026
  584    H    LYS  74           H        LYS  74   3.886  -5.519   7.609
  585    HA   LYS  74           HA       LYS  74   1.174  -6.052   7.040
  586   1HB   LYS  74          1HB       LYS  74   3.076  -7.605   8.806
  587   2HB   LYS  74          2HB       LYS  74   1.567  -8.211   8.137
  588   1HG   LYS  74          1HG       LYS  74   2.925  -7.328   5.913
  589   2HG   LYS  74          2HG       LYS  74   4.199  -8.012   6.926
  590   1HD   LYS  74          1HD       LYS  74   3.576  -9.955   5.972
  591   2HD   LYS  74          2HD       LYS  74   2.280  -9.910   7.169
  592   1HE   LYS  74          1HE       LYS  74   0.754  -8.984   5.588
  593   2HE   LYS  74          2HE       LYS  74   2.041  -8.718   4.413
  594   1HZ   LYS  74          1HZ       LYS  74   1.297 -10.656   3.592
  595   2HZ   LYS  74          2HZ       LYS  74   0.585 -11.144   5.046
  596   3HZ   LYS  74          3HZ       LYS  74   2.248 -11.345   4.810
  597    H    TRP  75           H        TRP  75   2.602  -4.457   9.637
  598    HA   TRP  75           HA       TRP  75   0.869  -5.261  11.740
  599   1HB   TRP  75          1HB       TRP  75   1.856  -3.549  13.017
  600   2HB   TRP  75          2HB       TRP  75   3.132  -4.053  11.912
  601    HD1  TRP  75           HD       TRP  75   2.266  -2.380   9.354
  602    HE1  TRP  75           1HE      TRP  75   2.541   0.179   9.360
  603    HE3  TRP  75           3HE      TRP  75   2.405  -1.591  14.403
  604    HZ2  TRP  75           2HZ      TRP  75   2.785   2.257  11.254
  605    HZ3  TRP  75           3HZ      TRP  75   2.662   0.713  15.230
  606    HH2  TRP  75           HH       TRP  75   2.848   2.595  13.686
  607    H    TYR  76           H        TYR  76   0.491  -3.181   9.045
  608    HA   TYR  76           HA       TYR  76  -1.957  -2.040  10.222
  609   1HB   TYR  76          1HB       TYR  76   0.158  -0.896   8.555
  610   2HB   TYR  76          2HB       TYR  76  -1.459  -0.571   7.940
  611    HD1  TYR  76           2HD      TYR  76  -2.961  -0.357  10.502
  612    HD2  TYR  76           1HD      TYR  76   0.840   1.188   9.377
  613    HE1  TYR  76           2HE      TYR  76  -3.222   1.461  12.138
  614    HE2  TYR  76           1HE      TYR  76   0.590   3.009  11.010
  615    HH   TYR  76           HH       TYR  76  -0.625   3.545  12.999
  616    H    LEU  77           H        LEU  77  -0.588  -3.222   7.156
  617    HA   LEU  77           HA       LEU  77  -3.145  -3.465   5.900
  618   1HB   LEU  77          1HB       LEU  77  -0.432  -4.551   5.165
  619   2HB   LEU  77          2HB       LEU  77  -1.866  -4.703   4.151
  620    HG   LEU  77           HG       LEU  77  -0.542  -2.110   4.947
  621   1HD1  LEU  77          1HD1      LEU  77  -0.562  -3.612   2.333
  622   2HD1  LEU  77          2HD1      LEU  77   0.827  -3.360   3.390
  623   3HD1  LEU  77          3HD1      LEU  77   0.081  -1.987   2.573
  624   1HD2  LEU  77          1HD2      LEU  77  -2.898  -2.708   3.164
  625   2HD2  LEU  77          2HD2      LEU  77  -2.068  -1.153   3.232
  626   3HD2  LEU  77          3HD2      LEU  77  -2.899  -1.773   4.660
  627    H    GLY  78           H        GLY  78  -1.512  -5.320   8.183
  628   1HA   GLY  78          1HA       GLY  78  -2.078  -7.318   9.177
  629   2HA   GLY  78          2HA       GLY  78  -3.518  -7.342   8.171
  630    H    ALA  79           H        ALA  79  -2.006  -9.628   8.812
  631    HA   ALA  79           HA       ALA  79  -0.253 -10.295   6.649
  632   1HB   ALA  79          1HB       ALA  79  -0.921 -12.694   7.737
  633   2HB   ALA  79          2HB       ALA  79   0.358 -11.638   8.340
  634   3HB   ALA  79          3HB       ALA  79  -1.241 -11.599   9.083
  635    H    ARG  80           H        ARG  80  -3.648 -10.845   7.398
  636    HA   ARG  80           HA       ARG  80  -4.285 -12.781   5.527
  637   1HB   ARG  80          1HB       ARG  80  -6.579 -11.737   5.533
  638   2HB   ARG  80          2HB       ARG  80  -5.932 -12.130   7.120
  639   1HG   ARG  80          1HG       ARG  80  -5.319  -9.796   7.461
  640   2HG   ARG  80          2HG       ARG  80  -5.944  -9.396   5.860
  641   1HD   ARG  80          1HD       ARG  80  -7.490  -8.906   7.786
  642   2HD   ARG  80          2HD       ARG  80  -8.167  -9.907   6.502
  643    HE   ARG  80           HE       ARG  80  -8.337 -11.644   7.988
  644   1HH1  ARG  80          1HH1      ARG  80  -6.281  -9.176   9.331
  645   2HH1  ARG  80          2HH1      ARG  80  -6.199  -9.913  10.896
  646   1HH2  ARG  80          1HH2      ARG  80  -8.237 -12.624  10.045
  647   2HH2  ARG  80          2HH2      ARG  80  -7.311 -11.875  11.301
  648    H    CYS  81           H        CYS  81  -3.966  -9.290   5.105
  649    HA   CYS  81           HA       CYS  81  -4.747  -9.408   2.327
  650   1HB   CYS  81          1HB       CYS  81  -5.025  -7.443   4.057
  651   2HB   CYS  81          2HB       CYS  81  -3.396  -7.028   3.539
  652    HG   CYS  81           HG       CYS  81  -5.725  -5.657   2.259
  653    H    HIS  82           H        HIS  82  -3.445  -9.659   0.626
  654    HA   HIS  82           HA       HIS  82  -0.688 -10.290   1.011
  655   1HB   HIS  82          1HB       HIS  82  -2.309 -11.229  -0.761
  656   2HB   HIS  82          2HB       HIS  82  -1.963  -9.756  -1.663
  657    HD1  HIS  82           1HD      HIS  82   0.165 -12.406   0.070
  658    HD2  HIS  82           2HD      HIS  82   0.003 -10.199  -3.446
  659    HE1  HIS  82           1HE      HIS  82   2.146 -13.156  -1.286
  660    H    ILE  83           H        ILE  83   1.019  -8.985   0.963
  661    HA   ILE  83           HA       ILE  83   0.651  -6.256  -0.086
  662    HB   ILE  83           HB       ILE  83   2.868  -6.953   1.795
  663   1HG1  ILE  83          1HG1      ILE  83   0.004  -6.380   2.583
  664   2HG1  ILE  83          2HG1      ILE  83   0.904  -7.859   2.899
  665   1HG2  ILE  83          1HG2      ILE  83   2.811  -4.761   0.693
  666   2HG2  ILE  83          2HG2      ILE  83   1.223  -4.458   1.397
  667   3HG2  ILE  83          3HG2      ILE  83   2.633  -4.622   2.442
  668   1HD1  ILE  83          1HD1      ILE  83   0.959  -6.745   4.924
  669   2HD1  ILE  83          2HD1      ILE  83   2.515  -6.335   4.202
  670   3HD1  ILE  83          3HD1      ILE  83   1.191  -5.170   4.166
  671    H    GLU  84           H        GLU  84   2.112  -5.412  -1.509
  672    HA   GLU  84           HA       GLU  84   4.502  -6.940  -2.183
  673   1HB   GLU  84          1HB       GLU  84   2.212  -6.423  -4.058
  674   2HB   GLU  84          2HB       GLU  84   3.851  -6.601  -4.669
  675   1HG   GLU  84          1HG       GLU  84   3.691  -8.781  -3.099
  676   2HG   GLU  84          2HG       GLU  84   2.004  -8.614  -3.583
  677    H    LYS  85           H        LYS  85   5.905  -5.736  -3.733
  678    HA   LYS  85           HA       LYS  85   6.011  -2.956  -2.945
  679   1HB   LYS  85          1HB       LYS  85   7.986  -4.638  -3.199
  680   2HB   LYS  85          2HB       LYS  85   7.890  -4.230  -4.907
  681   1HG   LYS  85          1HG       LYS  85   8.408  -1.960  -4.490
  682   2HG   LYS  85          2HG       LYS  85   8.186  -2.159  -2.750
  683   1HD   LYS  85          1HD       LYS  85  10.431  -2.359  -2.740
  684   2HD   LYS  85          2HD       LYS  85  10.091  -4.021  -3.229
  685   1HE   LYS  85          1HE       LYS  85  10.205  -3.202  -5.618
  686   2HE   LYS  85          2HE       LYS  85  10.842  -1.688  -4.978
  687   1HZ   LYS  85          1HZ       LYS  85  12.353  -3.643  -3.796
  688   2HZ   LYS  85          2HZ       LYS  85  12.827  -2.645  -5.076
  689   3HZ   LYS  85          3HZ       LYS  85  12.174  -4.173  -5.393
  690    H    ALA  86           H        ALA  86   5.495  -1.231  -4.156
  691    HA   ALA  86           HA       ALA  86   4.222  -1.701  -6.724
  692   1HB   ALA  86          1HB       ALA  86   4.263   1.058  -6.134
  693   2HB   ALA  86          2HB       ALA  86   2.904  -0.061  -6.023
  694   3HB   ALA  86          3HB       ALA  86   3.940   0.207  -4.622
  695    H    LYS  87           H        LYS  87   4.713  -0.378  -8.599
  696    HA   LYS  87           HA       LYS  87   7.377   0.812  -8.675
  697   1HB   LYS  87          1HB       LYS  87   8.145  -0.492 -10.512
  698   2HB   LYS  87          2HB       LYS  87   7.563  -1.625  -9.299
  699   1HG   LYS  87          1HG       LYS  87   5.497  -1.926 -10.533
  700   2HG   LYS  87          2HG       LYS  87   6.018  -0.735 -11.727
  701   1HD   LYS  87          1HD       LYS  87   7.632  -3.198 -11.127
  702   2HD   LYS  87          2HD       LYS  87   6.325  -3.205 -12.313
  703   1HE   LYS  87          1HE       LYS  87   7.651  -2.282 -13.838
  704   2HE   LYS  87          2HE       LYS  87   8.011  -0.935 -12.759
  705   1HZ   LYS  87          1HZ       LYS  87   9.693  -2.424 -11.695
  706   2HZ   LYS  87          2HZ       LYS  87  10.051  -1.973 -13.285
  707   3HZ   LYS  87          3HZ       LYS  87   9.448  -3.520 -12.961
  708    H    GLY  88           H        GLY  88   7.619   2.413 -10.206
  709   1HA   GLY  88          1HA       GLY  88   6.876   3.377 -12.344
  710   2HA   GLY  88          2HA       GLY  88   5.235   2.983 -11.856
  711    H    THR  89           H        THR  89   5.185   5.386 -12.519
  712    HA   THR  89           HA       THR  89   6.078   7.179 -10.405
  713    HB   THR  89           HB       THR  89   5.411   8.993 -11.827
  714    HG1  THR  89           1HG      THR  89   4.024   8.758 -13.461
  715   1HG2  THR  89          1HG2      THR  89   6.550   6.950 -13.719
  716   2HG2  THR  89          2HG2      THR  89   7.494   7.625 -12.392
  717   3HG2  THR  89          3HG2      THR  89   6.865   8.683 -13.654
  718    H    ASP  90           H        ASP  90   4.401   8.983  -9.870
  719    HA   ASP  90           HA       ASP  90   2.392   7.883  -8.305
  720   1HB   ASP  90          1HB       ASP  90   1.450  10.217  -8.243
  721   2HB   ASP  90          2HB       ASP  90   3.162  10.102  -7.842
  722    H    GLN  91           H        GLN  91   2.243   9.132 -11.604
  723    HA   GLN  91           HA       GLN  91  -0.574   8.919 -11.872
  724   1HB   GLN  91          1HB       GLN  91   0.975  10.313 -13.305
  725   2HB   GLN  91          2HB       GLN  91   1.453   8.822 -14.105
  726   1HG   GLN  91          1HG       GLN  91  -0.174   9.771 -15.489
  727   2HG   GLN  91          2HG       GLN  91  -1.002   8.478 -14.622
  728   1HE2  GLN  91          1HE2      GLN  91  -2.864   8.968 -13.712
  729   2HE2  GLN  91          2HE2      GLN  91  -3.423  10.558 -13.333
  730    H    GLN  92           H        GLN  92   2.106   6.731 -12.483
  731    HA   GLN  92           HA       GLN  92   0.636   4.769 -13.896
  732   1HB   GLN  92          1HB       GLN  92   3.289   4.933 -12.590
  733   2HB   GLN  92          2HB       GLN  92   2.626   3.318 -12.800
  734   1HG   GLN  92          1HG       GLN  92   2.206   4.478 -15.253
  735   2HG   GLN  92          2HG       GLN  92   3.760   5.145 -14.756
  736   1HE2  GLN  92          1HE2      GLN  92   5.531   3.863 -14.739
  737   2HE2  GLN  92          2HE2      GLN  92   5.537   2.212 -15.246
  738    H    ASN  93           H        ASN  93   1.277   5.309 -10.479
  739    HA   ASN  93           HA       ASN  93   0.097   2.826  -9.644
  740   1HB   ASN  93          1HB       ASN  93   1.074   5.280  -8.204
  741   2HB   ASN  93          2HB       ASN  93   0.194   4.018  -7.348
  742   1HD2  ASN  93          1HD2      ASN  93   2.558   3.788  -9.966
  743   2HD2  ASN  93          2HD2      ASN  93   3.697   2.830  -9.089
  744    H    LYS  94           H        LYS  94  -0.900   6.232  -9.634
  745    HA   LYS  94           HA       LYS  94  -3.395   5.864  -8.399
  746   1HB   LYS  94          1HB       LYS  94  -2.291   8.061  -8.696
  747   2HB   LYS  94          2HB       LYS  94  -2.610   7.969 -10.423
  748   1HG   LYS  94          1HG       LYS  94  -4.972   8.078 -10.059
  749   2HG   LYS  94          2HG       LYS  94  -4.755   7.948  -8.312
  750   1HD   LYS  94          1HD       LYS  94  -4.158  10.123  -8.091
  751   2HD   LYS  94          2HD       LYS  94  -3.320  10.161  -9.645
  752   1HE   LYS  94          1HE       LYS  94  -5.708   9.983 -10.645
  753   2HE   LYS  94          2HE       LYS  94  -6.232  10.524  -9.050
  754   1HZ   LYS  94          1HZ       LYS  94  -5.917  12.349 -10.657
  755   2HZ   LYS  94          2HZ       LYS  94  -4.271  11.971 -10.746
  756   3HZ   LYS  94          3HZ       LYS  94  -4.938  12.507  -9.286
  757    H    GLU  95           H        GLU  95  -2.458   5.858 -11.818
  758    HA   GLU  95           HA       GLU  95  -5.104   5.485 -12.799
  759   1HB   GLU  95          1HB       GLU  95  -2.969   6.340 -14.026
  760   2HB   GLU  95          2HB       GLU  95  -2.655   4.634 -14.308
  761   1HG   GLU  95          1HG       GLU  95  -5.374   5.486 -14.972
  762   2HG   GLU  95          2HG       GLU  95  -4.110   6.249 -15.935
  763    H    TYR  96           H        TYR  96  -2.483   3.324 -11.901
  764    HA   TYR  96           HA       TYR  96  -3.431   0.948 -13.006
  765   1HB   TYR  96          1HB       TYR  96  -1.206   1.075 -12.076
  766   2HB   TYR  96          2HB       TYR  96  -1.848   1.417 -10.473
  767    HD1  TYR  96           1HD      TYR  96  -2.958  -0.366  -9.176
  768    HD2  TYR  96           2HD      TYR  96  -1.106  -1.165 -12.922
  769    HE1  TYR  96           1HE      TYR  96  -2.975  -2.772  -8.664
  770    HE2  TYR  96           2HE      TYR  96  -1.119  -3.573 -12.422
  771    HH   TYR  96           HH       TYR  96  -1.151  -4.979 -10.150
  772    H    CYS  97           H        CYS  97  -4.056   2.354  -9.802
  773    HA   CYS  97           HA       CYS  97  -5.767   0.270  -8.931
  774   1HB   CYS  97          1HB       CYS  97  -5.628   3.140  -7.982
  775   2HB   CYS  97          2HB       CYS  97  -6.394   1.808  -7.125
  776    HG   CYS  97           HG       CYS  97  -3.821   0.411  -7.030
  777    H    SER  98           H        SER  98  -6.295   3.279 -10.655
  778    HA   SER  98           HA       SER  98  -9.158   3.160 -10.456
  779   1HB   SER  98          1HB       SER  98  -7.643   5.245 -10.821
  780   2HB   SER  98          2HB       SER  98  -7.686   4.775 -12.520
  781    HG   SER  98           HG       SER  98  -9.483   5.875 -12.506
  782    H    LYS  99           H        LYS  99  -6.852   1.577 -12.334
  783    HA   LYS  99           HA       LYS  99  -8.071   1.350 -14.830
  784   1HB   LYS  99          1HB       LYS  99  -5.792   0.572 -14.371
  785   2HB   LYS  99          2HB       LYS  99  -6.425  -0.708 -13.345
  786   1HG   LYS  99          1HG       LYS  99  -7.587  -1.654 -15.312
  787   2HG   LYS  99          2HG       LYS  99  -6.823  -0.419 -16.315
  788   1HD   LYS  99          1HD       LYS  99  -5.571  -2.489 -16.458
  789   2HD   LYS  99          2HD       LYS  99  -4.611  -1.265 -15.623
  790   1HE   LYS  99          1HE       LYS  99  -4.571  -2.437 -13.713
  791   2HE   LYS  99          2HE       LYS  99  -6.274  -2.878 -13.840
  792   1HZ   LYS  99          1HZ       LYS  99  -3.962  -4.212 -15.130
  793   2HZ   LYS  99          2HZ       LYS  99  -5.567  -4.534 -15.555
  794   3HZ   LYS  99          3HZ       LYS  99  -5.025  -4.862 -13.986
  795    H    GLU 100           H        GLU 100  -8.948  -0.010 -11.789
  796    HA   GLU 100           HA       GLU 100 -10.479  -2.201 -12.788
  797   1HB   GLU 100          1HB       GLU 100 -10.890  -0.833 -10.135
  798   2HB   GLU 100          2HB       GLU 100 -11.225  -2.507 -10.555
  799   1HG   GLU 100          1HG       GLU 100  -8.617  -2.513 -11.028
  800   2HG   GLU 100          2HG       GLU 100  -8.663  -1.200  -9.853
  801    H    GLY 101           H        GLY 101 -11.017   1.172 -12.532
  802   1HA   GLY 101          1HA       GLY 101 -12.786   2.369 -13.464
  803   2HA   GLY 101          2HA       GLY 101 -13.663   0.861 -13.674
  804    H    ASN 102           H        ASN 102 -12.650   0.720 -10.597
  805    HA   ASN 102           HA       ASN 102 -14.907   2.270  -9.529
  806   1HB   ASN 102          1HB       ASN 102 -14.836  -0.527  -9.711
  807   2HB   ASN 102          2HB       ASN 102 -14.483  -0.166  -8.024
  808   1HD2  ASN 102          1HD2      ASN 102 -16.190  -0.078  -6.776
  809   2HD2  ASN 102          2HD2      ASN 102 -17.785   0.386  -7.252
  810    H    LEU 103           H        LEU 103 -14.302   3.582  -7.945
  811    HA   LEU 103           HA       LEU 103 -11.704   3.150  -6.667
  812   1HB   LEU 103          1HB       LEU 103 -13.143   5.437  -7.566
  813   2HB   LEU 103          2HB       LEU 103 -12.893   5.583  -5.827
  814    HG   LEU 103           HG       LEU 103 -11.152   6.690  -7.229
  815   1HD1  LEU 103          1HD1      LEU 103  -9.304   5.056  -5.998
  816   2HD1  LEU 103          2HD1      LEU 103 -10.763   4.830  -5.034
  817   3HD1  LEU 103          3HD1      LEU 103 -10.109   6.449  -5.277
  818   1HD2  LEU 103          1HD2      LEU 103 -10.060   5.625  -8.848
  819   2HD2  LEU 103          2HD2      LEU 103 -11.226   4.315  -8.661
  820   3HD2  LEU 103          3HD2      LEU 103  -9.690   4.258  -7.795
  821    H    LEU 104           H        LEU 104 -11.466   2.744  -4.538
  822    HA   LEU 104           HA       LEU 104 -13.921   2.359  -2.978
  823   1HB   LEU 104          1HB       LEU 104 -12.019   0.580  -3.399
  824   2HB   LEU 104          2HB       LEU 104 -11.257   1.412  -2.045
  825    HG   LEU 104           HG       LEU 104 -12.464  -0.591  -1.328
  826   1HD1  LEU 104          1HD1      LEU 104 -12.487   1.857  -0.146
  827   2HD1  LEU 104          2HD1      LEU 104 -13.077   0.372   0.599
  828   3HD1  LEU 104          3HD1      LEU 104 -14.207   1.471  -0.192
  829   1HD2  LEU 104          1HD2      LEU 104 -14.413  -1.137  -2.233
  830   2HD2  LEU 104          2HD2      LEU 104 -14.440   0.383  -3.127
  831   3HD2  LEU 104          3HD2      LEU 104 -15.148   0.295  -1.514
  832    H    MET 105           H        MET 105 -10.823   4.008  -2.969
  833    HA   MET 105           HA       MET 105 -11.802   5.921  -1.057
  834   1HB   MET 105          1HB       MET 105 -11.079   4.563   0.660
  835   2HB   MET 105          2HB       MET 105  -9.786   3.856  -0.299
  836   1HG   MET 105          1HG       MET 105  -8.319   5.518   0.191
  837   2HG   MET 105          2HG       MET 105  -9.582   6.734   0.365
  838   1HE   MET 105          1HE       MET 105  -7.337   4.692   3.559
  839   2HE   MET 105          2HE       MET 105  -7.985   3.504   2.428
  840   3HE   MET 105          3HE       MET 105  -7.019   4.854   1.832
  841    H    GLU 106           H        GLU 106 -10.833   7.871  -1.305
  842    HA   GLU 106           HA       GLU 106  -8.378   7.984  -2.922
  843   1HB   GLU 106          1HB       GLU 106 -10.425   8.513  -4.273
  844   2HB   GLU 106          2HB       GLU 106 -10.707   9.885  -3.210
  845   1HG   GLU 106          1HG       GLU 106  -8.091  10.222  -3.997
  846   2HG   GLU 106          2HG       GLU 106  -8.882   9.604  -5.446
  847    H    CYS 107           H        CYS 107  -6.896   8.673  -1.508
  848    HA   CYS 107           HA       CYS 107  -7.363  11.228  -0.173
  849   1HB   CYS 107          1HB       CYS 107  -6.412   8.734   1.249
  850   2HB   CYS 107          2HB       CYS 107  -6.371  10.352   1.938
  851    HG   CYS 107           HG       CYS 107  -8.504   8.863   3.038
  852    H    GLY 108           H        GLY 108  -5.190  11.869   0.999
  853   1HA   GLY 108          1HA       GLY 108  -2.989  12.472   0.751
  854   2HA   GLY 108          2HA       GLY 108  -2.739  10.894   0.020
  855    H    ALA 109           H        ALA 109  -1.160  12.471  -1.123
  856    HA   ALA 109           HA       ALA 109  -2.506  13.666  -3.454
  857   1HB   ALA 109          1HB       ALA 109  -0.581  14.737  -1.735
  858   2HB   ALA 109          2HB       ALA 109   0.272  14.385  -3.238
  859   3HB   ALA 109          3HB       ALA 109  -1.156  15.419  -3.256
  860    HA   PRO 110           HA       PRO 110  -0.719  10.720  -6.174
  861   1HB   PRO 110          1HB       PRO 110  -0.278  12.231  -8.386
  862   2HB   PRO 110          2HB       PRO 110  -1.894  11.740  -7.864
  863   1HG   PRO 110          1HG       PRO 110  -0.481  14.346  -7.451
  864   2HG   PRO 110          2HG       PRO 110  -2.168  14.049  -7.910
  865   1HD   PRO 110          1HD       PRO 110  -1.437  14.676  -5.380
  866   2HD   PRO 110          2HD       PRO 110  -2.815  13.616  -5.741
  867    H    ARG 111           H        ARG 111   1.224  10.674  -4.702
  868    HA   ARG 111           HA       ARG 111   3.576  11.766  -6.104
  869   1HB   ARG 111          1HB       ARG 111   4.693  12.095  -4.041
  870   2HB   ARG 111          2HB       ARG 111   3.079  12.760  -3.825
  871   1HG   ARG 111          1HG       ARG 111   2.390  10.782  -2.614
  872   2HG   ARG 111          2HG       ARG 111   3.966  10.038  -2.893
  873   1HD   ARG 111          1HD       ARG 111   3.319  12.449  -1.214
  874   2HD   ARG 111          2HD       ARG 111   4.003  10.912  -0.688
  875    HE   ARG 111           HE       ARG 111   5.847  11.828  -2.434
  876   1HH1  ARG 111          1HH1      ARG 111   4.267  13.251   0.323
  877   2HH1  ARG 111          2HH1      ARG 111   5.608  14.269   0.730
  878   1HH2  ARG 111          1HH2      ARG 111   7.619  13.164  -1.908
  879   2HH2  ARG 111          2HH2      ARG 111   7.514  14.219  -0.540
  880    H    SER 112           H        SER 112   5.488  10.469  -6.071
  881    HA   SER 112           HA       SER 112   5.226   7.702  -5.204
  882   1HB   SER 112          1HB       SER 112   5.776   6.772  -7.383
  883   2HB   SER 112          2HB       SER 112   4.318   7.756  -7.520
  884    HG   SER 112           HG       SER 112   6.867   8.185  -8.550
  885    H    GLN 113           H        GLN 113   6.868  10.068  -4.533
  886    HA   GLN 113           HA       GLN 113   9.359   8.761  -4.249
  887   1HB   GLN 113          1HB       GLN 113   9.373   9.506  -6.698
  888   2HB   GLN 113          2HB       GLN 113   9.485  11.149  -6.080
  889   1HG   GLN 113          1HG       GLN 113  11.433   9.115  -5.122
  890   2HG   GLN 113          2HG       GLN 113  11.628   9.800  -6.734
  891   1HE2  GLN 113          1HE2      GLN 113  13.660  10.324  -5.278
  892   2HE2  GLN 113          2HE2      GLN 113  13.646  11.917  -4.611
  893    H    GLY 114           H        GLY 114  10.769   9.859  -2.852
  894   1HA   GLY 114          1HA       GLY 114   9.950  12.512  -1.919
  895   2HA   GLY 114          2HA       GLY 114   9.950  11.201  -0.747
  896    H    GLN 115           H        GLN 115  11.533  13.640  -0.738
  897    HA   GLN 115           HA       GLN 115  14.189  13.148  -1.538
  898   1HB   GLN 115          1HB       GLN 115  12.881  15.045   0.370
  899   2HB   GLN 115          2HB       GLN 115  14.634  14.900   0.371
  900   1HG   GLN 115          1HG       GLN 115  13.698  15.170  -2.317
  901   2HG   GLN 115          2HG       GLN 115  13.025  16.458  -1.319
  902   1HE2  GLN 115          1HE2      GLN 115  15.147  16.346  -3.453
  903   2HE2  GLN 115          2HE2      GLN 115  16.503  17.152  -2.750
  904    H    ARG 116           H        ARG 116  13.151  13.416   1.853
  905    HA   ARG 116           HA       ARG 116  15.025  11.237   2.495
  906   1HB   ARG 116          1HB       ARG 116  14.003  13.358   4.386
  907   2HB   ARG 116          2HB       ARG 116  15.314  12.219   4.665
  908   1HG   ARG 116          1HG       ARG 116  16.708  13.321   3.074
  909   2HG   ARG 116          2HG       ARG 116  15.374  14.345   2.538
  910   1HD   ARG 116          1HD       ARG 116  16.435  15.793   3.951
  911   2HD   ARG 116          2HD       ARG 116  15.326  15.023   5.085
  912    HE   ARG 116           HE       ARG 116  17.638  13.518   5.131
  913   1HH1  ARG 116          1HH1      ARG 116  16.727  16.810   5.810
  914   2HH1  ARG 116          2HH1      ARG 116  17.957  17.040   7.008
  915   1HH2  ARG 116          1HH2      ARG 116  19.261  13.810   6.708
  916   2HH2  ARG 116          2HH2      ARG 116  19.398  15.333   7.518
  Start of MODEL   29
    1    HA   PRO   2           HA       PRO   2  34.079  -0.610  18.279
    2   1HB   PRO   2          1HB       PRO   2  31.882  -2.034  18.996
    3   2HB   PRO   2          2HB       PRO   2  33.517  -2.467  19.510
    4   1HG   PRO   2          1HG       PRO   2  31.388  -0.989  21.010
    5   2HG   PRO   2          2HG       PRO   2  32.481  -2.263  21.582
    6   1HD   PRO   2          1HD       PRO   2  32.914   0.362  22.086
    7   2HD   PRO   2          2HD       PRO   2  34.238  -0.800  21.872
    8    H    SER   3           H        SER   3  31.867  -1.212  17.031
    9    HA   SER   3           HA       SER   3  30.184   1.201  16.984
   10   1HB   SER   3          1HB       SER   3  30.622  -0.056  14.363
   11   2HB   SER   3          2HB       SER   3  30.623   1.650  14.811
   12    HG   SER   3           HG       SER   3  32.739   1.425  15.527
   13    H    LYS   4           H        LYS   4  28.133   0.855  15.752
   14    HA   LYS   4           HA       LYS   4  27.231  -1.931  15.734
   15   1HB   LYS   4          1HB       LYS   4  25.876   0.325  17.218
   16   2HB   LYS   4          2HB       LYS   4  25.110  -1.221  16.875
   17   1HG   LYS   4          1HG       LYS   4  26.208  -2.270  18.519
   18   2HG   LYS   4          2HG       LYS   4  27.723  -1.430  18.181
   19   1HD   LYS   4          1HD       LYS   4  26.575   0.623  19.221
   20   2HD   LYS   4          2HD       LYS   4  25.404  -0.532  19.863
   21   1HE   LYS   4          1HE       LYS   4  27.613  -1.779  20.625
   22   2HE   LYS   4          2HE       LYS   4  28.274  -0.148  20.539
   23   1HZ   LYS   4          1HZ       LYS   4  27.387   0.241  22.513
   24   2HZ   LYS   4          2HZ       LYS   4  26.661  -1.287  22.546
   25   3HZ   LYS   4          3HZ       LYS   4  25.839   0.025  21.865
   26    H    LYS   5           H        LYS   5  27.803  -0.753  13.445
   27    HA   LYS   5           HA       LYS   5  25.185   0.033  12.343
   28   1HB   LYS   5          1HB       LYS   5  27.921   1.139  11.809
   29   2HB   LYS   5          2HB       LYS   5  26.692   1.200  10.553
   30   1HG   LYS   5          1HG       LYS   5  26.320   3.216  11.516
   31   2HG   LYS   5          2HG       LYS   5  25.257   2.233  12.527
   32   1HD   LYS   5          1HD       LYS   5  26.650   2.349  14.341
   33   2HD   LYS   5          2HD       LYS   5  28.100   2.540  13.352
   34   1HE   LYS   5          1HE       LYS   5  26.187   4.743  13.114
   35   2HE   LYS   5          2HE       LYS   5  26.851   4.542  14.734
   36   1HZ   LYS   5          1HZ       LYS   5  28.170   6.045  13.330
   37   2HZ   LYS   5          2HZ       LYS   5  28.480   4.771  12.262
   38   3HZ   LYS   5          3HZ       LYS   5  29.062   4.704  13.849
   39    H    ASN   6           H        ASN   6  25.157  -2.424  12.191
   40    HA   ASN   6           HA       ASN   6  26.207  -3.181   9.554
   41   1HB   ASN   6          1HB       ASN   6  26.819  -4.406  12.129
   42   2HB   ASN   6          2HB       ASN   6  26.160  -5.564  10.977
   43   1HD2  ASN   6          1HD2      ASN   6  27.444  -6.346   9.437
   44   2HD2  ASN   6          2HD2      ASN   6  29.050  -5.799   9.110
   45    H    GLY   7           H        GLY   7  24.682  -3.936   8.234
   46   1HA   GLY   7          1HA       GLY   7  22.799  -5.781   8.457
   47   2HA   GLY   7          2HA       GLY   7  22.029  -4.467   9.333
   48    H    ARG   8           H        ARG   8  22.527  -5.872   6.316
   49    HA   ARG   8           HA       ARG   8  21.119  -3.656   5.030
   50   1HB   ARG   8          1HB       ARG   8  23.676  -4.891   4.000
   51   2HB   ARG   8          2HB       ARG   8  22.614  -3.884   3.025
   52   1HG   ARG   8          1HG       ARG   8  22.939  -2.169   4.968
   53   2HG   ARG   8          2HG       ARG   8  24.383  -3.129   5.298
   54   1HD   ARG   8          1HD       ARG   8  25.243  -2.719   3.110
   55   2HD   ARG   8          2HD       ARG   8  23.727  -1.985   2.591
   56    HE   ARG   8           HE       ARG   8  24.609  -0.478   4.724
   57   1HH1  ARG   8          1HH1      ARG   8  25.793  -1.353   1.569
   58   2HH1  ARG   8          2HH1      ARG   8  26.699   0.110   1.360
   59   1HH2  ARG   8          1HH2      ARG   8  25.797   1.452   4.460
   60   2HH2  ARG   8          2HH2      ARG   8  26.701   1.704   3.006
   61    H    SER   9           H        SER   9  22.625  -6.756   4.099
   62    HA   SER   9           HA       SER   9  21.801  -8.587   3.030
   63   1HB   SER   9          1HB       SER   9  20.148  -8.229   5.099
   64   2HB   SER   9          2HB       SER   9  18.991  -7.961   3.796
   65    HG   SER   9           HG       SER   9  19.923 -10.269   4.713
   66    H    GLY  10           H        GLY  10  19.725  -9.237   1.543
   67   1HA   GLY  10          1HA       GLY  10  19.983  -7.552  -0.747
   68   2HA   GLY  10          2HA       GLY  10  18.953  -8.969  -0.611
   69    HA   PRO  11           HA       PRO  11  15.342  -6.516  -0.274
   70   1HB   PRO  11          1HB       PRO  11  13.951  -7.636   1.771
   71   2HB   PRO  11          2HB       PRO  11  14.148  -8.421   0.200
   72   1HG   PRO  11          1HG       PRO  11  15.647  -8.883   2.750
   73   2HG   PRO  11          2HG       PRO  11  15.021 -10.069   1.590
   74   1HD   PRO  11          1HD       PRO  11  17.624  -9.324   1.651
   75   2HD   PRO  11          2HD       PRO  11  16.797  -9.783   0.148
   76    H    GLN  12           H        GLN  12  14.916  -4.547   0.507
   77    HA   GLN  12           HA       GLN  12  15.550  -3.967   3.318
   78   1HB   GLN  12          1HB       GLN  12  16.224  -1.634   2.440
   79   2HB   GLN  12          2HB       GLN  12  17.370  -2.957   2.267
   80   1HG   GLN  12          1HG       GLN  12  17.049  -3.113  -0.016
   81   2HG   GLN  12          2HG       GLN  12  15.482  -2.307   0.047
   82   1HE2  GLN  12          1HE2      GLN  12  18.940  -1.772   0.505
   83   2HE2  GLN  12          2HE2      GLN  12  18.931  -0.116   0.011
   84    HA   PRO  13           HA       PRO  13  11.604  -2.069   3.576
   85   1HB   PRO  13          1HB       PRO  13  12.082  -0.017   5.289
   86   2HB   PRO  13          2HB       PRO  13  12.041  -1.708   5.803
   87   1HG   PRO  13          1HG       PRO  13  14.401   0.031   5.193
   88   2HG   PRO  13          2HG       PRO  13  14.170  -1.115   6.527
   89   1HD   PRO  13          1HD       PRO  13  15.620  -1.720   4.321
   90   2HD   PRO  13          2HD       PRO  13  14.690  -2.939   5.217
   91    H    HIS  14           H        HIS  14  10.358  -0.430   2.722
   92    HA   HIS  14           HA       HIS  14  11.737   1.882   1.558
   93   1HB   HIS  14          1HB       HIS  14   9.829   0.052   0.091
   94   2HB   HIS  14          2HB       HIS  14  10.356   1.620  -0.513
   95    HD1  HIS  14           1HD      HIS  14  11.485  -1.896  -0.055
   96    HD2  HIS  14           2HD      HIS  14  13.025   1.713  -1.422
   97    HE1  HIS  14           1HE      HIS  14  13.628  -2.482  -1.233
   98    H    LYS  15           H        LYS  15   9.913   3.374   0.541
   99    HA   LYS  15           HA       LYS  15   7.951   3.762   2.689
  100   1HB   LYS  15          1HB       LYS  15   7.758   6.079   1.699
  101   2HB   LYS  15          2HB       LYS  15   9.317   5.687   2.412
  102   1HG   LYS  15          1HG       LYS  15   9.317   4.988  -0.367
  103   2HG   LYS  15          2HG       LYS  15   8.797   6.662  -0.162
  104   1HD   LYS  15          1HD       LYS  15  11.098   5.885   1.487
  105   2HD   LYS  15          2HD       LYS  15  11.392   5.837  -0.253
  106   1HE   LYS  15          1HE       LYS  15  11.272   8.078  -0.461
  107   2HE   LYS  15          2HE       LYS  15   9.961   8.219   0.708
  108   1HZ   LYS  15          1HZ       LYS  15  12.859   8.231   1.156
  109   2HZ   LYS  15          2HZ       LYS  15  11.858   7.621   2.376
  110   3HZ   LYS  15          3HZ       LYS  15  11.660   9.212   1.837
  111    H    ARG  16           H        ARG  16   7.903   2.070   0.061
  112    HA   ARG  16           HA       ARG  16   5.167   2.865  -0.653
  113   1HB   ARG  16          1HB       ARG  16   7.105   1.849  -2.720
  114   2HB   ARG  16          2HB       ARG  16   5.549   2.630  -2.970
  115   1HG   ARG  16          1HG       ARG  16   6.911   4.566  -1.636
  116   2HG   ARG  16          2HG       ARG  16   8.200   3.797  -2.564
  117   1HD   ARG  16          1HD       ARG  16   6.867   4.074  -4.611
  118   2HD   ARG  16          2HD       ARG  16   5.612   4.880  -3.670
  119    HE   ARG  16           HE       ARG  16   7.916   6.292  -3.177
  120   1HH1  ARG  16          1HH1      ARG  16   6.047   5.436  -5.987
  121   2HH1  ARG  16          2HH1      ARG  16   6.485   6.859  -6.873
  122   1HH2  ARG  16          1HH2      ARG  16   8.500   8.169  -4.333
  123   2HH2  ARG  16          2HH2      ARG  16   7.881   8.412  -5.932
  124    H    TRP  17           H        TRP  17   3.771   1.238  -0.497
  125    HA   TRP  17           HA       TRP  17   4.589  -1.485  -1.079
  126   1HB   TRP  17          1HB       TRP  17   3.721  -0.582   1.663
  127   2HB   TRP  17          2HB       TRP  17   3.551  -2.254   1.135
  128    HD1  TRP  17           HD       TRP  17   6.127   0.260   2.319
  129    HE1  TRP  17           1HE      TRP  17   8.382  -0.936   2.655
  130    HE3  TRP  17           3HE      TRP  17   4.979  -4.249   0.199
  131    HZ2  TRP  17           2HZ      TRP  17   9.522  -3.456   2.096
  132    HZ3  TRP  17           3HZ      TRP  17   6.708  -5.998   0.139
  133    HH2  TRP  17           HH       TRP  17   8.932  -5.608   1.068
  134    H    VAL  18           H        VAL  18   2.956  -2.680  -1.900
  135    HA   VAL  18           HA       VAL  18   0.285  -1.439  -1.928
  136    HB   VAL  18           HB       VAL  18  -0.146  -2.620  -4.005
  137   1HG1  VAL  18          1HG1      VAL  18   0.734  -0.526  -4.459
  138   2HG1  VAL  18          2HG1      VAL  18   2.328  -0.946  -3.830
  139   3HG1  VAL  18          3HG1      VAL  18   1.793  -1.591  -5.382
  140   1HG2  VAL  18          1HG2      VAL  18   0.995  -4.414  -4.655
  141   2HG2  VAL  18          2HG2      VAL  18   2.519  -3.528  -4.611
  142   3HG2  VAL  18          3HG2      VAL  18   1.912  -4.310  -3.151
  143    H    PHE  19           H        PHE  19  -1.560  -2.938  -2.025
  144    HA   PHE  19           HA       PHE  19  -1.063  -5.566  -0.840
  145   1HB   PHE  19          1HB       PHE  19  -2.780  -5.220   0.871
  146   2HB   PHE  19          2HB       PHE  19  -1.480  -4.046   1.047
  147    HD1  PHE  19           1HD      PHE  19  -1.843  -1.718   0.093
  148    HD2  PHE  19           2HD      PHE  19  -4.991  -4.527   0.655
  149    HE1  PHE  19           1HE      PHE  19  -3.485   0.113   0.020
  150    HE2  PHE  19           2HE      PHE  19  -6.638  -2.701   0.583
  151    HZ   PHE  19           HZ       PHE  19  -5.886  -0.378   0.264
  152    H    THR  20           H        THR  20  -2.623  -7.110  -1.290
  153    HA   THR  20           HA       THR  20  -4.998  -6.332  -2.785
  154    HB   THR  20           HB       THR  20  -4.508  -8.025  -4.573
  155    HG1  THR  20           1HG      THR  20  -1.856  -7.849  -3.535
  156   1HG2  THR  20          1HG2      THR  20  -4.143  -5.519  -4.782
  157   2HG2  THR  20          2HG2      THR  20  -3.252  -6.535  -5.916
  158   3HG2  THR  20          3HG2      THR  20  -2.431  -5.846  -4.516
  159    H    LEU  21           H        LEU  21  -6.682  -7.543  -2.201
  160    HA   LEU  21           HA       LEU  21  -6.241 -10.286  -1.282
  161   1HB   LEU  21          1HB       LEU  21  -6.243  -8.888   0.720
  162   2HB   LEU  21          2HB       LEU  21  -7.799  -8.207   0.249
  163    HG   LEU  21           HG       LEU  21  -8.363 -10.877   0.332
  164   1HD1  LEU  21          1HD1      LEU  21  -7.362 -11.886   2.202
  165   2HD1  LEU  21          2HD1      LEU  21  -6.623 -10.375   2.728
  166   3HD1  LEU  21          3HD1      LEU  21  -6.028 -11.190   1.282
  167   1HD2  LEU  21          1HD2      LEU  21  -8.585  -9.354   2.869
  168   2HD2  LEU  21          2HD2      LEU  21  -9.800 -10.288   1.996
  169   3HD2  LEU  21          3HD2      LEU  21  -9.356  -8.676   1.435
  170    H    ASN  22           H        ASN  22  -7.690 -11.657  -2.098
  171    HA   ASN  22           HA       ASN  22  -9.815 -10.648  -3.760
  172   1HB   ASN  22          1HB       ASN  22 -10.209 -13.017  -4.308
  173   2HB   ASN  22          2HB       ASN  22  -8.510 -12.587  -4.483
  174   1HD2  ASN  22          1HD2      ASN  22  -7.002 -13.495  -3.145
  175   2HD2  ASN  22          2HD2      ASN  22  -7.360 -14.791  -2.060
  176    H    ASN  23           H        ASN  23 -11.962 -10.642  -3.358
  177    HA   ASN  23           HA       ASN  23 -13.874 -10.569  -2.120
  178   1HB   ASN  23          1HB       ASN  23 -13.452 -13.091  -2.549
  179   2HB   ASN  23          2HB       ASN  23 -13.014 -13.153  -0.844
  180   1HD2  ASN  23          1HD2      ASN  23 -15.558 -11.605  -2.781
  181   2HD2  ASN  23          2HD2      ASN  23 -16.870 -12.141  -1.792
  182    HA   PRO  24           HA       PRO  24 -11.536  -9.135   1.657
  183   1HB   PRO  24          1HB       PRO  24 -12.306  -6.539   1.458
  184   2HB   PRO  24          2HB       PRO  24 -10.873  -7.182   0.646
  185   1HG   PRO  24          1HG       PRO  24 -13.609  -6.671  -0.459
  186   2HG   PRO  24          2HG       PRO  24 -12.027  -6.326  -1.183
  187   1HD   PRO  24          1HD       PRO  24 -13.507  -8.485  -1.877
  188   2HD   PRO  24          2HD       PRO  24 -11.732  -8.502  -1.883
  189    H    SER  25           H        SER  25 -12.426  -8.665   3.663
  190    HA   SER  25           HA       SER  25 -15.310  -9.047   3.846
  191   1HB   SER  25          1HB       SER  25 -13.332  -8.887   6.125
  192   2HB   SER  25          2HB       SER  25 -14.954  -9.579   6.153
  193    HG   SER  25           HG       SER  25 -13.061 -11.059   5.934
  194    H    GLU  26           H        GLU  26 -16.593  -7.734   5.321
  195    HA   GLU  26           HA       GLU  26 -16.357  -4.990   4.798
  196   1HB   GLU  26          1HB       GLU  26 -18.215  -4.692   6.316
  197   2HB   GLU  26          2HB       GLU  26 -18.482  -6.137   5.352
  198   1HG   GLU  26          1HG       GLU  26 -18.907  -7.177   7.262
  199   2HG   GLU  26          2HG       GLU  26 -17.175  -7.093   7.579
  200    H    ASP  27           H        ASP  27 -15.155  -6.963   7.405
  201    HA   ASP  27           HA       ASP  27 -14.518  -4.752   9.129
  202   1HB   ASP  27          1HB       ASP  27 -14.830  -7.437   9.535
  203   2HB   ASP  27          2HB       ASP  27 -13.075  -7.282   9.557
  204    H    GLU  28           H        GLU  28 -12.639  -6.973   7.080
  205    HA   GLU  28           HA       GLU  28 -10.131  -5.786   7.581
  206   1HB   GLU  28          1HB       GLU  28 -11.087  -7.972   6.121
  207   2HB   GLU  28          2HB       GLU  28 -10.319  -6.934   4.928
  208   1HG   GLU  28          1HG       GLU  28  -8.244  -7.246   5.781
  209   2HG   GLU  28          2HG       GLU  28  -8.829  -7.442   7.432
  210    H    ARG  29           H        ARG  29 -12.449  -5.349   4.923
  211    HA   ARG  29           HA       ARG  29 -10.960  -3.493   3.449
  212   1HB   ARG  29          1HB       ARG  29 -12.851  -4.539   2.429
  213   2HB   ARG  29          2HB       ARG  29 -13.935  -3.938   3.676
  214   1HG   ARG  29          1HG       ARG  29 -12.596  -1.744   2.404
  215   2HG   ARG  29          2HG       ARG  29 -13.363  -2.778   1.197
  216   1HD   ARG  29          1HD       ARG  29 -14.983  -2.195   3.585
  217   2HD   ARG  29          2HD       ARG  29 -14.635  -0.811   2.550
  218    HE   ARG  29           HE       ARG  29 -15.506  -2.941   0.949
  219   1HH1  ARG  29          1HH1      ARG  29 -16.721  -0.732   3.350
  220   2HH1  ARG  29          2HH1      ARG  29 -18.342  -0.755   2.740
  221   1HH2  ARG  29          1HH2      ARG  29 -17.637  -2.980   0.136
  222   2HH2  ARG  29          2HH2      ARG  29 -18.863  -2.035   0.912
  223    H    LYS  30           H        LYS  30 -13.293  -3.036   6.069
  224    HA   LYS  30           HA       LYS  30 -13.267  -0.195   5.966
  225   1HB   LYS  30          1HB       LYS  30 -14.207  -2.224   7.966
  226   2HB   LYS  30          2HB       LYS  30 -14.163  -0.519   8.396
  227   1HG   LYS  30          1HG       LYS  30 -15.629  -0.013   6.497
  228   2HG   LYS  30          2HG       LYS  30 -15.692  -1.732   6.101
  229   1HD   LYS  30          1HD       LYS  30 -16.656  -2.172   8.336
  230   2HD   LYS  30          2HD       LYS  30 -16.669  -0.434   8.645
  231   1HE   LYS  30          1HE       LYS  30 -18.015  -0.334   6.414
  232   2HE   LYS  30          2HE       LYS  30 -18.323  -2.039   6.741
  233   1HZ   LYS  30          1HZ       LYS  30 -19.929  -1.414   8.108
  234   2HZ   LYS  30          2HZ       LYS  30 -19.560   0.220   7.879
  235   3HZ   LYS  30          3HZ       LYS  30 -18.791  -0.656   9.105
  236    H    LYS  31           H        LYS  31 -11.384  -2.603   7.691
  237    HA   LYS  31           HA       LYS  31 -10.136  -0.908   9.550
  238   1HB   LYS  31          1HB       LYS  31  -9.985  -3.268   9.870
  239   2HB   LYS  31          2HB       LYS  31  -9.263  -3.503   8.284
  240   1HG   LYS  31          1HG       LYS  31  -7.666  -1.707   9.864
  241   2HG   LYS  31          2HG       LYS  31  -7.946  -3.222  10.724
  242   1HD   LYS  31          1HD       LYS  31  -7.301  -3.599   7.904
  243   2HD   LYS  31          2HD       LYS  31  -6.020  -2.789   8.808
  244   1HE   LYS  31          1HE       LYS  31  -5.834  -5.277   8.760
  245   2HE   LYS  31          2HE       LYS  31  -5.900  -4.584  10.380
  246   1HZ   LYS  31          1HZ       LYS  31  -8.098  -5.291  10.662
  247   2HZ   LYS  31          2HZ       LYS  31  -7.322  -6.612   9.944
  248   3HZ   LYS  31          3HZ       LYS  31  -8.317  -5.608   9.014
  249    H    ILE  32           H        ILE  32  -9.079  -1.974   6.325
  250    HA   ILE  32           HA       ILE  32  -6.654  -0.553   6.296
  251    HB   ILE  32           HB       ILE  32  -8.410  -1.652   4.127
  252   1HG1  ILE  32          1HG1      ILE  32  -5.560  -2.257   4.944
  253   2HG1  ILE  32          2HG1      ILE  32  -6.970  -3.156   5.494
  254   1HG2  ILE  32          1HG2      ILE  32  -6.525  -1.043   2.547
  255   2HG2  ILE  32          2HG2      ILE  32  -7.570   0.279   3.068
  256   3HG2  ILE  32          3HG2      ILE  32  -5.975   0.078   3.793
  257   1HD1  ILE  32          1HD1      ILE  32  -6.942  -2.992   2.629
  258   2HD1  ILE  32          2HD1      ILE  32  -5.420  -3.645   3.234
  259   3HD1  ILE  32          3HD1      ILE  32  -6.946  -4.411   3.676
  260    H    ARG  33           H        ARG  33  -9.899   0.322   5.175
  261    HA   ARG  33           HA       ARG  33  -9.111   2.862   4.140
  262   1HB   ARG  33          1HB       ARG  33 -11.077   1.897   3.221
  263   2HB   ARG  33          2HB       ARG  33 -11.784   1.644   4.811
  264   1HG   ARG  33          1HG       ARG  33 -12.366   3.866   5.053
  265   2HG   ARG  33          2HG       ARG  33 -11.177   4.411   3.868
  266   1HD   ARG  33          1HD       ARG  33 -12.567   4.072   2.131
  267   2HD   ARG  33          2HD       ARG  33 -13.219   2.584   2.816
  268    HE   ARG  33           HE       ARG  33 -14.150   4.815   4.277
  269   1HH1  ARG  33          1HH1      ARG  33 -14.553   3.195   1.222
  270   2HH1  ARG  33          2HH1      ARG  33 -16.190   3.723   1.010
  271   1HH2  ARG  33          1HH2      ARG  33 -16.303   5.517   4.009
  272   2HH2  ARG  33          2HH2      ARG  33 -17.184   5.045   2.595
  273    H    ASP  34           H        ASP  34  -9.876   1.667   7.268
  274    HA   ASP  34           HA       ASP  34 -10.420   4.322   8.343
  275   1HB   ASP  34          1HB       ASP  34 -10.517   1.544   9.497
  276   2HB   ASP  34          2HB       ASP  34 -10.584   2.967  10.533
  277    H    LEU  35           H        LEU  35  -7.729   2.939   7.388
  278    HA   LEU  35           HA       LEU  35  -6.027   3.010   9.655
  279   1HB   LEU  35          1HB       LEU  35  -5.621   2.961   6.699
  280   2HB   LEU  35          2HB       LEU  35  -4.252   3.311   7.752
  281    HG   LEU  35           HG       LEU  35  -5.930   0.809   7.905
  282   1HD1  LEU  35          1HD1      LEU  35  -3.129   0.966   6.857
  283   2HD1  LEU  35          2HD1      LEU  35  -4.515   1.195   5.792
  284   3HD1  LEU  35          3HD1      LEU  35  -4.319  -0.322   6.669
  285   1HD2  LEU  35          1HD2      LEU  35  -4.116  -0.012   9.319
  286   2HD2  LEU  35          2HD2      LEU  35  -4.862   1.429  10.011
  287   3HD2  LEU  35          3HD2      LEU  35  -3.304   1.549   9.193
  288    HA   PRO  36           HA       PRO  36  -5.065   7.261  10.155
  289   1HB   PRO  36          1HB       PRO  36  -2.396   7.207  10.650
  290   2HB   PRO  36          2HB       PRO  36  -3.600   6.640  11.813
  291   1HG   PRO  36          1HG       PRO  36  -1.913   5.060   9.911
  292   2HG   PRO  36          2HG       PRO  36  -2.300   4.723  11.608
  293   1HD   PRO  36          1HD       PRO  36  -3.565   3.494   9.553
  294   2HD   PRO  36          2HD       PRO  36  -4.372   3.854  11.093
  295    H    ILE  37           H        ILE  37  -5.067   8.720   8.572
  296    HA   ILE  37           HA       ILE  37  -3.754   8.331   6.081
  297    HB   ILE  37           HB       ILE  37  -4.464  10.643   5.568
  298   1HG1  ILE  37          1HG1      ILE  37  -5.461  10.606   8.425
  299   2HG1  ILE  37          2HG1      ILE  37  -4.192  11.640   7.776
  300   1HG2  ILE  37          1HG2      ILE  37  -5.982   8.766   5.199
  301   2HG2  ILE  37          2HG2      ILE  37  -6.602   8.940   6.840
  302   3HG2  ILE  37          3HG2      ILE  37  -6.867  10.221   5.658
  303   1HD1  ILE  37          1HD1      ILE  37  -5.947  13.085   7.758
  304   2HD1  ILE  37          2HD1      ILE  37  -6.113  12.392   6.145
  305   3HD1  ILE  37          3HD1      ILE  37  -7.136  11.817   7.461
  306    H    SER  38           H        SER  38  -2.993  10.144   8.992
  307    HA   SER  38           HA       SER  38  -0.862  11.664   7.925
  308   1HB   SER  38          1HB       SER  38  -1.802  10.944  10.663
  309   2HB   SER  38          2HB       SER  38  -0.165  11.579  10.494
  310    HG   SER  38           HG       SER  38  -2.279  13.003  10.679
  311    H    LEU  39           H        LEU  39  -1.142   8.363   8.634
  312    HA   LEU  39           HA       LEU  39   1.642   7.898   9.223
  313   1HB   LEU  39          1HB       LEU  39  -0.610   6.510   9.748
  314   2HB   LEU  39          2HB       LEU  39  -0.046   5.658   8.312
  315    HG   LEU  39           HG       LEU  39   1.976   6.084  10.414
  316   1HD1  LEU  39          1HD1      LEU  39   1.156   4.314  11.835
  317   2HD1  LEU  39          2HD1      LEU  39  -0.275   4.122  10.824
  318   3HD1  LEU  39          3HD1      LEU  39  -0.042   5.606  11.747
  319   1HD2  LEU  39          1HD2      LEU  39   1.614   3.385   9.580
  320   2HD2  LEU  39          2HD2      LEU  39   2.949   4.483   9.228
  321   3HD2  LEU  39          3HD2      LEU  39   1.544   4.430   8.161
  322    H    PHE  40           H        PHE  40  -0.411   7.939   6.415
  323    HA   PHE  40           HA       PHE  40   1.911   7.194   4.762
  324   1HB   PHE  40          1HB       PHE  40  -0.938   6.709   3.915
  325   2HB   PHE  40          2HB       PHE  40   0.536   6.014   3.250
  326    HD1  PHE  40           2HD      PHE  40  -1.871   5.885   6.009
  327    HD2  PHE  40           1HD      PHE  40   1.592   4.120   4.274
  328    HE1  PHE  40           2HE      PHE  40  -2.147   3.921   7.464
  329    HE2  PHE  40           1HE      PHE  40   1.321   2.153   5.726
  330    HZ   PHE  40           HZ       PHE  40  -0.550   2.052   7.325
  331    H    ASP  41           H        ASP  41   2.604   8.817   3.554
  332    HA   ASP  41           HA       ASP  41   1.351  11.300   3.345
  333   1HB   ASP  41          1HB       ASP  41   3.783  10.847   2.960
  334   2HB   ASP  41          2HB       ASP  41   3.359  10.149   1.399
  335    H    TYR  42           H        TYR  42   0.925   8.405   1.507
  336    HA   TYR  42           HA       TYR  42  -1.193   9.697  -0.022
  337   1HB   TYR  42          1HB       TYR  42   0.757   9.878  -1.485
  338   2HB   TYR  42          2HB       TYR  42   1.055   8.150  -1.329
  339    HD1  TYR  42           1HD      TYR  42  -2.214   9.845  -1.822
  340    HD2  TYR  42           2HD      TYR  42   0.816   7.402  -3.540
  341    HE1  TYR  42           1HE      TYR  42  -3.663   9.425  -3.764
  342    HE2  TYR  42           2HE      TYR  42  -0.624   6.976  -5.488
  343    HH   TYR  42           HH       TYR  42  -3.840   8.461  -5.755
  344    H    PHE  43           H        PHE  43  -2.952   8.476   0.060
  345    HA   PHE  43           HA       PHE  43  -2.659   5.557   0.189
  346   1HB   PHE  43          1HB       PHE  43  -3.258   6.934   2.418
  347   2HB   PHE  43          2HB       PHE  43  -4.878   6.760   1.751
  348    HD1  PHE  43           1HD      PHE  43  -4.071   4.018   0.401
  349    HD2  PHE  43           2HD      PHE  43  -3.865   5.585   4.353
  350    HE1  PHE  43           1HE      PHE  43  -4.200   1.735   1.309
  351    HE2  PHE  43           2HE      PHE  43  -3.993   3.305   5.267
  352    HZ   PHE  43           HZ       PHE  43  -4.160   1.376   3.745
  353    H    ILE  44           H        ILE  44  -3.623   4.750  -1.545
  354    HA   ILE  44           HA       ILE  44  -6.269   5.768  -2.295
  355    HB   ILE  44           HB       ILE  44  -4.900   6.878  -3.876
  356   1HG1  ILE  44          1HG1      ILE  44  -5.483   4.552  -5.603
  357   2HG1  ILE  44          2HG1      ILE  44  -6.836   5.131  -4.637
  358   1HG2  ILE  44          1HG2      ILE  44  -3.424   4.273  -4.046
  359   2HG2  ILE  44          2HG2      ILE  44  -3.303   5.483  -5.322
  360   3HG2  ILE  44          3HG2      ILE  44  -2.799   5.881  -3.680
  361   1HD1  ILE  44          1HD1      ILE  44  -7.195   6.680  -6.168
  362   2HD1  ILE  44          2HD1      ILE  44  -5.640   7.406  -5.758
  363   3HD1  ILE  44          3HD1      ILE  44  -5.740   6.203  -7.044
  364    H    VAL  45           H        VAL  45  -7.698   4.184  -2.566
  365    HA   VAL  45           HA       VAL  45  -6.741   1.512  -3.328
  366    HB   VAL  45           HB       VAL  45  -8.897   1.853  -1.261
  367   1HG1  VAL  45          1HG1      VAL  45  -7.573  -0.500  -0.801
  368   2HG1  VAL  45          2HG1      VAL  45  -9.065  -0.329  -1.728
  369   3HG1  VAL  45          3HG1      VAL  45  -7.509  -0.364  -2.558
  370   1HG2  VAL  45          1HG2      VAL  45  -5.939   1.540  -0.762
  371   2HG2  VAL  45          2HG2      VAL  45  -6.929   2.939  -0.348
  372   3HG2  VAL  45          3HG2      VAL  45  -7.198   1.397   0.464
  373    H    GLY  46           H        GLY  46  -8.290   0.184  -4.380
  374   1HA   GLY  46          1HA       GLY  46 -10.840   1.422  -5.103
  375   2HA   GLY  46          2HA       GLY  46  -9.720   1.068  -6.410
  376    H    GLU  47           H        GLU  47 -12.445  -0.005  -5.513
  377    HA   GLU  47           HA       GLU  47 -11.721  -2.855  -5.394
  378   1HB   GLU  47          1HB       GLU  47 -13.085  -2.259  -3.525
  379   2HB   GLU  47          2HB       GLU  47 -14.222  -1.395  -4.550
  380   1HG   GLU  47          1HG       GLU  47 -15.408  -3.228  -4.912
  381   2HG   GLU  47          2HG       GLU  47 -13.975  -4.141  -5.381
  382    H    GLU  48           H        GLU  48 -12.290  -4.205  -7.000
  383    HA   GLU  48           HA       GLU  48 -13.895  -3.079  -9.201
  384   1HB   GLU  48          1HB       GLU  48 -11.400  -3.630  -9.574
  385   2HB   GLU  48          2HB       GLU  48 -11.908  -5.312  -9.530
  386   1HG   GLU  48          1HG       GLU  48 -13.671  -4.076 -11.294
  387   2HG   GLU  48          2HG       GLU  48 -12.090  -3.392 -11.666
  388    H    GLY  49           H        GLY  49 -15.877  -3.911  -9.189
  389   1HA   GLY  49          1HA       GLY  49 -16.162  -6.823  -8.981
  390   2HA   GLY  49          2HA       GLY  49 -17.102  -5.818  -7.888
  391    H    ASN  50           H        ASN  50 -16.325  -5.670 -11.367
  392    HA   ASN  50           HA       ASN  50 -19.220  -5.516 -11.891
  393   1HB   ASN  50          1HB       ASN  50 -17.340  -3.523 -12.381
  394   2HB   ASN  50          2HB       ASN  50 -17.578  -4.282 -13.952
  395   1HD2  ASN  50          1HD2      ASN  50 -19.719  -3.569 -11.214
  396   2HD2  ASN  50          2HD2      ASN  50 -20.893  -2.702 -12.139
  397    H    GLU  51           H        GLU  51 -17.524  -7.871 -11.850
  398    HA   GLU  51           HA       GLU  51 -17.903  -8.712 -14.641
  399   1HB   GLU  51          1HB       GLU  51 -15.418  -8.360 -13.507
  400   2HB   GLU  51          2HB       GLU  51 -15.709 -10.076 -13.260
  401   1HG   GLU  51          1HG       GLU  51 -16.404  -9.969 -15.801
  402   2HG   GLU  51          2HG       GLU  51 -15.354  -8.553 -15.781
  403    H    GLU  52           H        GLU  52 -19.578 -10.067 -14.515
  404    HA   GLU  52           HA       GLU  52 -20.329 -11.553 -12.263
  405   1HB   GLU  52          1HB       GLU  52 -21.863 -11.020 -14.108
  406   2HB   GLU  52          2HB       GLU  52 -20.960 -12.091 -15.170
  407   1HG   GLU  52          1HG       GLU  52 -21.607 -14.008 -13.903
  408   2HG   GLU  52          2HG       GLU  52 -22.338 -12.998 -12.657
  409    H    GLY  53           H        GLY  53 -20.110 -13.731 -11.727
  410   1HA   GLY  53          1HA       GLY  53 -19.288 -15.925 -11.976
  411   2HA   GLY  53          2HA       GLY  53 -18.315 -15.382 -13.335
  412    H    ARG  54           H        ARG  54 -17.467 -13.037 -11.555
  413    HA   ARG  54           HA       ARG  54 -15.466 -14.536  -9.993
  414   1HB   ARG  54          1HB       ARG  54 -14.585 -13.350 -12.026
  415   2HB   ARG  54          2HB       ARG  54 -15.073 -11.833 -11.283
  416   1HG   ARG  54          1HG       ARG  54 -13.442 -11.951  -9.655
  417   2HG   ARG  54          2HG       ARG  54 -13.271 -13.701  -9.809
  418   1HD   ARG  54          1HD       ARG  54 -12.057 -13.512 -11.813
  419   2HD   ARG  54          2HD       ARG  54 -12.533 -11.829 -12.038
  420    HE   ARG  54           HE       ARG  54 -10.778 -11.204 -10.719
  421   1HH1  ARG  54          1HH1      ARG  54 -11.447 -14.578 -10.176
  422   2HH1  ARG  54          2HH1      ARG  54 -10.059 -14.824  -9.167
  423   1HH2  ARG  54          1HH2      ARG  54  -8.949 -11.517  -9.393
  424   2HH2  ARG  54          2HH2      ARG  54  -8.640 -13.082  -8.722
  425    H    THR  55           H        THR  55 -14.617 -13.428  -8.099
  426    HA   THR  55           HA       THR  55 -16.732 -11.945  -6.734
  427    HB   THR  55           HB       THR  55 -14.794 -12.325  -4.841
  428    HG1  THR  55           1HG      THR  55 -13.854 -14.297  -5.175
  429   1HG2  THR  55          1HG2      THR  55 -16.899 -12.935  -4.179
  430   2HG2  THR  55          2HG2      THR  55 -16.202 -14.535  -4.433
  431   3HG2  THR  55          3HG2      THR  55 -17.232 -13.815  -5.670
  432    HA   PRO  56           HA       PRO  56 -14.684  -8.064  -6.707
  433   1HB   PRO  56          1HB       PRO  56 -15.229  -7.143  -4.212
  434   2HB   PRO  56          2HB       PRO  56 -16.451  -7.251  -5.484
  435   1HG   PRO  56          1HG       PRO  56 -15.911  -9.125  -3.213
  436   2HG   PRO  56          2HG       PRO  56 -17.465  -8.543  -3.838
  437   1HD   PRO  56          1HD       PRO  56 -16.470 -10.984  -4.454
  438   2HD   PRO  56          2HD       PRO  56 -17.471 -10.048  -5.583
  439    H    HIS  57           H        HIS  57 -12.603  -7.529  -6.547
  440    HA   HIS  57           HA       HIS  57 -11.039  -8.634  -4.308
  441   1HB   HIS  57          1HB       HIS  57 -10.500  -9.382  -6.698
  442   2HB   HIS  57          2HB       HIS  57  -9.890  -7.749  -6.950
  443    HD1  HIS  57           1HD      HIS  57  -8.729 -10.978  -6.094
  444    HD2  HIS  57           2HD      HIS  57  -7.851  -7.141  -4.766
  445    HE1  HIS  57           1HE      HIS  57  -6.477 -11.148  -4.987
  446    H    LEU  58           H        LEU  58  -9.696  -7.307  -3.148
  447    HA   LEU  58           HA       LEU  58 -10.117  -4.435  -3.542
  448   1HB   LEU  58          1HB       LEU  58 -10.047  -6.110  -1.275
  449   2HB   LEU  58          2HB       LEU  58  -8.640  -5.054  -1.170
  450    HG   LEU  58           HG       LEU  58 -11.538  -4.239  -1.297
  451   1HD1  LEU  58          1HD1      LEU  58 -11.322  -4.460   0.912
  452   2HD1  LEU  58          2HD1      LEU  58 -10.330  -3.004   0.833
  453   3HD1  LEU  58          3HD1      LEU  58  -9.565  -4.593   0.818
  454   1HD2  LEU  58          1HD2      LEU  58 -10.431  -1.915  -0.944
  455   2HD2  LEU  58          2HD2      LEU  58 -10.566  -2.577  -2.573
  456   3HD2  LEU  58          3HD2      LEU  58  -9.031  -2.666  -1.709
  457    H    GLN  59           H        GLN  59  -8.609  -3.381  -4.638
  458    HA   GLN  59           HA       GLN  59  -5.792  -4.132  -4.227
  459   1HB   GLN  59          1HB       GLN  59  -6.232  -4.898  -6.406
  460   2HB   GLN  59          2HB       GLN  59  -7.237  -3.507  -6.787
  461   1HG   GLN  59          1HG       GLN  59  -5.117  -3.399  -7.956
  462   2HG   GLN  59          2HG       GLN  59  -5.272  -2.073  -6.804
  463   1HE2  GLN  59          1HE2      GLN  59  -3.210  -4.322  -7.988
  464   2HE2  GLN  59          2HE2      GLN  59  -2.103  -4.434  -6.666
  465    H    GLY  60           H        GLY  60  -4.858  -2.541  -3.125
  466   1HA   GLY  60          1HA       GLY  60  -5.221   0.209  -4.079
  467   2HA   GLY  60          2HA       GLY  60  -5.533  -0.128  -2.383
  468    H    PHE  61           H        PHE  61  -3.595   1.700  -3.322
  469    HA   PHE  61           HA       PHE  61  -1.131   0.359  -2.422
  470   1HB   PHE  61          1HB       PHE  61  -0.712   0.826  -4.691
  471   2HB   PHE  61          2HB       PHE  61  -1.523   2.387  -4.610
  472    HD1  PHE  61           2HD      PHE  61   1.276   0.713  -2.787
  473    HD2  PHE  61           1HD      PHE  61  -0.118   4.173  -4.838
  474    HE1  PHE  61           2HE      PHE  61   3.442   1.812  -2.397
  475    HE2  PHE  61           1HE      PHE  61   2.047   5.277  -4.452
  476    HZ   PHE  61           HZ       PHE  61   3.829   4.098  -3.228
  477    H    ALA  62           H        ALA  62   0.099   1.398  -0.910
  478    HA   ALA  62           HA       ALA  62  -0.772   4.062  -0.029
  479   1HB   ALA  62          1HB       ALA  62  -0.001   2.683   2.290
  480   2HB   ALA  62          2HB       ALA  62  -1.616   3.239   1.850
  481   3HB   ALA  62          3HB       ALA  62  -1.096   1.610   1.419
  482    H    ASN  63           H        ASN  63   0.837   5.414   0.634
  483    HA   ASN  63           HA       ASN  63   3.577   4.401   0.332
  484   1HB   ASN  63          1HB       ASN  63   2.241   6.957  -0.295
  485   2HB   ASN  63          2HB       ASN  63   3.854   7.107   0.398
  486   1HD2  ASN  63          1HD2      ASN  63   2.435   7.282  -2.390
  487   2HD2  ASN  63          2HD2      ASN  63   3.585   6.519  -3.430
  488    H    PHE  64           H        PHE  64   4.597   3.956   2.162
  489    HA   PHE  64           HA       PHE  64   3.722   4.904   4.700
  490   1HB   PHE  64          1HB       PHE  64   5.728   3.040   3.681
  491   2HB   PHE  64          2HB       PHE  64   6.275   3.922   5.103
  492    HD1  PHE  64           2HD      PHE  64   4.765   3.904   7.158
  493    HD2  PHE  64           1HD      PHE  64   4.308   1.214   3.891
  494    HE1  PHE  64           2HE      PHE  64   3.481   2.378   8.599
  495    HE2  PHE  64           1HE      PHE  64   3.022  -0.316   5.327
  496    HZ   PHE  64           HZ       PHE  64   2.608   0.264   7.684
  497    H    VAL  65           H        VAL  65   4.286   6.675   5.787
  498    HA   VAL  65           HA       VAL  65   5.769   8.747   4.624
  499    HB   VAL  65           HB       VAL  65   4.985   8.291   7.502
  500   1HG1  VAL  65          1HG1      VAL  65   5.359  10.917   7.440
  501   2HG1  VAL  65          2HG1      VAL  65   6.658   9.797   7.856
  502   3HG1  VAL  65          3HG1      VAL  65   6.554  10.463   6.226
  503   1HG2  VAL  65          1HG2      VAL  65   3.013   9.202   6.986
  504   2HG2  VAL  65          2HG2      VAL  65   3.762  10.493   6.046
  505   3HG2  VAL  65          3HG2      VAL  65   3.451   8.925   5.300
  506    H    LYS  66           H        LYS  66   6.750   6.027   6.516
  507    HA   LYS  66           HA       LYS  66   9.511   7.054   6.514
  508   1HB   LYS  66          1HB       LYS  66   9.827   5.628   8.598
  509   2HB   LYS  66          2HB       LYS  66   8.887   7.101   8.791
  510   1HG   LYS  66          1HG       LYS  66   7.373   4.645   8.164
  511   2HG   LYS  66          2HG       LYS  66   8.122   4.734   9.760
  512   1HD   LYS  66          1HD       LYS  66   6.617   7.110   8.806
  513   2HD   LYS  66          2HD       LYS  66   5.687   5.687   9.280
  514   1HE   LYS  66          1HE       LYS  66   6.422   5.783  11.477
  515   2HE   LYS  66          2HE       LYS  66   7.847   6.735  11.064
  516   1HZ   LYS  66          1HZ       LYS  66   5.957   7.923  12.235
  517   2HZ   LYS  66          2HZ       LYS  66   5.113   7.822  10.772
  518   3HZ   LYS  66          3HZ       LYS  66   6.578   8.666  10.847
  519    H    LYS  67           H        LYS  67  10.940   4.926   7.201
  520    HA   LYS  67           HA       LYS  67  10.567   3.142   4.940
  521   1HB   LYS  67          1HB       LYS  67  12.794   3.279   6.981
  522   2HB   LYS  67          2HB       LYS  67  12.798   2.288   5.528
  523   1HG   LYS  67          1HG       LYS  67  12.265   5.038   4.873
  524   2HG   LYS  67          2HG       LYS  67  13.754   4.892   5.811
  525   1HD   LYS  67          1HD       LYS  67  14.527   3.147   4.233
  526   2HD   LYS  67          2HD       LYS  67  13.071   3.411   3.270
  527   1HE   LYS  67          1HE       LYS  67  13.801   5.856   3.160
  528   2HE   LYS  67          2HE       LYS  67  15.360   5.295   3.763
  529   1HZ   LYS  67          1HZ       LYS  67  15.807   5.026   1.599
  530   2HZ   LYS  67          2HZ       LYS  67  14.180   4.995   1.142
  531   3HZ   LYS  67          3HZ       LYS  67  14.916   3.595   1.741
  532    H    GLN  68           H        GLN  68   9.652   1.205   5.069
  533    HA   GLN  68           HA       GLN  68   9.676  -0.217   7.637
  534   1HB   GLN  68          1HB       GLN  68   7.252   0.111   5.860
  535   2HB   GLN  68          2HB       GLN  68   7.331  -0.888   7.305
  536   1HG   GLN  68          1HG       GLN  68   7.797   2.081   7.318
  537   2HG   GLN  68          2HG       GLN  68   6.221   1.337   7.586
  538   1HE2  GLN  68          1HE2      GLN  68   5.701   1.164   9.633
  539   2HE2  GLN  68          2HE2      GLN  68   6.791   0.923  10.951
  540    H    THR  69           H        THR  69   9.489  -2.500   7.481
  541    HA   THR  69           HA       THR  69  10.490  -3.534   4.941
  542    HB   THR  69           HB       THR  69  11.261  -5.434   6.105
  543    HG1  THR  69           1HG      THR  69  10.565  -5.899   8.245
  544   1HG2  THR  69          1HG2      THR  69  12.577  -3.449   6.608
  545   2HG2  THR  69          2HG2      THR  69  12.525  -4.516   8.012
  546   3HG2  THR  69          3HG2      THR  69  11.518  -3.069   7.966
  547    H    PHE  70           H        PHE  70   9.725  -5.838   4.410
  548    HA   PHE  70           HA       PHE  70   6.997  -5.743   3.756
  549   1HB   PHE  70          1HB       PHE  70   8.258  -7.086   2.333
  550   2HB   PHE  70          2HB       PHE  70   9.096  -7.881   3.662
  551    HD1  PHE  70           1HD      PHE  70   5.805  -7.622   1.974
  552    HD2  PHE  70           2HD      PHE  70   8.352  -9.932   4.483
  553    HE1  PHE  70           1HE      PHE  70   4.231  -9.508   1.831
  554    HE2  PHE  70           2HE      PHE  70   6.782 -11.821   4.343
  555    HZ   PHE  70           HZ       PHE  70   4.719 -11.611   3.015
  556    H    ASN  71           H        ASN  71   8.685  -7.812   6.120
  557    HA   ASN  71           HA       ASN  71   6.387  -9.021   7.174
  558   1HB   ASN  71          1HB       ASN  71   9.221  -8.798   7.921
  559   2HB   ASN  71          2HB       ASN  71   8.133  -9.023   9.288
  560   1HD2  ASN  71          1HD2      ASN  71   8.064 -11.063   9.854
  561   2HD2  ASN  71          2HD2      ASN  71   8.024 -12.420   8.785
  562    H    LYS  72           H        LYS  72   8.130  -6.099   8.140
  563    HA   LYS  72           HA       LYS  72   6.624  -5.555  10.461
  564   1HB   LYS  72          1HB       LYS  72   8.867  -4.521   9.546
  565   2HB   LYS  72          2HB       LYS  72   7.784  -3.346   8.812
  566   1HG   LYS  72          1HG       LYS  72   7.531  -3.965  11.718
  567   2HG   LYS  72          2HG       LYS  72   8.817  -2.894  11.155
  568   1HD   LYS  72          1HD       LYS  72   7.328  -1.286  10.411
  569   2HD   LYS  72          2HD       LYS  72   6.000  -2.439  10.259
  570   1HE   LYS  72          1HE       LYS  72   5.556  -1.023  12.138
  571   2HE   LYS  72          2HE       LYS  72   5.966  -2.628  12.740
  572   1HZ   LYS  72          1HZ       LYS  72   7.186  -0.184  13.350
  573   2HZ   LYS  72          2HZ       LYS  72   8.325  -1.138  12.542
  574   3HZ   LYS  72          3HZ       LYS  72   7.571  -1.722  13.940
  575    H    VAL  73           H        VAL  73   6.329  -4.330   7.134
  576    HA   VAL  73           HA       VAL  73   4.194  -2.603   7.489
  577    HB   VAL  73           HB       VAL  73   4.975  -4.293   5.122
  578   1HG1  VAL  73          1HG1      VAL  73   2.633  -3.983   4.850
  579   2HG1  VAL  73          2HG1      VAL  73   2.736  -2.292   5.346
  580   3HG1  VAL  73          3HG1      VAL  73   3.434  -2.806   3.809
  581   1HG2  VAL  73          1HG2      VAL  73   5.045  -1.315   5.230
  582   2HG2  VAL  73          2HG2      VAL  73   6.293  -2.233   6.073
  583   3HG2  VAL  73          3HG2      VAL  73   6.073  -2.434   4.335
  584    H    LYS  74           H        LYS  74   4.244  -6.068   7.456
  585    HA   LYS  74           HA       LYS  74   1.533  -6.558   6.860
  586   1HB   LYS  74          1HB       LYS  74   3.397  -8.205   8.579
  587   2HB   LYS  74          2HB       LYS  74   1.905  -8.767   7.837
  588   1HG   LYS  74          1HG       LYS  74   3.268  -7.821   5.678
  589   2HG   LYS  74          2HG       LYS  74   4.574  -8.444   6.689
  590   1HD   LYS  74          1HD       LYS  74   4.083 -10.434   5.786
  591   2HD   LYS  74          2HD       LYS  74   2.689 -10.427   6.869
  592   1HE   LYS  74          1HE       LYS  74   1.278  -9.541   5.151
  593   2HE   LYS  74          2HE       LYS  74   2.656  -9.281   4.083
  594   1HZ   LYS  74          1HZ       LYS  74   2.926 -11.584   3.783
  595   2HZ   LYS  74          2HZ       LYS  74   1.266 -11.305   3.622
  596   3HZ   LYS  74          3HZ       LYS  74   1.876 -11.969   5.053
  597    H    TRP  75           H        TRP  75   2.957  -5.086   9.530
  598    HA   TRP  75           HA       TRP  75   1.207  -5.971  11.587
  599   1HB   TRP  75          1HB       TRP  75   2.196  -4.321  12.943
  600   2HB   TRP  75          2HB       TRP  75   3.476  -4.796  11.831
  601    HD1  TRP  75           HD       TRP  75   2.619  -3.007   9.335
  602    HE1  TRP  75           1HE      TRP  75   2.938  -0.456   9.445
  603    HE3  TRP  75           3HE      TRP  75   2.805  -2.432  14.411
  604    HZ2  TRP  75           2HZ      TRP  75   3.231   1.537  11.423
  605    HZ3  TRP  75           3HZ      TRP  75   3.108  -0.170  15.331
  606    HH2  TRP  75           HH       TRP  75   3.317   1.772  13.867
  607    H    TYR  76           H        TYR  76   0.860  -3.770   8.986
  608    HA   TYR  76           HA       TYR  76  -1.588  -2.667  10.199
  609   1HB   TYR  76          1HB       TYR  76   0.547  -1.459   8.599
  610   2HB   TYR  76          2HB       TYR  76  -1.067  -1.087   8.002
  611    HD1  TYR  76           2HD      TYR  76  -2.568  -0.991  10.572
  612    HD2  TYR  76           1HD      TYR  76   1.250   0.570   9.530
  613    HE1  TYR  76           2HE      TYR  76  -2.812   0.741  12.301
  614    HE2  TYR  76           1HE      TYR  76   1.018   2.306  11.256
  615    HH   TYR  76           HH       TYR  76  -0.190   2.764  13.256
  616    H    LEU  77           H        LEU  77  -0.201  -3.696   7.085
  617    HA   LEU  77           HA       LEU  77  -2.740  -3.853   5.789
  618   1HB   LEU  77          1HB       LEU  77  -0.006  -4.881   5.070
  619   2HB   LEU  77          2HB       LEU  77  -1.416  -5.108   4.038
  620    HG   LEU  77           HG       LEU  77  -0.414  -2.394   4.877
  621   1HD1  LEU  77          1HD1      LEU  77   1.180  -3.941   3.491
  622   2HD1  LEU  77          2HD1      LEU  77   0.947  -2.253   3.038
  623   3HD1  LEU  77          3HD1      LEU  77   0.091  -3.525   2.167
  624   1HD2  LEU  77          1HD2      LEU  77  -2.653  -2.263   4.156
  625   2HD2  LEU  77          2HD2      LEU  77  -2.379  -3.400   2.835
  626   3HD2  LEU  77          3HD2      LEU  77  -1.682  -1.781   2.765
  627    H    GLY  78           H        GLY  78  -1.168  -5.838   8.009
  628   1HA   GLY  78          1HA       GLY  78  -1.739  -7.884   8.889
  629   2HA   GLY  78          2HA       GLY  78  -3.213  -7.803   7.935
  630    H    ALA  79           H        ALA  79  -1.621 -10.136   8.438
  631    HA   ALA  79           HA       ALA  79  -0.066 -10.726   6.105
  632   1HB   ALA  79          1HB       ALA  79  -0.765 -13.145   7.301
  633   2HB   ALA  79          2HB       ALA  79   0.721 -12.225   7.543
  634   3HB   ALA  79          3HB       ALA  79  -0.649 -11.989   8.629
  635    H    ARG  80           H        ARG  80  -3.400 -11.075   7.031
  636    HA   ARG  80           HA       ARG  80  -4.269 -13.083   5.339
  637   1HB   ARG  80          1HB       ARG  80  -5.756 -10.537   6.012
  638   2HB   ARG  80          2HB       ARG  80  -6.473 -12.042   5.452
  639   1HG   ARG  80          1HG       ARG  80  -4.994 -11.667   8.049
  640   2HG   ARG  80          2HG       ARG  80  -6.747 -11.737   7.858
  641   1HD   ARG  80          1HD       ARG  80  -4.812 -13.941   7.152
  642   2HD   ARG  80          2HD       ARG  80  -5.808 -13.881   8.605
  643    HE   ARG  80           HE       ARG  80  -7.608 -13.672   6.586
  644   1HH1  ARG  80          1HH1      ARG  80  -5.063 -15.927   7.331
  645   2HH1  ARG  80          2HH1      ARG  80  -5.857 -17.272   6.581
  646   1HH2  ARG  80          1HH2      ARG  80  -8.664 -15.435   5.595
  647   2HH2  ARG  80          2HH2      ARG  80  -7.905 -16.991   5.593
  648    H    CYS  81           H        CYS  81  -3.740  -9.656   4.641
  649    HA   CYS  81           HA       CYS  81  -4.482 -10.064   1.849
  650   1HB   CYS  81          1HB       CYS  81  -3.523  -7.495   3.105
  651   2HB   CYS  81          2HB       CYS  81  -4.455  -7.695   1.626
  652    HG   CYS  81           HG       CYS  81  -6.752  -7.409   2.721
  653    H    HIS  82           H        HIS  82  -3.061 -10.270   0.233
  654    HA   HIS  82           HA       HIS  82  -0.287 -10.611   0.820
  655   1HB   HIS  82          1HB       HIS  82  -1.633 -11.852  -0.951
  656   2HB   HIS  82          2HB       HIS  82  -1.508 -10.394  -1.931
  657    HD1  HIS  82           1HD      HIS  82   0.701 -13.022  -0.338
  658    HD2  HIS  82           2HD      HIS  82   0.823 -10.151  -3.339
  659    HE1  HIS  82           1HE      HIS  82   2.878 -13.397  -1.540
  660    H    ILE  83           H        ILE  83   1.288  -9.151   0.789
  661    HA   ILE  83           HA       ILE  83   0.756  -6.557  -0.506
  662    HB   ILE  83           HB       ILE  83   2.290  -5.537   1.092
  663   1HG1  ILE  83          1HG1      ILE  83   2.431  -8.276   2.370
  664   2HG1  ILE  83          2HG1      ILE  83   3.728  -7.522   1.450
  665   1HG2  ILE  83          1HG2      ILE  83   0.924  -5.888   3.161
  666   2HG2  ILE  83          2HG2      ILE  83  -0.009  -5.513   1.713
  667   3HG2  ILE  83          3HG2      ILE  83   0.072  -7.173   2.303
  668   1HD1  ILE  83          1HD1      ILE  83   3.799  -5.705   3.113
  669   2HD1  ILE  83          2HD1      ILE  83   2.574  -6.557   4.053
  670   3HD1  ILE  83          3HD1      ILE  83   4.158  -7.290   3.798
  671    H    GLU  84           H        GLU  84   2.425  -5.548  -1.657
  672    HA   GLU  84           HA       GLU  84   4.923  -6.981  -2.053
  673   1HB   GLU  84          1HB       GLU  84   2.792  -7.377  -3.822
  674   2HB   GLU  84          2HB       GLU  84   3.850  -6.235  -4.638
  675   1HG   GLU  84          1HG       GLU  84   5.522  -7.740  -4.889
  676   2HG   GLU  84          2HG       GLU  84   5.129  -8.593  -3.397
  677    H    LYS  85           H        LYS  85   6.437  -5.732  -3.451
  678    HA   LYS  85           HA       LYS  85   6.423  -2.981  -2.651
  679   1HB   LYS  85          1HB       LYS  85   8.300  -4.693  -4.256
  680   2HB   LYS  85          2HB       LYS  85   8.537  -2.954  -4.146
  681   1HG   LYS  85          1HG       LYS  85   8.823  -3.069  -1.782
  682   2HG   LYS  85          2HG       LYS  85   8.342  -4.767  -1.753
  683   1HD   LYS  85          1HD       LYS  85  10.709  -3.836  -3.347
  684   2HD   LYS  85          2HD       LYS  85  10.849  -4.215  -1.629
  685   1HE   LYS  85          1HE       LYS  85  10.108  -6.469  -2.014
  686   2HE   LYS  85          2HE       LYS  85   9.751  -6.109  -3.702
  687   1HZ   LYS  85          1HZ       LYS  85  12.377  -6.397  -2.392
  688   2HZ   LYS  85          2HZ       LYS  85  12.229  -5.520  -3.830
  689   3HZ   LYS  85          3HZ       LYS  85  11.798  -7.155  -3.789
  690    H    ALA  86           H        ALA  86   5.907  -1.208  -3.802
  691    HA   ALA  86           HA       ALA  86   4.698  -1.618  -6.427
  692   1HB   ALA  86          1HB       ALA  86   4.050  -0.013  -4.229
  693   2HB   ALA  86          2HB       ALA  86   4.566   1.099  -5.498
  694   3HB   ALA  86          3HB       ALA  86   3.259  -0.045  -5.805
  695    H    LYS  87           H        LYS  87   5.144  -0.126  -8.183
  696    HA   LYS  87           HA       LYS  87   7.722   1.248  -8.059
  697   1HB   LYS  87          1HB       LYS  87   8.617   0.172  -9.979
  698   2HB   LYS  87          2HB       LYS  87   8.057  -1.109  -8.910
  699   1HG   LYS  87          1HG       LYS  87   5.864  -0.605 -10.499
  700   2HG   LYS  87          2HG       LYS  87   7.227  -0.437 -11.608
  701   1HD   LYS  87          1HD       LYS  87   7.927  -2.629 -11.277
  702   2HD   LYS  87          2HD       LYS  87   7.063  -2.777  -9.745
  703   1HE   LYS  87          1HE       LYS  87   5.167  -3.425 -10.749
  704   2HE   LYS  87          2HE       LYS  87   5.323  -2.218 -12.024
  705   1HZ   LYS  87          1HZ       LYS  87   6.684  -4.854 -11.909
  706   2HZ   LYS  87          2HZ       LYS  87   6.974  -3.678 -13.090
  707   3HZ   LYS  87          3HZ       LYS  87   5.448  -4.400 -12.973
  708    H    GLY  88           H        GLY  88   7.899   3.002  -9.422
  709   1HA   GLY  88          1HA       GLY  88   7.139   4.111 -11.490
  710   2HA   GLY  88          2HA       GLY  88   5.513   3.595 -11.064
  711    H    THR  89           H        THR  89   4.951   5.858 -11.305
  712    HA   THR  89           HA       THR  89   5.831   7.542  -9.060
  713    HB   THR  89           HB       THR  89   5.246   9.464 -10.311
  714    HG1  THR  89           1HG      THR  89   3.925   7.657 -12.072
  715   1HG2  THR  89          1HG2      THR  89   6.744   9.370 -12.082
  716   2HG2  THR  89          2HG2      THR  89   6.289   7.720 -12.511
  717   3HG2  THR  89          3HG2      THR  89   7.271   8.020 -11.077
  718    H    ASP  90           H        ASP  90   4.036   9.189  -8.428
  719    HA   ASP  90           HA       ASP  90   1.976   7.789  -7.166
  720   1HB   ASP  90          1HB       ASP  90   1.273   9.834  -6.326
  721   2HB   ASP  90          2HB       ASP  90   2.955  10.174  -6.724
  722    H    GLN  91           H        GLN  91   2.068   9.449 -10.262
  723    HA   GLN  91           HA       GLN  91  -0.726   9.350 -10.759
  724   1HB   GLN  91          1HB       GLN  91   1.688   9.767 -12.500
  725   2HB   GLN  91          2HB       GLN  91   0.079   9.640 -13.198
  726   1HG   GLN  91          1HG       GLN  91   0.954  11.667 -11.152
  727   2HG   GLN  91          2HG       GLN  91   0.745  11.960 -12.878
  728   1HE2  GLN  91          1HE2      GLN  91  -1.395  11.752 -13.760
  729   2HE2  GLN  91          2HE2      GLN  91  -2.770  12.063 -12.761
  730    H    GLN  92           H        GLN  92   1.950   7.172 -11.419
  731    HA   GLN  92           HA       GLN  92   0.552   5.427 -13.156
  732   1HB   GLN  92          1HB       GLN  92   3.111   5.386 -11.675
  733   2HB   GLN  92          2HB       GLN  92   2.435   3.813 -12.076
  734   1HG   GLN  92          1HG       GLN  92   2.180   5.122 -14.441
  735   2HG   GLN  92          2HG       GLN  92   3.658   5.837 -13.798
  736   1HE2  GLN  92          1HE2      GLN  92   5.489   4.617 -13.645
  737   2HE2  GLN  92          2HE2      GLN  92   5.628   3.021 -14.293
  738    H    ASN  93           H        ASN  93   1.061   5.456  -9.658
  739    HA   ASN  93           HA       ASN  93  -0.340   2.975  -9.258
  740   1HB   ASN  93          1HB       ASN  93   0.826   5.058  -7.430
  741   2HB   ASN  93          2HB       ASN  93  -0.206   3.781  -6.793
  742   1HD2  ASN  93          1HD2      ASN  93   2.253   3.770  -9.341
  743   2HD2  ASN  93          2HD2      ASN  93   3.238   2.545  -8.623
  744    H    LYS  94           H        LYS  94  -1.072   6.407  -8.993
  745    HA   LYS  94           HA       LYS  94  -3.553   6.198  -7.698
  746   1HB   LYS  94          1HB       LYS  94  -2.286   8.311  -7.990
  747   2HB   LYS  94          2HB       LYS  94  -2.681   8.285  -9.704
  748   1HG   LYS  94          1HG       LYS  94  -4.921   8.753  -9.327
  749   2HG   LYS  94          2HG       LYS  94  -4.847   8.230  -7.643
  750   1HD   LYS  94          1HD       LYS  94  -4.542  10.353  -7.053
  751   2HD   LYS  94          2HD       LYS  94  -2.990  10.323  -7.893
  752   1HE   LYS  94          1HE       LYS  94  -4.171  10.938  -9.986
  753   2HE   LYS  94          2HE       LYS  94  -5.666  11.079  -9.062
  754   1HZ   LYS  94          1HZ       LYS  94  -4.948  13.229  -9.049
  755   2HZ   LYS  94          2HZ       LYS  94  -3.307  12.819  -9.057
  756   3HZ   LYS  94          3HZ       LYS  94  -4.206  12.683  -7.630
  757    H    GLU  95           H        GLU  95  -2.750   6.316 -11.158
  758    HA   GLU  95           HA       GLU  95  -5.453   6.074 -12.024
  759   1HB   GLU  95          1HB       GLU  95  -2.789   5.794 -13.387
  760   2HB   GLU  95          2HB       GLU  95  -4.282   5.416 -14.234
  761   1HG   GLU  95          1HG       GLU  95  -4.329   7.997 -12.875
  762   2HG   GLU  95          2HG       GLU  95  -3.092   7.868 -14.124
  763    H    TYR  96           H        TYR  96  -2.854   3.800 -11.385
  764    HA   TYR  96           HA       TYR  96  -3.894   1.520 -12.593
  765   1HB   TYR  96          1HB       TYR  96  -1.620   1.679 -11.630
  766   2HB   TYR  96          2HB       TYR  96  -2.317   1.666 -10.014
  767    HD1  TYR  96           1HD      TYR  96  -3.551  -0.388  -9.239
  768    HD2  TYR  96           2HD      TYR  96  -1.233  -0.333 -12.806
  769    HE1  TYR  96           1HE      TYR  96  -3.477  -2.846  -9.221
  770    HE2  TYR  96           2HE      TYR  96  -1.153  -2.791 -12.799
  771    HH   TYR  96           HH       TYR  96  -2.286  -4.668 -11.906
  772    H    CYS  97           H        CYS  97  -4.385   2.723  -9.283
  773    HA   CYS  97           HA       CYS  97  -6.138   0.632  -8.511
  774   1HB   CYS  97          1HB       CYS  97  -5.822   3.414  -7.363
  775   2HB   CYS  97          2HB       CYS  97  -6.675   2.084  -6.587
  776    HG   CYS  97           HG       CYS  97  -3.785   0.863  -7.222
  777    H    SER  98           H        SER  98  -6.609   3.771 -10.001
  778    HA   SER  98           HA       SER  98  -9.465   3.746  -9.705
  779   1HB   SER  98          1HB       SER  98  -8.388   5.889  -9.835
  780   2HB   SER  98          2HB       SER  98  -7.600   5.463 -11.354
  781    HG   SER  98           HG       SER  98  -9.943   6.623 -11.024
  782    H    LYS  99           H        LYS  99  -7.299   2.187 -11.754
  783    HA   LYS  99           HA       LYS  99  -8.591   2.177 -14.221
  784   1HB   LYS  99          1HB       LYS  99  -7.147   0.497 -14.810
  785   2HB   LYS  99          2HB       LYS  99  -6.316   1.111 -13.388
  786   1HG   LYS  99          1HG       LYS  99  -7.508  -0.666 -12.062
  787   2HG   LYS  99          2HG       LYS  99  -8.030  -1.347 -13.604
  788   1HD   LYS  99          1HD       LYS  99  -5.361  -1.036 -14.030
  789   2HD   LYS  99          2HD       LYS  99  -5.397  -1.405 -12.304
  790   1HE   LYS  99          1HE       LYS  99  -5.611  -3.554 -12.820
  791   2HE   LYS  99          2HE       LYS  99  -7.189  -3.190 -13.518
  792   1HZ   LYS  99          1HZ       LYS  99  -5.903  -2.588 -15.600
  793   2HZ   LYS  99          2HZ       LYS  99  -5.994  -4.232 -15.213
  794   3HZ   LYS  99          3HZ       LYS  99  -4.577  -3.365 -14.893
  795    H    GLU 100           H        GLU 100  -9.471   0.684 -11.246
  796    HA   GLU 100           HA       GLU 100 -11.139  -1.361 -12.329
  797   1HB   GLU 100          1HB       GLU 100 -11.420  -0.128  -9.594
  798   2HB   GLU 100          2HB       GLU 100 -11.854  -1.755 -10.099
  799   1HG   GLU 100          1HG       GLU 100  -9.053  -0.670  -9.914
  800   2HG   GLU 100          2HG       GLU 100  -9.830  -1.725  -8.735
  801    H    GLY 101           H        GLY 101 -11.480   2.012 -11.926
  802   1HA   GLY 101          1HA       GLY 101 -13.205   3.349 -12.737
  803   2HA   GLY 101          2HA       GLY 101 -14.170   1.902 -12.994
  804    H    ASN 102           H        ASN 102 -13.110   1.531  -9.962
  805    HA   ASN 102           HA       ASN 102 -15.208   3.188  -8.744
  806   1HB   ASN 102          1HB       ASN 102 -15.587   0.523  -9.186
  807   2HB   ASN 102          2HB       ASN 102 -14.888   0.503  -7.569
  808   1HD2  ASN 102          1HD2      ASN 102 -16.601   0.058  -6.336
  809   2HD2  ASN 102          2HD2      ASN 102 -18.044   1.006  -6.267
  810    H    LEU 103           H        LEU 103 -14.455   4.321  -7.088
  811    HA   LEU 103           HA       LEU 103 -11.908   3.524  -5.876
  812   1HB   LEU 103          1HB       LEU 103 -13.145   6.038  -6.566
  813   2HB   LEU 103          2HB       LEU 103 -12.661   6.018  -4.871
  814    HG   LEU 103           HG       LEU 103 -10.979   6.991  -6.448
  815   1HD1  LEU 103          1HD1      LEU 103  -9.241   5.044  -5.525
  816   2HD1  LEU 103          2HD1      LEU 103 -10.583   5.003  -4.382
  817   3HD1  LEU 103          3HD1      LEU 103  -9.723   6.513  -4.677
  818   1HD2  LEU 103          1HD2      LEU 103  -9.662   5.475  -7.818
  819   2HD2  LEU 103          2HD2      LEU 103 -11.354   5.447  -8.314
  820   3HD2  LEU 103          3HD2      LEU 103 -10.696   4.126  -7.348
  821    H    LEU 104           H        LEU 104 -11.912   2.567  -3.961
  822    HA   LEU 104           HA       LEU 104 -14.309   2.734  -2.289
  823   1HB   LEU 104          1HB       LEU 104 -13.454   0.511  -2.879
  824   2HB   LEU 104          2HB       LEU 104 -11.922   0.901  -2.100
  825    HG   LEU 104           HG       LEU 104 -12.968   0.936   0.064
  826   1HD1  LEU 104          1HD1      LEU 104 -15.073   1.738   0.031
  827   2HD1  LEU 104          2HD1      LEU 104 -15.497   0.030  -0.087
  828   3HD1  LEU 104          3HD1      LEU 104 -15.437   1.026  -1.542
  829   1HD2  LEU 104          1HD2      LEU 104 -12.610  -1.254   0.073
  830   2HD2  LEU 104          2HD2      LEU 104 -12.944  -1.358  -1.656
  831   3HD2  LEU 104          3HD2      LEU 104 -14.264  -1.492  -0.492
  832    H    MET 105           H        MET 105 -10.995   3.711  -2.409
  833    HA   MET 105           HA       MET 105 -11.342   5.109   0.135
  834   1HB   MET 105          1HB       MET 105  -9.950   2.806   0.152
  835   2HB   MET 105          2HB       MET 105  -8.664   3.915  -0.307
  836   1HG   MET 105          1HG       MET 105 -10.407   4.540   2.033
  837   2HG   MET 105          2HG       MET 105  -9.090   3.380   2.192
  838   1HE   MET 105          1HE       MET 105  -7.583   4.325   3.740
  839   2HE   MET 105          2HE       MET 105  -6.483   4.125   2.376
  840   3HE   MET 105          3HE       MET 105  -6.428   5.598   3.345
  841    H    GLU 106           H        GLU 106 -10.483   7.120   0.158
  842    HA   GLU 106           HA       GLU 106  -8.536   7.873  -1.884
  843   1HB   GLU 106          1HB       GLU 106 -11.088   8.313  -2.496
  844   2HB   GLU 106          2HB       GLU 106 -10.831   9.732  -1.491
  845   1HG   GLU 106          1HG       GLU 106  -8.764  10.137  -2.966
  846   2HG   GLU 106          2HG       GLU 106  -9.522   8.998  -4.076
  847    H    CYS 107           H        CYS 107  -6.924   8.501  -0.582
  848    HA   CYS 107           HA       CYS 107  -7.329  10.827   1.086
  849   1HB   CYS 107          1HB       CYS 107  -6.806   8.116   2.205
  850   2HB   CYS 107          2HB       CYS 107  -5.966   9.477   2.938
  851    HG   CYS 107           HG       CYS 107  -8.329   8.713   4.373
  852    H    GLY 108           H        GLY 108  -5.095  11.316   2.239
  853   1HA   GLY 108          1HA       GLY 108  -2.859  11.803   2.008
  854   2HA   GLY 108          2HA       GLY 108  -2.728  10.395   0.965
  855    H    ALA 109           H        ALA 109  -1.179  12.400   0.260
  856    HA   ALA 109           HA       ALA 109  -2.609  13.812  -1.895
  857   1HB   ALA 109          1HB       ALA 109  -1.543  15.674  -1.326
  858   2HB   ALA 109          2HB       ALA 109  -0.926  14.824   0.092
  859   3HB   ALA 109          3HB       ALA 109   0.022  14.863  -1.395
  860    HA   PRO 110           HA       PRO 110  -0.281  11.746  -4.989
  861   1HB   PRO 110          1HB       PRO 110   0.189  13.730  -6.782
  862   2HB   PRO 110          2HB       PRO 110  -1.407  13.010  -6.542
  863   1HG   PRO 110          1HG       PRO 110  -0.301  15.570  -5.455
  864   2HG   PRO 110          2HG       PRO 110  -1.905  15.245  -6.138
  865   1HD   PRO 110          1HD       PRO 110  -1.455  15.368  -3.471
  866   2HD   PRO 110          2HD       PRO 110  -2.685  14.305  -4.183
  867    H    ARG 111           H        ARG 111   1.733  11.044  -4.671
  868    HA   ARG 111           HA       ARG 111   3.832  12.690  -3.683
  869   1HB   ARG 111          1HB       ARG 111   3.690   9.868  -4.707
  870   2HB   ARG 111          2HB       ARG 111   5.236  10.610  -4.318
  871   1HG   ARG 111          1HG       ARG 111   3.285  10.955  -2.199
  872   2HG   ARG 111          2HG       ARG 111   3.586   9.258  -2.577
  873   1HD   ARG 111          1HD       ARG 111   5.077  10.280  -0.815
  874   2HD   ARG 111          2HD       ARG 111   5.900   9.476  -2.151
  875    HE   ARG 111           HE       ARG 111   5.591  12.233  -2.701
  876   1HH1  ARG 111          1HH1      ARG 111   7.432  10.020  -0.743
  877   2HH1  ARG 111          2HH1      ARG 111   8.814  11.059  -0.636
  878   1HH2  ARG 111          1HH2      ARG 111   7.405  13.610  -2.569
  879   2HH2  ARG 111          2HH2      ARG 111   8.797  13.101  -1.675
  880    H    SER 112           H        SER 112   5.831  13.193  -4.729
  881    HA   SER 112           HA       SER 112   6.018  12.948  -7.603
  882   1HB   SER 112          1HB       SER 112   6.472  15.683  -7.289
  883   2HB   SER 112          2HB       SER 112   5.080  14.934  -8.071
  884    HG   SER 112           HG       SER 112   5.317  16.040  -5.519
  885    H    GLN 113           H        GLN 113   8.048  12.329  -7.882
  886    HA   GLN 113           HA       GLN 113  10.097  12.683  -5.983
  887   1HB   GLN 113          1HB       GLN 113  10.265  11.966  -8.914
  888   2HB   GLN 113          2HB       GLN 113  11.601  11.843  -7.777
  889   1HG   GLN 113          1HG       GLN 113   9.373  10.463  -6.685
  890   2HG   GLN 113          2HG       GLN 113   9.592   9.941  -8.354
  891   1HE2  GLN 113          1HE2      GLN 113  12.225   9.953  -8.732
  892   2HE2  GLN 113          2HE2      GLN 113  13.021   8.869  -7.648
  893    H    GLY 114           H        GLY 114   9.988  14.015  -9.296
  894   1HA   GLY 114          1HA       GLY 114  10.272  16.662  -8.873
  895   2HA   GLY 114          2HA       GLY 114  11.895  16.066  -8.561
  896    H    GLN 115           H        GLN 115  13.160  15.330 -10.256
  897    HA   GLN 115           HA       GLN 115  12.022  15.427 -12.948
  898   1HB   GLN 115          1HB       GLN 115  13.809  17.407 -11.818
  899   2HB   GLN 115          2HB       GLN 115  14.531  16.631 -13.221
  900   1HG   GLN 115          1HG       GLN 115  13.402  18.112 -14.428
  901   2HG   GLN 115          2HG       GLN 115  11.975  17.143 -14.066
  902   1HE2  GLN 115          1HE2      GLN 115  12.958  20.176 -14.224
  903   2HE2  GLN 115          2HE2      GLN 115  12.015  20.899 -12.971
  904    H    ARG 116           H        ARG 116  15.283  15.209 -11.520
  905    HA   ARG 116           HA       ARG 116  15.544  12.544 -12.742
  906   1HB   ARG 116          1HB       ARG 116  17.776  13.019 -13.453
  907   2HB   ARG 116          2HB       ARG 116  16.751  14.321 -14.040
  908   1HG   ARG 116          1HG       ARG 116  17.559  15.328 -11.655
  909   2HG   ARG 116          2HG       ARG 116  18.970  14.379 -12.129
  910   1HD   ARG 116          1HD       ARG 116  18.916  15.529 -14.337
  911   2HD   ARG 116          2HD       ARG 116  17.620  16.554 -13.722
  912    HE   ARG 116           HE       ARG 116  19.731  16.740 -11.929
  913   1HH1  ARG 116          1HH1      ARG 116  19.080  17.512 -15.261
  914   2HH1  ARG 116          2HH1      ARG 116  20.188  18.843 -15.304
  915   1HH2  ARG 116          1HH2      ARG 116  21.192  18.491 -11.974
  916   2HH2  ARG 116          2HH2      ARG 116  21.389  19.398 -13.435
  Start of MODEL   30
    1    HA   PRO   2           HA       PRO   2  36.177  -1.315  15.352
    2   1HB   PRO   2          1HB       PRO   2  34.677  -1.639  17.592
    3   2HB   PRO   2          2HB       PRO   2  36.407  -1.999  17.533
    4   1HG   PRO   2          1HG       PRO   2  35.013   0.434  18.582
    5   2HG   PRO   2          2HG       PRO   2  36.370  -0.466  19.282
    6   1HD   PRO   2          1HD       PRO   2  36.707   1.844  17.910
    7   2HD   PRO   2          2HD       PRO   2  37.915   0.543  17.901
    8    H    SER   3           H        SER   3  34.633  -1.219  13.848
    9    HA   SER   3           HA       SER   3  32.397   0.615  14.133
   10   1HB   SER   3          1HB       SER   3  32.229  -1.119  11.822
   11   2HB   SER   3          2HB       SER   3  32.406   0.634  11.890
   12    HG   SER   3           HG       SER   3  34.234  -0.071  10.930
   13    H    LYS   4           H        LYS   4  30.300   0.054  14.457
   14    HA   LYS   4           HA       LYS   4  29.778  -2.515  15.613
   15   1HB   LYS   4          1HB       LYS   4  27.824  -0.317  14.915
   16   2HB   LYS   4          2HB       LYS   4  27.529  -1.669  16.000
   17   1HG   LYS   4          1HG       LYS   4  29.584  -0.703  17.290
   18   2HG   LYS   4          2HG       LYS   4  29.174   0.778  16.422
   19   1HD   LYS   4          1HD       LYS   4  26.779   0.356  17.274
   20   2HD   LYS   4          2HD       LYS   4  27.538  -0.756  18.415
   21   1HE   LYS   4          1HE       LYS   4  29.116   1.441  18.678
   22   2HE   LYS   4          2HE       LYS   4  27.552   2.180  18.335
   23   1HZ   LYS   4          1HZ       LYS   4  26.589   1.014  20.176
   24   2HZ   LYS   4          2HZ       LYS   4  27.964   1.832  20.723
   25   3HZ   LYS   4          3HZ       LYS   4  28.023   0.162  20.461
   26    H    LYS   5           H        LYS   5  28.419  -4.137  14.860
   27    HA   LYS   5           HA       LYS   5  28.455  -4.612  12.078
   28   1HB   LYS   5          1HB       LYS   5  27.093  -5.948  14.400
   29   2HB   LYS   5          2HB       LYS   5  26.781  -6.475  12.751
   30   1HG   LYS   5          1HG       LYS   5  29.588  -6.253  13.749
   31   2HG   LYS   5          2HG       LYS   5  28.603  -7.661  14.153
   32   1HD   LYS   5          1HD       LYS   5  28.424  -8.325  11.926
   33   2HD   LYS   5          2HD       LYS   5  28.854  -6.726  11.316
   34   1HE   LYS   5          1HE       LYS   5  30.890  -8.081  12.968
   35   2HE   LYS   5          2HE       LYS   5  30.560  -8.807  11.396
   36   1HZ   LYS   5          1HZ       LYS   5  30.749  -6.144  10.864
   37   2HZ   LYS   5          2HZ       LYS   5  31.960  -7.295  10.596
   38   3HZ   LYS   5          3HZ       LYS   5  31.955  -6.389  12.025
   39    H    ASN   6           H        ASN   6  27.342  -3.340  10.726
   40    HA   ASN   6           HA       ASN   6  24.697  -2.373  11.440
   41   1HB   ASN   6          1HB       ASN   6  26.801  -1.534   9.663
   42   2HB   ASN   6          2HB       ASN   6  25.290  -1.678   8.769
   43   1HD2  ASN   6          1HD2      ASN   6  26.840  -0.166  11.526
   44   2HD2  ASN   6          2HD2      ASN   6  25.758   1.176  11.637
   45    H    GLY   7           H        GLY   7  22.858  -2.636  10.011
   46   1HA   GLY   7          1HA       GLY   7  22.463  -5.346   9.264
   47   2HA   GLY   7          2HA       GLY   7  21.351  -4.019   8.961
   48    H    ARG   8           H        ARG   8  23.013  -6.357   7.461
   49    HA   ARG   8           HA       ARG   8  23.214  -4.792   4.976
   50   1HB   ARG   8          1HB       ARG   8  25.105  -6.942   5.943
   51   2HB   ARG   8          2HB       ARG   8  25.122  -6.264   4.320
   52   1HG   ARG   8          1HG       ARG   8  25.409  -3.997   5.503
   53   2HG   ARG   8          2HG       ARG   8  25.855  -4.963   6.911
   54   1HD   ARG   8          1HD       ARG   8  27.271  -6.029   4.728
   55   2HD   ARG   8          2HD       ARG   8  27.419  -4.277   4.607
   56    HE   ARG   8           HE       ARG   8  27.942  -4.855   7.233
   57   1HH1  ARG   8          1HH1      ARG   8  29.262  -5.817   4.159
   58   2HH1  ARG   8          2HH1      ARG   8  30.863  -6.062   4.776
   59   1HH2  ARG   8          1HH2      ARG   8  30.044  -5.174   8.057
   60   2HH2  ARG   8          2HH2      ARG   8  31.306  -5.697   6.994
   61    H    SER   9           H        SER   9  20.883  -5.916   5.380
   62    HA   SER   9           HA       SER   9  20.835  -8.633   4.353
   63   1HB   SER   9          1HB       SER   9  19.157  -7.151   6.031
   64   2HB   SER   9          2HB       SER   9  18.236  -7.357   4.541
   65    HG   SER   9           HG       SER   9  17.881  -9.117   5.899
   66    H    GLY  10           H        GLY  10  18.833  -8.917   2.717
   67   1HA   GLY  10          1HA       GLY  10  19.709  -7.585   0.312
   68   2HA   GLY  10          2HA       GLY  10  18.475  -8.832   0.427
   69    HA   PRO  11           HA       PRO  11  15.256  -5.891   0.032
   70   1HB   PRO  11          1HB       PRO  11  13.440  -6.645   1.904
   71   2HB   PRO  11          2HB       PRO  11  13.745  -7.575   0.432
   72   1HG   PRO  11          1HG       PRO  11  14.781  -8.024   3.204
   73   2HG   PRO  11          2HG       PRO  11  14.164  -9.206   2.035
   74   1HD   PRO  11          1HD       PRO  11  16.811  -8.813   2.449
   75   2HD   PRO  11          2HD       PRO  11  16.150  -9.278   0.868
   76    H    GLN  12           H        GLN  12  14.738  -3.870   0.694
   77    HA   GLN  12           HA       GLN  12  15.348  -3.132   3.477
   78   1HB   GLN  12          1HB       GLN  12  15.999  -0.854   2.450
   79   2HB   GLN  12          2HB       GLN  12  17.149  -2.180   2.341
   80   1HG   GLN  12          1HG       GLN  12  15.291  -1.970   0.081
   81   2HG   GLN  12          2HG       GLN  12  16.398  -0.611   0.269
   82   1HE2  GLN  12          1HE2      GLN  12  16.109  -3.057  -1.586
   83   2HE2  GLN  12          2HE2      GLN  12  17.723  -3.664  -1.684
   84    HA   PRO  13           HA       PRO  13  11.397  -1.238   3.673
   85   1HB   PRO  13          1HB       PRO  13  11.887   0.916   5.252
   86   2HB   PRO  13          2HB       PRO  13  11.862  -0.741   5.868
   87   1HG   PRO  13          1HG       PRO  13  14.204   0.967   5.122
   88   2HG   PRO  13          2HG       PRO  13  13.997  -0.097   6.526
   89   1HD   PRO  13          1HD       PRO  13  15.420  -0.828   4.341
   90   2HD   PRO  13          2HD       PRO  13  14.509  -1.994   5.321
   91    H    HIS  14           H        HIS  14  10.125   0.396   2.804
   92    HA   HIS  14           HA       HIS  14  11.476   2.627   1.472
   93   1HB   HIS  14          1HB       HIS  14   9.595   0.681   0.124
   94   2HB   HIS  14          2HB       HIS  14  10.061   2.233  -0.567
   95    HD1  HIS  14           1HD      HIS  14  11.373  -1.194   0.144
   96    HD2  HIS  14           2HD      HIS  14  12.654   2.346  -1.614
   97    HE1  HIS  14           1HE      HIS  14  13.504  -1.773  -1.059
   98    H    LYS  15           H        LYS  15   9.622   4.035   0.380
   99    HA   LYS  15           HA       LYS  15   7.660   4.508   2.514
  100   1HB   LYS  15          1HB       LYS  15   7.452   6.780   1.410
  101   2HB   LYS  15          2HB       LYS  15   9.000   6.434   2.171
  102   1HG   LYS  15          1HG       LYS  15   9.029   5.620  -0.587
  103   2HG   LYS  15          2HG       LYS  15   8.548   7.311  -0.436
  104   1HD   LYS  15          1HD       LYS  15  10.537   7.857   0.747
  105   2HD   LYS  15          2HD       LYS  15  10.960   6.156   0.950
  106   1HE   LYS  15          1HE       LYS  15  10.768   7.554  -1.714
  107   2HE   LYS  15          2HE       LYS  15  12.269   7.340  -0.814
  108   1HZ   LYS  15          1HZ       LYS  15  11.751   4.890  -0.875
  109   2HZ   LYS  15          2HZ       LYS  15  12.179   5.590  -2.354
  110   3HZ   LYS  15          3HZ       LYS  15  10.557   5.248  -2.019
  111    H    ARG  16           H        ARG  16   7.551   2.623   0.096
  112    HA   ARG  16           HA       ARG  16   4.836   3.381  -0.690
  113   1HB   ARG  16          1HB       ARG  16   6.871   2.418  -2.701
  114   2HB   ARG  16          2HB       ARG  16   5.229   2.959  -3.020
  115   1HG   ARG  16          1HG       ARG  16   5.806   5.219  -2.418
  116   2HG   ARG  16          2HG       ARG  16   7.426   4.710  -1.940
  117   1HD   ARG  16          1HD       ARG  16   6.234   4.715  -4.705
  118   2HD   ARG  16          2HD       ARG  16   7.585   5.681  -4.112
  119    HE   ARG  16           HE       ARG  16   8.384   3.091  -3.766
  120   1HH1  ARG  16          1HH1      ARG  16   7.274   4.996  -6.461
  121   2HH1  ARG  16          2HH1      ARG  16   8.197   4.114  -7.633
  122   1HH2  ARG  16          1HH2      ARG  16   9.604   1.922  -5.299
  123   2HH2  ARG  16          2HH2      ARG  16   9.521   2.365  -6.970
  124    H    TRP  17           H        TRP  17   3.472   1.728  -0.503
  125    HA   TRP  17           HA       TRP  17   4.357  -0.994  -0.982
  126   1HB   TRP  17          1HB       TRP  17   3.424  -0.025   1.717
  127   2HB   TRP  17          2HB       TRP  17   3.333  -1.719   1.243
  128    HD1  TRP  17           HD       TRP  17   5.775   0.932   2.400
  129    HE1  TRP  17           1HE      TRP  17   8.075  -0.151   2.800
  130    HE3  TRP  17           3HE      TRP  17   4.869  -3.670   0.367
  131    HZ2  TRP  17           2HZ      TRP  17   9.339  -2.628   2.318
  132    HZ3  TRP  17           3HZ      TRP  17   6.677  -5.340   0.375
  133    HH2  TRP  17           HH       TRP  17   8.865  -4.827   1.331
  134    H    VAL  18           H        VAL  18   2.748  -2.287  -1.723
  135    HA   VAL  18           HA       VAL  18   0.053  -1.100  -1.836
  136    HB   VAL  18           HB       VAL  18  -0.329  -2.407  -3.863
  137   1HG1  VAL  18          1HG1      VAL  18   2.182  -0.740  -3.917
  138   2HG1  VAL  18          2HG1      VAL  18   1.278  -1.236  -5.349
  139   3HG1  VAL  18          3HG1      VAL  18   0.528  -0.178  -4.153
  140   1HG2  VAL  18          1HG2      VAL  18   1.813  -3.939  -2.950
  141   2HG2  VAL  18          2HG2      VAL  18   0.933  -4.139  -4.465
  142   3HG2  VAL  18          3HG2      VAL  18   2.399  -3.160  -4.419
  143    H    PHE  19           H        PHE  19  -1.755  -2.638  -1.876
  144    HA   PHE  19           HA       PHE  19  -1.186  -5.176  -0.516
  145   1HB   PHE  19          1HB       PHE  19  -3.217  -4.752   0.927
  146   2HB   PHE  19          2HB       PHE  19  -1.820  -3.743   1.283
  147    HD1  PHE  19           1HD      PHE  19  -1.784  -1.379   0.487
  148    HD2  PHE  19           2HD      PHE  19  -5.269  -3.812   0.260
  149    HE1  PHE  19           1HE      PHE  19  -3.170   0.637   0.222
  150    HE2  PHE  19           2HE      PHE  19  -6.660  -1.801  -0.007
  151    HZ   PHE  19           HZ       PHE  19  -5.611   0.428  -0.027
  152    H    THR  20           H        THR  20  -2.590  -6.851  -0.973
  153    HA   THR  20           HA       THR  20  -4.913  -6.355  -2.652
  154    HB   THR  20           HB       THR  20  -4.249  -7.879  -4.413
  155    HG1  THR  20           1HG      THR  20  -2.245  -8.876  -4.399
  156   1HG2  THR  20          1HG2      THR  20  -2.590  -6.548  -5.510
  157   2HG2  THR  20          2HG2      THR  20  -1.990  -5.929  -3.971
  158   3HG2  THR  20          3HG2      THR  20  -3.591  -5.463  -4.546
  159    H    LEU  21           H        LEU  21  -6.525  -7.680  -2.109
  160    HA   LEU  21           HA       LEU  21  -5.913 -10.321  -1.006
  161   1HB   LEU  21          1HB       LEU  21  -6.190  -8.746   0.879
  162   2HB   LEU  21          2HB       LEU  21  -7.809  -8.370   0.293
  163    HG   LEU  21           HG       LEU  21  -7.830 -11.125   0.578
  164   1HD1  LEU  21          1HD1      LEU  21  -6.113  -9.847   2.666
  165   2HD1  LEU  21          2HD1      LEU  21  -5.893 -11.377   1.819
  166   3HD1  LEU  21          3HD1      LEU  21  -7.131 -11.230   3.065
  167   1HD2  LEU  21          1HD2      LEU  21  -9.478  -9.209   1.195
  168   2HD2  LEU  21          2HD2      LEU  21  -8.717  -9.314   2.783
  169   3HD2  LEU  21          3HD2      LEU  21  -9.522 -10.725   2.095
  170    H    ASN  22           H        ASN  22  -7.329 -11.886  -1.589
  171    HA   ASN  22           HA       ASN  22  -9.322 -11.193  -3.567
  172   1HB   ASN  22          1HB       ASN  22  -7.747 -13.499  -2.934
  173   2HB   ASN  22          2HB       ASN  22  -9.447 -13.959  -2.939
  174   1HD2  ASN  22          1HD2      ASN  22  -6.728 -13.200  -4.812
  175   2HD2  ASN  22          2HD2      ASN  22  -7.482 -13.259  -6.366
  176    H    ASN  23           H        ASN  23 -11.484 -11.198  -3.314
  177    HA   ASN  23           HA       ASN  23 -13.484 -11.059  -2.230
  178   1HB   ASN  23          1HB       ASN  23 -13.276 -13.511  -2.476
  179   2HB   ASN  23          2HB       ASN  23 -12.480 -13.589  -0.907
  180   1HD2  ASN  23          1HD2      ASN  23 -15.414 -12.177  -2.324
  181   2HD2  ASN  23          2HD2      ASN  23 -16.469 -12.664  -1.046
  182    HA   PRO  24           HA       PRO  24 -11.445  -9.284   1.587
  183   1HB   PRO  24          1HB       PRO  24 -12.143  -6.709   1.083
  184   2HB   PRO  24          2HB       PRO  24 -10.655  -7.439   0.468
  185   1HG   PRO  24          1HG       PRO  24 -13.267  -7.004  -0.927
  186   2HG   PRO  24          2HG       PRO  24 -11.620  -6.743  -1.530
  187   1HD   PRO  24          1HD       PRO  24 -13.071  -8.941  -2.159
  188   2HD   PRO  24          2HD       PRO  24 -11.303  -8.978  -1.999
  189    H    SER  25           H        SER  25 -12.516  -8.786   3.459
  190    HA   SER  25           HA       SER  25 -15.423  -8.991   3.366
  191   1HB   SER  25          1HB       SER  25 -13.399  -9.851   5.182
  192   2HB   SER  25          2HB       SER  25 -14.465  -8.740   6.043
  193    HG   SER  25           HG       SER  25 -15.490 -10.832   4.447
  194    H    GLU  26           H        GLU  26 -16.765  -7.561   4.655
  195    HA   GLU  26           HA       GLU  26 -16.353  -4.862   4.099
  196   1HB   GLU  26          1HB       GLU  26 -18.326  -6.462   5.487
  197   2HB   GLU  26          2HB       GLU  26 -18.064  -4.933   6.314
  198   1HG   GLU  26          1HG       GLU  26 -18.256  -4.065   3.777
  199   2HG   GLU  26          2HG       GLU  26 -19.292  -5.489   3.699
  200    H    ASP  27           H        ASP  27 -15.388  -6.790   6.835
  201    HA   ASP  27           HA       ASP  27 -14.762  -4.572   8.540
  202   1HB   ASP  27          1HB       ASP  27 -14.453  -7.524   8.652
  203   2HB   ASP  27          2HB       ASP  27 -13.350  -6.572   9.641
  204    H    GLU  28           H        GLU  28 -12.896  -6.758   6.465
  205    HA   GLU  28           HA       GLU  28 -10.348  -5.765   7.102
  206   1HB   GLU  28          1HB       GLU  28 -11.426  -7.691   5.350
  207   2HB   GLU  28          2HB       GLU  28 -10.484  -6.596   4.349
  208   1HG   GLU  28          1HG       GLU  28  -9.028  -8.327   4.994
  209   2HG   GLU  28          2HG       GLU  28  -8.587  -6.923   5.965
  210    H    ARG  29           H        ARG  29 -12.548  -4.930   4.434
  211    HA   ARG  29           HA       ARG  29 -10.880  -2.947   3.308
  212   1HB   ARG  29          1HB       ARG  29 -13.869  -3.354   3.130
  213   2HB   ARG  29          2HB       ARG  29 -12.974  -2.190   2.163
  214   1HG   ARG  29          1HG       ARG  29 -12.069  -3.783   0.825
  215   2HG   ARG  29          2HG       ARG  29 -12.049  -5.001   2.101
  216   1HD   ARG  29          1HD       ARG  29 -13.674  -5.428   0.233
  217   2HD   ARG  29          2HD       ARG  29 -14.371  -5.424   1.853
  218    HE   ARG  29           HE       ARG  29 -14.543  -2.858   0.640
  219   1HH1  ARG  29          1HH1      ARG  29 -15.990  -6.025   0.666
  220   2HH1  ARG  29          2HH1      ARG  29 -17.544  -5.462   0.148
  221   1HH2  ARG  29          1HH2      ARG  29 -16.585  -2.105  -0.043
  222   2HH2  ARG  29          2HH2      ARG  29 -17.881  -3.232  -0.256
  223    H    LYS  30           H        LYS  30 -13.245  -2.902   5.879
  224    HA   LYS  30           HA       LYS  30 -13.541  -0.078   6.026
  225   1HB   LYS  30          1HB       LYS  30 -14.286  -2.408   7.709
  226   2HB   LYS  30          2HB       LYS  30 -14.187  -0.849   8.517
  227   1HG   LYS  30          1HG       LYS  30 -15.830  -1.360   6.049
  228   2HG   LYS  30          2HG       LYS  30 -16.457  -1.451   7.696
  229   1HD   LYS  30          1HD       LYS  30 -15.292   0.973   7.777
  230   2HD   LYS  30          2HD       LYS  30 -15.723   0.902   6.066
  231   1HE   LYS  30          1HE       LYS  30 -17.886   1.214   6.511
  232   2HE   LYS  30          2HE       LYS  30 -17.880  -0.027   7.763
  233   1HZ   LYS  30          1HZ       LYS  30 -17.699   1.494   9.368
  234   2HZ   LYS  30          2HZ       LYS  30 -18.197   2.614   8.202
  235   3HZ   LYS  30          3HZ       LYS  30 -16.550   2.410   8.528
  236    H    LYS  31           H        LYS  31 -11.446  -2.411   7.657
  237    HA   LYS  31           HA       LYS  31 -10.286  -0.646   9.509
  238   1HB   LYS  31          1HB       LYS  31  -9.994  -2.987   9.839
  239   2HB   LYS  31          2HB       LYS  31  -9.286  -3.193   8.242
  240   1HG   LYS  31          1HG       LYS  31  -7.323  -1.926   8.940
  241   2HG   LYS  31          2HG       LYS  31  -8.035  -1.698  10.539
  242   1HD   LYS  31          1HD       LYS  31  -7.504  -3.781  11.203
  243   2HD   LYS  31          2HD       LYS  31  -7.923  -4.490   9.642
  244   1HE   LYS  31          1HE       LYS  31  -5.607  -4.825   9.875
  245   2HE   LYS  31          2HE       LYS  31  -5.769  -3.462   8.769
  246   1HZ   LYS  31          1HZ       LYS  31  -5.661  -2.524  11.427
  247   2HZ   LYS  31          2HZ       LYS  31  -4.599  -2.209  10.148
  248   3HZ   LYS  31          3HZ       LYS  31  -4.345  -3.550  11.148
  249    H    ILE  32           H        ILE  32  -9.108  -1.713   6.320
  250    HA   ILE  32           HA       ILE  32  -6.829  -0.045   6.303
  251    HB   ILE  32           HB       ILE  32  -8.342  -1.486   4.150
  252   1HG1  ILE  32          1HG1      ILE  32  -5.488  -1.702   5.132
  253   2HG1  ILE  32          2HG1      ILE  32  -6.814  -2.721   5.679
  254   1HG2  ILE  32          1HG2      ILE  32  -6.469  -0.772   2.606
  255   2HG2  ILE  32          2HG2      ILE  32  -7.669   0.459   2.995
  256   3HG2  ILE  32          3HG2      ILE  32  -6.096   0.480   3.791
  257   1HD1  ILE  32          1HD1      ILE  32  -6.664  -2.747   2.817
  258   2HD1  ILE  32          2HD1      ILE  32  -5.102  -3.161   3.523
  259   3HD1  ILE  32          3HD1      ILE  32  -6.540  -4.082   3.962
  260    H    ARG  33           H        ARG  33 -10.115   0.384   5.071
  261    HA   ARG  33           HA       ARG  33  -9.604   2.880   3.803
  262   1HB   ARG  33          1HB       ARG  33 -11.484   1.592   3.067
  263   2HB   ARG  33          2HB       ARG  33 -12.155   1.536   4.691
  264   1HG   ARG  33          1HG       ARG  33 -12.675   3.871   4.627
  265   2HG   ARG  33          2HG       ARG  33 -11.828   4.062   3.091
  266   1HD   ARG  33          1HD       ARG  33 -13.915   3.851   2.250
  267   2HD   ARG  33          2HD       ARG  33 -13.556   2.132   2.407
  268    HE   ARG  33           HE       ARG  33 -15.176   1.994   4.005
  269   1HH1  ARG  33          1HH1      ARG  33 -14.216   5.324   3.675
  270   2HH1  ARG  33          2HH1      ARG  33 -15.437   5.919   4.751
  271   1HH2  ARG  33          1HH2      ARG  33 -16.788   2.765   5.424
  272   2HH2  ARG  33          2HH2      ARG  33 -16.899   4.462   5.746
  273    H    ASP  34           H        ASP  34 -10.178   1.932   7.052
  274    HA   ASP  34           HA       ASP  34 -10.875   4.659   7.860
  275   1HB   ASP  34          1HB       ASP  34 -10.915   2.016   9.315
  276   2HB   ASP  34          2HB       ASP  34 -11.139   3.554  10.144
  277    H    LEU  35           H        LEU  35  -8.139   3.240   7.106
  278    HA   LEU  35           HA       LEU  35  -6.485   3.492   9.377
  279   1HB   LEU  35          1HB       LEU  35  -6.020   3.353   6.433
  280   2HB   LEU  35          2HB       LEU  35  -4.683   3.779   7.500
  281    HG   LEU  35           HG       LEU  35  -6.292   1.239   7.737
  282   1HD1  LEU  35          1HD1      LEU  35  -3.700   1.808   6.320
  283   2HD1  LEU  35          2HD1      LEU  35  -5.174   1.104   5.655
  284   3HD1  LEU  35          3HD1      LEU  35  -4.202   0.189   6.807
  285   1HD2  LEU  35          1HD2      LEU  35  -3.686   2.117   8.978
  286   2HD2  LEU  35          2HD2      LEU  35  -4.420   0.523   9.151
  287   3HD2  LEU  35          3HD2      LEU  35  -5.232   1.944   9.809
  288    HA   PRO  36           HA       PRO  36  -5.674   7.789   9.739
  289   1HB   PRO  36          1HB       PRO  36  -3.019   7.839  10.298
  290   2HB   PRO  36          2HB       PRO  36  -4.233   7.278  11.453
  291   1HG   PRO  36          1HG       PRO  36  -2.450   5.682   9.654
  292   2HG   PRO  36          2HG       PRO  36  -2.869   5.397  11.353
  293   1HD   PRO  36          1HD       PRO  36  -4.044   4.052   9.317
  294   2HD   PRO  36          2HD       PRO  36  -4.900   4.443  10.823
  295    H    ILE  37           H        ILE  37  -5.694   9.175   8.091
  296    HA   ILE  37           HA       ILE  37  -4.291   8.737   5.657
  297    HB   ILE  37           HB       ILE  37  -5.027  11.106   5.131
  298   1HG1  ILE  37          1HG1      ILE  37  -6.582  10.807   7.705
  299   2HG1  ILE  37          2HG1      ILE  37  -5.132  11.792   7.552
  300   1HG2  ILE  37          1HG2      ILE  37  -7.539   9.869   5.863
  301   2HG2  ILE  37          2HG2      ILE  37  -6.849  10.163   4.267
  302   3HG2  ILE  37          3HG2      ILE  37  -6.415   8.706   5.161
  303   1HD1  ILE  37          1HD1      ILE  37  -6.528  13.454   7.074
  304   2HD1  ILE  37          2HD1      ILE  37  -6.690  12.695   5.490
  305   3HD1  ILE  37          3HD1      ILE  37  -7.869  12.354   6.757
  306    H    SER  38           H        SER  38  -3.680  10.667   8.521
  307    HA   SER  38           HA       SER  38  -1.591  12.248   7.452
  308   1HB   SER  38          1HB       SER  38  -0.974  12.221  10.069
  309   2HB   SER  38          2HB       SER  38  -2.296  13.187   9.413
  310    HG   SER  38           HG       SER  38  -2.513  10.593  10.550
  311    H    LEU  39           H        LEU  39  -1.751   8.969   8.365
  312    HA   LEU  39           HA       LEU  39   1.029   8.644   9.016
  313   1HB   LEU  39          1HB       LEU  39  -1.190   7.176   9.503
  314   2HB   LEU  39          2HB       LEU  39  -0.514   6.295   8.134
  315    HG   LEU  39           HG       LEU  39   1.368   6.913  10.322
  316   1HD1  LEU  39          1HD1      LEU  39  -0.672   6.360  11.572
  317   2HD1  LEU  39          2HD1      LEU  39   0.570   5.120  11.743
  318   3HD1  LEU  39          3HD1      LEU  39  -0.803   4.850  10.670
  319   1HD2  LEU  39          1HD2      LEU  39   1.914   5.588   8.288
  320   2HD2  LEU  39          2HD2      LEU  39   0.764   4.365   8.828
  321   3HD2  LEU  39          3HD2      LEU  39   2.193   4.723   9.799
  322    H    PHE  40           H        PHE  40  -0.930   8.493   6.145
  323    HA   PHE  40           HA       PHE  40   1.482   7.822   4.592
  324   1HB   PHE  40          1HB       PHE  40  -1.285   7.113   3.653
  325   2HB   PHE  40          2HB       PHE  40   0.261   6.460   3.120
  326    HD1  PHE  40           2HD      PHE  40  -2.301   6.370   5.738
  327    HD2  PHE  40           1HD      PHE  40   1.347   4.695   4.325
  328    HE1  PHE  40           2HE      PHE  40  -2.565   4.488   7.300
  329    HE2  PHE  40           1HE      PHE  40   1.089   2.809   5.884
  330    HZ   PHE  40           HZ       PHE  40  -0.869   2.704   7.376
  331    H    ASP  41           H        ASP  41   2.113   9.550   3.497
  332    HA   ASP  41           HA       ASP  41   0.701  11.886   3.098
  333   1HB   ASP  41          1HB       ASP  41   3.209  11.380   2.732
  334   2HB   ASP  41          2HB       ASP  41   2.734  10.928   1.097
  335    H    TYR  42           H        TYR  42   0.648   8.940   1.234
  336    HA   TYR  42           HA       TYR  42  -1.515  10.067  -0.396
  337   1HB   TYR  42          1HB       TYR  42   0.490  10.166  -1.784
  338   2HB   TYR  42          2HB       TYR  42   0.816   8.465  -1.471
  339    HD1  TYR  42           1HD      TYR  42  -2.513   9.918  -2.180
  340    HD2  TYR  42           2HD      TYR  42   0.750   7.646  -3.693
  341    HE1  TYR  42           1HE      TYR  42  -3.859   9.304  -4.144
  342    HE2  TYR  42           2HE      TYR  42  -0.587   7.027  -5.662
  343    HH   TYR  42           HH       TYR  42  -3.967   8.047  -5.983
  344    H    PHE  43           H        PHE  43  -3.262   8.827  -0.337
  345    HA   PHE  43           HA       PHE  43  -2.947   5.934   0.060
  346   1HB   PHE  43          1HB       PHE  43  -3.718   7.503   2.111
  347   2HB   PHE  43          2HB       PHE  43  -5.284   7.211   1.361
  348    HD1  PHE  43           1HD      PHE  43  -4.278   4.384   0.335
  349    HD2  PHE  43           2HD      PHE  43  -4.446   6.321   4.121
  350    HE1  PHE  43           1HE      PHE  43  -4.402   2.192   1.446
  351    HE2  PHE  43           2HE      PHE  43  -4.569   4.133   5.239
  352    HZ   PHE  43           HZ       PHE  43  -4.547   2.065   3.902
  353    H    ILE  44           H        ILE  44  -3.808   4.943  -1.630
  354    HA   ILE  44           HA       ILE  44  -6.386   5.887  -2.666
  355    HB   ILE  44           HB       ILE  44  -4.934   6.795  -4.279
  356   1HG1  ILE  44          1HG1      ILE  44  -5.332   4.239  -5.716
  357   2HG1  ILE  44          2HG1      ILE  44  -6.769   4.928  -4.970
  358   1HG2  ILE  44          1HG2      ILE  44  -3.196   5.264  -5.398
  359   2HG2  ILE  44          2HG2      ILE  44  -2.837   5.908  -3.797
  360   3HG2  ILE  44          3HG2      ILE  44  -3.393   4.244  -3.973
  361   1HD1  ILE  44          1HD1      ILE  44  -5.787   7.107  -6.195
  362   2HD1  ILE  44          2HD1      ILE  44  -5.211   5.845  -7.285
  363   3HD1  ILE  44          3HD1      ILE  44  -6.934   5.992  -6.937
  364    H    VAL  45           H        VAL  45  -7.788   4.277  -2.517
  365    HA   VAL  45           HA       VAL  45  -6.827   1.524  -2.954
  366    HB   VAL  45           HB       VAL  45  -9.213   2.152  -1.243
  367   1HG1  VAL  45          1HG1      VAL  45  -7.600  -0.099  -0.468
  368   2HG1  VAL  45          2HG1      VAL  45  -9.292  -0.053  -0.968
  369   3HG1  VAL  45          3HG1      VAL  45  -8.018  -0.201  -2.178
  370   1HG2  VAL  45          1HG2      VAL  45  -7.487   1.745   0.673
  371   2HG2  VAL  45          2HG2      VAL  45  -6.321   2.327  -0.515
  372   3HG2  VAL  45          3HG2      VAL  45  -7.668   3.354  -0.024
  373    H    GLY  46           H        GLY  46  -8.019   0.203  -4.266
  374   1HA   GLY  46          1HA       GLY  46 -10.485   1.342  -5.420
  375   2HA   GLY  46          2HA       GLY  46  -9.234   0.661  -6.449
  376    H    GLU  47           H        GLU  47 -12.165  -0.008  -5.575
  377    HA   GLU  47           HA       GLU  47 -11.763  -2.775  -4.730
  378   1HB   GLU  47          1HB       GLU  47 -13.498  -1.352  -3.632
  379   2HB   GLU  47          2HB       GLU  47 -14.354  -1.283  -5.166
  380   1HG   GLU  47          1HG       GLU  47 -15.462  -2.955  -4.026
  381   2HG   GLU  47          2HG       GLU  47 -14.338  -3.852  -5.046
  382    H    GLU  48           H        GLU  48 -11.940  -4.471  -6.058
  383    HA   GLU  48           HA       GLU  48 -12.662  -3.945  -8.852
  384   1HB   GLU  48          1HB       GLU  48 -10.424  -4.967  -8.264
  385   2HB   GLU  48          2HB       GLU  48 -11.300  -6.398  -7.740
  386   1HG   GLU  48          1HG       GLU  48 -12.084  -6.834  -9.930
  387   2HG   GLU  48          2HG       GLU  48 -11.540  -5.260 -10.508
  388    H    GLY  49           H        GLY  49 -14.434  -4.796  -9.756
  389   1HA   GLY  49          1HA       GLY  49 -15.679  -7.173  -8.646
  390   2HA   GLY  49          2HA       GLY  49 -16.619  -5.696  -8.489
  391    H    ASN  50           H        ASN  50 -15.066  -7.843 -10.828
  392    HA   ASN  50           HA       ASN  50 -16.099  -6.672 -13.156
  393   1HB   ASN  50          1HB       ASN  50 -14.527  -8.919 -12.513
  394   2HB   ASN  50          2HB       ASN  50 -15.896  -9.535 -13.434
  395   1HD2  ASN  50          1HD2      ASN  50 -13.749  -6.706 -13.528
  396   2HD2  ASN  50          2HD2      ASN  50 -13.427  -6.798 -15.223
  397    H    GLU  51           H        GLU  51 -17.466  -8.532 -14.579
  398    HA   GLU  51           HA       GLU  51 -20.118  -8.131 -13.795
  399   1HB   GLU  51          1HB       GLU  51 -18.727  -9.702 -15.874
  400   2HB   GLU  51          2HB       GLU  51 -20.338 -10.265 -15.454
  401   1HG   GLU  51          1HG       GLU  51 -21.071  -7.838 -15.792
  402   2HG   GLU  51          2HG       GLU  51 -19.518  -7.623 -16.597
  403    H    GLU  52           H        GLU  52 -21.694 -10.092 -13.638
  404    HA   GLU  52           HA       GLU  52 -21.402 -11.268 -11.154
  405   1HB   GLU  52          1HB       GLU  52 -23.250 -12.751 -11.792
  406   2HB   GLU  52          2HB       GLU  52 -23.556 -11.092 -12.289
  407   1HG   GLU  52          1HG       GLU  52 -22.230 -12.533 -14.389
  408   2HG   GLU  52          2HG       GLU  52 -23.673 -13.397 -13.861
  409    H    GLY  53           H        GLY  53 -21.083 -13.491 -10.524
  410   1HA   GLY  53          1HA       GLY  53 -20.261 -15.680 -10.862
  411   2HA   GLY  53          2HA       GLY  53 -19.643 -15.181 -12.429
  412    H    ARG  54           H        ARG  54 -18.446 -12.735 -11.169
  413    HA   ARG  54           HA       ARG  54 -16.046 -14.069 -10.124
  414   1HB   ARG  54          1HB       ARG  54 -15.907 -12.627 -12.203
  415   2HB   ARG  54          2HB       ARG  54 -16.246 -11.246 -11.168
  416   1HG   ARG  54          1HG       ARG  54 -13.971 -11.165 -11.222
  417   2HG   ARG  54          2HG       ARG  54 -14.208 -12.184  -9.801
  418   1HD   ARG  54          1HD       ARG  54 -13.181 -13.906 -10.769
  419   2HD   ARG  54          2HD       ARG  54 -14.169 -13.757 -12.222
  420    HE   ARG  54           HE       ARG  54 -12.382 -11.753 -12.497
  421   1HH1  ARG  54          1HH1      ARG  54 -12.058 -15.151 -11.813
  422   2HH1  ARG  54          2HH1      ARG  54 -10.511 -15.291 -12.580
  423   1HH2  ARG  54          1HH2      ARG  54 -10.345 -11.924 -13.510
  424   2HH2  ARG  54          2HH2      ARG  54  -9.537 -13.455 -13.544
  425    H    THR  55           H        THR  55 -15.253 -13.617  -8.143
  426    HA   THR  55           HA       THR  55 -16.939 -12.145  -6.323
  427    HB   THR  55           HB       THR  55 -14.676 -12.795  -4.889
  428    HG1  THR  55           1HG      THR  55 -15.185 -14.998  -6.606
  429   1HG2  THR  55          1HG2      THR  55 -16.382 -13.623  -3.715
  430   2HG2  THR  55          2HG2      THR  55 -16.335 -15.046  -4.755
  431   3HG2  THR  55          3HG2      THR  55 -17.401 -13.698  -5.152
  432    HA   PRO  56           HA       PRO  56 -14.789  -8.322  -6.174
  433   1HB   PRO  56          1HB       PRO  56 -14.879  -7.717  -3.529
  434   2HB   PRO  56          2HB       PRO  56 -16.299  -7.649  -4.578
  435   1HG   PRO  56          1HG       PRO  56 -15.449  -9.800  -2.678
  436   2HG   PRO  56          2HG       PRO  56 -17.066  -9.125  -2.954
  437   1HD   PRO  56          1HD       PRO  56 -16.269 -11.482  -4.023
  438   2HD   PRO  56          2HD       PRO  56 -17.413 -10.399  -4.843
  439    H    HIS  57           H        HIS  57 -12.795  -7.383  -5.764
  440    HA   HIS  57           HA       HIS  57 -10.902  -8.844  -4.075
  441   1HB   HIS  57          1HB       HIS  57 -10.405  -9.781  -6.199
  442   2HB   HIS  57          2HB       HIS  57 -10.533  -8.219  -7.002
  443    HD1  HIS  57           1HD      HIS  57  -8.399  -7.003  -7.367
  444    HD2  HIS  57           2HD      HIS  57  -8.051  -9.921  -4.430
  445    HE1  HIS  57           1HE      HIS  57  -5.959  -7.057  -6.758
  446    H    LEU  58           H        LEU  58  -9.435  -7.572  -3.043
  447    HA   LEU  58           HA       LEU  58  -9.805  -4.689  -3.323
  448   1HB   LEU  58          1HB       LEU  58  -9.543  -6.348  -1.136
  449   2HB   LEU  58          2HB       LEU  58  -7.956  -5.590  -1.261
  450    HG   LEU  58           HG       LEU  58 -10.614  -4.217  -0.890
  451   1HD1  LEU  58          1HD1      LEU  58  -8.167  -4.519   0.838
  452   2HD1  LEU  58          2HD1      LEU  58  -9.792  -5.125   1.156
  453   3HD1  LEU  58          3HD1      LEU  58  -9.479  -3.390   1.175
  454   1HD2  LEU  58          1HD2      LEU  58  -9.227  -2.137  -0.776
  455   2HD2  LEU  58          2HD2      LEU  58  -9.357  -2.849  -2.385
  456   3HD2  LEU  58          3HD2      LEU  58  -7.884  -3.068  -1.439
  457    H    GLN  59           H        GLN  59  -8.274  -3.321  -4.047
  458    HA   GLN  59           HA       GLN  59  -5.502  -4.108  -4.221
  459   1HB   GLN  59          1HB       GLN  59  -6.198  -5.125  -6.252
  460   2HB   GLN  59          2HB       GLN  59  -7.201  -3.746  -6.683
  461   1HG   GLN  59          1HG       GLN  59  -5.236  -3.741  -8.047
  462   2HG   GLN  59          2HG       GLN  59  -5.160  -2.382  -6.927
  463   1HE2  GLN  59          1HE2      GLN  59  -3.718  -2.483  -5.167
  464   2HE2  GLN  59          2HE2      GLN  59  -2.350  -3.538  -5.191
  465    H    GLY  60           H        GLY  60  -4.547  -2.369  -3.395
  466   1HA   GLY  60          1HA       GLY  60  -5.026   0.225  -4.628
  467   2HA   GLY  60          2HA       GLY  60  -5.400   0.108  -2.915
  468    H    PHE  61           H        PHE  61  -3.601   1.938  -3.515
  469    HA   PHE  61           HA       PHE  61  -1.064   0.727  -2.651
  470   1HB   PHE  61          1HB       PHE  61  -0.631   1.245  -4.915
  471   2HB   PHE  61          2HB       PHE  61  -1.502   2.772  -4.818
  472    HD1  PHE  61           2HD      PHE  61   1.295   1.186  -2.916
  473    HD2  PHE  61           1HD      PHE  61  -0.137   4.591  -5.031
  474    HE1  PHE  61           2HE      PHE  61   3.408   2.357  -2.454
  475    HE2  PHE  61           1HE      PHE  61   1.976   5.767  -4.573
  476    HZ   PHE  61           HZ       PHE  61   3.751   4.651  -3.283
  477    H    ALA  62           H        ALA  62   0.052   1.816  -1.089
  478    HA   ALA  62           HA       ALA  62  -0.997   4.419  -0.215
  479   1HB   ALA  62          1HB       ALA  62  -0.255   3.133   2.135
  480   2HB   ALA  62          2HB       ALA  62  -1.897   3.477   1.587
  481   3HB   ALA  62          3HB       ALA  62  -1.154   1.918   1.225
  482    H    ASN  63           H        ASN  63   0.561   5.878   0.028
  483    HA   ASN  63           HA       ASN  63   3.339   5.007  -0.025
  484   1HB   ASN  63          1HB       ASN  63   2.553   6.815  -1.544
  485   2HB   ASN  63          2HB       ASN  63   2.210   7.812  -0.133
  486   1HD2  ASN  63          1HD2      ASN  63   4.234   7.714  -2.502
  487   2HD2  ASN  63          2HD2      ASN  63   5.722   8.141  -1.735
  488    H    PHE  64           H        PHE  64   4.325   4.614   1.837
  489    HA   PHE  64           HA       PHE  64   3.366   5.566   4.342
  490   1HB   PHE  64          1HB       PHE  64   5.326   3.676   3.406
  491   2HB   PHE  64          2HB       PHE  64   6.026   4.686   4.667
  492    HD1  PHE  64           2HD      PHE  64   4.612   4.959   6.825
  493    HD2  PHE  64           1HD      PHE  64   4.057   1.840   3.983
  494    HE1  PHE  64           2HE      PHE  64   3.479   3.605   8.538
  495    HE2  PHE  64           1HE      PHE  64   2.922   0.481   5.692
  496    HZ   PHE  64           HZ       PHE  64   2.633   1.362   7.973
  497    H    VAL  65           H        VAL  65   3.847   7.369   5.418
  498    HA   VAL  65           HA       VAL  65   5.276   9.479   4.248
  499    HB   VAL  65           HB       VAL  65   4.466   9.048   7.124
  500   1HG1  VAL  65          1HG1      VAL  65   6.044  10.654   7.458
  501   2HG1  VAL  65          2HG1      VAL  65   5.935  11.262   5.805
  502   3HG1  VAL  65          3HG1      VAL  65   4.697  11.690   6.987
  503   1HG2  VAL  65          1HG2      VAL  65   2.694   9.230   5.323
  504   2HG2  VAL  65          2HG2      VAL  65   2.582  10.391   6.646
  505   3HG2  VAL  65          3HG2      VAL  65   3.240  10.891   5.087
  506    H    LYS  66           H        LYS  66   6.308   6.836   6.227
  507    HA   LYS  66           HA       LYS  66   9.031   7.959   6.256
  508   1HB   LYS  66          1HB       LYS  66   9.347   6.579   8.377
  509   2HB   LYS  66          2HB       LYS  66   8.369   8.034   8.518
  510   1HG   LYS  66          1HG       LYS  66   6.933   5.520   7.920
  511   2HG   LYS  66          2HG       LYS  66   7.635   5.681   9.532
  512   1HD   LYS  66          1HD       LYS  66   6.096   7.985   8.466
  513   2HD   LYS  66          2HD       LYS  66   5.189   6.551   8.953
  514   1HE   LYS  66          1HE       LYS  66   5.860   6.725  11.167
  515   2HE   LYS  66          2HE       LYS  66   7.266   7.710  10.767
  516   1HZ   LYS  66          1HZ       LYS  66   4.950   9.074   9.965
  517   2HZ   LYS  66          2HZ       LYS  66   6.076   9.519  11.146
  518   3HZ   LYS  66          3HZ       LYS  66   4.738   8.573  11.567
  519    H    LYS  67           H        LYS  67  10.508   5.885   7.039
  520    HA   LYS  67           HA       LYS  67  10.205   4.015   4.825
  521   1HB   LYS  67          1HB       LYS  67  12.467   4.452   6.783
  522   2HB   LYS  67          2HB       LYS  67  12.499   3.284   5.468
  523   1HG   LYS  67          1HG       LYS  67  11.956   6.155   4.872
  524   2HG   LYS  67          2HG       LYS  67  13.609   5.617   5.178
  525   1HD   LYS  67          1HD       LYS  67  12.690   3.720   3.429
  526   2HD   LYS  67          2HD       LYS  67  11.885   5.182   2.853
  527   1HE   LYS  67          1HE       LYS  67  13.936   6.294   2.511
  528   2HE   LYS  67          2HE       LYS  67  14.831   5.098   3.446
  529   1HZ   LYS  67          1HZ       LYS  67  13.546   3.769   1.353
  530   2HZ   LYS  67          2HZ       LYS  67  15.207   3.992   1.583
  531   3HZ   LYS  67          3HZ       LYS  67  14.318   5.121   0.691
  532    H    GLN  68           H        GLN  68   9.344   2.069   5.075
  533    HA   GLN  68           HA       GLN  68   9.558   0.737   7.682
  534   1HB   GLN  68          1HB       GLN  68   7.032   0.885   6.028
  535   2HB   GLN  68          2HB       GLN  68   7.231  -0.017   7.524
  536   1HG   GLN  68          1HG       GLN  68   7.705   2.933   7.450
  537   2HG   GLN  68          2HG       GLN  68   6.072   2.281   7.584
  538   1HE2  GLN  68          1HE2      GLN  68   8.884   3.128   9.233
  539   2HE2  GLN  68          2HE2      GLN  68   8.476   2.473  10.778
  540    H    THR  69           H        THR  69   9.391  -1.567   7.604
  541    HA   THR  69           HA       THR  69  10.356  -2.648   5.071
  542    HB   THR  69           HB       THR  69  11.202  -4.488   6.261
  543    HG1  THR  69           1HG      THR  69  10.530  -4.916   8.442
  544   1HG2  THR  69          1HG2      THR  69  12.433  -2.436   6.754
  545   2HG2  THR  69          2HG2      THR  69  12.447  -3.520   8.145
  546   3HG2  THR  69          3HG2      THR  69  11.375  -2.120   8.129
  547    H    PHE  70           H        PHE  70   9.620  -4.979   4.612
  548    HA   PHE  70           HA       PHE  70   6.882  -4.943   3.998
  549   1HB   PHE  70          1HB       PHE  70   8.225  -6.287   2.613
  550   2HB   PHE  70          2HB       PHE  70   8.968  -7.109   3.980
  551    HD1  PHE  70           1HD      PHE  70   5.629  -6.632   2.395
  552    HD2  PHE  70           2HD      PHE  70   8.255  -9.228   4.510
  553    HE1  PHE  70           1HE      PHE  70   3.993  -8.457   2.179
  554    HE2  PHE  70           2HE      PHE  70   6.624 -11.058   4.297
  555    HZ   PHE  70           HZ       PHE  70   4.490 -10.674   3.129
  556    H    ASN  71           H        ASN  71   8.640  -6.900   6.404
  557    HA   ASN  71           HA       ASN  71   6.376  -8.123   7.522
  558   1HB   ASN  71          1HB       ASN  71   9.213  -7.912   8.142
  559   2HB   ASN  71          2HB       ASN  71   8.222  -7.943   9.597
  560   1HD2  ASN  71          1HD2      ASN  71   7.036  -9.770  10.088
  561   2HD2  ASN  71          2HD2      ASN  71   7.295 -11.284   9.298
  562    H    LYS  72           H        LYS  72   8.071  -5.135   8.360
  563    HA   LYS  72           HA       LYS  72   6.598  -4.550  10.693
  564   1HB   LYS  72          1HB       LYS  72   8.797  -3.490   9.633
  565   2HB   LYS  72          2HB       LYS  72   7.637  -2.333   8.993
  566   1HG   LYS  72          1HG       LYS  72   8.106  -2.994  11.892
  567   2HG   LYS  72          2HG       LYS  72   8.556  -1.506  11.055
  568   1HD   LYS  72          1HD       LYS  72   6.131  -1.132  10.581
  569   2HD   LYS  72          2HD       LYS  72   5.770  -2.523  11.606
  570   1HE   LYS  72          1HE       LYS  72   7.085   0.065  12.412
  571   2HE   LYS  72          2HE       LYS  72   5.511  -0.544  12.922
  572   1HZ   LYS  72          1HZ       LYS  72   7.049  -2.536  13.722
  573   2HZ   LYS  72          2HZ       LYS  72   6.715  -1.196  14.698
  574   3HZ   LYS  72          3HZ       LYS  72   8.173  -1.278  13.845
  575    H    VAL  73           H        VAL  73   6.225  -3.415   7.340
  576    HA   VAL  73           HA       VAL  73   4.046  -1.739   7.693
  577    HB   VAL  73           HB       VAL  73   4.817  -3.457   5.339
  578   1HG1  VAL  73          1HG1      VAL  73   2.547  -1.515   5.635
  579   2HG1  VAL  73          2HG1      VAL  73   3.268  -1.876   4.065
  580   3HG1  VAL  73          3HG1      VAL  73   2.514  -3.162   5.008
  581   1HG2  VAL  73          1HG2      VAL  73   6.157  -1.391   6.249
  582   2HG2  VAL  73          2HG2      VAL  73   5.918  -1.616   4.516
  583   3HG2  VAL  73          3HG2      VAL  73   4.906  -0.478   5.405
  584    H    LYS  74           H        LYS  74   4.197  -5.198   7.735
  585    HA   LYS  74           HA       LYS  74   1.495  -5.777   7.169
  586   1HB   LYS  74          1HB       LYS  74   3.450  -7.327   8.879
  587   2HB   LYS  74          2HB       LYS  74   1.944  -7.953   8.220
  588   1HG   LYS  74          1HG       LYS  74   3.233  -7.004   5.990
  589   2HG   LYS  74          2HG       LYS  74   4.553  -7.652   6.968
  590   1HD   LYS  74          1HD       LYS  74   3.993  -9.624   6.056
  591   2HD   LYS  74          2HD       LYS  74   2.658  -9.604   7.212
  592   1HE   LYS  74          1HE       LYS  74   1.158  -8.736   5.584
  593   2HE   LYS  74          2HE       LYS  74   2.471  -8.408   4.455
  594   1HZ   LYS  74          1HZ       LYS  74   0.924 -10.660   4.530
  595   2HZ   LYS  74          2HZ       LYS  74   2.383 -11.155   5.226
  596   3HZ   LYS  74          3HZ       LYS  74   2.374 -10.473   3.678
  597    H    TRP  75           H        TRP  75   2.902  -4.217   9.798
  598    HA   TRP  75           HA       TRP  75   1.196  -5.112  11.887
  599   1HB   TRP  75          1HB       TRP  75   2.156  -3.418  13.206
  600   2HB   TRP  75          2HB       TRP  75   3.437  -3.868  12.082
  601    HD1  TRP  75           HD       TRP  75   2.519  -2.141   9.575
  602    HE1  TRP  75           1HE      TRP  75   2.749   0.421   9.650
  603    HE3  TRP  75           3HE      TRP  75   2.688  -1.490  14.643
  604    HZ2  TRP  75           2HZ      TRP  75   2.973   2.450  11.600
  605    HZ3  TRP  75           3HZ      TRP  75   2.912   0.794  15.532
  606    HH2  TRP  75           HH       TRP  75   3.052   2.722  14.040
  607    H    TYR  76           H        TYR  76   0.765  -2.972   9.249
  608    HA   TYR  76           HA       TYR  76  -1.697  -1.906  10.468
  609   1HB   TYR  76          1HB       TYR  76   0.387  -0.682   8.818
  610   2HB   TYR  76          2HB       TYR  76  -1.240  -0.370   8.223
  611    HD1  TYR  76           2HD      TYR  76  -2.726  -0.251  10.802
  612    HD2  TYR  76           1HD      TYR  76   1.037   1.393   9.687
  613    HE1  TYR  76           2HE      TYR  76  -3.006   1.519  12.487
  614    HE2  TYR  76           1HE      TYR  76   0.768   3.166  11.370
  615    HH   TYR  76           HH       TYR  76  -1.885   3.136  13.662
  616    H    LEU  77           H        LEU  77  -0.324  -2.980   7.363
  617    HA   LEU  77           HA       LEU  77  -2.836  -3.192   6.057
  618   1HB   LEU  77          1HB       LEU  77  -0.134  -4.366   5.443
  619   2HB   LEU  77          2HB       LEU  77  -1.535  -4.555   4.392
  620    HG   LEU  77           HG       LEU  77  -0.142  -1.971   5.089
  621   1HD1  LEU  77          1HD1      LEU  77   1.179  -3.086   3.513
  622   2HD1  LEU  77          2HD1      LEU  77   0.180  -1.992   2.557
  623   3HD1  LEU  77          3HD1      LEU  77  -0.224  -3.707   2.643
  624   1HD2  LEU  77          1HD2      LEU  77  -1.697  -0.969   3.446
  625   2HD2  LEU  77          2HD2      LEU  77  -2.509  -1.563   4.895
  626   3HD2  LEU  77          3HD2      LEU  77  -2.583  -2.493   3.398
  627    H    GLY  78           H        GLY  78  -0.845  -5.425   7.901
  628   1HA   GLY  78          1HA       GLY  78  -1.685  -7.288   9.070
  629   2HA   GLY  78          2HA       GLY  78  -3.121  -7.249   8.057
  630    H    ALA  79           H        ALA  79  -1.447  -9.525   8.744
  631    HA   ALA  79           HA       ALA  79   0.129 -10.204   6.450
  632   1HB   ALA  79          1HB       ALA  79  -0.274 -12.582   7.650
  633   2HB   ALA  79          2HB       ALA  79   0.943 -11.414   8.168
  634   3HB   ALA  79          3HB       ALA  79  -0.614 -11.490   8.994
  635    H    ARG  80           H        ARG  80  -3.196 -10.573   7.377
  636    HA   ARG  80           HA       ARG  80  -4.015 -12.719   5.841
  637   1HB   ARG  80          1HB       ARG  80  -5.539 -10.147   6.297
  638   2HB   ARG  80          2HB       ARG  80  -6.235 -11.694   5.831
  639   1HG   ARG  80          1HG       ARG  80  -4.632 -11.862   8.252
  640   2HG   ARG  80          2HG       ARG  80  -5.985 -10.737   8.391
  641   1HD   ARG  80          1HD       ARG  80  -6.539 -13.063   9.069
  642   2HD   ARG  80          2HD       ARG  80  -7.547 -12.442   7.762
  643    HE   ARG  80           HE       ARG  80  -6.678 -14.044   6.372
  644   1HH1  ARG  80          1HH1      ARG  80  -4.718 -13.821   9.240
  645   2HH1  ARG  80          2HH1      ARG  80  -3.775 -15.224   8.863
  646   1HH2  ARG  80          1HH2      ARG  80  -5.443 -15.893   5.864
  647   2HH2  ARG  80          2HH2      ARG  80  -4.188 -16.402   6.941
  648    H    CYS  81           H        CYS  81  -3.434  -9.381   4.865
  649    HA   CYS  81           HA       CYS  81  -4.117 -10.054   2.097
  650   1HB   CYS  81          1HB       CYS  81  -4.210  -7.710   1.664
  651   2HB   CYS  81          2HB       CYS  81  -5.044  -7.976   3.190
  652    HG   CYS  81           HG       CYS  81  -3.058  -6.978   4.795
  653    H    HIS  82           H        HIS  82  -2.660  -9.915   0.424
  654    HA   HIS  82           HA       HIS  82   0.105 -10.256   1.133
  655   1HB   HIS  82          1HB       HIS  82  -1.177 -11.469  -0.734
  656   2HB   HIS  82          2HB       HIS  82  -0.961  -9.994  -1.672
  657    HD1  HIS  82           1HD      HIS  82   1.431 -12.081   0.444
  658    HD2  HIS  82           2HD      HIS  82   1.125 -10.373  -3.332
  659    HE1  HIS  82           1HE      HIS  82   3.595 -12.623  -0.717
  660    H    ILE  83           H        ILE  83   1.713  -8.808   1.026
  661    HA   ILE  83           HA       ILE  83   1.070  -6.142  -0.050
  662    HB   ILE  83           HB       ILE  83   3.292  -6.622   1.902
  663   1HG1  ILE  83          1HG1      ILE  83   0.374  -6.197   2.578
  664   2HG1  ILE  83          2HG1      ILE  83   1.333  -7.626   2.945
  665   1HG2  ILE  83          1HG2      ILE  83   3.075  -4.464   0.693
  666   2HG2  ILE  83          2HG2      ILE  83   1.501  -4.241   1.454
  667   3HG2  ILE  83          3HG2      ILE  83   2.958  -4.306   2.446
  668   1HD1  ILE  83          1HD1      ILE  83   1.365  -6.556   4.957
  669   2HD1  ILE  83          2HD1      ILE  83   2.830  -5.898   4.226
  670   3HD1  ILE  83          3HD1      ILE  83   1.343  -4.949   4.230
  671    H    GLU  84           H        GLU  84   2.514  -5.109  -1.391
  672    HA   GLU  84           HA       GLU  84   5.051  -6.380  -2.024
  673   1HB   GLU  84          1HB       GLU  84   2.912  -7.102  -3.535
  674   2HB   GLU  84          2HB       GLU  84   3.479  -5.697  -4.427
  675   1HG   GLU  84          1HG       GLU  84   5.811  -6.930  -4.122
  676   2HG   GLU  84          2HG       GLU  84   4.753  -8.337  -4.029
  677    H    LYS  85           H        LYS  85   6.344  -5.040  -3.554
  678    HA   LYS  85           HA       LYS  85   6.105  -2.256  -2.807
  679   1HB   LYS  85          1HB       LYS  85   8.274  -3.649  -2.938
  680   2HB   LYS  85          2HB       LYS  85   8.173  -3.390  -4.675
  681   1HG   LYS  85          1HG       LYS  85   8.472  -1.079  -4.464
  682   2HG   LYS  85          2HG       LYS  85   8.107  -1.103  -2.738
  683   1HD   LYS  85          1HD       LYS  85  10.455  -0.836  -2.925
  684   2HD   LYS  85          2HD       LYS  85  10.182  -2.512  -2.442
  685   1HE   LYS  85          1HE       LYS  85  10.258  -2.058  -5.342
  686   2HE   LYS  85          2HE       LYS  85  11.773  -1.727  -4.504
  687   1HZ   LYS  85          1HZ       LYS  85  10.341  -4.225  -3.930
  688   2HZ   LYS  85          2HZ       LYS  85  11.998  -3.898  -3.861
  689   3HZ   LYS  85          3HZ       LYS  85  11.240  -4.108  -5.358
  690    H    ALA  86           H        ALA  86   5.424  -0.620  -4.058
  691    HA   ALA  86           HA       ALA  86   4.218  -1.250  -6.608
  692   1HB   ALA  86          1HB       ALA  86   3.942   0.812  -4.609
  693   2HB   ALA  86          2HB       ALA  86   4.051   1.502  -6.229
  694   3HB   ALA  86          3HB       ALA  86   2.812   0.302  -5.863
  695    H    LYS  87           H        LYS  87   4.700  -0.211  -8.586
  696    HA   LYS  87           HA       LYS  87   7.339   1.081  -8.728
  697   1HB   LYS  87          1HB       LYS  87   7.812  -0.160 -10.803
  698   2HB   LYS  87          2HB       LYS  87   7.629  -1.233  -9.421
  699   1HG   LYS  87          1HG       LYS  87   6.032  -2.359 -10.457
  700   2HG   LYS  87          2HG       LYS  87   5.091  -0.884 -10.688
  701   1HD   LYS  87          1HD       LYS  87   6.429  -0.386 -12.704
  702   2HD   LYS  87          2HD       LYS  87   7.288  -1.912 -12.485
  703   1HE   LYS  87          1HE       LYS  87   5.685  -2.974 -13.594
  704   2HE   LYS  87          2HE       LYS  87   4.505  -2.455 -12.392
  705   1HZ   LYS  87          1HZ       LYS  87   5.330  -0.662 -14.588
  706   2HZ   LYS  87          2HZ       LYS  87   3.925  -0.606 -13.647
  707   3HZ   LYS  87          3HZ       LYS  87   4.112  -1.814 -14.816
  708    H    GLY  88           H        GLY  88   7.556   2.710 -10.232
  709   1HA   GLY  88          1HA       GLY  88   6.747   3.751 -12.307
  710   2HA   GLY  88          2HA       GLY  88   5.118   3.387 -11.758
  711    H    THR  89           H        THR  89   5.226   5.838 -12.408
  712    HA   THR  89           HA       THR  89   6.228   7.546 -10.291
  713    HB   THR  89           HB       THR  89   5.582   9.401 -11.634
  714    HG1  THR  89           1HG      THR  89   3.937   7.506 -12.943
  715   1HG2  THR  89          1HG2      THR  89   6.877   9.069 -13.544
  716   2HG2  THR  89          2HG2      THR  89   6.356   7.393 -13.724
  717   3HG2  THR  89          3HG2      THR  89   7.478   7.835 -12.438
  718    H    ASP  90           H        ASP  90   4.637   9.377  -9.613
  719    HA   ASP  90           HA       ASP  90   2.697   8.293  -7.953
  720   1HB   ASP  90          1HB       ASP  90   1.865  10.614  -7.693
  721   2HB   ASP  90          2HB       ASP  90   3.618  10.507  -7.564
  722    H    GLN  91           H        GLN  91   2.382   9.629 -11.206
  723    HA   GLN  91           HA       GLN  91  -0.452   9.490 -11.305
  724   1HB   GLN  91          1HB       GLN  91   0.976  10.908 -12.794
  725   2HB   GLN  91          2HB       GLN  91   1.479   9.444 -13.628
  726   1HG   GLN  91          1HG       GLN  91  -0.304  10.685 -14.796
  727   2HG   GLN  91          2HG       GLN  91  -0.752   9.030 -14.383
  728   1HE2  GLN  91          1HE2      GLN  91  -2.520   8.687 -13.189
  729   2HE2  GLN  91          2HE2      GLN  91  -3.491   9.927 -12.478
  730    H    GLN  92           H        GLN  92   2.131   7.258 -12.137
  731    HA   GLN  92           HA       GLN  92   0.543   5.371 -13.517
  732   1HB   GLN  92          1HB       GLN  92   3.265   5.488 -12.409
  733   2HB   GLN  92          2HB       GLN  92   2.569   3.873 -12.458
  734   1HG   GLN  92          1HG       GLN  92   1.960   4.866 -14.939
  735   2HG   GLN  92          2HG       GLN  92   3.549   5.557 -14.617
  736   1HE2  GLN  92          1HE2      GLN  92   5.322   4.233 -14.504
  737   2HE2  GLN  92          2HE2      GLN  92   5.285   2.566 -14.955
  738    H    ASN  93           H        ASN  93   1.454   5.710 -10.119
  739    HA   ASN  93           HA       ASN  93   0.289   3.269  -9.260
  740   1HB   ASN  93          1HB       ASN  93   0.650   5.695  -7.511
  741   2HB   ASN  93          2HB       ASN  93   0.738   3.996  -7.058
  742   1HD2  ASN  93          1HD2      ASN  93   2.381   3.015  -9.031
  743   2HD2  ASN  93          2HD2      ASN  93   3.956   3.706  -8.861
  744    H    LYS  94           H        LYS  94  -0.854   6.630  -9.248
  745    HA   LYS  94           HA       LYS  94  -3.329   6.135  -8.003
  746   1HB   LYS  94          1HB       LYS  94  -2.341   8.382  -8.234
  747   2HB   LYS  94          2HB       LYS  94  -2.603   8.314  -9.971
  748   1HG   LYS  94          1HG       LYS  94  -5.102   7.848  -9.145
  749   2HG   LYS  94          2HG       LYS  94  -4.518   8.799  -7.777
  750   1HD   LYS  94          1HD       LYS  94  -3.796  10.560  -9.345
  751   2HD   LYS  94          2HD       LYS  94  -4.450   9.614 -10.684
  752   1HE   LYS  94          1HE       LYS  94  -6.677   9.800  -9.791
  753   2HE   LYS  94          2HE       LYS  94  -6.071  10.585  -8.334
  754   1HZ   LYS  94          1HZ       LYS  94  -6.725  11.732 -10.851
  755   2HZ   LYS  94          2HZ       LYS  94  -5.132  12.104 -10.421
  756   3HZ   LYS  94          3HZ       LYS  94  -6.404  12.498  -9.377
  757    H    GLU  95           H        GLU  95  -2.361   6.157 -11.404
  758    HA   GLU  95           HA       GLU  95  -4.985   5.757 -12.429
  759   1HB   GLU  95          1HB       GLU  95  -3.100   6.705 -13.749
  760   2HB   GLU  95          2HB       GLU  95  -2.337   5.121 -13.740
  761   1HG   GLU  95          1HG       GLU  95  -5.099   5.120 -14.704
  762   2HG   GLU  95          2HG       GLU  95  -3.980   6.060 -15.689
  763    H    TYR  96           H        TYR  96  -2.372   3.621 -11.458
  764    HA   TYR  96           HA       TYR  96  -3.262   1.230 -12.568
  765   1HB   TYR  96          1HB       TYR  96  -1.068   1.454 -11.518
  766   2HB   TYR  96          2HB       TYR  96  -1.822   1.674  -9.943
  767    HD1  TYR  96           2HD      TYR  96  -1.018  -0.745 -12.582
  768    HD2  TYR  96           1HD      TYR  96  -2.730  -0.205  -8.724
  769    HE1  TYR  96           2HE      TYR  96  -0.957  -3.177 -12.221
  770    HE2  TYR  96           1HE      TYR  96  -2.672  -2.636  -8.352
  771    HH   TYR  96           HH       TYR  96  -1.402  -4.844 -10.831
  772    H    CYS  97           H        CYS  97  -3.901   2.507  -9.301
  773    HA   CYS  97           HA       CYS  97  -5.680   0.458  -8.545
  774   1HB   CYS  97          1HB       CYS  97  -5.624   3.302  -7.518
  775   2HB   CYS  97          2HB       CYS  97  -6.293   1.899  -6.693
  776    HG   CYS  97           HG       CYS  97  -2.995   1.909  -7.509
  777    H    SER  98           H        SER  98  -6.147   3.509 -10.214
  778    HA   SER  98           HA       SER  98  -9.010   3.427 -10.076
  779   1HB   SER  98          1HB       SER  98  -7.829   5.564 -10.291
  780   2HB   SER  98          2HB       SER  98  -7.176   5.060 -11.850
  781    HG   SER  98           HG       SER  98  -9.192   6.423 -11.759
  782    H    LYS  99           H        LYS  99  -6.704   1.806 -11.919
  783    HA   LYS  99           HA       LYS  99  -7.861   1.610 -14.440
  784   1HB   LYS  99          1HB       LYS  99  -5.618   0.748 -13.855
  785   2HB   LYS  99          2HB       LYS  99  -6.370  -0.546 -12.933
  786   1HG   LYS  99          1HG       LYS  99  -7.520  -0.639 -15.492
  787   2HG   LYS  99          2HG       LYS  99  -5.785  -0.417 -15.729
  788   1HD   LYS  99          1HD       LYS  99  -7.071  -2.550 -14.024
  789   2HD   LYS  99          2HD       LYS  99  -6.391  -2.791 -15.635
  790   1HE   LYS  99          1HE       LYS  99  -4.346  -1.561 -14.251
  791   2HE   LYS  99          2HE       LYS  99  -5.066  -2.628 -13.047
  792   1HZ   LYS  99          1HZ       LYS  99  -3.219  -3.514 -14.598
  793   2HZ   LYS  99          2HZ       LYS  99  -4.462  -3.659 -15.736
  794   3HZ   LYS  99          3HZ       LYS  99  -4.558  -4.493 -14.267
  795    H    GLU 100           H        GLU 100  -8.845   0.237 -11.426
  796    HA   GLU 100           HA       GLU 100 -10.449  -1.867 -12.497
  797   1HB   GLU 100          1HB       GLU 100 -10.823  -0.544  -9.814
  798   2HB   GLU 100          2HB       GLU 100 -11.246  -2.186 -10.278
  799   1HG   GLU 100          1HG       GLU 100  -8.453  -1.092 -10.029
  800   2HG   GLU 100          2HG       GLU 100  -9.268  -2.129  -8.860
  801    H    GLY 101           H        GLY 101 -10.890   1.525 -12.013
  802   1HA   GLY 101          1HA       GLY 101 -12.591   2.797 -13.021
  803   2HA   GLY 101          2HA       GLY 101 -13.542   1.332 -13.214
  804    H    ASN 102           H        ASN 102 -12.598   1.020 -10.179
  805    HA   ASN 102           HA       ASN 102 -14.643   2.796  -9.042
  806   1HB   ASN 102          1HB       ASN 102 -15.227   0.208  -9.473
  807   2HB   ASN 102          2HB       ASN 102 -14.448   0.060  -7.901
  808   1HD2  ASN 102          1HD2      ASN 102 -15.466   0.806  -6.102
  809   2HD2  ASN 102          2HD2      ASN 102 -17.082   1.416  -6.101
  810    H    LEU 103           H        LEU 103 -13.879   3.914  -7.379
  811    HA   LEU 103           HA       LEU 103 -11.425   2.983  -6.067
  812   1HB   LEU 103          1HB       LEU 103 -12.700   5.713  -6.023
  813   2HB   LEU 103          2HB       LEU 103 -11.141   5.281  -5.325
  814    HG   LEU 103           HG       LEU 103 -11.866   5.434  -8.246
  815   1HD1  LEU 103          1HD1      LEU 103 -10.419   7.254  -8.362
  816   2HD1  LEU 103          2HD1      LEU 103  -9.655   6.869  -6.821
  817   3HD1  LEU 103          3HD1      LEU 103 -11.296   7.514  -6.854
  818   1HD2  LEU 103          1HD2      LEU 103  -9.534   4.779  -8.678
  819   2HD2  LEU 103          2HD2      LEU 103 -10.460   3.489  -7.909
  820   3HD2  LEU 103          3HD2      LEU 103  -9.323   4.446  -6.958
  821    H    LEU 104           H        LEU 104 -11.451   2.298  -4.027
  822    HA   LEU 104           HA       LEU 104 -13.953   2.343  -2.558
  823   1HB   LEU 104          1HB       LEU 104 -12.601   0.291  -2.702
  824   2HB   LEU 104          2HB       LEU 104 -11.296   1.109  -1.845
  825    HG   LEU 104           HG       LEU 104 -12.985   1.394   0.064
  826   1HD1  LEU 104          1HD1      LEU 104 -14.978   0.363   0.017
  827   2HD1  LEU 104          2HD1      LEU 104 -14.352  -1.036  -0.854
  828   3HD1  LEU 104          3HD1      LEU 104 -14.772   0.434  -1.733
  829   1HD2  LEU 104          1HD2      LEU 104 -11.191  -0.661  -0.632
  830   2HD2  LEU 104          2HD2      LEU 104 -12.615  -1.443   0.054
  831   3HD2  LEU 104          3HD2      LEU 104 -11.754  -0.210   0.977
  832    H    MET 105           H        MET 105 -10.853   3.908  -2.512
  833    HA   MET 105           HA       MET 105 -11.792   5.786  -0.538
  834   1HB   MET 105          1HB       MET 105 -10.966   4.365   1.098
  835   2HB   MET 105          2HB       MET 105  -9.659   3.780   0.077
  836   1HG   MET 105          1HG       MET 105  -8.275   5.481   0.628
  837   2HG   MET 105          2HG       MET 105  -9.591   6.638   0.815
  838   1HE   MET 105          1HE       MET 105  -7.932   3.405   2.842
  839   2HE   MET 105          2HE       MET 105  -6.976   4.764   2.250
  840   3HE   MET 105          3HE       MET 105  -7.284   4.588   3.979
  841    H    GLU 106           H        GLU 106 -10.871   7.760  -0.791
  842    HA   GLU 106           HA       GLU 106  -8.469   7.958  -2.472
  843   1HB   GLU 106          1HB       GLU 106 -10.712   8.395  -3.689
  844   2HB   GLU 106          2HB       GLU 106 -10.746   9.896  -2.775
  845   1HG   GLU 106          1HG       GLU 106  -8.377  10.262  -3.732
  846   2HG   GLU 106          2HG       GLU 106  -8.839   9.030  -4.905
  847    H    CYS 107           H        CYS 107  -7.010   8.732  -1.077
  848    HA   CYS 107           HA       CYS 107  -7.582  11.286   0.221
  849   1HB   CYS 107          1HB       CYS 107  -6.488   8.870   1.676
  850   2HB   CYS 107          2HB       CYS 107  -6.551  10.499   2.339
  851    HG   CYS 107           HG       CYS 107  -8.813   8.179   2.482
  852    H    GLY 108           H        GLY 108  -5.431  12.043   1.362
  853   1HA   GLY 108          1HA       GLY 108  -3.266  12.752   1.078
  854   2HA   GLY 108          2HA       GLY 108  -2.944  11.167   0.391
  855    H    ALA 109           H        ALA 109  -1.448  12.790  -0.804
  856    HA   ALA 109           HA       ALA 109  -2.860  13.852  -3.160
  857   1HB   ALA 109          1HB       ALA 109  -1.552  15.652  -3.088
  858   2HB   ALA 109          2HB       ALA 109  -1.044  15.103  -1.490
  859   3HB   ALA 109          3HB       ALA 109  -0.092  14.678  -2.912
  860    HA   PRO 110           HA       PRO 110  -0.963  10.893  -5.791
  861   1HB   PRO 110          1HB       PRO 110  -0.668  12.337  -8.071
  862   2HB   PRO 110          2HB       PRO 110  -2.237  11.768  -7.491
  863   1HG   PRO 110          1HG       PRO 110  -0.983  14.472  -7.216
  864   2HG   PRO 110          2HG       PRO 110  -2.657  14.051  -7.622
  865   1HD   PRO 110          1HD       PRO 110  -1.911  14.826  -5.137
  866   2HD   PRO 110          2HD       PRO 110  -3.227  13.669  -5.422
  867    H    ARG 111           H        ARG 111   1.006  11.084  -4.330
  868    HA   ARG 111           HA       ARG 111   3.257  12.210  -5.863
  869   1HB   ARG 111          1HB       ARG 111   4.390  12.759  -3.852
  870   2HB   ARG 111          2HB       ARG 111   2.746  13.353  -3.664
  871   1HG   ARG 111          1HG       ARG 111   2.176  11.474  -2.269
  872   2HG   ARG 111          2HG       ARG 111   3.763  10.752  -2.541
  873   1HD   ARG 111          1HD       ARG 111   3.182  13.350  -1.124
  874   2HD   ARG 111          2HD       ARG 111   3.709  11.841  -0.380
  875    HE   ARG 111           HE       ARG 111   5.689  12.341  -2.127
  876   1HH1  ARG 111          1HH1      ARG 111   4.125  14.320   0.273
  877   2HH1  ARG 111          2HH1      ARG 111   5.531  15.284   0.583
  878   1HH2  ARG 111          1HH2      ARG 111   7.546  13.603  -1.727
  879   2HH2  ARG 111          2HH2      ARG 111   7.476  14.876  -0.556
  880    H    SER 112           H        SER 112   5.248  11.041  -5.775
  881    HA   SER 112           HA       SER 112   5.563   8.554  -4.494
  882   1HB   SER 112          1HB       SER 112   3.767   8.056  -6.282
  883   2HB   SER 112          2HB       SER 112   5.082   8.210  -7.448
  884    HG   SER 112           HG       SER 112   4.466   6.066  -6.190
  885    H    GLN 113           H        GLN 113   7.437   7.283  -5.537
  886    HA   GLN 113           HA       GLN 113   9.573   7.200  -6.333
  887   1HB   GLN 113          1HB       GLN 113   8.446   8.494  -8.287
  888   2HB   GLN 113          2HB       GLN 113   9.250   9.900  -7.603
  889   1HG   GLN 113          1HG       GLN 113  11.352   8.310  -7.708
  890   2HG   GLN 113          2HG       GLN 113  10.399   7.532  -8.970
  891   1HE2  GLN 113          1HE2      GLN 113  12.910   9.091  -9.073
  892   2HE2  GLN 113          2HE2      GLN 113  12.618  10.351 -10.218
  893    H    GLY 114           H        GLY 114   9.062  10.700  -5.856
  894   1HA   GLY 114          1HA       GLY 114   9.995  11.161  -3.387
  895   2HA   GLY 114          2HA       GLY 114  11.485  10.830  -4.259
  896    H    GLN 115           H        GLN 115  12.256  12.931  -3.905
  897    HA   GLN 115           HA       GLN 115  10.876  15.293  -4.465
  898   1HB   GLN 115          1HB       GLN 115  13.448  14.593  -3.607
  899   2HB   GLN 115          2HB       GLN 115  13.694  15.534  -5.072
  900   1HG   GLN 115          1HG       GLN 115  11.732  16.815  -3.437
  901   2HG   GLN 115          2HG       GLN 115  13.170  16.468  -2.479
  902   1HE2  GLN 115          1HE2      GLN 115  11.847  18.900  -3.905
  903   2HE2  GLN 115          2HE2      GLN 115  13.202  19.696  -4.622
  904    H    ARG 116           H        ARG 116  13.370  13.737  -6.492
  905    HA   ARG 116           HA       ARG 116  12.196  15.088  -8.824
  906   1HB   ARG 116          1HB       ARG 116  14.353  14.653  -9.935
  907   2HB   ARG 116          2HB       ARG 116  14.546  15.594  -8.462
  908   1HG   ARG 116          1HG       ARG 116  14.814  12.966  -7.627
  909   2HG   ARG 116          2HG       ARG 116  15.659  13.026  -9.175
  910   1HD   ARG 116          1HD       ARG 116  17.234  14.494  -8.416
  911   2HD   ARG 116          2HD       ARG 116  16.139  15.231  -7.246
  912    HE   ARG 116           HE       ARG 116  16.791  12.533  -6.573
  913   1HH1  ARG 116          1HH1      ARG 116  17.928  15.820  -6.439
  914   2HH1  ARG 116          2HH1      ARG 116  18.937  15.553  -5.056
  915   1HH2  ARG 116          1HH2      ARG 116  18.115  12.168  -4.752
  916   2HH2  ARG 116          2HH2      ARG 116  19.043  13.474  -4.098
  Start of MODEL   31
    1    HA   PRO   2           HA       PRO   2  38.559  -0.620  19.480
    2   1HB   PRO   2          1HB       PRO   2  37.415   1.610  20.523
    3   2HB   PRO   2          2HB       PRO   2  38.609   0.645  21.397
    4   1HG   PRO   2          1HG       PRO   2  38.984   3.189  19.865
    5   2HG   PRO   2          2HG       PRO   2  39.657   2.721  21.437
    6   1HD   PRO   2          1HD       PRO   2  41.088   2.587  19.142
    7   2HD   PRO   2          2HD       PRO   2  41.328   1.451  20.485
    8    H    SER   3           H        SER   3  36.986  -1.015  18.067
    9    HA   SER   3           HA       SER   3  35.452   1.070  16.861
   10   1HB   SER   3          1HB       SER   3  36.969   1.342  15.153
   11   2HB   SER   3          2HB       SER   3  37.566  -0.313  15.275
   12    HG   SER   3           HG       SER   3  35.067   0.490  14.191
   13    H    LYS   4           H        LYS   4  33.655   0.236  15.590
   14    HA   LYS   4           HA       LYS   4  33.176  -2.634  15.757
   15   1HB   LYS   4          1HB       LYS   4  31.826  -0.600  17.410
   16   2HB   LYS   4          2HB       LYS   4  30.751  -1.734  16.604
   17   1HG   LYS   4          1HG       LYS   4  33.055  -2.498  18.386
   18   2HG   LYS   4          2HG       LYS   4  31.357  -2.454  18.868
   19   1HD   LYS   4          1HD       LYS   4  31.174  -4.009  16.682
   20   2HD   LYS   4          2HD       LYS   4  32.813  -4.412  17.199
   21   1HE   LYS   4          1HE       LYS   4  31.544  -5.969  18.343
   22   2HE   LYS   4          2HE       LYS   4  31.730  -4.690  19.541
   23   1HZ   LYS   4          1HZ       LYS   4  29.538  -3.843  18.861
   24   2HZ   LYS   4          2HZ       LYS   4  29.459  -5.413  19.486
   25   3HZ   LYS   4          3HZ       LYS   4  29.360  -5.162  17.816
   26    H    LYS   5           H        LYS   5  31.310  -3.322  14.500
   27    HA   LYS   5           HA       LYS   5  30.163  -1.381  12.667
   28   1HB   LYS   5          1HB       LYS   5  32.440  -2.617  11.855
   29   2HB   LYS   5          2HB       LYS   5  31.234  -3.765  11.290
   30   1HG   LYS   5          1HG       LYS   5  30.347  -1.172  10.582
   31   2HG   LYS   5          2HG       LYS   5  32.044  -1.313  10.117
   32   1HD   LYS   5          1HD       LYS   5  30.205  -3.568   9.484
   33   2HD   LYS   5          2HD       LYS   5  30.105  -2.101   8.507
   34   1HE   LYS   5          1HE       LYS   5  32.846  -2.748   8.819
   35   2HE   LYS   5          2HE       LYS   5  31.999  -4.224   8.360
   36   1HZ   LYS   5          1HZ       LYS   5  32.635  -1.953   6.775
   37   2HZ   LYS   5          2HZ       LYS   5  30.972  -2.259   6.737
   38   3HZ   LYS   5          3HZ       LYS   5  32.065  -3.470   6.290
   39    H    ASN   6           H        ASN   6  28.612  -2.563  11.110
   40    HA   ASN   6           HA       ASN   6  27.232  -4.679  12.628
   41   1HB   ASN   6          1HB       ASN   6  26.227  -2.225  12.075
   42   2HB   ASN   6          2HB       ASN   6  25.682  -3.111  10.654
   43   1HD2  ASN   6          1HD2      ASN   6  25.138  -2.438  13.916
   44   2HD2  ASN   6          2HD2      ASN   6  23.860  -3.568  14.191
   45    H    GLY   7           H        GLY   7  25.416  -5.531  10.796
   46   1HA   GLY   7          1HA       GLY   7  26.462  -6.008   8.207
   47   2HA   GLY   7          2HA       GLY   7  26.836  -7.365   9.258
   48    H    ARG   8           H        ARG   8  24.831  -6.586   6.931
   49    HA   ARG   8           HA       ARG   8  22.864  -8.505   7.677
   50   1HB   ARG   8          1HB       ARG   8  20.907  -7.009   7.625
   51   2HB   ARG   8          2HB       ARG   8  21.977  -6.649   8.973
   52   1HG   ARG   8          1HG       ARG   8  22.055  -4.539   8.324
   53   2HG   ARG   8          2HG       ARG   8  22.806  -5.042   6.808
   54   1HD   ARG   8          1HD       ARG   8  20.842  -4.956   5.646
   55   2HD   ARG   8          2HD       ARG   8  19.863  -5.336   7.062
   56    HE   ARG   8           HE       ARG   8  19.610  -3.100   7.404
   57   1HH1  ARG   8          1HH1      ARG   8  22.455  -3.603   5.462
   58   2HH1  ARG   8          2HH1      ARG   8  22.749  -1.913   5.221
   59   1HH2  ARG   8          1HH2      ARG   8  19.986  -0.871   7.094
   60   2HH2  ARG   8          2HH2      ARG   8  21.344  -0.360   6.151
   61    H    SER   9           H        SER   9  21.626  -9.189   5.932
   62    HA   SER   9           HA       SER   9  22.048  -7.801   3.378
   63   1HB   SER   9          1HB       SER   9  23.535  -9.950   3.906
   64   2HB   SER   9          2HB       SER   9  22.079 -10.783   3.362
   65    HG   SER   9           HG       SER   9  22.657 -10.314   1.410
   66    H    GLY  10           H        GLY  10  20.273  -7.650   2.134
   67   1HA   GLY  10          1HA       GLY  10  18.267  -9.218   1.494
   68   2HA   GLY  10          2HA       GLY  10  17.819  -8.878   3.158
   69    HA   PRO  11           HA       PRO  11  15.976  -5.657   0.315
   70   1HB   PRO  11          1HB       PRO  11  13.412  -6.009   1.137
   71   2HB   PRO  11          2HB       PRO  11  14.136  -6.941  -0.180
   72   1HG   PRO  11          1HG       PRO  11  13.737  -7.707   2.687
   73   2HG   PRO  11          2HG       PRO  11  13.469  -8.671   1.223
   74   1HD   PRO  11          1HD       PRO  11  15.685  -8.936   2.757
   75   2HD   PRO  11          2HD       PRO  11  15.705  -9.182   0.999
   76    H    GLN  12           H        GLN  12  15.429  -3.595   0.934
   77    HA   GLN  12           HA       GLN  12  15.441  -3.085   3.830
   78   1HB   GLN  12          1HB       GLN  12  16.670  -1.760   1.534
   79   2HB   GLN  12          2HB       GLN  12  15.816  -0.644   2.592
   80   1HG   GLN  12          1HG       GLN  12  17.436  -0.718   4.096
   81   2HG   GLN  12          2HG       GLN  12  17.403  -2.480   4.132
   82   1HE2  GLN  12          1HE2      GLN  12  19.140  -3.497   3.431
   83   2HE2  GLN  12          2HE2      GLN  12  20.381  -2.821   2.438
   84    HA   PRO  13           HA       PRO  13  11.375  -1.442   3.828
   85   1HB   PRO  13          1HB       PRO  13  11.604   0.698   5.483
   86   2HB   PRO  13          2HB       PRO  13  11.664  -0.972   6.058
   87   1HG   PRO  13          1HG       PRO  13  13.914   0.923   5.502
   88   2HG   PRO  13          2HG       PRO  13  13.700  -0.191   6.866
   89   1HD   PRO  13          1HD       PRO  13  15.307  -0.757   4.761
   90   2HD   PRO  13          2HD       PRO  13  14.426  -2.013   5.655
   91    H    HIS  14           H        HIS  14  10.095  -0.041   2.714
   92    HA   HIS  14           HA       HIS  14  11.378   2.323   1.517
   93   1HB   HIS  14          1HB       HIS  14   9.322   0.641   0.089
   94   2HB   HIS  14          2HB       HIS  14  10.344   1.907  -0.585
   95    HD1  HIS  14           1HD      HIS  14  10.087  -1.637  -0.450
   96    HD2  HIS  14           2HD      HIS  14  13.243   1.064  -0.365
   97    HE1  HIS  14           1HE      HIS  14  12.125  -2.964  -1.088
   98    H    LYS  15           H        LYS  15   9.494   3.688   0.412
   99    HA   LYS  15           HA       LYS  15   7.520   4.132   2.542
  100   1HB   LYS  15          1HB       LYS  15   7.288   6.405   1.485
  101   2HB   LYS  15          2HB       LYS  15   8.865   6.069   2.187
  102   1HG   LYS  15          1HG       LYS  15   8.886   5.266  -0.548
  103   2HG   LYS  15          2HG       LYS  15   8.259   6.912  -0.433
  104   1HD   LYS  15          1HD       LYS  15  10.622   6.342   1.229
  105   2HD   LYS  15          2HD       LYS  15  10.893   6.285  -0.514
  106   1HE   LYS  15          1HE       LYS  15   9.384   8.558  -0.209
  107   2HE   LYS  15          2HE       LYS  15  10.391   8.567   1.238
  108   1HZ   LYS  15          1HZ       LYS  15  12.278   8.844   0.039
  109   2HZ   LYS  15          2HZ       LYS  15  11.205   9.599  -1.028
  110   3HZ   LYS  15          3HZ       LYS  15  11.700   8.007  -1.313
  111    H    ARG  16           H        ARG  16   7.617   2.442  -0.156
  112    HA   ARG  16           HA       ARG  16   4.849   3.120  -0.894
  113   1HB   ARG  16          1HB       ARG  16   6.881   2.067  -2.855
  114   2HB   ARG  16          2HB       ARG  16   5.291   2.737  -3.197
  115   1HG   ARG  16          1HG       ARG  16   6.278   4.680  -3.579
  116   2HG   ARG  16          2HG       ARG  16   6.658   4.763  -1.858
  117   1HD   ARG  16          1HD       ARG  16   8.782   3.706  -2.218
  118   2HD   ARG  16          2HD       ARG  16   8.390   3.393  -3.908
  119    HE   ARG  16           HE       ARG  16   8.212   6.116  -3.614
  120   1HH1  ARG  16          1HH1      ARG  16  10.670   3.699  -3.128
  121   2HH1  ARG  16          2HH1      ARG  16  11.982   4.773  -3.484
  122   1HH2  ARG  16          1HH2      ARG  16   9.930   7.540  -4.086
  123   2HH2  ARG  16          2HH2      ARG  16  11.560   6.958  -4.028
  124    H    TRP  17           H        TRP  17   3.484   1.493  -0.607
  125    HA   TRP  17           HA       TRP  17   4.363  -1.251  -1.045
  126   1HB   TRP  17          1HB       TRP  17   3.328  -0.201   1.584
  127   2HB   TRP  17          2HB       TRP  17   3.212  -1.904   1.150
  128    HD1  TRP  17           HD       TRP  17   5.638   0.682   2.426
  129    HE1  TRP  17           1HE      TRP  17   7.903  -0.436   2.918
  130    HE3  TRP  17           3HE      TRP  17   4.779  -3.874   0.271
  131    HZ2  TRP  17           2HZ      TRP  17   9.160  -2.921   2.454
  132    HZ3  TRP  17           3HZ      TRP  17   6.565  -5.565   0.338
  133    HH2  TRP  17           HH       TRP  17   8.709  -5.096   1.407
  134    H    VAL  18           H        VAL  18   2.799  -2.521  -1.886
  135    HA   VAL  18           HA       VAL  18   0.124  -1.324  -2.164
  136    HB   VAL  18           HB       VAL  18  -0.170  -2.725  -4.143
  137   1HG1  VAL  18          1HG1      VAL  18   0.610  -0.716  -4.876
  138   2HG1  VAL  18          2HG1      VAL  18   2.094  -0.819  -3.926
  139   3HG1  VAL  18          3HG1      VAL  18   1.938  -1.739  -5.424
  140   1HG2  VAL  18          1HG2      VAL  18   2.574  -3.540  -4.506
  141   2HG2  VAL  18          2HG2      VAL  18   1.893  -4.242  -3.038
  142   3HG2  VAL  18          3HG2      VAL  18   1.097  -4.500  -4.591
  143    H    PHE  19           H        PHE  19  -1.713  -2.809  -2.199
  144    HA   PHE  19           HA       PHE  19  -1.271  -5.313  -0.737
  145   1HB   PHE  19          1HB       PHE  19  -3.329  -4.767   0.636
  146   2HB   PHE  19          2HB       PHE  19  -1.894  -3.818   1.009
  147    HD1  PHE  19           1HD      PHE  19  -1.719  -1.480   0.144
  148    HD2  PHE  19           2HD      PHE  19  -5.315  -3.744  -0.093
  149    HE1  PHE  19           1HE      PHE  19  -2.996   0.593  -0.207
  150    HE2  PHE  19           2HE      PHE  19  -6.598  -1.674  -0.445
  151    HZ   PHE  19           HZ       PHE  19  -5.439   0.498  -0.503
  152    H    THR  20           H        THR  20  -2.694  -6.957  -1.210
  153    HA   THR  20           HA       THR  20  -4.985  -6.434  -2.923
  154    HB   THR  20           HB       THR  20  -4.299  -8.106  -4.608
  155    HG1  THR  20           1HG      THR  20  -2.022  -8.199  -2.958
  156   1HG2  THR  20          1HG2      THR  20  -2.796  -6.697  -5.831
  157   2HG2  THR  20          2HG2      THR  20  -2.232  -5.923  -4.349
  158   3HG2  THR  20          3HG2      THR  20  -3.881  -5.654  -4.913
  159    H    LEU  21           H        LEU  21  -6.626  -7.720  -2.378
  160    HA   LEU  21           HA       LEU  21  -6.077 -10.364  -1.249
  161   1HB   LEU  21          1HB       LEU  21  -6.347  -8.745   0.613
  162   2HB   LEU  21          2HB       LEU  21  -7.964  -8.380   0.013
  163    HG   LEU  21           HG       LEU  21  -7.979 -11.132   0.340
  164   1HD1  LEU  21          1HD1      LEU  21  -6.213  -9.828   2.350
  165   2HD1  LEU  21          2HD1      LEU  21  -6.108 -11.431   1.624
  166   3HD1  LEU  21          3HD1      LEU  21  -7.307 -11.108   2.877
  167   1HD2  LEU  21          1HD2      LEU  21  -8.895  -9.400   2.570
  168   2HD2  LEU  21          2HD2      LEU  21  -9.735 -10.700   1.724
  169   3HD2  LEU  21          3HD2      LEU  21  -9.579  -9.113   0.969
  170    H    ASN  22           H        ASN  22  -7.521 -11.906  -1.826
  171    HA   ASN  22           HA       ASN  22  -9.499 -11.177  -3.814
  172   1HB   ASN  22          1HB       ASN  22  -8.017 -13.128  -4.164
  173   2HB   ASN  22          2HB       ASN  22  -8.731 -13.906  -2.754
  174   1HD2  ASN  22          1HD2      ASN  22  -8.785 -13.818  -6.009
  175   2HD2  ASN  22          2HD2      ASN  22 -10.386 -14.400  -6.299
  176    H    ASN  23           H        ASN  23 -11.661 -11.186  -3.560
  177    HA   ASN  23           HA       ASN  23 -13.664 -11.070  -2.479
  178   1HB   ASN  23          1HB       ASN  23 -13.458 -13.515  -2.721
  179   2HB   ASN  23          2HB       ASN  23 -12.633 -13.595  -1.167
  180   1HD2  ASN  23          1HD2      ASN  23 -15.485 -11.791  -2.242
  181   2HD2  ASN  23          2HD2      ASN  23 -16.557 -12.443  -1.054
  182    HA   PRO  24           HA       PRO  24 -11.657  -9.243   1.321
  183   1HB   PRO  24          1HB       PRO  24 -12.464  -6.697   0.833
  184   2HB   PRO  24          2HB       PRO  24 -10.959  -7.368   0.193
  185   1HG   PRO  24          1HG       PRO  24 -13.609  -7.034  -1.158
  186   2HG   PRO  24          2HG       PRO  24 -11.984  -6.708  -1.788
  187   1HD   PRO  24          1HD       PRO  24 -13.358  -8.960  -2.397
  188   2HD   PRO  24          2HD       PRO  24 -11.588  -8.928  -2.266
  189    H    SER  25           H        SER  25 -12.719  -8.838   3.212
  190    HA   SER  25           HA       SER  25 -15.619  -9.121   3.158
  191   1HB   SER  25          1HB       SER  25 -13.506  -9.853   4.988
  192   2HB   SER  25          2HB       SER  25 -14.754  -8.932   5.826
  193    HG   SER  25           HG       SER  25 -15.411 -11.067   4.101
  194    H    GLU  26           H        GLU  26 -16.845  -7.819   4.851
  195    HA   GLU  26           HA       GLU  26 -16.571  -5.066   4.235
  196   1HB   GLU  26          1HB       GLU  26 -18.471  -6.762   5.599
  197   2HB   GLU  26          2HB       GLU  26 -18.213  -5.276   6.502
  198   1HG   GLU  26          1HG       GLU  26 -18.504  -4.233   4.067
  199   2HG   GLU  26          2HG       GLU  26 -19.457  -5.701   3.857
  200    H    ASP  27           H        ASP  27 -15.487  -7.062   6.877
  201    HA   ASP  27           HA       ASP  27 -14.866  -4.890   8.641
  202   1HB   ASP  27          1HB       ASP  27 -15.113  -7.625   8.930
  203   2HB   ASP  27          2HB       ASP  27 -13.376  -7.370   9.081
  204    H    GLU  28           H        GLU  28 -12.992  -6.970   6.462
  205    HA   GLU  28           HA       GLU  28 -10.461  -5.909   7.059
  206   1HB   GLU  28          1HB       GLU  28 -11.440  -7.904   5.413
  207   2HB   GLU  28          2HB       GLU  28 -10.787  -6.733   4.276
  208   1HG   GLU  28          1HG       GLU  28  -9.169  -7.633   6.621
  209   2HG   GLU  28          2HG       GLU  28  -9.270  -8.619   5.164
  210    H    ARG  29           H        ARG  29 -12.754  -5.095   4.464
  211    HA   ARG  29           HA       ARG  29 -11.186  -3.054   3.313
  212   1HB   ARG  29          1HB       ARG  29 -14.164  -3.553   3.259
  213   2HB   ARG  29          2HB       ARG  29 -13.370  -2.306   2.306
  214   1HG   ARG  29          1HG       ARG  29 -12.377  -3.817   0.897
  215   2HG   ARG  29          2HG       ARG  29 -12.406  -5.114   2.094
  216   1HD   ARG  29          1HD       ARG  29 -13.999  -5.536   0.292
  217   2HD   ARG  29          2HD       ARG  29 -14.823  -5.311   1.834
  218    HE   ARG  29           HE       ARG  29 -14.666  -2.858   0.437
  219   1HH1  ARG  29          1HH1      ARG  29 -16.331  -5.915   0.418
  220   2HH1  ARG  29          2HH1      ARG  29 -17.757  -5.283  -0.336
  221   1HH2  ARG  29          1HH2      ARG  29 -16.538  -2.013  -0.557
  222   2HH2  ARG  29          2HH2      ARG  29 -17.873  -3.063  -0.891
  223    H    LYS  30           H        LYS  30 -13.461  -3.089   5.970
  224    HA   LYS  30           HA       LYS  30 -13.770  -0.270   6.185
  225   1HB   LYS  30          1HB       LYS  30 -15.419  -1.746   7.161
  226   2HB   LYS  30          2HB       LYS  30 -14.202  -2.489   8.191
  227   1HG   LYS  30          1HG       LYS  30 -14.186  -0.758   9.662
  228   2HG   LYS  30          2HG       LYS  30 -14.593   0.439   8.431
  229   1HD   LYS  30          1HD       LYS  30 -16.610  -1.630   9.185
  230   2HD   LYS  30          2HD       LYS  30 -16.348  -0.248  10.252
  231   1HE   LYS  30          1HE       LYS  30 -16.524   0.724   7.593
  232   2HE   LYS  30          2HE       LYS  30 -17.869  -0.387   7.850
  233   1HZ   LYS  30          1HZ       LYS  30 -17.252   1.681   9.856
  234   2HZ   LYS  30          2HZ       LYS  30 -18.721   0.902   9.545
  235   3HZ   LYS  30          3HZ       LYS  30 -18.146   2.079   8.475
  236    H    LYS  31           H        LYS  31 -11.599  -2.622   7.676
  237    HA   LYS  31           HA       LYS  31 -10.402  -0.903   9.548
  238   1HB   LYS  31          1HB       LYS  31 -10.076  -3.256   9.779
  239   2HB   LYS  31          2HB       LYS  31  -9.398  -3.387   8.161
  240   1HG   LYS  31          1HG       LYS  31  -7.420  -2.203   8.838
  241   2HG   LYS  31          2HG       LYS  31  -8.111  -1.885  10.431
  242   1HD   LYS  31          1HD       LYS  31  -7.598  -3.936  11.191
  243   2HD   LYS  31          2HD       LYS  31  -8.071  -4.717   9.680
  244   1HE   LYS  31          1HE       LYS  31  -5.770  -5.105   9.835
  245   2HE   LYS  31          2HE       LYS  31  -5.907  -3.748   8.718
  246   1HZ   LYS  31          1HZ       LYS  31  -5.691  -2.887  11.431
  247   2HZ   LYS  31          2HZ       LYS  31  -4.763  -2.449  10.087
  248   3HZ   LYS  31          3HZ       LYS  31  -4.368  -3.836  10.972
  249    H    ILE  32           H        ILE  32  -9.310  -1.852   6.291
  250    HA   ILE  32           HA       ILE  32  -7.061  -0.143   6.258
  251    HB   ILE  32           HB       ILE  32  -8.606  -1.557   4.111
  252   1HG1  ILE  32          1HG1      ILE  32  -5.727  -1.739   5.026
  253   2HG1  ILE  32          2HG1      ILE  32  -7.021  -2.813   5.547
  254   1HG2  ILE  32          1HG2      ILE  32  -6.802  -0.764   2.529
  255   2HG2  ILE  32          2HG2      ILE  32  -8.005   0.438   2.995
  256   3HG2  ILE  32          3HG2      ILE  32  -6.405   0.458   3.737
  257   1HD1  ILE  32          1HD1      ILE  32  -6.682  -4.108   3.792
  258   2HD1  ILE  32          2HD1      ILE  32  -6.951  -2.750   2.698
  259   3HD1  ILE  32          3HD1      ILE  32  -5.333  -3.076   3.318
  260    H    ARG  33           H        ARG  33 -10.395   0.262   5.167
  261    HA   ARG  33           HA       ARG  33  -9.970   2.794   3.934
  262   1HB   ARG  33          1HB       ARG  33 -11.856   1.447   3.263
  263   2HB   ARG  33          2HB       ARG  33 -12.483   1.430   4.906
  264   1HG   ARG  33          1HG       ARG  33 -13.122   3.684   4.804
  265   2HG   ARG  33          2HG       ARG  33 -12.146   3.979   3.363
  266   1HD   ARG  33          1HD       ARG  33 -14.051   3.692   2.228
  267   2HD   ARG  33          2HD       ARG  33 -13.815   1.972   2.540
  268    HE   ARG  33           HE       ARG  33 -15.146   2.858   4.738
  269   1HH1  ARG  33          1HH1      ARG  33 -15.728   3.028   1.310
  270   2HH1  ARG  33          2HH1      ARG  33 -17.453   3.028   1.471
  271   1HH2  ARG  33          1HH2      ARG  33 -17.416   2.858   4.963
  272   2HH2  ARG  33          2HH2      ARG  33 -18.412   2.932   3.549
  273    H    ASP  34           H        ASP  34 -10.385   1.763   7.177
  274    HA   ASP  34           HA       ASP  34 -11.081   4.466   8.072
  275   1HB   ASP  34          1HB       ASP  34 -12.349   2.460   8.934
  276   2HB   ASP  34          2HB       ASP  34 -10.871   1.967   9.756
  277    H    LEU  35           H        LEU  35  -8.370   3.069   7.210
  278    HA   LEU  35           HA       LEU  35  -6.670   3.288   9.463
  279   1HB   LEU  35          1HB       LEU  35  -6.264   3.109   6.513
  280   2HB   LEU  35          2HB       LEU  35  -4.901   3.534   7.546
  281    HG   LEU  35           HG       LEU  35  -6.530   1.006   7.796
  282   1HD1  LEU  35          1HD1      LEU  35  -5.336   0.899   5.739
  283   2HD1  LEU  35          2HD1      LEU  35  -4.449  -0.067   6.917
  284   3HD1  LEU  35          3HD1      LEU  35  -3.873   1.543   6.485
  285   1HD2  LEU  35          1HD2      LEU  35  -3.950   1.863   9.104
  286   2HD2  LEU  35          2HD2      LEU  35  -4.726   0.288   9.279
  287   3HD2  LEU  35          3HD2      LEU  35  -5.522   1.737   9.895
  288    HA   PRO  36           HA       PRO  36  -5.796   7.576   9.766
  289   1HB   PRO  36          1HB       PRO  36  -3.130   7.595  10.280
  290   2HB   PRO  36          2HB       PRO  36  -4.333   7.063  11.461
  291   1HG   PRO  36          1HG       PRO  36  -2.603   5.424   9.648
  292   2HG   PRO  36          2HG       PRO  36  -2.996   5.162  11.358
  293   1HD   PRO  36          1HD       PRO  36  -4.224   3.813   9.356
  294   2HD   PRO  36          2HD       PRO  36  -5.048   4.231  10.872
  295    H    ILE  37           H        ILE  37  -5.848   8.922   8.083
  296    HA   ILE  37           HA       ILE  37  -4.472   8.444   5.643
  297    HB   ILE  37           HB       ILE  37  -5.226  10.771   5.053
  298   1HG1  ILE  37          1HG1      ILE  37  -6.607  10.619   7.741
  299   2HG1  ILE  37          2HG1      ILE  37  -5.213  11.635   7.390
  300   1HG2  ILE  37          1HG2      ILE  37  -7.747   9.701   5.899
  301   2HG2  ILE  37          2HG2      ILE  37  -7.042   9.753   4.284
  302   3HG2  ILE  37          3HG2      ILE  37  -6.691   8.397   5.356
  303   1HD1  ILE  37          1HD1      ILE  37  -6.774  13.192   7.004
  304   2HD1  ILE  37          2HD1      ILE  37  -6.899  12.406   5.430
  305   3HD1  ILE  37          3HD1      ILE  37  -8.040  12.000   6.711
  306    H    SER  38           H        SER  38  -3.810  10.394   8.478
  307    HA   SER  38           HA       SER  38  -1.730  11.957   7.351
  308   1HB   SER  38          1HB       SER  38  -1.170  12.531   9.663
  309   2HB   SER  38          2HB       SER  38  -2.917  12.586   9.427
  310    HG   SER  38           HG       SER  38  -3.029  11.217  11.004
  311    H    LEU  39           H        LEU  39  -1.898   8.705   8.393
  312    HA   LEU  39           HA       LEU  39   0.866   8.364   9.044
  313   1HB   LEU  39          1HB       LEU  39  -1.322   6.912   9.548
  314   2HB   LEU  39          2HB       LEU  39  -0.742   6.055   8.121
  315    HG   LEU  39           HG       LEU  39   1.256   6.542  10.242
  316   1HD1  LEU  39          1HD1      LEU  39   0.466   4.708  11.622
  317   2HD1  LEU  39          2HD1      LEU  39  -0.965   4.535  10.607
  318   3HD1  LEU  39          3HD1      LEU  39  -0.735   5.998  11.565
  319   1HD2  LEU  39          1HD2      LEU  39   2.291   5.003   9.029
  320   2HD2  LEU  39          2HD2      LEU  39   0.879   4.862   7.982
  321   3HD2  LEU  39          3HD2      LEU  39   1.022   3.840   9.413
  322    H    PHE  40           H        PHE  40  -1.030   8.244   6.132
  323    HA   PHE  40           HA       PHE  40   1.399   7.518   4.630
  324   1HB   PHE  40          1HB       PHE  40  -1.376   6.958   3.614
  325   2HB   PHE  40          2HB       PHE  40   0.150   6.249   3.095
  326    HD1  PHE  40           2HD      PHE  40  -2.439   6.237   5.697
  327    HD2  PHE  40           1HD      PHE  40   1.108   4.388   4.243
  328    HE1  PHE  40           2HE      PHE  40  -2.816   4.333   7.209
  329    HE2  PHE  40           1HE      PHE  40   0.737   2.480   5.752
  330    HZ   PHE  40           HZ       PHE  40  -1.227   2.451   7.238
  331    H    ASP  41           H        ASP  41   2.131   9.146   3.453
  332    HA   ASP  41           HA       ASP  41   0.875  11.594   3.107
  333   1HB   ASP  41          1HB       ASP  41   3.259  10.268   2.052
  334   2HB   ASP  41          2HB       ASP  41   2.562  11.432   0.928
  335    H    TYR  42           H        TYR  42   0.515   8.653   1.322
  336    HA   TYR  42           HA       TYR  42  -1.591   9.881  -0.267
  337   1HB   TYR  42          1HB       TYR  42   0.349  10.127  -1.711
  338   2HB   TYR  42          2HB       TYR  42   0.752   8.425  -1.509
  339    HD1  TYR  42           1HD      TYR  42  -2.598   9.917  -2.117
  340    HD2  TYR  42           2HD      TYR  42   0.599   7.596  -3.696
  341    HE1  TYR  42           1HE      TYR  42  -3.976   9.363  -4.078
  342    HE2  TYR  42           2HE      TYR  42  -0.769   7.037  -5.662
  343    HH   TYR  42           HH       TYR  42  -4.076   8.292  -6.015
  344    H    PHE  43           H        PHE  43  -3.314   8.608  -0.223
  345    HA   PHE  43           HA       PHE  43  -2.937   5.699  -0.065
  346   1HB   PHE  43          1HB       PHE  43  -3.665   7.104   2.124
  347   2HB   PHE  43          2HB       PHE  43  -5.249   6.814   1.412
  348    HD1  PHE  43           1HD      PHE  43  -4.313   4.100   0.153
  349    HD2  PHE  43           2HD      PHE  43  -4.163   5.761   4.069
  350    HE1  PHE  43           1HE      PHE  43  -4.328   1.834   1.111
  351    HE2  PHE  43           2HE      PHE  43  -4.176   3.497   5.034
  352    HZ   PHE  43           HZ       PHE  43  -4.258   1.530   3.554
  353    H    ILE  44           H        ILE  44  -3.860   4.808  -1.777
  354    HA   ILE  44           HA       ILE  44  -6.474   5.808  -2.663
  355    HB   ILE  44           HB       ILE  44  -5.078   6.800  -4.273
  356   1HG1  ILE  44          1HG1      ILE  44  -5.515   4.327  -5.836
  357   2HG1  ILE  44          2HG1      ILE  44  -6.930   4.962  -5.004
  358   1HG2  ILE  44          1HG2      ILE  44  -3.368   5.355  -5.523
  359   2HG2  ILE  44          2HG2      ILE  44  -2.968   5.882  -3.889
  360   3HG2  ILE  44          3HG2      ILE  44  -3.531   4.234  -4.171
  361   1HD1  ILE  44          1HD1      ILE  44  -5.660   5.872  -7.411
  362   2HD1  ILE  44          2HD1      ILE  44  -7.215   6.330  -6.715
  363   3HD1  ILE  44          3HD1      ILE  44  -5.745   7.170  -6.220
  364    H    VAL  45           H        VAL  45  -7.879   4.198  -2.559
  365    HA   VAL  45           HA       VAL  45  -6.948   1.470  -3.185
  366    HB   VAL  45           HB       VAL  45  -9.279   1.974  -1.368
  367   1HG1  VAL  45          1HG1      VAL  45  -7.312  -0.290  -1.686
  368   2HG1  VAL  45          2HG1      VAL  45  -8.601  -0.234  -0.481
  369   3HG1  VAL  45          3HG1      VAL  45  -8.999  -0.274  -2.200
  370   1HG2  VAL  45          1HG2      VAL  45  -7.458   1.513   0.468
  371   2HG2  VAL  45          2HG2      VAL  45  -6.382   2.244  -0.722
  372   3HG2  VAL  45          3HG2      VAL  45  -7.764   3.151  -0.108
  373    H    GLY  46           H        GLY  46  -8.120   0.297  -4.614
  374   1HA   GLY  46          1HA       GLY  46 -10.656   1.476  -5.567
  375   2HA   GLY  46          2HA       GLY  46  -9.439   0.878  -6.686
  376    H    GLU  47           H        GLU  47 -12.320   0.114  -5.935
  377    HA   GLU  47           HA       GLU  47 -11.963  -2.650  -5.099
  378   1HB   GLU  47          1HB       GLU  47 -14.069  -0.742  -4.943
  379   2HB   GLU  47          2HB       GLU  47 -14.651  -2.107  -5.886
  380   1HG   GLU  47          1HG       GLU  47 -13.238  -2.615  -3.315
  381   2HG   GLU  47          2HG       GLU  47 -14.913  -2.064  -3.290
  382    H    GLU  48           H        GLU  48 -12.067  -4.386  -6.404
  383    HA   GLU  48           HA       GLU  48 -12.401  -3.879  -9.276
  384   1HB   GLU  48          1HB       GLU  48 -10.277  -4.858  -8.776
  385   2HB   GLU  48          2HB       GLU  48 -11.016  -6.092  -7.764
  386   1HG   GLU  48          1HG       GLU  48 -10.319  -7.026  -9.882
  387   2HG   GLU  48          2HG       GLU  48 -12.074  -7.077  -9.729
  388    H    GLY  49           H        GLY  49 -14.445  -4.199  -9.900
  389   1HA   GLY  49          1HA       GLY  49 -15.633  -6.817  -9.426
  390   2HA   GLY  49          2HA       GLY  49 -16.529  -5.440  -8.804
  391    H    ASN  50           H        ASN  50 -14.827  -6.283 -11.826
  392    HA   ASN  50           HA       ASN  50 -17.226  -5.394 -13.288
  393   1HB   ASN  50          1HB       ASN  50 -14.695  -4.236 -13.396
  394   2HB   ASN  50          2HB       ASN  50 -14.773  -5.235 -14.844
  395   1HD2  ASN  50          1HD2      ASN  50 -17.115  -3.251 -13.060
  396   2HD2  ASN  50          2HD2      ASN  50 -17.627  -2.326 -14.427
  397    H    GLU  51           H        GLU  51 -16.554  -8.069 -12.375
  398    HA   GLU  51           HA       GLU  51 -16.642  -9.404 -14.974
  399   1HB   GLU  51          1HB       GLU  51 -14.345  -9.433 -13.371
  400   2HB   GLU  51          2HB       GLU  51 -15.114 -10.989 -13.095
  401   1HG   GLU  51          1HG       GLU  51 -15.274 -10.816 -15.789
  402   2HG   GLU  51          2HG       GLU  51 -13.776  -9.938 -15.482
  403    H    GLU  52           H        GLU  52 -18.617 -10.269 -14.903
  404    HA   GLU  52           HA       GLU  52 -19.905 -11.093 -12.508
  405   1HB   GLU  52          1HB       GLU  52 -21.667 -11.941 -13.976
  406   2HB   GLU  52          2HB       GLU  52 -21.167 -10.327 -14.461
  407   1HG   GLU  52          1HG       GLU  52 -19.554 -12.070 -15.925
  408   2HG   GLU  52          2HG       GLU  52 -21.169 -12.773 -15.966
  409    H    GLY  53           H        GLY  53 -20.403 -13.172 -11.773
  410   1HA   GLY  53          1HA       GLY  53 -20.285 -15.525 -11.774
  411   2HA   GLY  53          2HA       GLY  53 -19.135 -15.445 -13.100
  412    H    ARG  54           H        ARG  54 -17.671 -13.300 -11.488
  413    HA   ARG  54           HA       ARG  54 -16.249 -15.182  -9.723
  414   1HB   ARG  54          1HB       ARG  54 -15.021 -14.296 -11.751
  415   2HB   ARG  54          2HB       ARG  54 -15.093 -12.706 -11.003
  416   1HG   ARG  54          1HG       ARG  54 -13.766 -13.448  -9.151
  417   2HG   ARG  54          2HG       ARG  54 -13.818 -15.115  -9.729
  418   1HD   ARG  54          1HD       ARG  54 -12.483 -14.591 -11.621
  419   2HD   ARG  54          2HD       ARG  54 -12.645 -12.858 -11.336
  420    HE   ARG  54           HE       ARG  54 -10.958 -12.983  -9.786
  421   1HH1  ARG  54          1HH1      ARG  54 -12.055 -16.193 -10.569
  422   2HH1  ARG  54          2HH1      ARG  54 -10.766 -16.981  -9.721
  423   1HH2  ARG  54          1HH2      ARG  54  -9.256 -14.009  -8.667
  424   2HH2  ARG  54          2HH2      ARG  54  -9.175 -15.738  -8.639
  425    H    THR  55           H        THR  55 -15.166 -14.199  -7.842
  426    HA   THR  55           HA       THR  55 -16.981 -12.392  -6.493
  427    HB   THR  55           HB       THR  55 -14.888 -12.803  -4.748
  428    HG1  THR  55           1HG      THR  55 -15.325 -15.317  -5.963
  429   1HG2  THR  55          1HG2      THR  55 -17.611 -13.680  -5.100
  430   2HG2  THR  55          2HG2      THR  55 -16.725 -13.356  -3.610
  431   3HG2  THR  55          3HG2      THR  55 -16.641 -14.951  -4.357
  432    HA   PRO  56           HA       PRO  56 -14.697  -8.662  -6.866
  433   1HB   PRO  56          1HB       PRO  56 -15.001  -7.555  -4.406
  434   2HB   PRO  56          2HB       PRO  56 -16.317  -7.659  -5.581
  435   1HG   PRO  56          1HG       PRO  56 -15.732  -9.421  -3.233
  436   2HG   PRO  56          2HG       PRO  56 -17.288  -8.776  -3.787
  437   1HD   PRO  56          1HD       PRO  56 -16.495 -11.312  -4.307
  438   2HD   PRO  56          2HD       PRO  56 -17.514 -10.383  -5.424
  439    H    HIS  57           H        HIS  57 -12.810  -7.496  -6.169
  440    HA   HIS  57           HA       HIS  57 -11.080  -8.872  -4.249
  441   1HB   HIS  57          1HB       HIS  57 -10.351  -9.825  -6.312
  442   2HB   HIS  57          2HB       HIS  57 -10.376  -8.260  -7.120
  443    HD1  HIS  57           1HD      HIS  57  -8.467  -6.550  -6.379
  444    HD2  HIS  57           2HD      HIS  57  -7.981 -10.472  -5.098
  445    HE1  HIS  57           1HE      HIS  57  -6.058  -6.735  -5.681
  446    H    LEU  58           H        LEU  58  -9.731  -7.545  -3.113
  447    HA   LEU  58           HA       LEU  58 -10.176  -4.680  -3.457
  448   1HB   LEU  58          1HB       LEU  58 -10.119  -6.254  -1.239
  449   2HB   LEU  58          2HB       LEU  58  -8.485  -5.596  -1.239
  450    HG   LEU  58           HG       LEU  58 -11.074  -4.058  -1.106
  451   1HD1  LEU  58          1HD1      LEU  58  -8.817  -4.532   0.825
  452   2HD1  LEU  58          2HD1      LEU  58 -10.520  -4.949   1.016
  453   3HD1  LEU  58          3HD1      LEU  58 -10.020  -3.258   1.034
  454   1HD2  LEU  58          1HD2      LEU  58  -9.968  -2.430  -2.165
  455   2HD2  LEU  58          2HD2      LEU  58  -8.415  -3.249  -1.996
  456   3HD2  LEU  58          3HD2      LEU  58  -9.043  -2.268  -0.672
  457    H    GLN  59           H        GLN  59  -8.792  -3.576  -4.662
  458    HA   GLN  59           HA       GLN  59  -5.934  -4.255  -4.499
  459   1HB   GLN  59          1HB       GLN  59  -6.626  -5.068  -6.627
  460   2HB   GLN  59          2HB       GLN  59  -7.560  -3.614  -6.954
  461   1HG   GLN  59          1HG       GLN  59  -5.575  -3.547  -8.269
  462   2HG   GLN  59          2HG       GLN  59  -5.443  -2.327  -7.003
  463   1HE2  GLN  59          1HE2      GLN  59  -3.939  -2.584  -5.376
  464   2HE2  GLN  59          2HE2      GLN  59  -2.670  -3.753  -5.455
  465    H    GLY  60           H        GLY  60  -4.907  -2.623  -3.558
  466   1HA   GLY  60          1HA       GLY  60  -5.371   0.091  -4.520
  467   2HA   GLY  60          2HA       GLY  60  -5.677  -0.194  -2.813
  468    H    PHE  61           H        PHE  61  -3.859   1.662  -3.347
  469    HA   PHE  61           HA       PHE  61  -1.368   0.382  -2.505
  470   1HB   PHE  61          1HB       PHE  61  -0.843   0.651  -4.773
  471   2HB   PHE  61          2HB       PHE  61  -1.704   2.182  -4.887
  472    HD1  PHE  61           2HD      PHE  61   1.163   0.696  -3.015
  473    HD2  PHE  61           1HD      PHE  61  -0.445   4.089  -5.020
  474    HE1  PHE  61           2HE      PHE  61   3.276   1.905  -2.656
  475    HE2  PHE  61           1HE      PHE  61   1.666   5.303  -4.665
  476    HZ   PHE  61           HZ       PHE  61   3.529   4.212  -3.481
  477    H    ALA  62           H        ALA  62  -0.180   1.555  -1.056
  478    HA   ALA  62           HA       ALA  62  -1.071   4.285  -0.440
  479   1HB   ALA  62          1HB       ALA  62  -1.731   3.822   1.642
  480   2HB   ALA  62          2HB       ALA  62  -1.788   2.139   1.115
  481   3HB   ALA  62          3HB       ALA  62  -0.355   2.758   1.937
  482    H    ASN  63           H        ASN  63   0.499   5.632   0.488
  483    HA   ASN  63           HA       ASN  63   3.251   4.623   0.220
  484   1HB   ASN  63          1HB       ASN  63   1.947   7.182  -0.485
  485   2HB   ASN  63          2HB       ASN  63   3.551   7.319   0.229
  486   1HD2  ASN  63          1HD2      ASN  63   2.302   7.614  -2.561
  487   2HD2  ASN  63          2HD2      ASN  63   3.406   6.760  -3.580
  488    H    PHE  64           H        PHE  64   4.188   4.199   2.099
  489    HA   PHE  64           HA       PHE  64   3.235   5.212   4.581
  490   1HB   PHE  64          1HB       PHE  64   5.225   3.288   3.676
  491   2HB   PHE  64          2HB       PHE  64   5.787   4.219   5.061
  492    HD1  PHE  64           2HD      PHE  64   4.249   4.332   7.103
  493    HD2  PHE  64           1HD      PHE  64   3.789   1.490   3.968
  494    HE1  PHE  64           2HE      PHE  64   2.929   2.896   8.603
  495    HE2  PHE  64           1HE      PHE  64   2.467   0.050   5.463
  496    HZ   PHE  64           HZ       PHE  64   2.037   0.752   7.784
  497    H    VAL  65           H        VAL  65   3.726   7.044   5.588
  498    HA   VAL  65           HA       VAL  65   5.362   9.020   4.434
  499    HB   VAL  65           HB       VAL  65   4.348   8.816   7.272
  500   1HG1  VAL  65          1HG1      VAL  65   6.217  10.356   7.135
  501   2HG1  VAL  65          2HG1      VAL  65   5.466  11.178   5.766
  502   3HG1  VAL  65          3HG1      VAL  65   4.711  11.246   7.359
  503   1HG2  VAL  65          1HG2      VAL  65   2.463  10.015   6.604
  504   2HG2  VAL  65          2HG2      VAL  65   3.211  10.535   5.094
  505   3HG2  VAL  65          3HG2      VAL  65   2.701   8.858   5.294
  506    H    LYS  66           H        LYS  66   6.063   6.411   6.581
  507    HA   LYS  66           HA       LYS  66   8.827   7.396   6.840
  508   1HB   LYS  66          1HB       LYS  66   6.978   6.313   8.897
  509   2HB   LYS  66          2HB       LYS  66   8.658   5.799   8.991
  510   1HG   LYS  66          1HG       LYS  66   8.577   7.664  10.364
  511   2HG   LYS  66          2HG       LYS  66   9.221   8.299   8.848
  512   1HD   LYS  66          1HD       LYS  66   6.637   8.694   8.367
  513   2HD   LYS  66          2HD       LYS  66   6.579   8.741  10.131
  514   1HE   LYS  66          1HE       LYS  66   8.441  10.429  10.039
  515   2HE   LYS  66          2HE       LYS  66   8.211  10.482   8.292
  516   1HZ   LYS  66          1HZ       LYS  66   6.683  11.727  10.359
  517   2HZ   LYS  66          2HZ       LYS  66   5.704  10.821   9.320
  518   3HZ   LYS  66          3HZ       LYS  66   6.698  12.039   8.696
  519    H    LYS  67           H        LYS  67  10.474   5.796   6.855
  520    HA   LYS  67           HA       LYS  67  10.132   3.729   5.001
  521   1HB   LYS  67          1HB       LYS  67  12.282   3.964   7.114
  522   2HB   LYS  67          2HB       LYS  67  12.370   2.999   5.646
  523   1HG   LYS  67          1HG       LYS  67  12.006   5.979   5.594
  524   2HG   LYS  67          2HG       LYS  67  13.595   5.211   5.633
  525   1HD   LYS  67          1HD       LYS  67  12.376   3.838   3.622
  526   2HD   LYS  67          2HD       LYS  67  11.658   5.441   3.439
  527   1HE   LYS  67          1HE       LYS  67  14.399   5.853   3.891
  528   2HE   LYS  67          2HE       LYS  67  14.289   4.528   2.733
  529   1HZ   LYS  67          1HZ       LYS  67  13.949   7.260   2.263
  530   2HZ   LYS  67          2HZ       LYS  67  12.455   6.514   1.996
  531   3HZ   LYS  67          3HZ       LYS  67  13.825   5.987   1.155
  532    H    GLN  68           H        GLN  68   9.202   1.807   5.182
  533    HA   GLN  68           HA       GLN  68   9.226   0.453   7.787
  534   1HB   GLN  68          1HB       GLN  68   6.835   0.776   5.968
  535   2HB   GLN  68          2HB       GLN  68   6.891  -0.316   7.345
  536   1HG   GLN  68          1HG       GLN  68   6.915   2.679   7.331
  537   2HG   GLN  68          2HG       GLN  68   5.775   1.586   8.114
  538   1HE2  GLN  68          1HE2      GLN  68   7.547   3.803   9.098
  539   2HE2  GLN  68          2HE2      GLN  68   8.407   3.111  10.427
  540    H    THR  69           H        THR  69   9.057  -1.842   7.691
  541    HA   THR  69           HA       THR  69  10.129  -2.927   5.197
  542    HB   THR  69           HB       THR  69  10.962  -4.747   6.421
  543    HG1  THR  69           1HG      THR  69  10.216  -4.884   8.764
  544   1HG2  THR  69          1HG2      THR  69  11.049  -2.368   8.282
  545   2HG2  THR  69          2HG2      THR  69  12.157  -2.686   6.946
  546   3HG2  THR  69          3HG2      THR  69  12.131  -3.759   8.345
  547    H    PHE  70           H        PHE  70   9.419  -5.244   4.701
  548    HA   PHE  70           HA       PHE  70   6.692  -5.235   4.041
  549   1HB   PHE  70          1HB       PHE  70   8.088  -6.548   2.670
  550   2HB   PHE  70          2HB       PHE  70   8.796  -7.386   4.047
  551    HD1  PHE  70           1HD      PHE  70   5.454  -6.871   2.468
  552    HD2  PHE  70           2HD      PHE  70   8.121  -9.541   4.435
  553    HE1  PHE  70           1HE      PHE  70   3.831  -8.698   2.182
  554    HE2  PHE  70           2HE      PHE  70   6.503 -11.372   4.151
  555    HZ   PHE  70           HZ       PHE  70   4.355 -10.952   3.023
  556    H    ASN  71           H        ASN  71   8.434  -7.181   6.466
  557    HA   ASN  71           HA       ASN  71   6.179  -8.460   7.531
  558   1HB   ASN  71          1HB       ASN  71   8.820  -8.749   7.914
  559   2HB   ASN  71          2HB       ASN  71   8.430  -7.833   9.367
  560   1HD2  ASN  71          1HD2      ASN  71   8.293  -9.173  11.008
  561   2HD2  ASN  71          2HD2      ASN  71   7.482 -10.699  11.013
  562    H    LYS  72           H        LYS  72   7.770  -5.429   8.415
  563    HA   LYS  72           HA       LYS  72   6.214  -4.890  10.709
  564   1HB   LYS  72          1HB       LYS  72   8.421  -3.776   9.718
  565   2HB   LYS  72          2HB       LYS  72   7.254  -2.640   9.055
  566   1HG   LYS  72          1HG       LYS  72   7.657  -3.316  11.961
  567   2HG   LYS  72          2HG       LYS  72   8.096  -1.811  11.150
  568   1HD   LYS  72          1HD       LYS  72   5.681  -1.480  10.614
  569   2HD   LYS  72          2HD       LYS  72   5.318  -2.895  11.605
  570   1HE   LYS  72          1HE       LYS  72   6.550  -0.292  12.492
  571   2HE   LYS  72          2HE       LYS  72   4.977  -0.946  12.946
  572   1HZ   LYS  72          1HZ       LYS  72   6.128  -1.617  14.743
  573   2HZ   LYS  72          2HZ       LYS  72   7.621  -1.613  13.949
  574   3HZ   LYS  72          3HZ       LYS  72   6.560  -2.915  13.747
  575    H    VAL  73           H        VAL  73   5.923  -3.747   7.351
  576    HA   VAL  73           HA       VAL  73   3.696  -2.123   7.643
  577    HB   VAL  73           HB       VAL  73   4.568  -3.810   5.301
  578   1HG1  VAL  73          1HG1      VAL  73   2.310  -3.541   4.832
  579   2HG1  VAL  73          2HG1      VAL  73   2.242  -1.944   5.580
  580   3HG1  VAL  73          3HG1      VAL  73   3.047  -2.158   4.025
  581   1HG2  VAL  73          1HG2      VAL  73   5.855  -1.733   6.279
  582   2HG2  VAL  73          2HG2      VAL  73   5.691  -1.961   4.538
  583   3HG2  VAL  73          3HG2      VAL  73   4.631  -0.833   5.383
  584    H    LYS  74           H        LYS  74   3.927  -5.573   7.686
  585    HA   LYS  74           HA       LYS  74   1.261  -6.217   7.019
  586   1HB   LYS  74          1HB       LYS  74   3.199  -7.723   8.787
  587   2HB   LYS  74          2HB       LYS  74   1.727  -8.384   8.089
  588   1HG   LYS  74          1HG       LYS  74   3.084  -7.380   5.905
  589   2HG   LYS  74          2HG       LYS  74   4.359  -8.062   6.919
  590   1HD   LYS  74          1HD       LYS  74   3.796  -9.969   5.840
  591   2HD   LYS  74          2HD       LYS  74   2.543 -10.037   7.081
  592   1HE   LYS  74          1HE       LYS  74   0.928  -9.083   5.593
  593   2HE   LYS  74          2HE       LYS  74   2.165  -8.750   4.382
  594   1HZ   LYS  74          1HZ       LYS  74   1.495 -11.488   5.298
  595   2HZ   LYS  74          2HZ       LYS  74   2.431 -11.046   3.960
  596   3HZ   LYS  74          3HZ       LYS  74   0.764 -10.758   3.958
  597    H    TRP  75           H        TRP  75   2.536  -4.631   9.699
  598    HA   TRP  75           HA       TRP  75   0.781  -5.575  11.725
  599   1HB   TRP  75          1HB       TRP  75   1.646  -3.854  13.079
  600   2HB   TRP  75          2HB       TRP  75   2.979  -4.276  12.006
  601    HD1  TRP  75           HD       TRP  75   2.108  -2.575   9.461
  602    HE1  TRP  75           1HE      TRP  75   2.282  -0.008   9.538
  603    HE3  TRP  75           3HE      TRP  75   2.094  -1.913  14.530
  604    HZ2  TRP  75           2HZ      TRP  75   2.398   2.028  11.490
  605    HZ3  TRP  75           3HZ      TRP  75   2.240   0.376  15.421
  606    HH2  TRP  75           HH       TRP  75   2.389   2.305  13.931
  607    H    TYR  76           H        TYR  76   0.382  -3.447   9.075
  608    HA   TYR  76           HA       TYR  76  -2.143  -2.441  10.211
  609   1HB   TYR  76          1HB       TYR  76  -0.040  -1.171   8.617
  610   2HB   TYR  76          2HB       TYR  76  -1.658  -0.898   7.979
  611    HD1  TYR  76           2HD      TYR  76  -3.215  -0.807  10.515
  612    HD2  TYR  76           1HD      TYR  76   0.541   0.917   9.502
  613    HE1  TYR  76           2HE      TYR  76  -3.581   0.959  12.188
  614    HE2  TYR  76           1HE      TYR  76   0.186   2.686  11.174
  615    HH   TYR  76           HH       TYR  76  -2.667   3.460  12.455
  616    H    LEU  77           H        LEU  77  -0.647  -3.492   7.157
  617    HA   LEU  77           HA       LEU  77  -3.148  -3.807   5.817
  618   1HB   LEU  77          1HB       LEU  77  -0.384  -4.809   5.160
  619   2HB   LEU  77          2HB       LEU  77  -1.778  -4.975   4.094
  620    HG   LEU  77           HG       LEU  77  -0.505  -2.383   4.971
  621   1HD1  LEU  77          1HD1      LEU  77  -0.423  -3.958   2.415
  622   2HD1  LEU  77          2HD1      LEU  77   0.926  -3.389   3.398
  623   3HD1  LEU  77          3HD1      LEU  77  -0.045  -2.237   2.482
  624   1HD2  LEU  77          1HD2      LEU  77  -2.040  -1.385   3.290
  625   2HD2  LEU  77          2HD2      LEU  77  -2.866  -2.053   4.698
  626   3HD2  LEU  77          3HD2      LEU  77  -2.860  -2.943   3.175
  627    H    GLY  78           H        GLY  78  -1.530  -5.649   8.125
  628   1HA   GLY  78          1HA       GLY  78  -2.026  -7.692   9.057
  629   2HA   GLY  78          2HA       GLY  78  -3.478  -7.712   8.067
  630    H    ALA  79           H        ALA  79  -1.813  -9.956   8.672
  631    HA   ALA  79           HA       ALA  79  -0.157 -10.539   6.408
  632   1HB   ALA  79          1HB       ALA  79  -0.568 -12.960   7.507
  633   2HB   ALA  79          2HB       ALA  79   0.612 -11.798   8.115
  634   3HB   ALA  79          3HB       ALA  79  -0.974 -11.926   8.877
  635    H    ARG  80           H        ARG  80  -3.502 -11.017   7.241
  636    HA   ARG  80           HA       ARG  80  -4.228 -13.095   5.568
  637   1HB   ARG  80          1HB       ARG  80  -5.863 -10.608   6.098
  638   2HB   ARG  80          2HB       ARG  80  -6.475 -12.185   5.614
  639   1HG   ARG  80          1HG       ARG  80  -5.006 -12.679   7.922
  640   2HG   ARG  80          2HG       ARG  80  -5.867 -11.172   8.243
  641   1HD   ARG  80          1HD       ARG  80  -7.142 -13.708   7.225
  642   2HD   ARG  80          2HD       ARG  80  -7.140 -13.187   8.910
  643    HE   ARG  80           HE       ARG  80  -8.193 -11.102   7.410
  644   1HH1  ARG  80          1HH1      ARG  80  -8.987 -14.403   8.180
  645   2HH1  ARG  80          2HH1      ARG  80 -10.697 -14.160   8.045
  646   1HH2  ARG  80          1HH2      ARG  80 -10.442 -10.769   7.230
  647   2HH2  ARG  80          2HH2      ARG  80 -11.524 -12.093   7.504
  648    H    CYS  81           H        CYS  81  -3.500  -9.767   4.791
  649    HA   CYS  81           HA       CYS  81  -4.257 -10.217   1.993
  650   1HB   CYS  81          1HB       CYS  81  -5.153  -8.190   3.042
  651   2HB   CYS  81          2HB       CYS  81  -3.521  -7.658   3.428
  652    HG   CYS  81           HG       CYS  81  -5.146  -6.666   0.969
  653    H    HIS  82           H        HIS  82  -2.801  -9.984   0.313
  654    HA   HIS  82           HA       HIS  82  -0.038 -10.472   1.010
  655   1HB   HIS  82          1HB       HIS  82  -1.320 -11.654  -0.850
  656   2HB   HIS  82          2HB       HIS  82  -1.166 -10.161  -1.771
  657    HD1  HIS  82           1HD      HIS  82   1.120 -12.646  -0.016
  658    HD2  HIS  82           2HD      HIS  82   1.087 -10.055  -3.264
  659    HE1  HIS  82           1HE      HIS  82   3.309 -13.021  -1.198
  660    H    ILE  83           H        ILE  83   1.571  -9.036   0.989
  661    HA   ILE  83           HA       ILE  83   1.010  -6.361  -0.112
  662    HB   ILE  83           HB       ILE  83   3.168  -6.846   1.903
  663   1HG1  ILE  83          1HG1      ILE  83   0.234  -6.447   2.525
  664   2HG1  ILE  83          2HG1      ILE  83   1.183  -7.887   2.877
  665   1HG2  ILE  83          1HG2      ILE  83   2.702  -4.530   2.494
  666   2HG2  ILE  83          2HG2      ILE  83   3.025  -4.684   0.768
  667   3HG2  ILE  83          3HG2      ILE  83   1.368  -4.493   1.341
  668   1HD1  ILE  83          1HD1      ILE  83   1.070  -6.780   4.909
  669   2HD1  ILE  83          2HD1      ILE  83   2.652  -6.319   4.279
  670   3HD1  ILE  83          3HD1      ILE  83   1.298  -5.195   4.170
  671    H    GLU  84           H        GLU  84   2.458  -5.403  -1.473
  672    HA   GLU  84           HA       GLU  84   5.011  -6.712  -1.997
  673   1HB   GLU  84          1HB       GLU  84   2.702  -6.753  -3.807
  674   2HB   GLU  84          2HB       GLU  84   4.182  -6.172  -4.557
  675   1HG   GLU  84          1HG       GLU  84   5.265  -8.182  -4.305
  676   2HG   GLU  84          2HG       GLU  84   4.248  -8.682  -2.955
  677    H    LYS  85           H        LYS  85   6.387  -5.398  -3.475
  678    HA   LYS  85           HA       LYS  85   6.221  -2.620  -2.704
  679   1HB   LYS  85          1HB       LYS  85   8.413  -2.412  -3.783
  680   2HB   LYS  85          2HB       LYS  85   8.379  -3.770  -2.666
  681   1HG   LYS  85          1HG       LYS  85   7.912  -5.237  -4.674
  682   2HG   LYS  85          2HG       LYS  85   8.319  -3.835  -5.667
  683   1HD   LYS  85          1HD       LYS  85  10.348  -4.126  -3.707
  684   2HD   LYS  85          2HD       LYS  85  10.067  -5.712  -4.428
  685   1HE   LYS  85          1HE       LYS  85  10.219  -4.561  -6.679
  686   2HE   LYS  85          2HE       LYS  85  10.815  -3.147  -5.812
  687   1HZ   LYS  85          1HZ       LYS  85  12.681  -4.385  -5.035
  688   2HZ   LYS  85          2HZ       LYS  85  12.585  -4.603  -6.709
  689   3HZ   LYS  85          3HZ       LYS  85  12.072  -5.832  -5.665
  690    H    ALA  86           H        ALA  86   5.596  -0.944  -3.930
  691    HA   ALA  86           HA       ALA  86   4.455  -1.510  -6.539
  692   1HB   ALA  86          1HB       ALA  86   4.363   1.269  -5.757
  693   2HB   ALA  86          2HB       ALA  86   3.043   0.140  -6.063
  694   3HB   ALA  86          3HB       ALA  86   3.787   0.216  -4.466
  695    H    LYS  87           H        LYS  87   4.898  -0.153  -8.400
  696    HA   LYS  87           HA       LYS  87   7.516   1.164  -8.386
  697   1HB   LYS  87          1HB       LYS  87   8.308  -0.008 -10.290
  698   2HB   LYS  87          2HB       LYS  87   7.716  -1.234  -9.177
  699   1HG   LYS  87          1HG       LYS  87   5.518  -0.619 -10.754
  700   2HG   LYS  87          2HG       LYS  87   6.882  -0.630 -11.874
  701   1HD   LYS  87          1HD       LYS  87   7.349  -2.854 -11.493
  702   2HD   LYS  87          2HD       LYS  87   6.612  -2.843  -9.889
  703   1HE   LYS  87          1HE       LYS  87   4.392  -2.643 -10.948
  704   2HE   LYS  87          2HE       LYS  87   5.160  -2.738 -12.532
  705   1HZ   LYS  87          1HZ       LYS  87   4.302  -4.882 -11.872
  706   2HZ   LYS  87          2HZ       LYS  87   5.207  -4.848 -10.443
  707   3HZ   LYS  87          3HZ       LYS  87   5.992  -4.940 -11.938
  708    H    GLY  88           H        GLY  88   7.766   2.806  -9.909
  709   1HA   GLY  88          1HA       GLY  88   6.988   3.927 -11.929
  710   2HA   GLY  88          2HA       GLY  88   5.355   3.457 -11.484
  711    H    THR  89           H        THR  89   4.760   5.682 -11.712
  712    HA   THR  89           HA       THR  89   5.725   7.416  -9.536
  713    HB   THR  89           HB       THR  89   5.115   9.320 -10.818
  714    HG1  THR  89           1HG      THR  89   3.818   7.474 -12.560
  715   1HG2  THR  89          1HG2      THR  89   6.166   7.535 -12.980
  716   2HG2  THR  89          2HG2      THR  89   7.146   7.865 -11.551
  717   3HG2  THR  89          3HG2      THR  89   6.615   9.193 -12.583
  718    H    ASP  90           H        ASP  90   3.961   9.098  -8.908
  719    HA   ASP  90           HA       ASP  90   1.911   7.753  -7.576
  720   1HB   ASP  90          1HB       ASP  90   2.689   9.920  -6.820
  721   2HB   ASP  90          2HB       ASP  90   2.142  10.677  -8.314
  722    H    GLN  91           H        GLN  91   1.904   9.459 -10.667
  723    HA   GLN  91           HA       GLN  91  -0.879   9.330 -11.120
  724   1HB   GLN  91          1HB       GLN  91   1.524   9.783 -12.839
  725   2HB   GLN  91          2HB       GLN  91  -0.027   9.478 -13.611
  726   1HG   GLN  91          1HG       GLN  91   0.210  11.572 -11.496
  727   2HG   GLN  91          2HG       GLN  91   0.725  11.909 -13.148
  728   1HE2  GLN  91          1HE2      GLN  91  -1.909  11.570 -11.010
  729   2HE2  GLN  91          2HE2      GLN  91  -3.173  11.868 -12.150
  730    H    GLN  92           H        GLN  92   1.757   7.108 -11.796
  731    HA   GLN  92           HA       GLN  92   0.260   5.340 -13.442
  732   1HB   GLN  92          1HB       GLN  92   2.899   5.282 -12.078
  733   2HB   GLN  92          2HB       GLN  92   2.197   3.733 -12.528
  734   1HG   GLN  92          1HG       GLN  92   1.864   5.197 -14.809
  735   2HG   GLN  92          2HG       GLN  92   3.399   5.806 -14.190
  736   1HE2  GLN  92          1HE2      GLN  92   5.183   4.553 -14.305
  737   2HE2  GLN  92          2HE2      GLN  92   5.219   2.977 -15.012
  738    H    ASN  93           H        ASN  93   0.888   5.529  -9.985
  739    HA   ASN  93           HA       ASN  93  -0.365   3.007  -9.408
  740   1HB   ASN  93          1HB       ASN  93   0.691   5.266  -7.724
  741   2HB   ASN  93          2HB       ASN  93  -0.233   3.952  -7.001
  742   1HD2  ASN  93          1HD2      ASN  93   2.129   3.917  -9.632
  743   2HD2  ASN  93          2HD2      ASN  93   3.232   2.835  -8.861
  744    H    LYS  94           H        LYS  94  -1.278   6.413  -9.241
  745    HA   LYS  94           HA       LYS  94  -3.743   6.092  -7.936
  746   1HB   LYS  94          1HB       LYS  94  -2.590   8.265  -8.257
  747   2HB   LYS  94          2HB       LYS  94  -2.981   8.195  -9.971
  748   1HG   LYS  94          1HG       LYS  94  -5.325   8.350  -9.507
  749   2HG   LYS  94          2HG       LYS  94  -5.036   8.211  -7.771
  750   1HD   LYS  94          1HD       LYS  94  -4.015  10.341  -7.674
  751   2HD   LYS  94          2HD       LYS  94  -3.878  10.438  -9.431
  752   1HE   LYS  94          1HE       LYS  94  -6.320  10.536  -9.608
  753   2HE   LYS  94          2HE       LYS  94  -6.450  10.446  -7.852
  754   1HZ   LYS  94          1HZ       LYS  94  -4.938  12.596  -9.213
  755   2HZ   LYS  94          2HZ       LYS  94  -5.484  12.554  -7.612
  756   3HZ   LYS  94          3HZ       LYS  94  -6.591  12.730  -8.879
  757    H    GLU  95           H        GLU  95  -2.951   6.204 -11.399
  758    HA   GLU  95           HA       GLU  95  -5.631   5.829 -12.269
  759   1HB   GLU  95          1HB       GLU  95  -2.946   5.838 -13.537
  760   2HB   GLU  95          2HB       GLU  95  -4.230   5.007 -14.403
  761   1HG   GLU  95          1HG       GLU  95  -5.187   7.539 -13.490
  762   2HG   GLU  95          2HG       GLU  95  -3.667   7.757 -14.355
  763    H    TYR  96           H        TYR  96  -2.959   3.661 -11.562
  764    HA   TYR  96           HA       TYR  96  -3.935   1.317 -12.708
  765   1HB   TYR  96          1HB       TYR  96  -1.672   1.449 -11.857
  766   2HB   TYR  96          2HB       TYR  96  -2.263   1.696 -10.217
  767    HD1  TYR  96           2HD      TYR  96  -1.754  -0.755 -12.895
  768    HD2  TYR  96           1HD      TYR  96  -3.113  -0.156  -8.908
  769    HE1  TYR  96           2HE      TYR  96  -1.713  -3.186 -12.522
  770    HE2  TYR  96           1HE      TYR  96  -3.076  -2.586  -8.524
  771    HH   TYR  96           HH       TYR  96  -1.470  -4.672 -10.104
  772    H    CYS  97           H        CYS  97  -4.473   2.644  -9.460
  773    HA   CYS  97           HA       CYS  97  -6.105   0.507  -8.562
  774   1HB   CYS  97          1HB       CYS  97  -5.901   3.365  -7.593
  775   2HB   CYS  97          2HB       CYS  97  -6.759   2.083  -6.749
  776    HG   CYS  97           HG       CYS  97  -4.384   0.528  -6.433
  777    H    SER  98           H        SER  98  -6.761   3.530 -10.219
  778    HA   SER  98           HA       SER  98  -9.614   3.320  -9.936
  779   1HB   SER  98          1HB       SER  98  -8.462   5.509 -10.156
  780   2HB   SER  98          2HB       SER  98  -8.001   5.076 -11.802
  781    HG   SER  98           HG       SER  98 -10.219   4.967 -12.319
  782    H    LYS  99           H        LYS  99  -7.311   1.873 -11.925
  783    HA   LYS  99           HA       LYS  99  -8.598   1.683 -14.393
  784   1HB   LYS  99          1HB       LYS  99  -6.277   0.978 -14.026
  785   2HB   LYS  99          2HB       LYS  99  -6.833  -0.359 -13.027
  786   1HG   LYS  99          1HG       LYS  99  -8.166  -0.511 -15.529
  787   2HG   LYS  99          2HG       LYS  99  -6.441  -0.289 -15.828
  788   1HD   LYS  99          1HD       LYS  99  -7.664  -2.394 -14.043
  789   2HD   LYS  99          2HD       LYS  99  -7.034  -2.662 -15.671
  790   1HE   LYS  99          1HE       LYS  99  -4.981  -1.369 -14.291
  791   2HE   LYS  99          2HE       LYS  99  -5.634  -2.543 -13.149
  792   1HZ   LYS  99          1HZ       LYS  99  -4.489  -3.047 -15.830
  793   2HZ   LYS  99          2HZ       LYS  99  -5.435  -4.198 -15.030
  794   3HZ   LYS  99          3HZ       LYS  99  -3.983  -3.670 -14.340
  795    H    GLU 100           H        GLU 100  -9.297   0.158 -11.374
  796    HA   GLU 100           HA       GLU 100 -10.799  -2.033 -12.415
  797   1HB   GLU 100          1HB       GLU 100 -10.747  -0.745  -9.684
  798   2HB   GLU 100          2HB       GLU 100 -11.670  -2.192 -10.063
  799   1HG   GLU 100          1HG       GLU 100  -9.826  -3.513 -10.183
  800   2HG   GLU 100          2HG       GLU 100  -8.780  -2.198 -10.716
  801    H    GLY 101           H        GLY 101 -11.412   1.289 -12.122
  802   1HA   GLY 101          1HA       GLY 101 -13.270   2.453 -12.893
  803   2HA   GLY 101          2HA       GLY 101 -14.120   0.925 -13.068
  804    H    ASN 102           H        ASN 102 -12.902   0.794 -10.059
  805    HA   ASN 102           HA       ASN 102 -15.127   2.270  -8.832
  806   1HB   ASN 102          1HB       ASN 102 -14.899  -0.562  -9.005
  807   2HB   ASN 102          2HB       ASN 102 -14.644  -0.107  -7.323
  808   1HD2  ASN 102          1HD2      ASN 102 -16.451  -0.348  -6.239
  809   2HD2  ASN 102          2HD2      ASN 102 -18.030   0.111  -6.771
  810    H    LEU 103           H        LEU 103 -14.581   3.414  -7.075
  811    HA   LEU 103           HA       LEU 103 -11.867   3.044  -6.004
  812   1HB   LEU 103          1HB       LEU 103 -13.369   5.353  -6.800
  813   2HB   LEU 103          2HB       LEU 103 -12.943   5.480  -5.095
  814    HG   LEU 103           HG       LEU 103 -11.341   6.571  -6.680
  815   1HD1  LEU 103          1HD1      LEU 103  -9.462   4.800  -5.570
  816   2HD1  LEU 103          2HD1      LEU 103 -10.818   4.863  -4.444
  817   3HD1  LEU 103          3HD1      LEU 103 -10.003   6.351  -4.927
  818   1HD2  LEU 103          1HD2      LEU 103 -10.319   5.465  -8.334
  819   2HD2  LEU 103          2HD2      LEU 103 -11.591   4.260  -8.127
  820   3HD2  LEU 103          3HD2      LEU 103 -10.031   4.043  -7.331
  821    H    LEU 104           H        LEU 104 -11.739   2.104  -4.086
  822    HA   LEU 104           HA       LEU 104 -14.072   1.942  -2.370
  823   1HB   LEU 104          1HB       LEU 104 -12.799  -0.066  -2.677
  824   2HB   LEU 104          2HB       LEU 104 -11.314   0.747  -2.185
  825    HG   LEU 104           HG       LEU 104 -12.181   0.940   0.099
  826   1HD1  LEU 104          1HD1      LEU 104 -14.549   1.064  -0.358
  827   2HD1  LEU 104          2HD1      LEU 104 -14.223  -0.292   0.721
  828   3HD1  LEU 104          3HD1      LEU 104 -14.545  -0.584  -0.988
  829   1HD2  LEU 104          1HD2      LEU 104 -12.210  -1.522   0.614
  830   2HD2  LEU 104          2HD2      LEU 104 -10.829  -0.964  -0.331
  831   3HD2  LEU 104          3HD2      LEU 104 -12.158  -1.811  -1.125
  832    H    MET 105           H        MET 105 -11.099   3.700  -2.573
  833    HA   MET 105           HA       MET 105 -11.892   5.416  -0.416
  834   1HB   MET 105          1HB       MET 105 -10.900   4.027   1.120
  835   2HB   MET 105          2HB       MET 105  -9.742   3.391  -0.039
  836   1HG   MET 105          1HG       MET 105  -8.257   5.092   0.294
  837   2HG   MET 105          2HG       MET 105  -9.508   6.237   0.770
  838   1HE   MET 105          1HE       MET 105  -6.963   3.583   3.373
  839   2HE   MET 105          2HE       MET 105  -7.991   2.685   2.257
  840   3HE   MET 105          3HE       MET 105  -6.862   3.893   1.640
  841    H    GLU 106           H        GLU 106 -11.029   7.423  -0.631
  842    HA   GLU 106           HA       GLU 106  -8.740   7.775  -2.431
  843   1HB   GLU 106          1HB       GLU 106 -11.233   8.186  -3.373
  844   2HB   GLU 106          2HB       GLU 106 -10.915   9.770  -2.681
  845   1HG   GLU 106          1HG       GLU 106  -8.608   9.164  -4.093
  846   2HG   GLU 106          2HG       GLU 106  -9.920   8.582  -5.117
  847    H    CYS 107           H        CYS 107  -7.282   8.584  -1.049
  848    HA   CYS 107           HA       CYS 107  -7.813  11.161   0.156
  849   1HB   CYS 107          1HB       CYS 107  -7.487   8.661   1.749
  850   2HB   CYS 107          2HB       CYS 107  -6.726  10.127   2.353
  851    HG   CYS 107           HG       CYS 107  -9.252   9.607   3.593
  852    H    GLY 108           H        GLY 108  -5.715  11.797   1.489
  853   1HA   GLY 108          1HA       GLY 108  -3.379  11.911   1.588
  854   2HA   GLY 108          2HA       GLY 108  -3.288  10.692   0.326
  855    H    ALA 109           H        ALA 109  -1.550  12.512  -0.115
  856    HA   ALA 109           HA       ALA 109  -2.765  14.507  -1.910
  857   1HB   ALA 109          1HB       ALA 109  -0.873  14.823   0.136
  858   2HB   ALA 109          2HB       ALA 109   0.006  15.028  -1.380
  859   3HB   ALA 109          3HB       ALA 109  -1.406  16.028  -1.037
  860    HA   PRO 110           HA       PRO 110  -0.880  12.710  -5.442
  861   1HB   PRO 110          1HB       PRO 110  -0.139  14.895  -6.873
  862   2HB   PRO 110          2HB       PRO 110  -1.824  14.399  -6.682
  863   1HG   PRO 110          1HG       PRO 110  -0.293  16.511  -5.213
  864   2HG   PRO 110          2HG       PRO 110  -1.945  16.570  -5.857
  865   1HD   PRO 110          1HD       PRO 110  -1.416  16.124  -3.239
  866   2HD   PRO 110          2HD       PRO 110  -2.819  15.415  -4.064
  867    H    ARG 111           H        ARG 111   0.970  11.632  -4.959
  868    HA   ARG 111           HA       ARG 111   3.355  12.897  -4.062
  869   1HB   ARG 111          1HB       ARG 111   2.548  10.144  -4.841
  870   2HB   ARG 111          2HB       ARG 111   4.266  10.518  -4.886
  871   1HG   ARG 111          1HG       ARG 111   2.539  11.012  -2.476
  872   2HG   ARG 111          2HG       ARG 111   3.421   9.508  -2.750
  873   1HD   ARG 111          1HD       ARG 111   4.781  12.187  -2.787
  874   2HD   ARG 111          2HD       ARG 111   4.538  11.284  -1.292
  875    HE   ARG 111           HE       ARG 111   5.753   9.631  -3.229
  876   1HH1  ARG 111          1HH1      ARG 111   6.440  12.324  -1.133
  877   2HH1  ARG 111          2HH1      ARG 111   8.127  11.956  -0.996
  878   1HH2  ARG 111          1HH2      ARG 111   7.973   9.135  -3.057
  879   2HH2  ARG 111          2HH2      ARG 111   8.998  10.143  -2.092
  880    H    SER 112           H        SER 112   5.382  13.014  -5.171
  881    HA   SER 112           HA       SER 112   5.070  13.333  -8.083
  882   1HB   SER 112          1HB       SER 112   6.852  14.809  -6.136
  883   2HB   SER 112          2HB       SER 112   6.985  14.958  -7.888
  884    HG   SER 112           HG       SER 112   5.274  16.185  -7.906
  885    H    GLN 113           H        GLN 113   7.410  12.452  -5.556
  886    HA   GLN 113           HA       GLN 113   9.228  11.083  -5.568
  887   1HB   GLN 113          1HB       GLN 113   7.231   9.567  -6.350
  888   2HB   GLN 113          2HB       GLN 113   8.082   9.581  -7.889
  889   1HG   GLN 113          1HG       GLN 113  10.040   9.020  -5.993
  890   2HG   GLN 113          2HG       GLN 113   8.633   8.081  -5.495
  891   1HE2  GLN 113          1HE2      GLN 113  11.175   7.163  -6.555
  892   2HE2  GLN 113          2HE2      GLN 113  10.810   6.261  -7.982
  893    H    GLY 114           H        GLY 114   9.840  13.353  -6.792
  894   1HA   GLY 114          1HA       GLY 114  11.672  12.467  -8.891
  895   2HA   GLY 114          2HA       GLY 114  10.541  13.747  -9.306
  896    H    GLN 115           H        GLN 115  13.299  14.093  -9.444
  897    HA   GLN 115           HA       GLN 115  13.656  16.175  -7.412
  898   1HB   GLN 115          1HB       GLN 115  15.943  15.549  -7.000
  899   2HB   GLN 115          2HB       GLN 115  14.919  14.149  -6.711
  900   1HG   GLN 115          1HG       GLN 115  15.503  13.320  -8.972
  901   2HG   GLN 115          2HG       GLN 115  16.625  14.670  -9.134
  902   1HE2  GLN 115          1HE2      GLN 115  18.629  14.035  -8.854
  903   2HE2  GLN 115          2HE2      GLN 115  19.184  12.876  -7.699
  904    H    ARG 116           H        ARG 116  15.980  17.268  -8.095
  905    HA   ARG 116           HA       ARG 116  15.550  18.089 -10.885
  906   1HB   ARG 116          1HB       ARG 116  15.909  19.570  -8.487
  907   2HB   ARG 116          2HB       ARG 116  17.319  19.855  -9.499
  908   1HG   ARG 116          1HG       ARG 116  14.645  20.037 -10.770
  909   2HG   ARG 116          2HG       ARG 116  15.138  21.333  -9.679
  910   1HD   ARG 116          1HD       ARG 116  17.369  20.887 -11.263
  911   2HD   ARG 116          2HD       ARG 116  16.012  20.743 -12.380
  912    HE   ARG 116           HE       ARG 116  16.990  23.132 -11.184
  913   1HH1  ARG 116          1HH1      ARG 116  14.089  21.556 -12.288
  914   2HH1  ARG 116          2HH1      ARG 116  13.249  23.038 -12.607
  915   1HH2  ARG 116          1HH2      ARG 116  15.896  25.089 -11.600
  916   2HH2  ARG 116          2HH2      ARG 116  14.278  25.047 -12.217