*HEADER    MEMBRANE PROTEIN                        18-DEC-01   1KN7              
*TITLE     SOLUTION STRUCTURE OF THE TANDEM INACTIVATION DOMAIN                  
*TITLE    2 (RESIDUES 1-75) OF POTASSIUM CHANNEL RCK4 (KV1.4)                    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VOLTAGE-GATED POTASSIUM CHANNEL PROTEIN KV1.4;             
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: N-TERMINAL TANDEM INACTIVATION DOMAIN (RESIDUES            
*COMPND   5 1-75);                                                               
*COMPND   6 SYNONYM: RCK4;                                                       
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS;                              
*SOURCE   3 ORGANISM_COMMON: RAT;                                                
*SOURCE   4 GENE: KCNA4;                                                         
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET41A                                    
*KEYWDS    VOLTAGE-GATED POTASSIUM CHANNEL, INACTIVATION DOMAIN,                 
*KEYWDS   2  KV1.4, RCK4,                                                        
*EXPDTA    NMR, 25 STRUCTURES                                                    
*AUTHOR    R.WISSMANN, W.BILDL, D.OLIVER, M.BEYERMANN, H.R.KALBITZER,            
*AUTHOR   2 D.BENTROP, B.FAKLER                                                  
*REVDAT   1   06-MAY-03 1KN7    0                                                
  1 MET  HN      1 MET  HA      3.76   
  1 MET  HN      1 MET  HB2     3.48   
  1 MET  HN      1 MET  HB3     3.61   
  1 MET  HN      1 MET  QG      6.38   
  1 MET  HA      2 GLU  HN      2.86   
  2 GLU  HN      2 GLU  HA      3.67   
  2 GLU  HN      2 GLU  HB2     3.52   
  2 GLU  HN      2 GLU  HB3     3.02   
  2 GLU  HN      2 GLU  QG      6.38   
  2 GLU  HA      3 VAL  HN      2.59   
  3 VAL  HN      3 VAL  HA      3.70   
  3 VAL  HN      3 VAL  HB      3.05   
  3 VAL  HN      3 VAL  QG1     4.51   
  3 VAL  HA      4 ALA  HN      2.62   
  3 VAL  HB      4 ALA  HN      3.70   
  3 VAL  QG1     4 ALA  HN      5.60   
  3 VAL  QG2     4 ALA  HN      6.53   
  4 ALA  HN      4 ALA  HA      3.30   
  4 ALA  HN      4 ALA  QB      4.17   
  4 ALA  HA      5 MET  HN      2.55   
  4 ALA  QB      5 MET  HN      4.95   
  5 MET  HN      5 MET  HA      3.36   
  5 MET  HN      5 MET  HB2     3.17   
  5 MET  HN      5 MET  HB3     3.98   
  5 MET  HN      5 MET  HG2     5.50   
  5 MET  HN      5 MET  HG3     5.10   
  5 MET  HA      6 VAL  HN      2.62   
  6 VAL  HN      6 VAL  HA      3.45   
  6 VAL  HN      6 VAL  HB      2.80   
  6 VAL  HN      6 VAL  QQG     5.98   
  6 VAL  HA      7 SER  HN      2.65   
  6 VAL  HB      7 SER  HN      3.52   
  6 VAL  QQG     7 SER  HN      7.50   
  7 SER  HN      7 SER  HA      3.55   
  7 SER  HN      7 SER  QB      4.52   
  7 SER  HA      8 ALA  HN      2.80   
  7 SER  QB      8 ALA  HN      5.17   
  7 SER  QB      9 GLU  HN      5.29   
  8 ALA  HN      8 ALA  HA      3.55   
  8 ALA  HN      8 ALA  QB      4.17   
  8 ALA  HA      9 GLU  HN      3.02   
  8 ALA  QB      9 GLU  HN      4.82   
  9 GLU  HN      9 GLU  HA      2.83   
  9 GLU  HN      9 GLU  HB2     3.42   
  9 GLU  HN      9 GLU  HB3     3.02   
  9 GLU  HN      9 GLU  QG      5.73   
  9 GLU  HA     10 SER  HN      2.71   
  9 GLU  HB2    10 SER  HN      4.17   
  9 GLU  HB3    10 SER  HN      4.11   
  9 GLU  QG     10 SER  HN      6.38   
 10 SER  HN     10 SER  HA      3.30   
 10 SER  HN     10 SER  QB      4.27   
 11 SER  HN     11 SER  HA      3.08   
 11 SER  HN     11 SER  QB      4.39   
 11 SER  HA     12 GLY  HN      3.11   
 12 GLY  HN     12 GLY  QA      3.93   
 12 GLY  HN     13 CYS  HN      4.20   
 12 GLY  QA     13 CYS  HN      3.93   
 13 CYS  HN     13 CYS  HA      3.27   
 13 CYS  HN     13 CYS  QB      4.18   
 13 CYS  HN     14 ASN  HN      3.42   
 13 CYS  HA     14 ASN  HN      2.86   
 14 ASN  HN     14 ASN  HA      3.14   
 14 ASN  HN     14 ASN  HB2     3.27   
 14 ASN  HN     14 ASN  HB3     3.27   
 14 ASN  HN     15 SER  HN      3.58   
 14 ASN  HA     14 ASN  HD21    5.31   
 14 ASN  HA     15 SER  HN      2.96   
 14 ASN  HB2    14 ASN  HD21    4.63   
 14 ASN  HB2    14 ASN  HD22    5.50   
 14 ASN  HB2    15 SER  HN      4.32   
 14 ASN  HB3    14 ASN  HD21    4.11   
 14 ASN  HB3    14 ASN  HD22    5.50   
 14 ASN  HB3    15 SER  HN      3.89   
 14 ASN  HD21   14 ASN  HD22    2.40   
 15 SER  HN     15 SER  HA      3.45   
 15 SER  HN     15 SER  QB      4.33   
 15 SER  HN     16 HIS  HN      3.52   
 15 SER  HA     16 HIS  HN      2.90   
 15 SER  QB     16 HIS  HN      5.17   
 16 HIS  HN     16 HIS  HA      2.99   
 16 HIS  HN     16 HIS  HB2     3.64   
 16 HIS  HN     16 HIS  HB3     3.17   
 16 HIS  HN     17 MET  HN      3.33   
 16 HIS  HA     17 MET  HN      2.96   
 16 HIS  HB2    17 MET  HN      3.79   
 17 MET  HN     17 MET  HA      3.05   
 17 MET  HN     17 MET  QB      3.87   
 17 MET  HN     17 MET  QG      5.35   
 18 PRO  HA     19 TYR  HN      3.05   
 18 PRO  HB2    19 TYR  HN      4.20   
 18 PRO  HB3    19 TYR  HN      5.50   
 18 PRO  QG     19 TYR  HN      6.38   
 19 TYR  HN     19 TYR  HA      3.21   
 19 TYR  HN     19 TYR  QB      4.14   
 19 TYR  HN     19 TYR  QD      7.64   
 19 TYR  HA     20 GLY  HN      2.55   
 19 TYR  HA     22 ALA  QB      6.53   
 19 TYR  QB     20 GLY  HN      4.64   
 19 TYR  QB     22 ALA  QB      7.40   
 19 TYR  QD     20 GLY  HN      7.64   
 20 GLY  HN     20 GLY  HA1     2.77   
 20 GLY  HN     20 GLY  HA2     2.74   
 20 GLY  HN     21 TYR  HN      3.36   
 20 GLY  HA1    21 TYR  HN      3.27   
 20 GLY  HA2    21 TYR  HN      3.14   
 21 TYR  HN     21 TYR  HA      2.77   
 21 TYR  HN     21 TYR  HB2     3.39   
 21 TYR  HN     21 TYR  HB3     3.52   
 21 TYR  HN     21 TYR  QB      3.87   
 21 TYR  HN     21 TYR  QD      7.30   
 21 TYR  HN     21 TYR  QE      7.63   
 21 TYR  HN     22 ALA  HN      3.33   
 21 TYR  HA     22 ALA  HN      4.17   
 21 TYR  HA     24 GLN  HN      5.04   
 21 TYR  QB     22 ALA  HN      4.70   
 22 ALA  HN     22 ALA  HA      3.21   
 22 ALA  HN     22 ALA  QB      4.20   
 22 ALA  HN     23 ALA  HN      2.99   
 23 ALA  HN     23 ALA  HA      3.21   
 23 ALA  HN     23 ALA  QB      3.68   
 23 ALA  HN     24 GLN  HN      3.39   
 23 ALA  HA     24 GLN  HN      3.36   
 23 ALA  QB     24 GLN  HN      4.26   
 23 ALA  QB     24 GLN  HE21    6.53   
 24 GLN  HN     24 GLN  HA      3.08   
 24 GLN  HN     24 GLN  QB      3.99   
 24 GLN  HN     24 GLN  HG2     4.38   
 24 GLN  HN     24 GLN  HG3     5.28   
 24 GLN  HA     25 ALA  HN      3.30   
 24 GLN  HA     27 ALA  HN      3.14   
 24 GLN  QB     24 GLN  HE21    6.38   
 24 GLN  QB     24 GLN  HE22    6.38   
 24 GLN  QB     25 ALA  HN      4.33   
 24 GLN  HG2    24 GLN  HE21    4.11   
 24 GLN  HG2    24 GLN  HE22    5.10   
 24 GLN  HG3    24 GLN  HE21    4.60   
 24 GLN  HG3    24 GLN  HE22    5.28   
 25 ALA  HN     25 ALA  HA      2.90   
 25 ALA  HN     25 ALA  QB      3.64   
 25 ALA  HN     26 ARG  HN      3.42   
 25 ALA  HA     26 ARG  HN      3.37   
 25 ALA  HA     28 ARG  HN      3.11   
 25 ALA  QB     26 ARG  HN      3.99   
 25 ALA  QB     28 ARG  HN      6.53   
 26 ARG  HN     26 ARG  HA      2.77   
 26 ARG  HN     26 ARG  HB2     3.11   
 26 ARG  HN     26 ARG  HB3     3.17   
 26 ARG  HN     26 ARG  QG      6.38   
 26 ARG  HN     27 ALA  HN      3.24   
 26 ARG  HA     27 ALA  HN      3.45   
 26 ARG  HA     29 GLU  HN      3.30   
 26 ARG  HB2    27 ALA  HN      3.33   
 26 ARG  HB3    27 ALA  HN      3.76   
 27 ALA  HN     27 ALA  HA      3.17   
 27 ALA  HN     27 ALA  QB      3.74   
 27 ALA  HN     28 ARG  HN      3.30   
 27 ALA  HA     28 ARG  HN      3.45   
 27 ALA  HA     30 ARG  HN      2.80   
 27 ALA  QB     28 ARG  HN      4.39   
 28 ARG  HN     28 ARG  HA      3.02   
 28 ARG  HN     28 ARG  HB2     2.93   
 28 ARG  HN     28 ARG  HB3     3.11   
 28 ARG  HN     28 ARG  QG      6.38   
 28 ARG  HN     28 ARG  QD      6.38   
 28 ARG  HN     29 GLU  HN      3.14   
 28 ARG  HA     29 GLU  HN      3.73   
 28 ARG  HA     31 GLU  HN      3.17   
 28 ARG  HB2    29 GLU  HN      3.27   
 28 ARG  HB3    29 GLU  HN      3.76   
 28 ARG  QG     29 GLU  HN      6.38   
 29 GLU  HN     29 GLU  HA      3.08   
 29 GLU  HN     29 GLU  QB      3.87   
 29 GLU  HN     29 GLU  QG      5.85   
 29 GLU  HN     30 ARG  HN      3.08   
 29 GLU  HA     30 ARG  HN      3.64   
 29 GLU  HA     32 ARG  HN      3.92   
 29 GLU  QB     30 ARG  HN      4.39   
 29 GLU  QG     30 ARG  HN      6.38   
 30 ARG  HN     30 ARG  HA      3.08   
 30 ARG  HN     30 ARG  HB2     2.68   
 30 ARG  HN     30 ARG  HB3     3.36   
 30 ARG  HN     30 ARG  QG      6.38   
 30 ARG  HN     31 GLU  HN      2.99   
 30 ARG  HA     31 GLU  HN      4.11   
 30 ARG  HB2    31 GLU  HN      3.11   
 30 ARG  QG     31 GLU  HN      6.38   
 31 GLU  HN     31 GLU  HA      3.86   
 31 GLU  HN     31 GLU  QB      3.93   
 31 GLU  HN     31 GLU  QG      6.28   
 31 GLU  HN     32 ARG  HN      3.21   
 31 GLU  HA     32 ARG  HN      4.66   
 31 GLU  HA     34 ALA  HN      2.86   
 31 GLU  QB     32 ARG  HN      4.55   
 31 GLU  QG     32 ARG  HN      6.38   
 32 ARG  HN     32 ARG  HA      3.05   
 32 ARG  HN     32 ARG  HB2     2.83   
 32 ARG  HN     32 ARG  HB3     3.36   
 32 ARG  HN     32 ARG  HG2     4.66   
 32 ARG  HN     32 ARG  HG3     5.50   
 32 ARG  HN     32 ARG  QD      6.38   
 32 ARG  HN     33 LEU  HN      3.21   
 32 ARG  HA     33 LEU  HN      3.55   
 32 ARG  HB2    33 LEU  HN      3.14   
 33 LEU  HN     33 LEU  HA      2.99   
 33 LEU  HN     33 LEU  HB2     2.80   
 33 LEU  HN     33 LEU  HB3     3.05   
 33 LEU  HN     33 LEU  HG      5.50   
 33 LEU  HN     33 LEU  QQD     6.95   
 33 LEU  HN     34 ALA  HN      3.21   
 33 LEU  HA     34 ALA  HN      3.36   
 33 LEU  HA     36 SER  HN      3.73   
 33 LEU  HB2    34 ALA  HN      3.42   
 33 LEU  HB3    34 ALA  HN      3.89   
 33 LEU  QQD    34 ALA  HN      7.63   
 34 ALA  HN     34 ALA  HA      3.73   
 34 ALA  HN     34 ALA  QB      4.02   
 34 ALA  HN     35 HIS  HN      3.17   
 34 ALA  HA     35 HIS  HN      3.08   
 34 ALA  HA     37 ARG  HN      4.23   
 34 ALA  HA     37 ARG  HB2     3.27   
 34 ALA  HA     37 ARG  HB3     3.92   
 34 ALA  QB     35 HIS  HN      4.42   
 34 ALA  QB     36 SER  HN      5.23   
 34 ALA  QB     37 ARG  HN      6.40   
 34 ALA  QB     37 ARG  HB2     5.60   
 35 HIS  HN     35 HIS  HA      2.90   
 35 HIS  HN     35 HIS  QB      3.96   
 35 HIS  HA     36 SER  HN      3.58   
 35 HIS  HA     38 ALA  HN      4.11   
 35 HIS  HA     38 ALA  QB      4.42   
 35 HIS  QB     36 SER  HN      4.52   
 35 HIS  QB     38 ALA  QB      7.40   
 36 SER  HN     36 SER  HA      3.27   
 36 SER  HN     36 SER  QB      4.36   
 36 SER  HA     37 ARG  HN      3.48   
 36 SER  QB     37 ARG  HN      4.58   
 37 ARG  HN     37 ARG  HA      2.93   
 37 ARG  HN     37 ARG  HB2     2.99   
 37 ARG  HN     37 ARG  HB3     3.48   
 37 ARG  HN     37 ARG  QG      6.25   
 37 ARG  HN     38 ALA  HN      3.11   
 37 ARG  HA     38 ALA  HN      3.17   
 37 ARG  HB2    38 ALA  HN      3.11   
 38 ALA  HN     38 ALA  HA      2.99   
 38 ALA  HN     38 ALA  QB      3.68   
 38 ALA  HN     39 ALA  HN      3.45   
 39 ALA  HN     39 ALA  HA      2.93   
 39 ALA  HN     39 ALA  QB      4.20   
 40 ALA  HN     40 ALA  HA      2.90   
 40 ALA  HN     40 ALA  QB      3.80   
 40 ALA  HN     41 ALA  HN      3.58   
 41 ALA  HN     41 ALA  HA      2.55   
 41 ALA  HN     41 ALA  QB      3.68   
 41 ALA  HA     44 VAL  HN      3.61   
 41 ALA  HA     44 VAL  HB      3.14   
 41 ALA  HA     44 VAL  QG1     5.13   
 41 ALA  QB     44 VAL  HB      5.63   
 42 ALA  HN     43 ALA  HN      3.05   
 43 ALA  HN     43 ALA  HA      2.55   
 43 ALA  HN     43 ALA  QB      3.43   
 43 ALA  HN     44 VAL  HN      3.08   
 43 ALA  HA     44 VAL  HN      3.33   
 43 ALA  QB     44 VAL  HN      3.99   
 44 VAL  HN     44 VAL  HA      2.90   
 44 VAL  HN     44 VAL  HB      2.74   
 44 VAL  HN     44 VAL  QG1     3.92   
 44 VAL  HN     44 VAL  QG2     5.81   
 44 VAL  HN     45 ALA  HN      2.93   
 44 VAL  HA     44 VAL  QG1     4.17   
 44 VAL  HA     44 VAL  QG2     4.54   
 44 VAL  HA     45 ALA  HN      3.38   
 44 VAL  HA     47 ALA  QB      4.48   
 44 VAL  HA     48 THR  HN      5.50   
 44 VAL  HB     45 ALA  HN      3.17   
 44 VAL  QG1    45 ALA  HN      6.22   
 44 VAL  QG1    48 THR  HN      6.53   
 44 VAL  QG2    45 ALA  HN      5.78   
 44 VAL  QG2    48 THR  HN      6.53   
 45 ALA  HN     45 ALA  HA      2.74   
 45 ALA  HN     45 ALA  QB      3.64   
 46 ALA  HN     46 ALA  HA      3.11   
 46 ALA  HN     46 ALA  QB      4.05   
 47 ALA  HN     47 ALA  HA      2.86   
 47 ALA  HN     47 ALA  QB      3.68   
 47 ALA  HA     48 THR  HN      2.99   
 47 ALA  QB     48 THR  HN      4.11   
 48 THR  HN     48 THR  HA      2.55   
 48 THR  HN     48 THR  QG2     4.98   
 48 THR  QG2    49 ALA  HN      5.66   
 49 ALA  HN     49 ALA  HA      2.73   
 49 ALA  HN     49 ALA  QB      3.64   
 50 ALA  HN     50 ALA  HA      2.77   
 50 ALA  HN     50 ALA  QB      3.89   
 50 ALA  HN     51 VAL  HN      3.36   
 50 ALA  HA     51 VAL  HN      2.68   
 50 ALA  QB     51 VAL  HN      4.42   
 50 ALA  QB     52 GLU  HN      6.53   
 51 VAL  HN     51 VAL  HA      2.99   
 51 VAL  HN     51 VAL  HB      2.90   
 51 VAL  HN     51 VAL  QQG     5.67   
 51 VAL  HN     52 GLU  HN      2.96   
 51 VAL  HA     52 GLU  HN      2.68   
 51 VAL  QQG    52 GLU  HN      6.82   
 52 GLU  HN     52 GLU  HA      2.96   
 52 GLU  HN     52 GLU  HB2     3.02   
 52 GLU  HN     52 GLU  HB3     2.93   
 52 GLU  HN     52 GLU  QG      5.48   
 52 GLU  HA     53 GLY  HN      2.71   
 52 GLU  HB2    53 GLY  HN      4.23   
 52 GLU  HB3    53 GLY  HN      3.86   
 52 GLU  QG     53 GLY  HN      6.38   
 53 GLY  HN     53 GLY  QA      3.68   
 53 GLY  HN     54 THR  HN      3.21   
 53 GLY  QA     54 THR  HN      3.83   
 54 THR  HN     54 THR  HA      3.05   
 54 THR  HN     54 THR  QG2     4.95   
 54 THR  HA     55 GLY  HN      3.17   
 55 GLY  HN     55 GLY  QA      3.96   
 56 GLY  HN     56 GLY  QA      3.87   
 56 GLY  QA     57 SER  HN      3.93   
 57 SER  HN     57 SER  HA      3.33   
 57 SER  HN     57 SER  QB      4.61   
 57 SER  HA     58 GLY  HN      3.27   
 57 SER  QB     58 GLY  HN      6.00   
 58 GLY  HN     58 GLY  QA      3.80   
 59 GLY  HN     59 GLY  QA      3.65   
 60 GLY  HN     60 GLY  HA1     2.80   
 60 GLY  HN     60 GLY  HA2     2.99   
 61 PRO  HA     62 HIS  HN      2.77   
 61 PRO  HB2    62 HIS  HN      4.72   
 61 PRO  QG     62 HIS  HN      6.38   
 61 PRO  QD     62 HIS  HN      6.38   
 62 HIS  HN     62 HIS  HA      3.30   
 62 HIS  HN     62 HIS  HB2     3.92   
 62 HIS  HN     62 HIS  HB3     3.27   
 63 HIS  HN     63 HIS  HA      2.65   
 63 HIS  HN     63 HIS  HB2     3.08   
 63 HIS  HN     63 HIS  HB3     3.33   
 64 HIS  HN     64 HIS  HA      2.96   
 64 HIS  HN     64 HIS  HB2     4.01   
 64 HIS  HN     64 HIS  HB3     3.64   
 65 HIS  HN     65 HIS  HA      2.55   
 65 HIS  HN     65 HIS  QB      4.05   
 65 HIS  HA     66 GLN  HN      2.52   
 65 HIS  QB     66 GLN  HN      4.67   
 66 GLN  HN     66 GLN  HA      3.33   
 66 GLN  HN     66 GLN  HB2     3.61   
 66 GLN  HN     66 GLN  HB3     3.08   
 66 GLN  HN     66 GLN  QG      6.38   
 66 GLN  HA     67 THR  HN      2.96   
 66 GLN  HB2    67 THR  HN      3.79   
 66 GLN  HB3    67 THR  HN      3.86   
 66 GLN  QG     67 THR  HN      6.38   
 66 GLN  QG     68 ARG  HN      6.38   
 67 THR  HN     67 THR  HA      2.80   
 67 THR  HN     67 THR  HB      3.27   
 67 THR  HN     67 THR  QG2     5.32   
 67 THR  HA     68 ARG  HN      2.96   
 67 THR  HB     68 ARG  HN      3.64   
 67 THR  QG2    68 ARG  HN      6.53   
 68 ARG  HN     68 ARG  HA      2.77   
 68 ARG  HN     68 ARG  HB2     3.67   
 68 ARG  HN     68 ARG  HB3     3.17   
 68 ARG  HN     68 ARG  QG      6.04   
 68 ARG  HA     69 GLY  HN      2.68   
 68 ARG  QD     69 GLY  HN      6.38   
 69 GLY  HN     69 GLY  QA      3.83   
 69 GLY  HN     70 ALA  HN      3.70   
 69 GLY  QA     70 ALA  HN      3.87   
 70 ALA  HN     70 ALA  HA      3.39   
 70 ALA  HN     70 ALA  QB      4.08   
 70 ALA  HA     71 TYR  HN      2.80   
 70 ALA  QB     71 TYR  HN      5.10   
 71 TYR  HN     71 TYR  HA      3.45   
 71 TYR  HN     71 TYR  HB2     3.36   
 71 TYR  HN     71 TYR  HB3     3.48   
 71 TYR  HA     72 SER  HN      2.83   
 71 TYR  HB2    72 SER  HN      3.86   
 72 SER  HN     72 SER  HA      3.64   
 72 SER  HN     72 SER  QB      4.61   
 73 SER  HN     73 SER  HA      2.90   
 73 SER  HN     73 SER  QB      4.55   
 73 SER  HA     74 HIS  HN      3.14   
 74 HIS  HN     74 HIS  HA      3.52   
 74 HIS  HN     74 HIS  HB2     3.67   
 74 HIS  HN     74 HIS  HB3     3.98   
 74 HIS  HA     75 ASP  HN      3.33   
 74 HIS  HB2    75 ASP  HN      3.98   
 75 ASP  HN     75 ASP  HA      4.17   
 75 ASP  HN     75 ASP  QB      5.07   


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    MET   1           H        MET   1 -35.417 -18.483  30.362
    2    HA   MET   1           HA       MET   1 -36.062 -17.581  33.047
    3   1HB   MET   1          1HB       MET   1 -34.343 -16.088  31.684
    4   2HB   MET   1          2HB       MET   1 -35.735 -15.626  30.726
    5   1HG   MET   1          1HG       MET   1 -36.545 -14.258  32.367
    6   2HG   MET   1          2HG       MET   1 -36.316 -15.473  33.609
    7   1HE   MET   1          1HE       MET   1 -34.172 -13.265  35.583
    8   2HE   MET   1          2HE       MET   1 -35.781 -13.964  35.283
    9   3HE   MET   1          3HE       MET   1 -34.383 -15.032  35.552
   10    H    GLU   2           H        GLU   2 -38.018 -18.877  32.740
   11    HA   GLU   2           HA       GLU   2 -39.674 -18.652  30.573
   12   1HB   GLU   2          1HB       GLU   2 -41.294 -19.784  31.890
   13   2HB   GLU   2          2HB       GLU   2 -39.757 -20.305  32.548
   14   1HG   GLU   2          1HG       GLU   2 -40.217 -18.051  34.068
   15   2HG   GLU   2          2HG       GLU   2 -41.861 -18.584  33.779
   16    HE2  GLU   2           HE2      GLU   2 -39.318 -19.789  36.182
   17    H    VAL   3           H        VAL   3 -41.440 -17.311  30.015
   18    HA   VAL   3           HA       VAL   3 -42.301 -15.270  31.833
   19    HB   VAL   3           HB       VAL   3 -40.682 -14.585  29.375
   20   1HG1  VAL   3          1HG1      VAL   3 -41.221 -12.203  29.956
   21   2HG1  VAL   3          2HG1      VAL   3 -42.607 -13.144  29.353
   22   3HG1  VAL   3          3HG1      VAL   3 -42.447 -12.813  31.094
   23   1HG2  VAL   3          1HG2      VAL   3 -39.450 -13.160  31.110
   24   2HG2  VAL   3          2HG2      VAL   3 -40.309 -14.118  32.341
   25   3HG2  VAL   3          3HG2      VAL   3 -39.212 -14.922  31.193
   26    H    ALA   4           H        ALA   4 -44.057 -13.893  30.725
   27    HA   ALA   4           HA       ALA   4 -45.667 -15.726  29.165
   28   1HB   ALA   4          1HB       ALA   4 -46.068 -13.452  30.984
   29   2HB   ALA   4          2HB       ALA   4 -47.104 -13.375  29.539
   30   3HB   ALA   4          3HB       ALA   4 -47.155 -14.807  30.595
   31    H    MET   5           H        MET   5 -46.413 -15.338  27.051
   32    HA   MET   5           HA       MET   5 -44.664 -13.729  25.512
   33   1HB   MET   5          1HB       MET   5 -47.036 -15.557  25.017
   34   2HB   MET   5          2HB       MET   5 -46.542 -14.489  23.719
   35   1HG   MET   5          1HG       MET   5 -44.290 -15.943  25.021
   36   2HG   MET   5          2HG       MET   5 -45.443 -16.984  24.209
   37   1HE   MET   5          1HE       MET   5 -42.688 -17.180  22.353
   38   2HE   MET   5          2HE       MET   5 -44.289 -17.892  22.664
   39   3HE   MET   5          3HE       MET   5 -43.915 -17.209  21.063
   40    H    VAL   6           H        VAL   6 -44.912 -11.616  24.913
   41    HA   VAL   6           HA       VAL   6 -47.449 -10.351  25.581
   42    HB   VAL   6           HB       VAL   6 -44.976  -8.956  24.608
   43   1HG1  VAL   6          1HG1      VAL   6 -46.164  -7.140  25.115
   44   2HG1  VAL   6          2HG1      VAL   6 -47.526  -8.166  25.623
   45   3HG1  VAL   6          3HG1      VAL   6 -46.287  -7.682  26.805
   46   1HG2  VAL   6          1HG2      VAL   6 -44.595  -8.793  27.256
   47   2HG2  VAL   6          2HG2      VAL   6 -45.340 -10.408  27.187
   48   3HG2  VAL   6          3HG2      VAL   6 -43.861 -10.071  26.257
   49    H    SER   7           H        SER   7 -48.437  -8.815  24.019
   50    HA   SER   7           HA       SER   7 -47.641  -9.152  21.294
   51   1HB   SER   7          1HB       SER   7 -50.455  -9.986  22.117
   52   2HB   SER   7          2HB       SER   7 -49.779 -10.034  20.500
   53    HG   SER   7           HG       SER   7 -49.822 -12.112  21.794
   54    H    ALA   8           H        ALA   8 -47.636  -7.038  20.625
   55    HA   ALA   8           HA       ALA   8 -49.204  -5.078  21.956
   56   1HB   ALA   8          1HB       ALA   8 -47.141  -4.309  21.163
   57   2HB   ALA   8          2HB       ALA   8 -47.307  -5.159  19.608
   58   3HB   ALA   8          3HB       ALA   8 -48.270  -3.698  19.930
   59    H    GLU   9           H        GLU   9 -51.405  -5.165  21.749
   60    HA   GLU   9           HA       GLU   9 -52.457  -4.665  19.171
   61   1HB   GLU   9          1HB       GLU   9 -52.150  -7.301  19.509
   62   2HB   GLU   9          2HB       GLU   9 -53.635  -7.140  20.427
   63   1HG   GLU   9          1HG       GLU   9 -54.700  -5.991  18.451
   64   2HG   GLU   9          2HG       GLU   9 -53.224  -6.234  17.537
   65    HE2  GLU   9           HE2      GLU   9 -53.501  -8.032  16.247
   66    H    SER  10           H        SER  10 -54.840  -4.177  19.286
   67    HA   SER  10           HA       SER  10 -55.968  -4.071  21.899
   68   1HB   SER  10          1HB       SER  10 -56.373  -1.548  21.733
   69   2HB   SER  10          2HB       SER  10 -54.739  -2.039  22.133
   70    HG   SER  10           HG       SER  10 -55.001  -0.343  20.410
   71    H    SER  11           H        SER  11 -58.029  -4.774  21.493
   72    HA   SER  11           HA       SER  11 -60.001  -4.962  20.602
   73   1HB   SER  11          1HB       SER  11 -59.258  -2.259  19.907
   74   2HB   SER  11          2HB       SER  11 -60.141  -2.946  18.558
   75    HG   SER  11           HG       SER  11 -61.644  -2.017  19.999
   76    H    GLY  12           H        GLY  12 -61.175  -5.256  18.289
   77   1HA   GLY  12          1HA       GLY  12 -60.135  -7.309  16.934
   78   2HA   GLY  12          2HA       GLY  12 -61.144  -6.092  16.177
   79    H    CYS  13           H        CYS  13 -59.808  -3.896  15.701
   80    HA   CYS  13           HA       CYS  13 -57.084  -4.101  15.200
   81   1HB   CYS  13          1HB       CYS  13 -57.792  -5.795  13.512
   82   2HB   CYS  13          2HB       CYS  13 -58.752  -4.570  12.706
   83    HG   CYS  13           HG       CYS  13 -56.006  -3.253  13.350
   84    H    ASN  14           H        ASN  14 -57.870  -2.060  16.392
   85    HA   ASN  14           HA       ASN  14 -58.882  -0.123  14.469
   86   1HB   ASN  14          1HB       ASN  14 -59.467  -0.661  17.276
   87   2HB   ASN  14          2HB       ASN  14 -58.851   0.972  17.128
   88   1HD2  ASN  14          1HD2      ASN  14 -60.840   1.853  17.637
   89   2HD2  ASN  14          2HD2      ASN  14 -62.172   1.898  16.530
   90    H    SER  15           H        SER  15 -56.034  -1.171  14.877
   91    HA   SER  15           HA       SER  15 -54.674   1.157  14.553
   92   1HB   SER  15          1HB       SER  15 -55.067   0.458  17.408
   93   2HB   SER  15          2HB       SER  15 -53.390   0.728  16.977
   94    HG   SER  15           HG       SER  15 -54.175   2.788  15.942
   95    H    HIS  16           H        HIS  16 -53.451   0.032  13.033
   96    HA   HIS  16           HA       HIS  16 -51.825  -2.147  14.123
   97   1HB   HIS  16          1HB       HIS  16 -53.809  -2.374  12.156
   98   2HB   HIS  16          2HB       HIS  16 -52.303  -2.366  11.261
   99    HD1  HIS  16           HD1      HIS  16 -52.704  -3.921  14.716
  100    HD2  HIS  16           HD2      HIS  16 -52.192  -5.084  10.718
  101    HE1  HIS  16           HE1      HIS  16 -52.280  -6.437  14.752
  102    H    MET  17           H        MET  17 -51.160   0.654  14.129
  103    HA   MET  17           HA       MET  17 -49.918   1.752  12.094
  104   1HB   MET  17          1HB       MET  17 -49.773   1.899  14.926
  105   2HB   MET  17          2HB       MET  17 -48.104   1.700  14.431
  106   1HG   MET  17          1HG       MET  17 -48.108   3.949  14.046
  107   2HG   MET  17          2HG       MET  17 -49.019   3.583  12.595
  108   1HE   MET  17          1HE       MET  17 -48.894   4.823  16.100
  109   2HE   MET  17          2HE       MET  17 -50.560   5.255  16.553
  110   3HE   MET  17          3HE       MET  17 -50.053   3.549  16.549
  111    HA   PRO  18           HA       PRO  18 -47.064  -1.487  11.020
  112   1HB   PRO  18          1HB       PRO  18 -46.882  -0.870   8.363
  113   2HB   PRO  18          2HB       PRO  18 -48.076  -1.977   9.011
  114   1HG   PRO  18          1HG       PRO  18 -48.439   0.806   8.082
  115   2HG   PRO  18          2HG       PRO  18 -49.650  -0.437   8.325
  116   1HD   PRO  18          1HD       PRO  18 -49.104   1.787  10.053
  117   2HD   PRO  18          2HD       PRO  18 -50.234   0.481  10.350
  118    H    TYR  19           H        TYR  19 -45.488  -0.569  12.420
  119    HA   TYR  19           HA       TYR  19 -43.963   1.605  11.287
  120   1HB   TYR  19          1HB       TYR  19 -44.632   0.555  13.824
  121   2HB   TYR  19          2HB       TYR  19 -42.978   0.011  13.629
  122    HD1  TYR  19           HD1      TYR  19 -44.879   3.188  12.951
  123    HD2  TYR  19           HD2      TYR  19 -41.404   1.360  14.650
  124    HE1  TYR  19           HE1      TYR  19 -44.034   5.468  13.694
  125    HE2  TYR  19           HE2      TYR  19 -40.571   3.646  15.387
  126    HH   TYR  19           HH       TYR  19 -41.788   6.482  14.181
  127    H    GLY  20           H        GLY  20 -42.873   0.875   9.441
  128   1HA   GLY  20          1HA       GLY  20 -41.358  -1.606   9.585
  129   2HA   GLY  20          2HA       GLY  20 -41.574  -0.559   8.196
  130    H    TYR  21           H        TYR  21 -39.950   0.862   7.640
  131    HA   TYR  21           HA       TYR  21 -37.462   0.667   8.842
  132   1HB   TYR  21          1HB       TYR  21 -36.962   2.475   7.255
  133   2HB   TYR  21          2HB       TYR  21 -38.214   1.506   6.502
  134    HD1  TYR  21           HD1      TYR  21 -37.671   4.615   8.494
  135    HD2  TYR  21           HD2      TYR  21 -40.264   2.477   5.846
  136    HE1  TYR  21           HE1      TYR  21 -39.130   6.681   8.243
  137    HE2  TYR  21           HE2      TYR  21 -41.715   4.551   5.604
  138    HH   TYR  21           HH       TYR  21 -42.104   6.564   6.312
  139    H    ALA  22           H        ALA  22 -40.281   2.392   9.883
  140    HA   ALA  22           HA       ALA  22 -39.184   4.662  11.017
  141   1HB   ALA  22          1HB       ALA  22 -41.605   4.168  10.757
  142   2HB   ALA  22          2HB       ALA  22 -41.476   2.930  12.030
  143   3HB   ALA  22          3HB       ALA  22 -41.196   4.644  12.423
  144    H    ALA  23           H        ALA  23 -39.154   1.251  12.063
  145    HA   ALA  23           HA       ALA  23 -38.017   1.993  14.629
  146   1HB   ALA  23          1HB       ALA  23 -39.427  -0.279  13.461
  147   2HB   ALA  23          2HB       ALA  23 -37.949  -0.797  14.307
  148   3HB   ALA  23          3HB       ALA  23 -39.185   0.147  15.172
  149    H    GLN  24           H        GLN  24 -36.762   2.314  11.752
  150    HA   GLN  24           HA       GLN  24 -34.470   0.604  12.078
  151   1HB   GLN  24          1HB       GLN  24 -35.723   1.271   9.842
  152   2HB   GLN  24          2HB       GLN  24 -34.736   2.716   9.929
  153   1HG   GLN  24          1HG       GLN  24 -33.021   1.551   9.016
  154   2HG   GLN  24          2HG       GLN  24 -32.948   0.578  10.472
  155   1HE2  GLN  24          1HE2      GLN  24 -34.029  -1.396  10.588
  156   2HE2  GLN  24          2HE2      GLN  24 -34.534  -2.271   9.181
  157    H    ALA  25           H        ALA  25 -35.492   3.457  13.433
  158    HA   ALA  25           HA       ALA  25 -33.331   5.187  13.093
  159   1HB   ALA  25          1HB       ALA  25 -35.167   6.218  14.034
  160   2HB   ALA  25          2HB       ALA  25 -35.572   4.814  15.050
  161   3HB   ALA  25          3HB       ALA  25 -34.233   5.890  15.513
  162    H    ARG  26           H        ARG  26 -33.649   2.151  14.783
  163    HA   ARG  26           HA       ARG  26 -31.694   2.670  16.726
  164   1HB   ARG  26          1HB       ARG  26 -33.548   0.751  16.502
  165   2HB   ARG  26          2HB       ARG  26 -32.264  -0.120  15.687
  166   1HG   ARG  26          1HG       ARG  26 -31.171  -0.537  17.640
  167   2HG   ARG  26          2HG       ARG  26 -31.271   1.139  18.143
  168   1HD   ARG  26          1HD       ARG  26 -33.609   0.786  18.930
  169   2HD   ARG  26          2HD       ARG  26 -33.559  -0.877  18.378
  170    HE   ARG  26           HE       ARG  26 -31.334  -0.517  20.103
  171   1HH1  ARG  26          2HH2      ARG  26 -34.870  -0.480  20.323
  172   2HH1  ARG  26          1HH2      ARG  26 -34.896  -0.982  21.980
  173   1HH2  ARG  26          1HH       ARG  26 -32.826  -1.388  23.117
  174    H    ALA  27           H        ALA  27 -31.695   1.564  13.346
  175    HA   ALA  27           HA       ALA  27 -29.083   0.468  13.371
  176   1HB   ALA  27          1HB       ALA  27 -30.332  -0.326  11.603
  177   2HB   ALA  27          2HB       ALA  27 -31.161   1.228  11.347
  178   3HB   ALA  27          3HB       ALA  27 -29.488   1.008  10.781
  179    H    ARG  28           H        ARG  28 -30.478   3.719  13.019
  180    HA   ARG  28           HA       ARG  28 -28.320   4.906  11.784
  181   1HB   ARG  28          1HB       ARG  28 -30.792   5.750  12.543
  182   2HB   ARG  28          2HB       ARG  28 -29.865   6.468  13.845
  183   1HG   ARG  28          1HG       ARG  28 -28.500   7.742  12.307
  184   2HG   ARG  28          2HG       ARG  28 -29.070   6.825  10.926
  185   1HD   ARG  28          1HD       ARG  28 -31.400   7.725  11.338
  186   2HD   ARG  28          2HD       ARG  28 -30.764   8.702  12.646
  187    HE   ARG  28           HE       ARG  28 -29.323   9.082  10.123
  188   1HH1  ARG  28          2HH2      ARG  28 -32.102  10.139  12.050
  189   2HH1  ARG  28          1HH2      ARG  28 -32.219  11.678  11.265
  190   1HH2  ARG  28          1HH       ARG  28 -30.666  12.230   9.526
  191    H    GLU  29           H        GLU  29 -28.935   3.950  15.152
  192    HA   GLU  29           HA       GLU  29 -26.801   5.543  16.167
  193   1HB   GLU  29          1HB       GLU  29 -28.876   3.708  17.267
  194   2HB   GLU  29          2HB       GLU  29 -27.378   3.760  18.175
  195   1HG   GLU  29          1HG       GLU  29 -27.539   6.283  18.223
  196   2HG   GLU  29          2HG       GLU  29 -29.085   6.174  17.406
  197    HE2  GLU  29           HE2      GLU  29 -30.725   6.017  18.658
  198    H    ARG  30           H        ARG  30 -27.242   2.341  14.790
  199    HA   ARG  30           HA       ARG  30 -24.784   1.404  15.937
  200   1HB   ARG  30          1HB       ARG  30 -27.080   0.220  14.437
  201   2HB   ARG  30          2HB       ARG  30 -25.527  -0.508  14.075
  202   1HG   ARG  30          1HG       ARG  30 -25.861  -0.073  16.965
  203   2HG   ARG  30          2HG       ARG  30 -27.158  -1.053  16.312
  204   1HD   ARG  30          1HD       ARG  30 -25.784  -2.852  16.080
  205   2HD   ARG  30          2HD       ARG  30 -24.613  -1.915  15.174
  206    HE   ARG  30           HE       ARG  30 -24.501  -1.269  18.002
  207   1HH1  ARG  30          2HH2      ARG  30 -23.473  -3.686  15.624
  208   2HH1  ARG  30          1HH2      ARG  30 -22.116  -4.212  16.561
  209   1HH2  ARG  30          1HH       ARG  30 -21.686  -3.186  18.684
  210    H    GLU  31           H        GLU  31 -26.078   2.807  12.952
  211    HA   GLU  31           HA       GLU  31 -24.172   1.926  11.174
  212   1HB   GLU  31          1HB       GLU  31 -25.998   4.322  11.326
  213   2HB   GLU  31          2HB       GLU  31 -24.770   4.290  10.076
  214   1HG   GLU  31          1HG       GLU  31 -25.824   1.718   9.912
  215   2HG   GLU  31          2HG       GLU  31 -27.238   2.662  10.338
  216    HE2  GLU  31           HE2      GLU  31 -25.240   1.938   7.630
  217    H    ARG  32           H        ARG  32 -23.967   4.223  13.814
  218    HA   ARG  32           HA       ARG  32 -21.958   5.840  12.870
  219   1HB   ARG  32          1HB       ARG  32 -23.398   5.573  15.243
  220   2HB   ARG  32          2HB       ARG  32 -21.778   5.149  15.759
  221   1HG   ARG  32          1HG       ARG  32 -21.919   7.521  16.039
  222   2HG   ARG  32          2HG       ARG  32 -20.963   7.290  14.589
  223   1HD   ARG  32          1HD       ARG  32 -22.733   7.946  13.151
  224   2HD   ARG  32          2HD       ARG  32 -23.970   7.592  14.342
  225    HE   ARG  32           HE       ARG  32 -22.487  10.079  14.079
  226   1HH1  ARG  32          2HH2      ARG  32 -24.130   8.003  16.434
  227   2HH1  ARG  32          1HH2      ARG  32 -24.454   9.300  17.536
  228   1HH2  ARG  32          1HH       ARG  32 -23.731  11.517  16.986
  229    H    LEU  33           H        LEU  33 -21.938   2.522  14.131
  230    HA   LEU  33           HA       LEU  33 -19.050   2.535  14.409
  231   1HB   LEU  33          1HB       LEU  33 -21.157   1.200  15.666
  232   2HB   LEU  33          2HB       LEU  33 -20.365  -0.031  14.703
  233    HG   LEU  33           HG       LEU  33 -19.473   0.015  16.962
  234   1HD1  LEU  33          1HD1      LEU  33 -18.021  -0.247  14.738
  235   2HD1  LEU  33          2HD1      LEU  33 -17.192   1.166  15.433
  236   3HD1  LEU  33          3HD1      LEU  33 -17.311  -0.345  16.367
  237   1HD2  LEU  33          1HD2      LEU  33 -18.074   2.016  17.666
  238   2HD2  LEU  33          2HD2      LEU  33 -18.890   2.919  16.367
  239   3HD2  LEU  33          3HD2      LEU  33 -19.841   2.224  17.701
  240    H    ALA  34           H        ALA  34 -21.434   2.074  11.986
  241    HA   ALA  34           HA       ALA  34 -19.961   0.073  10.531
  242   1HB   ALA  34          1HB       ALA  34 -21.758   0.279   8.924
  243   2HB   ALA  34          2HB       ALA  34 -22.474   0.284  10.553
  244   3HB   ALA  34          3HB       ALA  34 -22.300   1.810   9.653
  245    H    HIS  35           H        HIS  35 -19.218   3.162  11.287
  246    HA   HIS  35           HA       HIS  35 -18.531   4.011   8.606
  247   1HB   HIS  35          1HB       HIS  35 -19.032   5.288  11.158
  248   2HB   HIS  35          2HB       HIS  35 -17.492   5.814  10.507
  249    HD1  HIS  35           HD1      HIS  35 -18.386   8.192   9.969
  250    HD2  HIS  35           HD2      HIS  35 -20.445   5.106   8.010
  251    HE1  HIS  35           HE1      HIS  35 -19.831   9.313   8.190
  252    H    SER  36           H        SER  36 -17.235   2.094  11.119
  253    HA   SER  36           HA       SER  36 -14.519   2.858  10.556
  254   1HB   SER  36          1HB       SER  36 -15.172   2.334  12.881
  255   2HB   SER  36          2HB       SER  36 -15.694   0.732  12.402
  256    HG   SER  36           HG       SER  36 -13.468   0.947  13.367
  257    H    ARG  37           H        ARG  37 -16.950   0.609   9.478
  258    HA   ARG  37           HA       ARG  37 -14.999  -1.274   8.537
  259   1HB   ARG  37          1HB       ARG  37 -17.618  -1.543   9.366
  260   2HB   ARG  37          2HB       ARG  37 -17.843  -1.496   7.629
  261   1HG   ARG  37          1HG       ARG  37 -17.467  -3.772   7.892
  262   2HG   ARG  37          2HG       ARG  37 -15.816  -3.245   7.636
  263   1HD   ARG  37          1HD       ARG  37 -15.444  -4.412   9.591
  264   2HD   ARG  37          2HD       ARG  37 -15.937  -2.901  10.331
  265    HE   ARG  37           HE       ARG  37 -17.794  -4.025  11.166
  266   1HH1  ARG  37          2HH2      ARG  37 -16.814  -5.626   8.160
  267   2HH1  ARG  37          1HH2      ARG  37 -18.045  -6.840   8.260
  268   1HH2  ARG  37          1HH       ARG  37 -19.565  -6.822  10.113
  269    H    ALA  38           H        ALA  38 -15.562   1.706   7.564
  270    HA   ALA  38           HA       ALA  38 -16.565   1.628   4.985
  271   1HB   ALA  38          1HB       ALA  38 -14.790   3.659   4.854
  272   2HB   ALA  38          2HB       ALA  38 -16.329   3.779   5.741
  273   3HB   ALA  38          3HB       ALA  38 -14.822   3.421   6.618
  274    H    ALA  39           H        ALA  39 -13.070   1.655   6.009
  275    HA   ALA  39           HA       ALA  39 -12.335   0.707   3.379
  276   1HB   ALA  39          1HB       ALA  39 -11.078   2.059   5.656
  277   2HB   ALA  39          2HB       ALA  39 -10.068   0.744   5.007
  278   3HB   ALA  39          3HB       ALA  39 -10.616   2.057   3.937
  279    H    ALA  40           H        ALA  40 -13.736  -1.310   3.796
  280    HA   ALA  40           HA       ALA  40 -12.505  -3.208   5.606
  281   1HB   ALA  40          1HB       ALA  40 -14.938  -3.320   3.781
  282   2HB   ALA  40          2HB       ALA  40 -14.425  -4.640   4.859
  283   3HB   ALA  40          3HB       ALA  40 -14.932  -3.077   5.544
  284    H    ALA  41           H        ALA  41 -13.545  -3.302   2.119
  285    HA   ALA  41           HA       ALA  41 -12.748  -4.520   0.430
  286   1HB   ALA  41          1HB       ALA  41  -9.937  -4.076   0.788
  287   2HB   ALA  41          2HB       ALA  41 -11.064  -3.227  -0.296
  288   3HB   ALA  41          3HB       ALA  41 -10.805  -2.632   1.361
  289    H    ALA  42           H        ALA  42 -13.445  -6.329   2.225
  290    HA   ALA  42           HA       ALA  42 -11.095  -8.077   2.496
  291   1HB   ALA  42          1HB       ALA  42 -11.930  -8.846   4.533
  292   2HB   ALA  42          2HB       ALA  42 -12.395  -7.129   4.582
  293   3HB   ALA  42          3HB       ALA  42 -13.600  -8.365   4.149
  294    H    ALA  43           H        ALA  43 -14.727  -8.289   2.367
  295    HA   ALA  43           HA       ALA  43 -14.898 -10.826   1.394
  296   1HB   ALA  43          1HB       ALA  43 -16.906  -9.831   2.051
  297   2HB   ALA  43          2HB       ALA  43 -16.591  -8.342   1.127
  298   3HB   ALA  43          3HB       ALA  43 -17.064  -9.834   0.278
  299    H    VAL  44           H        VAL  44 -13.732  -7.928  -0.210
  300    HA   VAL  44           HA       VAL  44 -13.954  -9.212  -2.819
  301    HB   VAL  44           HB       VAL  44 -13.805  -6.486  -1.779
  302   1HG1  VAL  44          1HG1      VAL  44 -12.054  -7.274  -4.125
  303   2HG1  VAL  44          2HG1      VAL  44 -12.620  -5.611  -3.836
  304   3HG1  VAL  44          3HG1      VAL  44 -11.579  -6.418  -2.639
  305   1HG2  VAL  44          1HG2      VAL  44 -15.714  -6.720  -2.970
  306   2HG2  VAL  44          2HG2      VAL  44 -14.672  -6.298  -4.350
  307   3HG2  VAL  44          3HG2      VAL  44 -15.041  -8.004  -4.002
  308    H    ALA  45           H        ALA  45 -11.655  -8.334  -0.256
  309    HA   ALA  45           HA       ALA  45  -9.271  -8.315  -1.492
  310   1HB   ALA  45          1HB       ALA  45  -9.868  -9.926   1.018
  311   2HB   ALA  45          2HB       ALA  45  -8.346  -9.111   0.587
  312   3HB   ALA  45          3HB       ALA  45  -9.790  -8.148   0.981
  313    H    ALA  46           H        ALA  46 -10.920 -11.351  -0.342
  314    HA   ALA  46           HA       ALA  46  -9.104 -13.085  -1.529
  315   1HB   ALA  46          1HB       ALA  46 -10.739 -14.776  -1.049
  316   2HB   ALA  46          2HB       ALA  46 -10.871 -13.558   0.242
  317   3HB   ALA  46          3HB       ALA  46 -12.067 -13.592  -1.076
  318    H    ALA  47           H        ALA  47 -12.389 -12.045  -2.704
  319    HA   ALA  47           HA       ALA  47 -12.139 -13.299  -5.187
  320   1HB   ALA  47          1HB       ALA  47 -14.092 -11.946  -3.756
  321   2HB   ALA  47          2HB       ALA  47 -13.779 -10.855  -5.128
  322   3HB   ALA  47          3HB       ALA  47 -14.257 -12.543  -5.425
  323    H    THR  48           H        THR  48 -12.530 -11.583  -7.237
  324    HA   THR  48           HA       THR  48 -11.471 -10.275  -8.688
  325    HB   THR  48           HB       THR  48 -10.791  -8.861  -6.066
  326    HG1  THR  48           HG1      THR  48 -12.514  -8.341  -8.386
  327   1HG2  THR  48          1HG2      THR  48 -10.106  -8.168  -8.938
  328   2HG2  THR  48          2HG2      THR  48 -10.598  -6.867  -7.827
  329   3HG2  THR  48          3HG2      THR  48  -9.165  -7.857  -7.459
  330    H    ALA  49           H        ALA  49 -10.106 -11.748  -9.644
  331    HA   ALA  49           HA       ALA  49  -7.855 -12.849  -8.561
  332   1HB   ALA  49          1HB       ALA  49  -8.981 -12.362 -11.244
  333   2HB   ALA  49          2HB       ALA  49  -7.208 -12.521 -11.229
  334   3HB   ALA  49          3HB       ALA  49  -8.224 -13.825 -10.570
  335    H    ALA  50           H        ALA  50  -5.508 -12.350  -9.502
  336    HA   ALA  50           HA       ALA  50  -4.932  -9.668  -8.598
  337   1HB   ALA  50          1HB       ALA  50  -3.542 -12.249  -8.885
  338   2HB   ALA  50          2HB       ALA  50  -2.546 -10.852  -9.357
  339   3HB   ALA  50          3HB       ALA  50  -3.263 -10.924  -7.730
  340    H    VAL  51           H        VAL  51  -6.449  -9.380 -10.838
  341    HA   VAL  51           HA       VAL  51  -6.509  -8.685 -12.950
  342    HB   VAL  51           HB       VAL  51  -5.574  -6.769 -11.768
  343   1HG1  VAL  51          1HG1      VAL  51  -2.910  -8.040 -12.452
  344   2HG1  VAL  51          2HG1      VAL  51  -3.085  -6.326 -12.006
  345   3HG1  VAL  51          3HG1      VAL  51  -3.543  -7.597 -10.848
  346   1HG2  VAL  51          1HG2      VAL  51  -4.032  -6.140 -14.021
  347   2HG2  VAL  51          2HG2      VAL  51  -5.224  -7.329 -14.599
  348   3HG2  VAL  51          3HG2      VAL  51  -5.771  -5.840 -13.791
  349    H    GLU  52           H        GLU  52  -5.803 -11.276 -13.025
  350    HA   GLU  52           HA       GLU  52  -3.614 -11.274 -14.955
  351   1HB   GLU  52          1HB       GLU  52  -3.040 -12.427 -12.790
  352   2HB   GLU  52          2HB       GLU  52  -4.365 -13.542 -13.058
  353   1HG   GLU  52          1HG       GLU  52  -3.166 -14.771 -14.555
  354   2HG   GLU  52          2HG       GLU  52  -2.648 -13.346 -15.434
  355    HE2  GLU  52           HE2      GLU  52  -1.592 -14.787 -12.177
  356    H    GLY  53           H        GLY  53  -3.896 -12.581 -16.849
  357   1HA   GLY  53          1HA       GLY  53  -6.044 -14.348 -17.244
  358   2HA   GLY  53          2HA       GLY  53  -6.520 -12.762 -17.817
  359    H    THR  54           H        THR  54  -4.158 -15.425 -18.192
  360    HA   THR  54           HA       THR  54  -3.908 -14.812 -20.985
  361    HB   THR  54           HB       THR  54  -2.218 -13.261 -20.341
  362    HG1  THR  54           HG1      THR  54  -1.546 -15.185 -21.724
  363   1HG2  THR  54          1HG2      THR  54  -1.462 -15.339 -18.228
  364   2HG2  THR  54          2HG2      THR  54  -0.395 -13.988 -18.677
  365   3HG2  THR  54          3HG2      THR  54  -1.986 -13.661 -17.951
  366    H    GLY  55           H        GLY  55  -4.148 -16.725 -21.938
  367   1HA   GLY  55          1HA       GLY  55  -2.794 -19.036 -20.691
  368   2HA   GLY  55          2HA       GLY  55  -4.464 -19.125 -21.214
  369    H    GLY  56           H        GLY  56  -2.999 -20.970 -22.411
  370   1HA   GLY  56          1HA       GLY  56  -3.284 -20.862 -25.032
  371   2HA   GLY  56          2HA       GLY  56  -1.818 -19.916 -24.865
  372    H    SER  57           H        SER  57  -3.310 -23.101 -24.038
  373    HA   SER  57           HA       SER  57  -0.916 -24.257 -23.200
  374   1HB   SER  57          1HB       SER  57  -2.132 -26.365 -23.284
  375   2HB   SER  57          2HB       SER  57  -3.204 -25.124 -22.668
  376    HG   SER  57           HG       SER  57  -4.533 -25.547 -24.280
  377    H    GLY  58           H        GLY  58   0.504 -25.753 -24.320
  378   1HA   GLY  58          1HA       GLY  58   0.449 -26.864 -26.715
  379   2HA   GLY  58          2HA       GLY  58   0.690 -25.192 -27.180
  380    H    GLY  59           H        GLY  59   2.604 -27.257 -27.704
  381   1HA   GLY  59          1HA       GLY  59   4.802 -26.433 -25.901
  382   2HA   GLY  59          2HA       GLY  59   4.631 -28.059 -26.530
  383    H    GLY  60           H        GLY  60   4.173 -27.981 -29.140
  384   1HA   GLY  60          1HA       GLY  60   4.759 -26.734 -31.128
  385   2HA   GLY  60          2HA       GLY  60   6.160 -26.110 -30.280
  386    HA   PRO  61           HA       PRO  61   6.922 -30.680 -31.388
  387   1HB   PRO  61          1HB       PRO  61   5.340 -31.804 -33.313
  388   2HB   PRO  61          2HB       PRO  61   5.069 -32.031 -31.597
  389   1HG   PRO  61          1HG       PRO  61   3.575 -30.332 -33.500
  390   2HG   PRO  61          2HG       PRO  61   3.084 -30.901 -31.917
  391   1HD   PRO  61          1HD       PRO  61   3.997 -28.266 -32.586
  392   2HD   PRO  61          2HD       PRO  61   3.616 -28.868 -30.985
  393    H    HIS  62           H        HIS  62   8.776 -30.927 -32.468
  394    HA   HIS  62           HA       HIS  62   8.893 -29.378 -34.937
  395   1HB   HIS  62          1HB       HIS  62  11.244 -29.272 -34.632
  396   2HB   HIS  62          2HB       HIS  62  10.505 -28.890 -33.091
  397    HD1  HIS  62           HD1      HIS  62  10.651 -30.757 -31.189
  398    HD2  HIS  62           HD2      HIS  62  12.896 -31.523 -34.649
  399    HE1  HIS  62           HE1      HIS  62  12.292 -32.614 -30.580
  400    H    HIS  63           H        HIS  63   8.789 -30.420 -36.859
  401    HA   HIS  63           HA       HIS  63   8.279 -33.010 -37.212
  402   1HB   HIS  63          1HB       HIS  63   8.718 -30.875 -38.845
  403   2HB   HIS  63          2HB       HIS  63  10.096 -31.875 -39.258
  404    HD1  HIS  63           HD1      HIS  63   9.682 -33.652 -40.976
  405    HD2  HIS  63           HD2      HIS  63   6.143 -32.399 -39.105
  406    HE1  HIS  63           HE1      HIS  63   7.776 -34.848 -42.178
  407    H    HIS  64           H        HIS  64   9.335 -34.979 -37.255
  408    HA   HIS  64           HA       HIS  64  12.241 -34.898 -37.032
  409   1HB   HIS  64          1HB       HIS  64  11.422 -35.026 -34.748
  410   2HB   HIS  64          2HB       HIS  64  10.374 -36.370 -35.154
  411    HD1  HIS  64           HD1      HIS  64  11.671 -38.659 -35.912
  412    HD2  HIS  64           HD2      HIS  64  13.963 -35.740 -33.958
  413    HE1  HIS  64           HE1      HIS  64  13.783 -39.836 -35.098
  414    H    HIS  65           H        HIS  65  13.298 -36.644 -38.033
  415    HA   HIS  65           HA       HIS  65  13.559 -38.299 -39.447
  416   1HB   HIS  65          1HB       HIS  65  11.287 -39.185 -37.789
  417   2HB   HIS  65          2HB       HIS  65  11.401 -39.993 -39.341
  418    HD1  HIS  65           HD1      HIS  65  12.021 -42.205 -38.007
  419    HD2  HIS  65           HD2      HIS  65  14.821 -39.095 -37.716
  420    HE1  HIS  65           HE1      HIS  65  14.155 -43.249 -37.076
  421    H    GLN  66           H        GLN  66  13.548 -37.305 -41.441
  422    HA   GLN  66           HA       GLN  66  11.073 -36.463 -42.565
  423   1HB   GLN  66          1HB       GLN  66  12.449 -35.676 -44.441
  424   2HB   GLN  66          2HB       GLN  66  13.175 -35.193 -42.920
  425   1HG   GLN  66          1HG       GLN  66  14.106 -37.850 -43.818
  426   2HG   GLN  66          2HG       GLN  66  14.455 -36.591 -44.986
  427   1HE2  GLN  66          1HE2      GLN  66  16.666 -37.239 -44.349
  428   2HE2  GLN  66          2HE2      GLN  66  17.427 -36.426 -43.023
  429    H    THR  67           H        THR  67  10.613 -37.118 -44.984
  430    HA   THR  67           HA       THR  67  10.007 -39.838 -45.022
  431    HB   THR  67           HB       THR  67  10.211 -37.726 -47.231
  432    HG1  THR  67           HG1      THR  67   8.721 -37.414 -45.369
  433   1HG2  THR  67          1HG2      THR  67   8.844 -40.464 -47.139
  434   2HG2  THR  67          2HG2      THR  67   8.431 -39.197 -48.319
  435   3HG2  THR  67          3HG2      THR  67  10.058 -39.918 -48.321
  436    H    ARG  68           H        ARG  68  10.679 -41.322 -46.940
  437    HA   ARG  68           HA       ARG  68  13.324 -41.957 -46.476
  438   1HB   ARG  68          1HB       ARG  68  11.147 -42.882 -48.314
  439   2HB   ARG  68          2HB       ARG  68  12.774 -43.278 -48.832
  440   1HG   ARG  68          1HG       ARG  68  13.177 -44.203 -46.460
  441   2HG   ARG  68          2HG       ARG  68  11.457 -44.019 -46.182
  442   1HD   ARG  68          1HD       ARG  68  12.098 -45.416 -48.725
  443   2HD   ARG  68          2HD       ARG  68  12.668 -46.263 -47.300
  444    HE   ARG  68           HE       ARG  68  10.431 -46.601 -46.601
  445   1HH1  ARG  68          2HH2      ARG  68  10.523 -44.420 -49.391
  446   2HH1  ARG  68          1HH2      ARG  68   8.815 -44.504 -49.670
  447   1HH2  ARG  68          1HH       ARG  68   7.457 -45.858 -48.233
  448    H    GLY  69           H        GLY  69  15.242 -41.683 -47.744
  449   1HA   GLY  69          1HA       GLY  69  15.499 -39.303 -49.179
  450   2HA   GLY  69          2HA       GLY  69  16.644 -40.630 -49.147
  451    H    ALA  70           H        ALA  70  15.708 -42.711 -50.451
  452    HA   ALA  70           HA       ALA  70  15.220 -43.573 -52.428
  453   1HB   ALA  70          1HB       ALA  70  13.465 -41.161 -52.984
  454   2HB   ALA  70          2HB       ALA  70  13.267 -42.832 -53.565
  455   3HB   ALA  70          3HB       ALA  70  12.981 -42.446 -51.851
  456    H    TYR  71           H        TYR  71  15.423 -43.167 -54.895
  457    HA   TYR  71           HA       TYR  71  16.935 -42.643 -56.461
  458   1HB   TYR  71          1HB       TYR  71  15.305 -40.870 -56.822
  459   2HB   TYR  71          2HB       TYR  71  15.761 -40.047 -55.343
  460    HD1  TYR  71           HD1      TYR  71  17.706 -41.215 -58.342
  461    HD2  TYR  71           HD2      TYR  71  16.618 -37.946 -55.806
  462    HE1  TYR  71           HE1      TYR  71  19.231 -39.671 -59.666
  463    HE2  TYR  71           HE2      TYR  71  18.146 -36.413 -57.139
  464    HH   TYR  71           HH       TYR  71  19.538 -37.412 -60.129
  465    H    SER  72           H        SER  72  18.942 -43.383 -55.656
  466    HA   SER  72           HA       SER  72  20.474 -41.351 -54.241
  467   1HB   SER  72          1HB       SER  72  20.278 -44.285 -54.036
  468   2HB   SER  72          2HB       SER  72  21.939 -43.741 -54.154
  469    HG   SER  72           HG       SER  72  20.979 -42.052 -52.430
  470    H    SER  73           H        SER  73  22.124 -40.344 -55.341
  471    HA   SER  73           HA       SER  73  22.734 -41.389 -57.960
  472   1HB   SER  73          1HB       SER  73  23.724 -39.211 -58.401
  473   2HB   SER  73          2HB       SER  73  22.160 -38.970 -57.648
  474    HG   SER  73           HG       SER  73  23.520 -37.602 -56.537
  475    H    HIS  74           H        HIS  74  24.654 -42.428 -58.443
  476    HA   HIS  74           HA       HIS  74  27.072 -41.851 -57.208
  477   1HB   HIS  74          1HB       HIS  74  25.578 -43.181 -55.408
  478   2HB   HIS  74          2HB       HIS  74  26.246 -44.555 -56.267
  479    HD1  HIS  74           HD1      HIS  74  27.150 -41.831 -53.880
  480    HD2  HIS  74           HD2      HIS  74  29.101 -44.828 -56.073
  481    HE1  HIS  74           HE1      HIS  74  29.496 -42.025 -52.896
  482    H    ASP  75           H        ASP  75  26.950 -41.823 -59.709
  483    HA   ASP  75           HA       ASP  75  27.754 -44.480 -60.584
  484   1HB   ASP  75          1HB       ASP  75  25.531 -44.034 -61.521
  485   2HB   ASP  75          2HB       ASP  75  26.029 -42.443 -62.062
  486    HD2  ASP  75           HD2      ASP  75  25.658 -42.785 -64.134
  Start of MODEL    2
    1    H    MET   1           H        MET   1 -36.567  39.025  13.513
    2    HA   MET   1           HA       MET   1 -35.351  37.509  15.586
    3   1HB   MET   1          1HB       MET   1 -36.640  39.946  16.298
    4   2HB   MET   1          2HB       MET   1 -37.826  38.708  16.662
    5   1HG   MET   1          1HG       MET   1 -36.398  37.612  18.223
    6   2HG   MET   1          2HG       MET   1 -34.950  38.344  17.563
    7   1HE   MET   1          1HE       MET   1 -34.316  39.626  20.495
    8   2HE   MET   1          2HE       MET   1 -35.880  39.264  21.265
    9   3HE   MET   1          3HE       MET   1 -35.126  38.073  20.178
   10    H    GLU   2           H        GLU   2 -35.942  35.674  14.360
   11    HA   GLU   2           HA       GLU   2 -38.824  35.344  14.046
   12   1HB   GLU   2          1HB       GLU   2 -36.574  34.871  12.227
   13   2HB   GLU   2          2HB       GLU   2 -37.539  33.422  12.427
   14   1HG   GLU   2          1HG       GLU   2 -39.521  35.327  12.163
   15   2HG   GLU   2          2HG       GLU   2 -38.264  36.020  11.157
   16    HE2  GLU   2           HE2      GLU   2 -39.889  35.468   9.560
   17    H    VAL   3           H        VAL   3 -39.553  32.963  14.175
   18    HA   VAL   3           HA       VAL   3 -38.262  31.807  16.509
   19    HB   VAL   3           HB       VAL   3 -40.761  32.292  16.245
   20   1HG1  VAL   3          1HG1      VAL   3 -42.128  30.693  15.100
   21   2HG1  VAL   3          2HG1      VAL   3 -40.898  31.267  13.947
   22   3HG1  VAL   3          3HG1      VAL   3 -40.721  29.672  14.718
   23   1HG2  VAL   3          1HG2      VAL   3 -41.049  30.892  17.975
   24   2HG2  VAL   3          2HG2      VAL   3 -40.657  29.460  16.994
   25   3HG2  VAL   3          3HG2      VAL   3 -39.350  30.425  17.722
   26    H    ALA   4           H        ALA   4 -38.633  29.154  16.358
   27    HA   ALA   4           HA       ALA   4 -36.618  28.335  14.591
   28   1HB   ALA   4          1HB       ALA   4 -36.779  26.351  15.727
   29   2HB   ALA   4          2HB       ALA   4 -37.708  27.358  16.863
   30   3HB   ALA   4          3HB       ALA   4 -38.558  26.340  15.675
   31    H    MET   5           H        MET   5 -36.784  26.810  12.779
   32    HA   MET   5           HA       MET   5 -38.498  27.650  10.852
   33   1HB   MET   5          1HB       MET   5 -36.366  25.932  10.998
   34   2HB   MET   5          2HB       MET   5 -37.650  24.753  10.823
   35   1HG   MET   5          1HG       MET   5 -37.068  25.202   8.578
   36   2HG   MET   5          2HG       MET   5 -38.464  26.234   8.814
   37   1HE   MET   5          1HE       MET   5 -38.332  27.780   7.318
   38   2HE   MET   5          2HE       MET   5 -37.207  29.155   7.207
   39   3HE   MET   5          3HE       MET   5 -36.821  27.622   6.390
   40    H    VAL   6           H        VAL   6 -40.604  27.235  10.251
   41    HA   VAL   6           HA       VAL   6 -42.087  25.430  11.986
   42    HB   VAL   6           HB       VAL   6 -43.247  27.203   9.858
   43   1HG1  VAL   6          1HG1      VAL   6 -44.825  27.345  12.111
   44   2HG1  VAL   6          2HG1      VAL   6 -45.081  26.244  10.736
   45   3HG1  VAL   6          3HG1      VAL   6 -44.210  25.677  12.181
   46   1HG2  VAL   6          1HG2      VAL   6 -42.039  28.884  10.840
   47   2HG2  VAL   6          2HG2      VAL   6 -43.432  28.849  11.946
   48   3HG2  VAL   6          3HG2      VAL   6 -41.914  28.039  12.401
   49    H    SER   7           H        SER   7 -43.740  23.966  10.970
   50    HA   SER   7           HA       SER   7 -42.457  22.387   9.049
   51   1HB   SER   7          1HB       SER   7 -44.510  22.049  10.904
   52   2HB   SER   7          2HB       SER   7 -45.363  21.941   9.377
   53    HG   SER   7           HG       SER   7 -43.406  20.422   8.821
   54    H    ALA   8           H        ALA   8 -42.216  23.114   6.953
   55    HA   ALA   8           HA       ALA   8 -43.923  24.970   5.751
   56   1HB   ALA   8          1HB       ALA   8 -42.339  24.916   4.135
   57   2HB   ALA   8          2HB       ALA   8 -41.455  23.832   5.236
   58   3HB   ALA   8          3HB       ALA   8 -42.469  23.152   3.941
   59    H    GLU   9           H        GLU   9 -46.112  24.429   5.809
   60    HA   GLU   9           HA       GLU   9 -47.967  23.439   5.268
   61   1HB   GLU   9          1HB       GLU   9 -47.537  23.828   2.982
   62   2HB   GLU   9          2HB       GLU   9 -46.219  22.674   2.923
   63   1HG   GLU   9          1HG       GLU   9 -47.844  20.796   3.211
   64   2HG   GLU   9          2HG       GLU   9 -49.165  21.945   3.288
   65    HE2  GLU   9           HE2      GLU   9 -48.979  22.745  -0.113
   66    H    SER  10           H        SER  10 -49.175  21.305   5.127
   67    HA   SER  10           HA       SER  10 -47.501  19.095   5.992
   68   1HB   SER  10          1HB       SER  10 -48.312  19.811   8.090
   69   2HB   SER  10          2HB       SER  10 -49.865  20.298   7.441
   70    HG   SER  10           HG       SER  10 -49.113  17.535   7.315
   71    H    SER  11           H        SER  11 -48.045  17.168   4.979
   72    HA   SER  11           HA       SER  11 -50.720  16.821   4.030
   73   1HB   SER  11          1HB       SER  11 -48.402  16.782   2.048
   74   2HB   SER  11          2HB       SER  11 -50.077  16.418   1.681
   75    HG   SER  11           HG       SER  11 -50.505  18.510   1.517
   76    H    GLY  12           H        GLY  12 -51.102  14.543   3.326
   77   1HA   GLY  12          1HA       GLY  12 -50.017  12.377   2.931
   78   2HA   GLY  12          2HA       GLY  12 -48.977  12.725   4.299
   79    H    CYS  13           H        CYS  13 -51.737  11.065   3.340
   80    HA   CYS  13           HA       CYS  13 -52.426  10.554   6.074
   81   1HB   CYS  13          1HB       CYS  13 -53.867  12.584   4.876
   82   2HB   CYS  13          2HB       CYS  13 -54.877  11.185   4.571
   83    HG   CYS  13           HG       CYS  13 -54.087  10.433   7.292
   84    H    ASN  14           H        ASN  14 -51.288   8.623   4.921
   85    HA   ASN  14           HA       ASN  14 -53.031   7.268   3.075
   86   1HB   ASN  14          1HB       ASN  14 -50.178   7.233   3.740
   87   2HB   ASN  14          2HB       ASN  14 -50.816   5.601   3.789
   88   1HD2  ASN  14          1HD2      ASN  14 -49.357   5.326   1.966
   89   2HD2  ASN  14          2HD2      ASN  14 -49.898   5.694   0.363
   90    H    SER  15           H        SER  15 -53.669   7.726   6.034
   91    HA   SER  15           HA       SER  15 -54.324   6.663   7.822
   92   1HB   SER  15          1HB       SER  15 -55.052   4.486   5.812
   93   2HB   SER  15          2HB       SER  15 -55.711   4.619   7.430
   94    HG   SER  15           HG       SER  15 -57.225   5.758   6.391
   95    H    HIS  16           H        HIS  16 -52.272   6.362   8.875
   96    HA   HIS  16           HA       HIS  16 -51.633   3.663   9.362
   97   1HB   HIS  16          1HB       HIS  16 -50.537   4.210   7.073
   98   2HB   HIS  16          2HB       HIS  16 -49.395   5.158   8.004
   99    HD1  HIS  16           HD1      HIS  16 -49.784   1.873   6.657
  100    HD2  HIS  16           HD2      HIS  16 -48.234   3.403  10.242
  101    HE1  HIS  16           HE1      HIS  16 -48.280   0.051   7.621
  102    H    MET  17           H        MET  17 -52.133   4.474  11.486
  103    HA   MET  17           HA       MET  17 -50.748   6.681  12.527
  104   1HB   MET  17          1HB       MET  17 -52.852   4.872  13.294
  105   2HB   MET  17          2HB       MET  17 -51.655   4.792  14.571
  106   1HG   MET  17          1HG       MET  17 -52.643   7.464  13.490
  107   2HG   MET  17          2HG       MET  17 -53.502   6.621  14.763
  108   1HE   MET  17          1HE       MET  17 -52.434   7.855  17.580
  109   2HE   MET  17          2HE       MET  17 -53.146   6.438  16.772
  110   3HE   MET  17          3HE       MET  17 -51.583   6.293  17.611
  111    HA   PRO  18           HA       PRO  18 -48.071   3.312  14.531
  112   1HB   PRO  18          1HB       PRO  18 -48.280   0.721  13.688
  113   2HB   PRO  18          2HB       PRO  18 -49.118   1.341  15.096
  114   1HG   PRO  18          1HG       PRO  18 -50.205   0.711  12.421
  115   2HG   PRO  18          2HG       PRO  18 -51.064   0.916  13.934
  116   1HD   PRO  18          1HD       PRO  18 -50.901   2.807  11.783
  117   2HD   PRO  18          2HD       PRO  18 -51.661   3.056  13.342
  118    H    TYR  19           H        TYR  19 -46.624   4.672  13.380
  119    HA   TYR  19           HA       TYR  19 -45.748   3.614  10.831
  120   1HB   TYR  19          1HB       TYR  19 -46.063   6.117  11.950
  121   2HB   TYR  19          2HB       TYR  19 -44.392   5.835  12.393
  122    HD1  TYR  19           HD1      TYR  19 -46.678   5.841   9.431
  123    HD2  TYR  19           HD2      TYR  19 -42.673   6.298  10.865
  124    HE1  TYR  19           HE1      TYR  19 -45.931   6.601   7.123
  125    HE2  TYR  19           HE2      TYR  19 -41.939   7.055   8.551
  126    HH   TYR  19           HH       TYR  19 -42.751   6.695   6.199
  127    H    GLY  20           H        GLY  20 -45.115   1.529  12.163
  128   1HA   GLY  20          1HA       GLY  20 -42.782   1.672  13.791
  129   2HA   GLY  20          2HA       GLY  20 -43.522   0.238  13.107
  130    H    TYR  21           H        TYR  21 -43.199   2.249  10.480
  131    HA   TYR  21           HA       TYR  21 -41.121   0.753   9.349
  132   1HB   TYR  21          1HB       TYR  21 -43.040   2.103   8.264
  133   2HB   TYR  21          2HB       TYR  21 -42.201   3.572   8.722
  134    HD1  TYR  21           HD1      TYR  21 -42.531   1.002   6.237
  135    HD2  TYR  21           HD2      TYR  21 -39.853   3.975   7.752
  136    HE1  TYR  21           HE1      TYR  21 -41.220   0.942   4.059
  137    HE2  TYR  21           HE2      TYR  21 -38.551   3.905   5.569
  138    HH   TYR  21           HH       TYR  21 -39.282   3.234   3.060
  139    H    ALA  22           H        ALA  22 -41.123   3.573  11.444
  140    HA   ALA  22           HA       ALA  22 -38.429   4.307  10.637
  141   1HB   ALA  22          1HB       ALA  22 -40.467   5.458  12.576
  142   2HB   ALA  22          2HB       ALA  22 -38.816   6.100  12.400
  143   3HB   ALA  22          3HB       ALA  22 -39.936   6.135  11.018
  144    H    ALA  23           H        ALA  23 -38.877   1.621  11.719
  145    HA   ALA  23           HA       ALA  23 -37.875   1.797  14.439
  146   1HB   ALA  23          1HB       ALA  23 -38.641  -0.554  12.660
  147   2HB   ALA  23          2HB       ALA  23 -38.164  -0.673  14.371
  148   3HB   ALA  23          3HB       ALA  23 -39.654   0.191  13.921
  149    H    GLN  24           H        GLN  24 -36.632   1.966  11.304
  150    HA   GLN  24           HA       GLN  24 -34.331   0.349  11.801
  151   1HB   GLN  24          1HB       GLN  24 -35.067   2.250   9.536
  152   2HB   GLN  24          2HB       GLN  24 -33.580   1.324   9.570
  153   1HG   GLN  24          1HG       GLN  24 -36.058  -0.263  10.078
  154   2HG   GLN  24          2HG       GLN  24 -35.942   0.427   8.471
  155   1HE2  GLN  24          1HE2      GLN  24 -35.951  -2.228   8.688
  156   2HE2  GLN  24          2HE2      GLN  24 -34.399  -2.923   8.362
  157    H    ALA  25           H        ALA  25 -35.342   3.274  13.003
  158    HA   ALA  25           HA       ALA  25 -33.148   4.957  12.613
  159   1HB   ALA  25          1HB       ALA  25 -34.564   5.101  15.216
  160   2HB   ALA  25          2HB       ALA  25 -34.332   6.349  13.968
  161   3HB   ALA  25          3HB       ALA  25 -35.618   5.133  13.782
  162    H    ARG  26           H        ARG  26 -33.549   2.020  14.453
  163    HA   ARG  26           HA       ARG  26 -31.628   2.613  16.408
  164   1HB   ARG  26          1HB       ARG  26 -33.510   0.667  16.139
  165   2HB   ARG  26          2HB       ARG  26 -32.123  -0.237  15.566
  166   1HG   ARG  26          1HG       ARG  26 -30.960   0.775  17.756
  167   2HG   ARG  26          2HG       ARG  26 -32.616   0.950  18.301
  168   1HD   ARG  26          1HD       ARG  26 -32.582  -1.241  18.902
  169   2HD   ARG  26          2HD       ARG  26 -32.512  -1.658  17.201
  170    HE   ARG  26           HE       ARG  26 -29.881  -0.944  18.172
  171   1HH1  ARG  26          2HH2      ARG  26 -32.249  -3.579  18.222
  172   2HH1  ARG  26          1HH2      ARG  26 -31.057  -4.812  18.462
  173   1HH2  ARG  26          1HH       ARG  26 -28.746  -4.197  18.616
  174    H    ALA  27           H        ALA  27 -31.575   1.330  13.092
  175    HA   ALA  27           HA       ALA  27 -28.980   0.200  13.232
  176   1HB   ALA  27          1HB       ALA  27 -30.576   1.189  10.835
  177   2HB   ALA  27          2HB       ALA  27 -29.210   0.049  10.803
  178   3HB   ALA  27          3HB       ALA  27 -30.743  -0.419  11.578
  179    H    ARG  28           H        ARG  28 -30.318   3.447  12.680
  180    HA   ARG  28           HA       ARG  28 -28.116   4.536  11.431
  181   1HB   ARG  28          1HB       ARG  28 -30.593   5.452  12.099
  182   2HB   ARG  28          2HB       ARG  28 -29.674   6.232  13.371
  183   1HG   ARG  28          1HG       ARG  28 -28.535   7.620  11.902
  184   2HG   ARG  28          2HG       ARG  28 -28.504   6.426  10.620
  185   1HD   ARG  28          1HD       ARG  28 -30.159   7.664   9.649
  186   2HD   ARG  28          2HD       ARG  28 -31.228   6.939  10.834
  187    HE   ARG  28           HE       ARG  28 -30.139   9.681  10.893
  188   1HH1  ARG  28          2HH2      ARG  28 -31.803   7.133  12.707
  189   2HH1  ARG  28          1HH2      ARG  28 -32.463   8.225  13.878
  190   1HH2  ARG  28          1HH       ARG  28 -31.983  10.566  13.700
  191    H    GLU  29           H        GLU  29 -28.817   3.769  14.831
  192    HA   GLU  29           HA       GLU  29 -26.680   5.384  15.806
  193   1HB   GLU  29          1HB       GLU  29 -28.946   4.561  16.968
  194   2HB   GLU  29          2HB       GLU  29 -27.956   3.196  17.442
  195   1HG   GLU  29          1HG       GLU  29 -27.122   4.447  19.137
  196   2HG   GLU  29          2HG       GLU  29 -26.338   5.469  17.950
  197    HE2  GLU  29           HE2      GLU  29 -27.354   7.334  17.399
  198    H    ARG  30           H        ARG  30 -27.142   2.119  14.591
  199    HA   ARG  30           HA       ARG  30 -24.723   1.209  15.839
  200   1HB   ARG  30          1HB       ARG  30 -27.005  -0.020  14.354
  201   2HB   ARG  30          2HB       ARG  30 -25.457  -0.788  14.065
  202   1HG   ARG  30          1HG       ARG  30 -25.324  -0.527  16.784
  203   2HG   ARG  30          2HG       ARG  30 -27.062  -0.639  16.591
  204   1HD   ARG  30          1HD       ARG  30 -26.760  -2.900  16.534
  205   2HD   ARG  30          2HD       ARG  30 -26.167  -2.667  14.902
  206    HE   ARG  30           HE       ARG  30 -24.065  -2.203  16.850
  207   1HH1  ARG  30          2HH2      ARG  30 -25.832  -4.778  15.177
  208   2HH1  ARG  30          1HH2      ARG  30 -24.547  -5.929  15.330
  209   1HH2  ARG  30          1HH       ARG  30 -22.521  -5.286  16.437
  210    H    GLU  31           H        GLU  31 -25.932   2.470  12.757
  211    HA   GLU  31           HA       GLU  31 -23.876   1.481  11.149
  212   1HB   GLU  31          1HB       GLU  31 -26.004   3.581  10.919
  213   2HB   GLU  31          2HB       GLU  31 -24.662   3.700   9.798
  214   1HG   GLU  31          1HG       GLU  31 -25.962   1.001  10.195
  215   2HG   GLU  31          2HG       GLU  31 -26.809   2.199   9.237
  216    HE2  GLU  31           HE2      GLU  31 -23.948  -0.031   8.553
  217    H    ARG  32           H        ARG  32 -24.068   4.084  13.488
  218    HA   ARG  32           HA       ARG  32 -22.184   5.789  12.451
  219   1HB   ARG  32          1HB       ARG  32 -23.664   6.268  14.424
  220   2HB   ARG  32          2HB       ARG  32 -22.742   5.131  15.388
  221   1HG   ARG  32          1HG       ARG  32 -20.913   6.548  15.582
  222   2HG   ARG  32          2HG       ARG  32 -21.153   7.260  13.998
  223   1HD   ARG  32          1HD       ARG  32 -23.416   7.891  15.749
  224   2HD   ARG  32          2HD       ARG  32 -21.909   8.368  16.505
  225    HE   ARG  32           HE       ARG  32 -23.073   9.493  14.048
  226   1HH1  ARG  32          2HH2      ARG  32 -20.143   9.179  16.016
  227   2HH1  ARG  32          1HH2      ARG  32 -19.386  10.580  15.335
  228   1HH2  ARG  32          1HH       ARG  32 -20.540  11.837  13.652
  229    H    LEU  33           H        LEU  33 -21.893   2.661  14.104
  230    HA   LEU  33           HA       LEU  33 -19.043   3.024  14.509
  231   1HB   LEU  33          1HB       LEU  33 -21.070   1.614  15.817
  232   2HB   LEU  33          2HB       LEU  33 -20.098   0.378  15.046
  233    HG   LEU  33           HG       LEU  33 -18.069   1.584  16.115
  234   1HD1  LEU  33          1HD1      LEU  33 -19.031   2.534  18.437
  235   2HD1  LEU  33          2HD1      LEU  33 -18.686   3.560  17.024
  236   3HD1  LEU  33          3HD1      LEU  33 -20.352   3.023  17.349
  237   1HD2  LEU  33          1HD2      LEU  33 -19.657   0.382  18.299
  238   2HD2  LEU  33          2HD2      LEU  33 -19.517  -0.597  16.819
  239   3HD2  LEU  33          3HD2      LEU  33 -18.050  -0.048  17.666
  240    H    ALA  34           H        ALA  34 -21.219   2.030  12.052
  241    HA   ALA  34           HA       ALA  34 -19.462   0.052  10.915
  242   1HB   ALA  34          1HB       ALA  34 -21.677   1.271   9.332
  243   2HB   ALA  34          2HB       ALA  34 -21.247  -0.440   9.570
  244   3HB   ALA  34          3HB       ALA  34 -22.143   0.436  10.834
  245    H    HIS  35           H        HIS  35 -19.092   3.269  11.331
  246    HA   HIS  35           HA       HIS  35 -18.340   3.880   8.603
  247   1HB   HIS  35          1HB       HIS  35 -18.919   5.401  11.069
  248   2HB   HIS  35          2HB       HIS  35 -17.613   6.053  10.099
  249    HD1  HIS  35           HD1      HIS  35 -18.207   7.062   7.778
  250    HD2  HIS  35           HD2      HIS  35 -21.495   5.496   9.858
  251    HE1  HIS  35           HE1      HIS  35 -20.287   7.886   6.551
  252    H    SER  36           H        SER  36 -17.001   2.416  11.383
  253    HA   SER  36           HA       SER  36 -14.351   3.405  10.860
  254   1HB   SER  36          1HB       SER  36 -13.709   2.318  12.879
  255   2HB   SER  36          2HB       SER  36 -15.309   2.956  13.199
  256    HG   SER  36           HG       SER  36 -14.448   0.353  13.260
  257    H    ARG  37           H        ARG  37 -16.467   0.793   9.947
  258    HA   ARG  37           HA       ARG  37 -14.278  -0.956   9.329
  259   1HB   ARG  37          1HB       ARG  37 -16.900  -1.417  10.061
  260   2HB   ARG  37          2HB       ARG  37 -17.024  -1.594   8.322
  261   1HG   ARG  37          1HG       ARG  37 -16.225  -3.704   8.561
  262   2HG   ARG  37          2HG       ARG  37 -14.671  -3.003   8.969
  263   1HD   ARG  37          1HD       ARG  37 -16.789  -3.264  11.123
  264   2HD   ARG  37          2HD       ARG  37 -15.862  -4.677  10.657
  265    HE   ARG  37           HE       ARG  37 -14.865  -2.330  12.107
  266   1HH1  ARG  37          2HH2      ARG  37 -13.943  -5.120  10.127
  267   2HH1  ARG  37          1HH2      ARG  37 -12.315  -5.158  10.718
  268   1HH2  ARG  37          1HH       ARG  37 -11.616  -3.538  12.340
  269    H    ALA  38           H        ALA  38 -15.090   1.812   7.982
  270    HA   ALA  38           HA       ALA  38 -15.519   0.919   5.253
  271   1HB   ALA  38          1HB       ALA  38 -15.029   3.785   5.952
  272   2HB   ALA  38          2HB       ALA  38 -16.236   3.065   4.860
  273   3HB   ALA  38          3HB       ALA  38 -16.494   3.027   6.621
  274    H    ALA  39           H        ALA  39 -13.162   3.053   7.029
  275    HA   ALA  39           HA       ALA  39 -11.248   2.598   4.894
  276   1HB   ALA  39          1HB       ALA  39 -10.147   4.481   5.725
  277   2HB   ALA  39          2HB       ALA  39 -11.842   4.847   6.125
  278   3HB   ALA  39          3HB       ALA  39 -10.745   4.228   7.382
  279    H    ALA  40           H        ALA  40  -9.067   1.805   5.337
  280    HA   ALA  40           HA       ALA  40  -9.148  -0.292   7.338
  281   1HB   ALA  40          1HB       ALA  40  -7.854   0.210   4.768
  282   2HB   ALA  40          2HB       ALA  40  -6.687  -0.344   5.991
  283   3HB   ALA  40          3HB       ALA  40  -8.123  -1.328   5.621
  284    H    ALA  41           H        ALA  41  -6.827   2.320   6.312
  285    HA   ALA  41           HA       ALA  41  -5.413   3.560   7.476
  286   1HB   ALA  41          1HB       ALA  41  -6.040   3.822  10.023
  287   2HB   ALA  41          2HB       ALA  41  -7.105   4.504   8.771
  288   3HB   ALA  41          3HB       ALA  41  -7.520   2.957   9.546
  289    H    ALA  42           H        ALA  42  -4.194   1.383   6.830
  290    HA   ALA  42           HA       ALA  42  -3.096   0.285   9.329
  291   1HB   ALA  42          1HB       ALA  42  -4.321  -1.029   7.120
  292   2HB   ALA  42          2HB       ALA  42  -2.579  -1.382   7.032
  293   3HB   ALA  42          3HB       ALA  42  -3.492  -1.768   8.510
  294    H    ALA  43           H        ALA  43  -2.202   0.523   5.809
  295    HA   ALA  43           HA       ALA  43   0.500   0.579   6.151
  296   1HB   ALA  43          1HB       ALA  43   0.529   1.043   3.913
  297   2HB   ALA  43          2HB       ALA  43  -1.215   0.713   4.051
  298   3HB   ALA  43          3HB       ALA  43  -0.623   2.391   4.069
  299    H    VAL  44           H        VAL  44  -1.876   3.026   6.981
  300    HA   VAL  44           HA       VAL  44   0.204   5.056   7.217
  301    HB   VAL  44           HB       VAL  44  -2.692   4.988   6.840
  302   1HG1  VAL  44          1HG1      VAL  44  -2.835   5.730   9.120
  303   2HG1  VAL  44          2HG1      VAL  44  -1.515   6.900   8.881
  304   3HG1  VAL  44          3HG1      VAL  44  -3.080   7.146   8.069
  305   1HG2  VAL  44          1HG2      VAL  44  -0.628   7.176   6.416
  306   2HG2  VAL  44          2HG2      VAL  44  -1.062   5.922   5.229
  307   3HG2  VAL  44          3HG2      VAL  44  -2.274   7.122   5.739
  308    H    ALA  45           H        ALA  45  -1.854   2.851   9.095
  309    HA   ALA  45           HA       ALA  45  -1.891   3.934  11.555
  310   1HB   ALA  45          1HB       ALA  45  -2.069   1.700  12.382
  311   2HB   ALA  45          2HB       ALA  45  -2.735   1.664  10.731
  312   3HB   ALA  45          3HB       ALA  45  -1.093   1.050  11.042
  313    H    ALA  46           H        ALA  46   0.843   1.907  10.265
  314    HA   ALA  46           HA       ALA  46   2.524   2.308  12.430
  315   1HB   ALA  46          1HB       ALA  46   2.897   0.570  10.776
  316   2HB   ALA  46          2HB       ALA  46   3.103   1.782   9.488
  317   3HB   ALA  46          3HB       ALA  46   4.310   1.652  10.789
  318    H    ALA  47           H        ALA  47   2.594   3.988   9.200
  319    HA   ALA  47           HA       ALA  47   4.476   5.887   9.964
  320   1HB   ALA  47          1HB       ALA  47   2.825   5.239   7.701
  321   2HB   ALA  47          2HB       ALA  47   2.704   6.988   8.011
  322   3HB   ALA  47          3HB       ALA  47   4.298   6.238   7.755
  323    H    THR  48           H        THR  48   3.651   8.417   9.646
  324    HA   THR  48           HA       THR  48   2.711  10.140  10.691
  325    HB   THR  48           HB       THR  48   0.418   8.127  10.689
  326    HG1  THR  48           HG1      THR  48   0.919  10.724   9.425
  327   1HG2  THR  48          1HG2      THR  48  -1.099   9.948  11.285
  328   2HG2  THR  48          2HG2      THR  48   0.119   9.834  12.578
  329   3HG2  THR  48          3HG2      THR  48   0.246  11.112  11.346
  330    H    ALA  49           H        ALA  49   4.332  10.078  12.332
  331    HA   ALA  49           HA       ALA  49   4.292   8.542  14.588
  332   1HB   ALA  49          1HB       ALA  49   5.636  10.345  15.587
  333   2HB   ALA  49          2HB       ALA  49   6.106  10.080  13.892
  334   3HB   ALA  49          3HB       ALA  49   5.084  11.472  14.324
  335    H    ALA  50           H        ALA  50   3.928   9.664  16.922
  336    HA   ALA  50           HA       ALA  50   1.082  10.153  16.992
  337   1HB   ALA  50          1HB       ALA  50   1.511   8.779  18.749
  338   2HB   ALA  50          2HB       ALA  50   3.225   9.255  18.829
  339   3HB   ALA  50          3HB       ALA  50   1.980  10.280  19.584
  340    H    VAL  51           H        VAL  51   2.155  12.236  15.609
  341    HA   VAL  51           HA       VAL  51   2.558  14.423  15.585
  342    HB   VAL  51           HB       VAL  51   0.181  14.310  16.112
  343   1HG1  VAL  51          1HG1      VAL  51   1.139  14.335  18.985
  344   2HG1  VAL  51          2HG1      VAL  51  -0.519  14.780  18.514
  345   3HG1  VAL  51          3HG1      VAL  51   0.092  13.143  18.177
  346   1HG2  VAL  51          1HG2      VAL  51   0.025  16.551  16.254
  347   2HG2  VAL  51          2HG2      VAL  51   0.895  16.611  17.806
  348   3HG2  VAL  51          3HG2      VAL  51   1.805  16.519  16.279
  349    H    GLU  52           H        GLU  52   4.710  13.270  16.704
  350    HA   GLU  52           HA       GLU  52   5.169  14.807  19.137
  351   1HB   GLU  52          1HB       GLU  52   5.425  12.281  19.234
  352   2HB   GLU  52          2HB       GLU  52   6.758  12.418  18.105
  353   1HG   GLU  52          1HG       GLU  52   7.905  13.993  19.731
  354   2HG   GLU  52          2HG       GLU  52   6.607  13.704  20.872
  355    HE2  GLU  52           HE2      GLU  52   9.299  12.713  21.532
  356    H    GLY  53           H        GLY  53   7.341  15.834  19.382
  357   1HA   GLY  53          1HA       GLY  53   8.028  17.401  17.178
  358   2HA   GLY  53          2HA       GLY  53   8.970  17.190  18.640
  359    H    THR  54           H        THR  54  10.414  15.236  18.801
  360    HA   THR  54           HA       THR  54  12.235  14.258  17.910
  361    HB   THR  54           HB       THR  54   9.909  13.088  16.299
  362    HG1  THR  54           HG1      THR  54  10.297  11.475  18.099
  363   1HG2  THR  54          1HG2      THR  54  11.404  11.032  16.232
  364   2HG2  THR  54          2HG2      THR  54  12.000  12.366  15.216
  365   3HG2  THR  54          3HG2      THR  54  12.748  12.051  16.800
  366    H    GLY  55           H        GLY  55  13.454  15.967  17.088
  367   1HA   GLY  55          1HA       GLY  55  13.021  17.302  14.704
  368   2HA   GLY  55          2HA       GLY  55  14.574  17.070  15.482
  369    H    GLY  56           H        GLY  56  14.420  17.161  12.690
  370   1HA   GLY  56          1HA       GLY  56  14.182  14.536  11.563
  371   2HA   GLY  56          2HA       GLY  56  14.776  15.989  10.784
  372    H    SER  57           H        SER  57  15.687  12.933  11.626
  373    HA   SER  57           HA       SER  57  18.463  13.739  11.650
  374   1HB   SER  57          1HB       SER  57  17.275  11.751  13.637
  375   2HB   SER  57          2HB       SER  57  18.988  12.065  13.438
  376    HG   SER  57           HG       SER  57  17.154  13.451  14.919
  377    H    GLY  58           H        GLY  58  19.909  11.690  11.258
  378   1HA   GLY  58          1HA       GLY  58  18.607  10.124   9.157
  379   2HA   GLY  58          2HA       GLY  58  20.327  10.317   9.432
  380    H    GLY  59           H        GLY  59  21.231   8.372   9.943
  381   1HA   GLY  59          1HA       GLY  59  21.590   6.408  10.972
  382   2HA   GLY  59          2HA       GLY  59  20.630   7.012  12.308
  383    H    GLY  60           H        GLY  60  20.432   4.341  11.854
  384   1HA   GLY  60          1HA       GLY  60  17.747   3.834  11.591
  385   2HA   GLY  60          2HA       GLY  60  18.394   3.644   9.974
  386    HA   PRO  61           HA       PRO  61  19.884  -0.271  11.092
  387   1HB   PRO  61          1HB       PRO  61  21.983  -0.630   9.381
  388   2HB   PRO  61          2HB       PRO  61  20.311  -0.838   8.902
  389   1HG   PRO  61          1HG       PRO  61  22.150   1.393   8.287
  390   2HG   PRO  61          2HG       PRO  61  20.651   0.955   7.492
  391   1HD   PRO  61          1HD       PRO  61  21.045   3.107   9.346
  392   2HD   PRO  61          2HD       PRO  61  19.525   2.597   8.640
  393    H    HIS  62           H        HIS  62  21.811  -1.651  11.791
  394    HA   HIS  62           HA       HIS  62  23.533   0.153  13.332
  395   1HB   HIS  62          1HB       HIS  62  22.502  -2.584  14.128
  396   2HB   HIS  62          2HB       HIS  62  23.612  -1.601  15.062
  397    HD1  HIS  62           HD1      HIS  62  22.421  -0.536  16.969
  398    HD2  HIS  62           HD2      HIS  62  20.011  -0.746  13.542
  399    HE1  HIS  62           HE1      HIS  62  20.196   0.545  17.593
  400    H    HIS  63           H        HIS  63  25.603  -1.227  14.104
  401    HA   HIS  63           HA       HIS  63  27.225  -1.545  12.016
  402   1HB   HIS  63          1HB       HIS  63  27.589  -1.731  14.611
  403   2HB   HIS  63          2HB       HIS  63  27.487  -3.456  14.320
  404    HD1  HIS  63           HD1      HIS  63  29.674  -4.551  13.832
  405    HD2  HIS  63           HD2      HIS  63  29.672  -0.497  12.756
  406    HE1  HIS  63           HE1      HIS  63  32.032  -4.029  13.009
  407    H    HIS  64           H        HIS  64  25.578  -4.364  13.630
  408    HA   HIS  64           HA       HIS  64  24.955  -6.321  12.862
  409   1HB   HIS  64          1HB       HIS  64  23.987  -4.473  11.036
  410   2HB   HIS  64          2HB       HIS  64  24.770  -5.659  10.011
  411    HD1  HIS  64           HD1      HIS  64  22.382  -6.380   9.138
  412    HD2  HIS  64           HD2      HIS  64  23.062  -7.075  13.218
  413    HE1  HIS  64           HE1      HIS  64  20.529  -7.952   9.914
  414    H    HIS  65           H        HIS  65  25.518  -8.128  11.102
  415    HA   HIS  65           HA       HIS  65  27.056  -9.441  10.254
  416   1HB   HIS  65          1HB       HIS  65  27.743  -6.805   9.245
  417   2HB   HIS  65          2HB       HIS  65  29.175  -7.801   9.407
  418    HD1  HIS  65           HD1      HIS  65  29.637  -8.517   7.041
  419    HD2  HIS  65           HD2      HIS  65  25.619  -9.054   8.120
  420    HE1  HIS  65           HE1      HIS  65  28.532  -9.741   5.094
  421    H    GLN  66           H        GLN  66  28.957 -10.605  10.873
  422    HA   GLN  66           HA       GLN  66  29.686 -10.171  13.520
  423   1HB   GLN  66          1HB       GLN  66  29.699 -12.354  12.101
  424   2HB   GLN  66          2HB       GLN  66  31.280 -11.843  11.547
  425   1HG   GLN  66          1HG       GLN  66  32.280 -12.185  13.613
  426   2HG   GLN  66          2HG       GLN  66  30.842 -11.739  14.509
  427   1HE2  GLN  66          1HE2      GLN  66  31.514 -13.652  15.747
  428   2HE2  GLN  66          2HE2      GLN  66  30.933 -15.214  15.273
  429    H    THR  67           H        THR  67  32.243 -10.236  14.085
  430    HA   THR  67           HA       THR  67  33.846  -8.604  12.350
  431    HB   THR  67           HB       THR  67  33.037  -7.458  15.066
  432    HG1  THR  67           HG1      THR  67  31.165  -7.293  13.805
  433   1HG2  THR  67          1HG2      THR  67  34.697  -6.581  12.710
  434   2HG2  THR  67          2HG2      THR  67  33.655  -5.351  13.465
  435   3HG2  THR  67          3HG2      THR  67  34.892  -6.187  14.435
  436    H    ARG  68           H        ARG  68  36.008  -8.070  13.509
  437    HA   ARG  68           HA       ARG  68  37.111 -10.461  14.209
  438   1HB   ARG  68          1HB       ARG  68  37.981  -7.775  13.837
  439   2HB   ARG  68          2HB       ARG  68  38.559  -8.221  15.430
  440   1HG   ARG  68          1HG       ARG  68  38.938 -10.279  13.286
  441   2HG   ARG  68          2HG       ARG  68  39.892  -8.819  13.117
  442   1HD   ARG  68          1HD       ARG  68  39.993  -9.644  15.892
  443   2HD   ARG  68          2HD       ARG  68  40.348 -11.040  14.894
  444    HE   ARG  68           HE       ARG  68  42.320  -9.988  14.118
  445   1HH1  ARG  68          2HH2      ARG  68  40.379  -7.697  15.998
  446   2HH1  ARG  68          1HH2      ARG  68  41.643  -6.517  16.097
  447   1HH2  ARG  68          1HH       ARG  68  43.756  -6.970  15.062
  448    H    GLY  69           H        GLY  69  37.647 -11.476  16.208
  449   1HA   GLY  69          1HA       GLY  69  37.057 -10.110  18.703
  450   2HA   GLY  69          2HA       GLY  69  35.995 -11.448  18.308
  451    H    ALA  70           H        ALA  70  39.404 -10.502  18.916
  452    HA   ALA  70           HA       ALA  70  40.190 -13.295  19.047
  453   1HB   ALA  70          1HB       ALA  70  41.475 -10.687  18.651
  454   2HB   ALA  70          2HB       ALA  70  42.343 -11.706  19.825
  455   3HB   ALA  70          3HB       ALA  70  42.028 -12.313  18.182
  456    H    TYR  71           H        TYR  71  39.950 -14.430  20.900
  457    HA   TYR  71           HA       TYR  71  39.198 -13.153  23.308
  458   1HB   TYR  71          1HB       TYR  71  38.927 -15.616  22.196
  459   2HB   TYR  71          2HB       TYR  71  40.429 -15.935  23.041
  460    HD1  TYR  71           HD1      TYR  71  40.104 -17.149  24.982
  461    HD2  TYR  71           HD2      TYR  71  37.238 -14.151  23.931
  462    HE1  TYR  71           HE1      TYR  71  38.798 -17.643  27.107
  463    HE2  TYR  71           HE2      TYR  71  35.941 -14.655  26.059
  464    HH   TYR  71           HH       TYR  71  35.910 -17.105  27.609
  465    H    SER  72           H        SER  72  40.397 -12.417  25.008
  466    HA   SER  72           HA       SER  72  43.241 -12.524  24.680
  467   1HB   SER  72          1HB       SER  72  42.072 -10.419  25.345
  468   2HB   SER  72          2HB       SER  72  41.528 -11.187  26.823
  469    HG   SER  72           HG       SER  72  44.108 -11.612  26.904
  470    H    SER  73           H        SER  73  44.452 -14.163  25.549
  471    HA   SER  73           HA       SER  73  43.600 -15.191  28.120
  472   1HB   SER  73          1HB       SER  73  43.789 -16.718  25.561
  473   2HB   SER  73          2HB       SER  73  44.515 -17.496  26.953
  474    HG   SER  73           HG       SER  73  41.777 -16.676  26.582
  475    H    HIS  74           H        HIS  74  45.405 -13.859  28.900
  476    HA   HIS  74           HA       HIS  74  48.025 -14.597  27.916
  477   1HB   HIS  74          1HB       HIS  74  48.790 -12.776  29.442
  478   2HB   HIS  74          2HB       HIS  74  47.686 -12.262  28.182
  479    HD1  HIS  74           HD1      HIS  74  45.124 -11.834  28.969
  480    HD2  HIS  74           HD2      HIS  74  47.975 -12.207  32.023
  481    HE1  HIS  74           HE1      HIS  74  44.044 -10.882  31.076
  482    H    ASP  75           H        ASP  75  49.704 -15.454  29.290
  483    HA   ASP  75           HA       ASP  75  49.243 -16.088  31.949
  484   1HB   ASP  75          1HB       ASP  75  49.240 -18.654  31.583
  485   2HB   ASP  75          2HB       ASP  75  47.724 -17.807  31.348
  486    HD2  ASP  75           HD2      ASP  75  49.347 -20.220  29.955
  Start of MODEL    3
    1    H    MET   1           H        MET   1 -53.122  35.323   3.246
    2    HA   MET   1           HA       MET   1 -55.282  35.626   1.585
    3   1HB   MET   1          1HB       MET   1 -53.116  33.522   1.954
    4   2HB   MET   1          2HB       MET   1 -54.376  33.234   0.769
    5   1HG   MET   1          1HG       MET   1 -53.106  34.459  -0.675
    6   2HG   MET   1          2HG       MET   1 -53.641  35.870   0.216
    7   1HE   MET   1          1HE       MET   1 -50.522  37.211  -0.047
    8   2HE   MET   1          2HE       MET   1 -52.276  37.344   0.221
    9   3HE   MET   1          3HE       MET   1 -51.155  37.456   1.599
   10    H    GLU   2           H        GLU   2 -57.291  35.417   2.695
   11    HA   GLU   2           HA       GLU   2 -57.980  32.647   3.186
   12   1HB   GLU   2          1HB       GLU   2 -57.516  34.426   5.295
   13   2HB   GLU   2          2HB       GLU   2 -59.258  34.478   5.114
   14   1HG   GLU   2          1HG       GLU   2 -58.843  32.678   6.636
   15   2HG   GLU   2          2HG       GLU   2 -59.226  31.906   5.109
   16    HE2  GLU   2           HE2      GLU   2 -56.841  30.076   4.958
   17    H    VAL   3           H        VAL   3 -59.559  32.269   1.689
   18    HA   VAL   3           HA       VAL   3 -61.307  34.476   0.957
   19    HB   VAL   3           HB       VAL   3 -61.105  31.694  -0.205
   20   1HG1  VAL   3          1HG1      VAL   3 -62.595  34.180  -0.909
   21   2HG1  VAL   3          2HG1      VAL   3 -61.907  33.233  -2.249
   22   3HG1  VAL   3          3HG1      VAL   3 -63.048  32.471  -1.115
   23   1HG2  VAL   3          1HG2      VAL   3 -59.076  32.271  -0.951
   24   2HG2  VAL   3          2HG2      VAL   3 -59.896  33.463  -1.987
   25   3HG2  VAL   3          3HG2      VAL   3 -59.266  33.951  -0.395
   26    H    ALA   4           H        ALA   4 -63.683  34.086   0.809
   27    HA   ALA   4           HA       ALA   4 -64.682  33.185   3.246
   28   1HB   ALA   4          1HB       ALA   4 -66.264  33.415   0.668
   29   2HB   ALA   4          2HB       ALA   4 -66.806  33.736   2.333
   30   3HB   ALA   4          3HB       ALA   4 -65.662  34.845   1.540
   31    H    MET   5           H        MET   5 -64.641  31.119   3.977
   32    HA   MET   5           HA       MET   5 -64.837  28.956   4.053
   33   1HB   MET   5          1HB       MET   5 -67.069  29.855   2.630
   34   2HB   MET   5          2HB       MET   5 -66.434  28.633   1.546
   35   1HG   MET   5          1HG       MET   5 -67.449  27.064   2.840
   36   2HG   MET   5          2HG       MET   5 -66.281  27.426   4.096
   37   1HE   MET   5          1HE       MET   5 -68.828  26.223   4.687
   38   2HE   MET   5          2HE       MET   5 -70.067  27.227   5.477
   39   3HE   MET   5          3HE       MET   5 -70.051  27.065   3.705
   40    H    VAL   6           H        VAL   6 -62.809  28.103   3.645
   41    HA   VAL   6           HA       VAL   6 -62.209  27.552   0.820
   42    HB   VAL   6           HB       VAL   6 -60.134  27.826   2.974
   43   1HG1  VAL   6          1HG1      VAL   6 -59.483  26.830   0.820
   44   2HG1  VAL   6          2HG1      VAL   6 -60.067  28.282  -0.029
   45   3HG1  VAL   6          3HG1      VAL   6 -58.683  28.398   1.084
   46   1HG2  VAL   6          1HG2      VAL   6 -59.945  30.241   1.839
   47   2HG2  VAL   6          2HG2      VAL   6 -61.701  30.005   1.665
   48   3HG2  VAL   6          3HG2      VAL   6 -60.949  29.939   3.277
   49    H    SER   7           H        SER   7 -60.950  25.532   0.449
   50    HA   SER   7           HA       SER   7 -61.159  23.648   2.629
   51   1HB   SER   7          1HB       SER   7 -62.945  23.687   0.337
   52   2HB   SER   7          2HB       SER   7 -61.981  22.224   0.294
   53    HG   SER   7           HG       SER   7 -63.686  23.155   2.435
   54    H    ALA   8           H        ALA   8 -58.828  23.729   2.667
   55    HA   ALA   8           HA       ALA   8 -57.328  23.314   0.286
   56   1HB   ALA   8          1HB       ALA   8 -56.557  23.120   3.226
   57   2HB   ALA   8          2HB       ALA   8 -55.426  23.217   1.855
   58   3HB   ALA   8          3HB       ALA   8 -56.492  24.592   2.228
   59    H    GLU   9           H        GLU   9 -58.505  21.381  -0.522
   60    HA   GLU   9           HA       GLU   9 -58.897  19.067   0.684
   61   1HB   GLU   9          1HB       GLU   9 -58.935  18.069  -1.441
   62   2HB   GLU   9          2HB       GLU   9 -59.160  19.766  -1.819
   63   1HG   GLU   9          1HG       GLU   9 -57.394  19.525  -3.237
   64   2HG   GLU   9          2HG       GLU   9 -56.390  19.561  -1.802
   65    HE2  GLU   9           HE2      GLU   9 -55.280  17.593  -1.391
   66    H    SER  10           H        SER  10 -57.711  17.031   0.970
   67    HA   SER  10           HA       SER  10 -54.907  17.044   0.588
   68   1HB   SER  10          1HB       SER  10 -56.033  17.783   3.225
   69   2HB   SER  10          2HB       SER  10 -54.893  16.455   3.308
   70    HG   SER  10           HG       SER  10 -54.146  18.877   3.365
   71    H    SER  11           H        SER  11 -54.122  14.899   0.544
   72    HA   SER  11           HA       SER  11 -55.665  12.850   1.792
   73   1HB   SER  11          1HB       SER  11 -55.577  13.170  -1.223
   74   2HB   SER  11          2HB       SER  11 -55.756  11.582  -0.505
   75    HG   SER  11           HG       SER  11 -57.537  13.011   0.799
   76    H    GLY  12           H        GLY  12 -54.432  10.879   2.017
   77   1HA   GLY  12          1HA       GLY  12 -52.592   9.512   1.443
   78   2HA   GLY  12          2HA       GLY  12 -51.730  10.916   0.846
   79    H    CYS  13           H        CYS  13 -50.895   8.887   2.885
   80    HA   CYS  13           HA       CYS  13 -49.774   8.838   4.770
   81   1HB   CYS  13          1HB       CYS  13 -48.683  10.901   3.919
   82   2HB   CYS  13          2HB       CYS  13 -49.887  11.873   4.741
   83    HG   CYS  13           HG       CYS  13 -49.438  10.729   7.140
   84    H    ASN  14           H        ASN  14 -52.011   7.908   5.407
   85    HA   ASN  14           HA       ASN  14 -53.516   9.691   7.092
   86   1HB   ASN  14          1HB       ASN  14 -54.021   7.214   5.613
   87   2HB   ASN  14          2HB       ASN  14 -54.532   7.022   7.278
   88   1HD2  ASN  14          1HD2      ASN  14 -55.982   7.322   4.681
   89   2HD2  ASN  14          2HD2      ASN  14 -57.131   8.597   4.915
   90    H    SER  15           H        SER  15 -50.694   8.686   7.725
   91    HA   SER  15           HA       SER  15 -49.545   7.985   9.426
   92   1HB   SER  15          1HB       SER  15 -52.058   8.886  10.627
   93   2HB   SER  15          2HB       SER  15 -51.337   7.608  11.584
   94    HG   SER  15           HG       SER  15 -49.526   9.577  10.687
   95    H    HIS  16           H        HIS  16 -49.304   5.923   8.212
   96    HA   HIS  16           HA       HIS  16 -49.833   3.717   9.832
   97   1HB   HIS  16          1HB       HIS  16 -52.148   4.207   8.831
   98   2HB   HIS  16          2HB       HIS  16 -51.484   3.662   7.303
   99    HD1  HIS  16           HD1      HIS  16 -53.634   2.338   9.588
  100    HD2  HIS  16           HD2      HIS  16 -49.920   0.955   8.214
  101    HE1  HIS  16           HE1      HIS  16 -53.599  -0.175  10.030
  102    H    MET  17           H        MET  17 -47.454   4.371   9.126
  103    HA   MET  17           HA       MET  17 -46.807   3.414   6.506
  104   1HB   MET  17          1HB       MET  17 -45.247   4.556   8.872
  105   2HB   MET  17          2HB       MET  17 -44.400   3.893   7.489
  106   1HG   MET  17          1HG       MET  17 -45.797   5.471   6.011
  107   2HG   MET  17          2HG       MET  17 -46.366   6.229   7.485
  108   1HE   MET  17          1HE       MET  17 -44.071   8.938   6.454
  109   2HE   MET  17          2HE       MET  17 -45.709   8.242   6.510
  110   3HE   MET  17          3HE       MET  17 -44.881   8.694   8.020
  111    HA   PRO  18           HA       PRO  18 -45.639  -0.591   7.700
  112   1HB   PRO  18          1HB       PRO  18 -43.675  -1.204   5.902
  113   2HB   PRO  18          2HB       PRO  18 -45.383  -1.268   5.514
  114   1HG   PRO  18          1HG       PRO  18 -43.378   0.756   4.725
  115   2HG   PRO  18          2HG       PRO  18 -44.951   0.436   4.022
  116   1HD   PRO  18          1HD       PRO  18 -44.261   2.602   5.771
  117   2HD   PRO  18          2HD       PRO  18 -45.858   2.215   5.161
  118    H    TYR  19           H        TYR  19 -44.810  -1.111   9.615
  119    HA   TYR  19           HA       TYR  19 -42.840   0.186  10.879
  120   1HB   TYR  19          1HB       TYR  19 -43.419  -2.833  10.668
  121   2HB   TYR  19          2HB       TYR  19 -42.464  -2.140  11.963
  122    HD1  TYR  19           HD1      TYR  19 -45.839  -2.597  10.620
  123    HD2  TYR  19           HD2      TYR  19 -43.524  -0.750  13.708
  124    HE1  TYR  19           HE1      TYR  19 -47.953  -2.191  11.972
  125    HE2  TYR  19           HE2      TYR  19 -45.647  -0.349  15.049
  126    HH   TYR  19           HH       TYR  19 -48.776  -0.855  13.664
  127    H    GLY  20           H        GLY  20 -40.955   0.887   9.926
  128   1HA   GLY  20          1HA       GLY  20 -38.977  -1.136   9.310
  129   2HA   GLY  20          2HA       GLY  20 -39.491  -0.176   7.937
  130    H    TYR  21           H        TYR  21 -38.608   1.849   7.619
  131    HA   TYR  21           HA       TYR  21 -36.337   2.679   8.729
  132   1HB   TYR  21          1HB       TYR  21 -38.663   3.780   7.298
  133   2HB   TYR  21          2HB       TYR  21 -38.039   5.001   8.389
  134    HD1  TYR  21           HD1      TYR  21 -37.086   2.748   5.582
  135    HD2  TYR  21           HD2      TYR  21 -36.066   6.216   7.870
  136    HE1  TYR  21           HE1      TYR  21 -35.270   3.333   3.900
  137    HE2  TYR  21           HE2      TYR  21 -34.254   6.789   6.182
  138    HH   TYR  21           HH       TYR  21 -33.194   4.575   3.855
  139    H    ALA  22           H        ALA  22 -39.593   3.041  10.163
  140    HA   ALA  22           HA       ALA  22 -38.907   4.919  12.117
  141   1HB   ALA  22          1HB       ALA  22 -40.966   2.751  12.533
  142   2HB   ALA  22          2HB       ALA  22 -41.035   4.473  12.979
  143   3HB   ALA  22          3HB       ALA  22 -41.210   3.986  11.275
  144    H    ALA  23           H        ALA  23 -39.270   1.306  12.386
  145    HA   ALA  23           HA       ALA  23 -37.990   1.315  14.940
  146   1HB   ALA  23          1HB       ALA  23 -38.439  -1.025  14.915
  147   2HB   ALA  23          2HB       ALA  23 -39.815  -0.270  14.076
  148   3HB   ALA  23          3HB       ALA  23 -38.530  -1.067  13.138
  149    H    GLN  24           H        GLN  24 -36.853   1.756  11.804
  150    HA   GLN  24           HA       GLN  24 -34.484   0.170  12.166
  151   1HB   GLN  24          1HB       GLN  24 -35.904   0.947   9.937
  152   2HB   GLN  24          2HB       GLN  24 -34.605   2.124   9.922
  153   1HG   GLN  24          1HG       GLN  24 -33.186   0.564   9.098
  154   2HG   GLN  24          2HG       GLN  24 -33.410  -0.413  10.536
  155   1HE2  GLN  24          1HE2      GLN  24 -33.334  -2.339   9.457
  156   2HE2  GLN  24          2HE2      GLN  24 -34.592  -2.921   8.418
  157    H    ALA  25           H        ALA  25 -35.573   3.043  13.418
  158    HA   ALA  25           HA       ALA  25 -33.475   4.824  12.937
  159   1HB   ALA  25          1HB       ALA  25 -34.350   5.663  15.303
  160   2HB   ALA  25          2HB       ALA  25 -35.361   5.817  13.847
  161   3HB   ALA  25          3HB       ALA  25 -35.645   4.482  14.991
  162    H    ARG  26           H        ARG  26 -33.658   1.866  14.768
  163    HA   ARG  26           HA       ARG  26 -31.672   2.558  16.638
  164   1HB   ARG  26          1HB       ARG  26 -33.488   0.449  16.296
  165   2HB   ARG  26          2HB       ARG  26 -31.944  -0.327  16.006
  166   1HG   ARG  26          1HG       ARG  26 -31.719  -0.465  18.263
  167   2HG   ARG  26          2HG       ARG  26 -31.419   1.262  18.249
  168   1HD   ARG  26          1HD       ARG  26 -34.261   0.948  18.095
  169   2HD   ARG  26          2HD       ARG  26 -33.712  -0.179  19.319
  170    HE   ARG  26           HE       ARG  26 -33.112   1.626  20.692
  171   1HH1  ARG  26          2HH2      ARG  26 -33.605   2.806  17.388
  172   2HH1  ARG  26          1HH2      ARG  26 -33.489   4.476  17.835
  173   1HH2  ARG  26          1HH       ARG  26 -33.109   5.053  20.129
  174    H    ALA  27           H        ALA  27 -31.742   1.331  13.320
  175    HA   ALA  27           HA       ALA  27 -29.104   0.254  13.352
  176   1HB   ALA  27          1HB       ALA  27 -31.360   0.564  11.499
  177   2HB   ALA  27          2HB       ALA  27 -29.785   0.810  10.709
  178   3HB   ALA  27          3HB       ALA  27 -30.117  -0.707  11.578
  179    H    ARG  28           H        ARG  28 -30.594   3.433  12.883
  180    HA   ARG  28           HA       ARG  28 -28.526   4.587  11.455
  181   1HB   ARG  28          1HB       ARG  28 -31.006   5.398  12.405
  182   2HB   ARG  28          2HB       ARG  28 -29.930   6.344  13.415
  183   1HG   ARG  28          1HG       ARG  28 -29.116   6.315  10.566
  184   2HG   ARG  28          2HG       ARG  28 -30.711   6.996  10.814
  185   1HD   ARG  28          1HD       ARG  28 -29.892   8.859  11.880
  186   2HD   ARG  28          2HD       ARG  28 -28.720   7.939  12.803
  187    HE   ARG  28           HE       ARG  28 -28.005   8.057   9.985
  188   1HH1  ARG  28          2HH2      ARG  28 -27.883   9.884  13.018
  189   2HH1  ARG  28          1HH2      ARG  28 -26.516  10.832  12.537
  190   1HH2  ARG  28          1HH       ARG  28 -25.543  10.476  10.375
  191    H    GLU  29           H        GLU  29 -29.024   3.925  14.926
  192    HA   GLU  29           HA       GLU  29 -26.857   5.603  15.707
  193   1HB   GLU  29          1HB       GLU  29 -27.340   4.827  17.965
  194   2HB   GLU  29          2HB       GLU  29 -28.853   5.194  17.160
  195   1HG   GLU  29          1HG       GLU  29 -29.544   3.000  17.154
  196   2HG   GLU  29          2HG       GLU  29 -27.943   2.386  16.791
  197    HE2  GLU  29           HE2      GLU  29 -27.182   1.200  18.727
  198    H    ARG  30           H        ARG  30 -27.326   2.305  14.620
  199    HA   ARG  30           HA       ARG  30 -24.848   1.455  15.794
  200   1HB   ARG  30          1HB       ARG  30 -27.175   0.161  14.441
  201   2HB   ARG  30          2HB       ARG  30 -25.632  -0.600  14.109
  202   1HG   ARG  30          1HG       ARG  30 -25.948   0.082  16.965
  203   2HG   ARG  30          2HG       ARG  30 -27.212  -0.991  16.397
  204   1HD   ARG  30          1HD       ARG  30 -25.457  -2.532  15.455
  205   2HD   ARG  30          2HD       ARG  30 -24.209  -1.470  16.075
  206    HE   ARG  30           HE       ARG  30 -24.686  -2.189  18.284
  207   1HH1  ARG  30          2HH2      ARG  30 -27.064  -3.509  16.013
  208   2HH1  ARG  30          1HH2      ARG  30 -27.709  -4.641  17.154
  209   1HH2  ARG  30          1HH       ARG  30 -26.797  -4.724  19.369
  210    H    GLU  31           H        GLU  31 -26.198   2.616  12.732
  211    HA   GLU  31           HA       GLU  31 -24.224   1.597  11.053
  212   1HB   GLU  31          1HB       GLU  31 -26.325   3.734  10.890
  213   2HB   GLU  31          2HB       GLU  31 -25.042   3.795   9.698
  214   1HG   GLU  31          1HG       GLU  31 -26.158   1.071  10.133
  215   2HG   GLU  31          2HG       GLU  31 -27.318   2.224   9.501
  216    HE2  GLU  31           HE2      GLU  31 -24.318   0.666   7.602
  217    H    ARG  32           H        ARG  32 -24.337   4.334  13.279
  218    HA   ARG  32           HA       ARG  32 -22.423   5.924  12.127
  219   1HB   ARG  32          1HB       ARG  32 -23.974   6.143  14.327
  220   2HB   ARG  32          2HB       ARG  32 -22.505   5.631  15.134
  221   1HG   ARG  32          1HG       ARG  32 -22.079   7.899  15.125
  222   2HG   ARG  32          2HG       ARG  32 -21.417   7.530  13.545
  223   1HD   ARG  32          1HD       ARG  32 -23.290   8.402  12.398
  224   2HD   ARG  32          2HD       ARG  32 -24.367   8.172  13.761
  225    HE   ARG  32           HE       ARG  32 -23.610  10.207  14.711
  226   1HH1  ARG  32          2HH2      ARG  32 -21.655   9.369  11.877
  227   2HH1  ARG  32          1HH2      ARG  32 -20.903  10.926  11.781
  228   1HH2  ARG  32          1HH       ARG  32 -21.484  12.611  13.383
  229    H    LEU  33           H        LEU  33 -22.184   2.905  13.984
  230    HA   LEU  33           HA       LEU  33 -19.319   3.224  14.319
  231   1HB   LEU  33          1HB       LEU  33 -21.356   1.969  15.763
  232   2HB   LEU  33          2HB       LEU  33 -20.430   0.653  15.068
  233    HG   LEU  33           HG       LEU  33 -18.704   2.701  16.233
  234   1HD1  LEU  33          1HD1      LEU  33 -21.025   1.745  17.806
  235   2HD1  LEU  33          2HD1      LEU  33 -19.441   1.673  18.614
  236   3HD1  LEU  33          3HD1      LEU  33 -20.043   3.220  17.974
  237   1HD2  LEU  33          1HD2      LEU  33 -17.392   0.927  16.475
  238   2HD2  LEU  33          2HD2      LEU  33 -18.602   0.095  17.481
  239   3HD2  LEU  33          3HD2      LEU  33 -18.666  -0.051  15.708
  240    H    ALA  34           H        ALA  34 -21.565   2.107  11.979
  241    HA   ALA  34           HA       ALA  34 -19.877   0.005  10.964
  242   1HB   ALA  34          1HB       ALA  34 -21.622  -0.231   9.289
  243   2HB   ALA  34          2HB       ALA  34 -22.386  -0.033  10.885
  244   3HB   ALA  34          3HB       ALA  34 -22.331   1.336   9.749
  245    H    HIS  35           H        HIS  35 -19.422   3.234  11.132
  246    HA   HIS  35           HA       HIS  35 -18.707   3.621   8.354
  247   1HB   HIS  35          1HB       HIS  35 -19.343   5.314  10.643
  248   2HB   HIS  35          2HB       HIS  35 -17.890   5.851   9.824
  249    HD1  HIS  35           HD1      HIS  35 -21.432   4.775   8.782
  250    HD2  HIS  35           HD2      HIS  35 -18.443   7.533   7.754
  251    HE1  HIS  35           HE1      HIS  35 -22.400   6.214   6.910
  252    H    SER  36           H        SER  36 -17.352   2.334  11.213
  253    HA   SER  36           HA       SER  36 -14.689   3.215  10.572
  254   1HB   SER  36          1HB       SER  36 -16.043   1.889  12.869
  255   2HB   SER  36          2HB       SER  36 -14.400   1.351  12.584
  256    HG   SER  36           HG       SER  36 -15.358   3.956  13.285
  257    H    ARG  37           H        ARG  37 -16.884   0.597   9.893
  258    HA   ARG  37           HA       ARG  37 -14.750  -1.249   9.370
  259   1HB   ARG  37          1HB       ARG  37 -17.367  -1.587  10.180
  260   2HB   ARG  37          2HB       ARG  37 -17.529  -1.890   8.461
  261   1HG   ARG  37          1HG       ARG  37 -15.293  -3.229  10.012
  262   2HG   ARG  37          2HG       ARG  37 -16.917  -3.880  10.102
  263   1HD   ARG  37          1HD       ARG  37 -16.936  -3.894   7.526
  264   2HD   ARG  37          2HD       ARG  37 -15.228  -3.508   7.586
  265    HE   ARG  37           HE       ARG  37 -15.326  -5.685   9.229
  266   1HH1  ARG  37          2HH2      ARG  37 -16.709  -5.141   6.013
  267   2HH1  ARG  37          1HH2      ARG  37 -16.625  -6.810   5.559
  268   1HH2  ARG  37          1HH       ARG  37 -15.743  -8.407   7.113
  269    H    ALA  38           H        ALA  38 -15.521   1.432   7.834
  270    HA   ALA  38           HA       ALA  38 -16.344   0.654   5.263
  271   1HB   ALA  38          1HB       ALA  38 -16.113   2.895   4.772
  272   2HB   ALA  38          2HB       ALA  38 -16.152   2.995   6.548
  273   3HB   ALA  38          3HB       ALA  38 -14.595   3.052   5.688
  274    H    ALA  39           H        ALA  39 -13.058   1.585   6.524
  275    HA   ALA  39           HA       ALA  39 -11.670   0.927   4.230
  276   1HB   ALA  39          1HB       ALA  39  -9.711   0.930   5.686
  277   2HB   ALA  39          2HB       ALA  39 -10.822   2.228   6.187
  278   3HB   ALA  39          3HB       ALA  39 -10.740   0.716   7.122
  279    H    ALA  40           H        ALA  40 -10.495  -0.951   3.569
  280    HA   ALA  40           HA       ALA  40 -11.778  -3.315   3.658
  281   1HB   ALA  40          1HB       ALA  40  -9.486  -2.356   2.530
  282   2HB   ALA  40          2HB       ALA  40  -8.812  -3.511   3.705
  283   3HB   ALA  40          3HB       ALA  40  -9.977  -4.066   2.479
  284    H    ALA  41           H        ALA  41  -8.947  -2.458   5.780
  285    HA   ALA  41           HA       ALA  41  -8.625  -2.933   7.946
  286   1HB   ALA  41          1HB       ALA  41 -11.023  -4.770   8.023
  287   2HB   ALA  41          2HB       ALA  41 -10.321  -3.781   9.326
  288   3HB   ALA  41          3HB       ALA  41 -11.240  -3.004   8.014
  289    H    ALA  42           H        ALA  42  -7.447  -4.248   5.702
  290    HA   ALA  42           HA       ALA  42  -7.227  -7.007   6.686
  291   1HB   ALA  42          1HB       ALA  42  -5.969  -6.756   4.170
  292   2HB   ALA  42          2HB       ALA  42  -7.536  -7.524   4.520
  293   3HB   ALA  42          3HB       ALA  42  -7.471  -5.809   4.049
  294    H    ALA  43           H        ALA  43  -5.290  -4.288   5.241
  295    HA   ALA  43           HA       ALA  43  -2.796  -5.268   5.745
  296   1HB   ALA  43          1HB       ALA  43  -3.588  -3.120   4.543
  297   2HB   ALA  43          2HB       ALA  43  -3.538  -2.357   6.150
  298   3HB   ALA  43          3HB       ALA  43  -2.055  -3.040   5.442
  299    H    VAL  44           H        VAL  44  -5.249  -4.205   8.019
  300    HA   VAL  44           HA       VAL  44  -3.275  -3.992  10.153
  301    HB   VAL  44           HB       VAL  44  -5.956  -2.972   9.598
  302   1HG1  VAL  44          1HG1      VAL  44  -5.350  -4.120  12.340
  303   2HG1  VAL  44          2HG1      VAL  44  -6.614  -2.906  12.030
  304   3HG1  VAL  44          3HG1      VAL  44  -6.717  -4.512  11.270
  305   1HG2  VAL  44          1HG2      VAL  44  -3.526  -2.173  11.174
  306   2HG2  VAL  44          2HG2      VAL  44  -4.348  -1.327   9.841
  307   3HG2  VAL  44          3HG2      VAL  44  -5.075  -1.345  11.465
  308    H    ALA  45           H        ALA  45  -5.814  -6.093   8.824
  309    HA   ALA  45           HA       ALA  45  -6.530  -7.663  10.871
  310   1HB   ALA  45          1HB       ALA  45  -6.772  -9.454   9.228
  311   2HB   ALA  45          2HB       ALA  45  -7.196  -7.899   8.475
  312   3HB   ALA  45          3HB       ALA  45  -5.618  -8.650   8.138
  313    H    ALA  46           H        ALA  46  -3.333  -7.595   9.237
  314    HA   ALA  46           HA       ALA  46  -2.403  -9.770  10.919
  315   1HB   ALA  46          1HB       ALA  46  -1.095  -8.129   8.714
  316   2HB   ALA  46          2HB       ALA  46  -0.322  -9.489   9.563
  317   3HB   ALA  46          3HB       ALA  46  -1.768  -9.769   8.564
  318    H    ALA  47           H        ALA  47  -0.874  -6.609  10.021
  319    HA   ALA  47           HA       ALA  47   0.321  -6.460  12.619
  320   1HB   ALA  47          1HB       ALA  47   1.777  -5.151  11.510
  321   2HB   ALA  47          2HB       ALA  47   0.844  -5.481  10.031
  322   3HB   ALA  47          3HB       ALA  47   0.482  -4.038  11.009
  323    H    THR  48           H        THR  48  -0.844  -5.859  14.376
  324    HA   THR  48           HA       THR  48  -3.313  -4.853  14.511
  325    HB   THR  48           HB       THR  48  -2.452  -3.783  16.713
  326    HG1  THR  48           HG1      THR  48  -0.113  -4.476  16.992
  327   1HG2  THR  48          1HG2      THR  48  -3.131  -6.158  16.761
  328   2HG2  THR  48          2HG2      THR  48  -1.593  -6.637  16.006
  329   3HG2  THR  48          3HG2      THR  48  -1.605  -5.974  17.658
  330    H    ALA  49           H        ALA  49  -0.780  -2.431  15.270
  331    HA   ALA  49           HA       ALA  49  -2.257  -0.247  14.687
  332   1HB   ALA  49          1HB       ALA  49   0.706  -0.506  14.062
  333   2HB   ALA  49          2HB       ALA  49  -0.176   0.945  14.596
  334   3HB   ALA  49          3HB       ALA  49   0.062  -0.416  15.719
  335    H    ALA  50           H        ALA  50  -2.778   1.006  12.877
  336    HA   ALA  50           HA       ALA  50  -2.642  -0.428  10.374
  337   1HB   ALA  50          1HB       ALA  50  -4.733   0.499  10.563
  338   2HB   ALA  50          2HB       ALA  50  -4.156   1.870  11.541
  339   3HB   ALA  50          3HB       ALA  50  -3.917   1.872   9.777
  340    H    VAL  51           H        VAL  51  -0.062   0.068  11.079
  341    HA   VAL  51           HA       VAL  51   0.635   2.291   9.293
  342    HB   VAL  51           HB       VAL  51   0.931   2.697  11.807
  343   1HG1  VAL  51          1HG1      VAL  51   2.489   1.573  13.030
  344   2HG1  VAL  51          2HG1      VAL  51   2.092   0.272  11.882
  345   3HG1  VAL  51          3HG1      VAL  51   3.541   1.274  11.626
  346   1HG2  VAL  51          1HG2      VAL  51   2.808   3.196   9.573
  347   2HG2  VAL  51          2HG2      VAL  51   2.016   4.335  10.689
  348   3HG2  VAL  51          3HG2      VAL  51   3.475   3.454  11.204
  349    H    GLU  52           H        GLU  52   0.251  -0.103   8.139
  350    HA   GLU  52           HA       GLU  52   2.054  -2.058   8.293
  351   1HB   GLU  52          1HB       GLU  52   0.190  -2.150   6.740
  352   2HB   GLU  52          2HB       GLU  52   0.817  -0.805   5.808
  353   1HG   GLU  52          1HG       GLU  52   2.917  -2.263   5.384
  354   2HG   GLU  52          2HG       GLU  52   2.000  -3.603   6.045
  355    HE2  GLU  52           HE2      GLU  52   2.044  -3.076   2.493
  356    H    GLY  53           H        GLY  53   4.133  -2.561   7.386
  357   1HA   GLY  53          1HA       GLY  53   5.954  -0.385   7.339
  358   2HA   GLY  53          2HA       GLY  53   6.293  -2.066   6.978
  359    H    THR  54           H        THR  54   5.968  -2.889   4.786
  360    HA   THR  54           HA       THR  54   6.510  -2.623   2.611
  361    HB   THR  54           HB       THR  54   3.888  -1.119   3.045
  362    HG1  THR  54           HG1      THR  54   4.316  -3.530   3.405
  363   1HG2  THR  54          1HG2      THR  54   3.748  -2.033   0.474
  364   2HG2  THR  54          2HG2      THR  54   4.220  -0.363   0.869
  365   3HG2  THR  54          3HG2      THR  54   5.470  -1.585   0.533
  366    H    GLY  55           H        GLY  55   8.514  -1.572   2.651
  367   1HA   GLY  55          1HA       GLY  55   8.818   1.208   2.965
  368   2HA   GLY  55          2HA       GLY  55   9.967   0.096   2.250
  369    H    GLY  56           H        GLY  56  10.593   1.415   0.496
  370   1HA   GLY  56          1HA       GLY  56   9.018   2.967  -1.114
  371   2HA   GLY  56          2HA       GLY  56  10.480   2.150  -1.629
  372    H    SER  57           H        SER  57   8.110   2.646  -3.267
  373    HA   SER  57           HA       SER  57   7.163  -0.093  -3.586
  374   1HB   SER  57          1HB       SER  57   5.871   2.579  -3.908
  375   2HB   SER  57          2HB       SER  57   5.454   1.394  -5.130
  376    HG   SER  57           HG       SER  57   4.666  -0.017  -3.532
  377    H    GLY  58           H        GLY  58   6.548  -0.544  -6.043
  378   1HA   GLY  58          1HA       GLY  58   8.945   0.039  -7.587
  379   2HA   GLY  58          2HA       GLY  58   7.685  -1.121  -7.958
  380    H    GLY  59           H        GLY  59   7.984  -0.080 -10.185
  381   1HA   GLY  59          1HA       GLY  59   6.049   2.122 -10.433
  382   2HA   GLY  59          2HA       GLY  59   7.636   2.285 -11.158
  383    H    GLY  60           H        GLY  60   5.856   2.487 -13.041
  384   1HA   GLY  60          1HA       GLY  60   5.639  -0.206 -14.248
  385   2HA   GLY  60          2HA       GLY  60   4.352   0.980 -14.342
  386    HA   PRO  61           HA       PRO  61   7.958   2.587 -16.984
  387   1HB   PRO  61          1HB       PRO  61  10.132   0.984 -17.406
  388   2HB   PRO  61          2HB       PRO  61  10.088   2.237 -16.181
  389   1HG   PRO  61          1HG       PRO  61   9.887  -0.693 -15.844
  390   2HG   PRO  61          2HG       PRO  61  10.269   0.527 -14.645
  391   1HD   PRO  61          1HD       PRO  61   7.766  -0.836 -14.970
  392   2HD   PRO  61          2HD       PRO  61   8.113   0.465 -13.848
  393    H    HIS  62           H        HIS  62   8.756   2.289 -19.285
  394    HA   HIS  62           HA       HIS  62   7.368  -0.022 -20.410
  395   1HB   HIS  62          1HB       HIS  62   6.255   1.252 -22.037
  396   2HB   HIS  62          2HB       HIS  62   5.975   2.087 -20.522
  397    HD1  HIS  62           HD1      HIS  62   6.195   3.163 -23.685
  398    HD2  HIS  62           HD2      HIS  62   8.737   3.917 -20.434
  399    HE1  HIS  62           HE1      HIS  62   7.420   5.335 -24.224
  400    H    HIS  63           H        HIS  63   8.088  -0.411 -22.756
  401    HA   HIS  63           HA       HIS  63  10.696  -0.932 -22.907
  402   1HB   HIS  63          1HB       HIS  63  10.258  -1.581 -25.012
  403   2HB   HIS  63          2HB       HIS  63   8.599  -1.225 -24.573
  404    HD1  HIS  63           HD1      HIS  63  10.334  -0.908 -27.438
  405    HD2  HIS  63           HD2      HIS  63   8.610   2.045 -25.007
  406    HE1  HIS  63           HE1      HIS  63   9.967   1.126 -28.934
  407    H    HIS  64           H        HIS  64  12.602   0.052 -23.832
  408    HA   HIS  64           HA       HIS  64  12.432   2.975 -23.767
  409   1HB   HIS  64          1HB       HIS  64  13.835   1.580 -22.045
  410   2HB   HIS  64          2HB       HIS  64  14.983   1.438 -23.361
  411    HD1  HIS  64           HD1      HIS  64  14.356   3.482 -20.530
  412    HD2  HIS  64           HD2      HIS  64  15.491   4.281 -24.488
  413    HE1  HIS  64           HE1      HIS  64  15.411   5.806 -20.516
  414    H    HIS  65           H        HIS  65  11.592   2.440 -26.097
  415    HA   HIS  65           HA       HIS  65  11.941   2.615 -28.256
  416   1HB   HIS  65          1HB       HIS  65  14.375   3.791 -27.107
  417   2HB   HIS  65          2HB       HIS  65  14.603   3.184 -28.735
  418    HD1  HIS  65           HD1      HIS  65  13.680   6.180 -27.055
  419    HD2  HIS  65           HD2      HIS  65  12.273   4.216 -30.484
  420    HE1  HIS  65           HE1      HIS  65  12.427   7.934 -28.420
  421    H    GLN  66           H        GLN  66  12.174   1.094 -29.870
  422    HA   GLN  66           HA       GLN  66  13.485  -1.322 -29.060
  423   1HB   GLN  66          1HB       GLN  66  12.338  -2.353 -30.915
  424   2HB   GLN  66          2HB       GLN  66  11.199  -1.267 -30.143
  425   1HG   GLN  66          1HG       GLN  66  12.675   0.222 -32.146
  426   2HG   GLN  66          2HG       GLN  66  12.078  -1.254 -32.879
  427   1HE2  GLN  66          1HE2      GLN  66  10.534  -0.337 -34.124
  428   2HE2  GLN  66          2HE2      GLN  66   9.097   0.420 -33.521
  429    H    THR  67           H        THR  67  14.542  -2.520 -31.215
  430    HA   THR  67           HA       THR  67  15.987  -0.900 -32.987
  431    HB   THR  67           HB       THR  67  17.004  -0.478 -30.529
  432    HG1  THR  67           HG1      THR  67  19.110  -0.379 -31.835
  433   1HG2  THR  67          1HG2      THR  67  18.475  -2.071 -29.747
  434   2HG2  THR  67          2HG2      THR  67  17.512  -3.208 -30.722
  435   3HG2  THR  67          3HG2      THR  67  19.005  -2.506 -31.390
  436    H    ARG  68           H        ARG  68  18.333  -2.538 -33.221
  437    HA   ARG  68           HA       ARG  68  17.275  -4.529 -34.777
  438   1HB   ARG  68          1HB       ARG  68  19.775  -3.451 -34.398
  439   2HB   ARG  68          2HB       ARG  68  20.001  -5.003 -33.617
  440   1HG   ARG  68          1HG       ARG  68  20.522  -5.630 -35.785
  441   2HG   ARG  68          2HG       ARG  68  18.794  -5.913 -35.842
  442   1HD   ARG  68          1HD       ARG  68  18.638  -4.419 -37.543
  443   2HD   ARG  68          2HD       ARG  68  19.124  -3.146 -36.441
  444    HE   ARG  68           HE       ARG  68  21.351  -4.746 -37.520
  445   1HH1  ARG  68          2HH2      ARG  68  19.354  -1.847 -37.922
  446   2HH1  ARG  68          1HH2      ARG  68  20.518  -1.031 -38.911
  447   1HH2  ARG  68          1HH       ARG  68  22.588  -2.122 -39.430
  448    H    GLY  69           H        GLY  69  17.848  -6.989 -34.480
  449   1HA   GLY  69          1HA       GLY  69  18.361  -8.667 -32.768
  450   2HA   GLY  69          2HA       GLY  69  17.357  -7.751 -31.662
  451    H    ALA  70           H        ALA  70  17.429 -10.122 -34.230
  452    HA   ALA  70           HA       ALA  70  14.831 -11.000 -33.660
  453   1HB   ALA  70          1HB       ALA  70  13.510 -10.097 -35.295
  454   2HB   ALA  70          2HB       ALA  70  14.669  -8.752 -35.166
  455   3HB   ALA  70          3HB       ALA  70  14.851  -9.965 -36.457
  456    H    TYR  71           H        TYR  71  15.435 -13.117 -33.696
  457    HA   TYR  71           HA       TYR  71  16.322 -14.190 -36.230
  458   1HB   TYR  71          1HB       TYR  71  18.376 -13.440 -34.862
  459   2HB   TYR  71          2HB       TYR  71  17.843 -14.490 -33.565
  460    HD1  TYR  71           HD1      TYR  71  18.257 -14.898 -37.282
  461    HD2  TYR  71           HD2      TYR  71  19.152 -16.387 -33.373
  462    HE1  TYR  71           HE1      TYR  71  19.553 -16.831 -38.307
  463    HE2  TYR  71           HE2      TYR  71  20.445 -18.314 -34.410
  464    HH   TYR  71           HH       TYR  71  20.806 -19.428 -36.294
  465    H    SER  72           H        SER  72  14.818 -15.763 -36.524
  466    HA   SER  72           HA       SER  72  13.601 -17.526 -36.181
  467   1HB   SER  72          1HB       SER  72  15.825 -18.450 -35.304
  468   2HB   SER  72          2HB       SER  72  15.244 -18.119 -33.685
  469    HG   SER  72           HG       SER  72  13.901 -19.814 -35.615
  470    H    SER  73           H        SER  73  11.619 -18.082 -35.123
  471    HA   SER  73           HA       SER  73  11.120 -17.208 -32.492
  472   1HB   SER  73          1HB       SER  73   9.320 -15.573 -33.029
  473   2HB   SER  73          2HB       SER  73  10.896 -15.015 -33.556
  474    HG   SER  73           HG       SER  73   9.578 -16.506 -35.516
  475    H    HIS  74           H        HIS  74   9.201 -18.207 -31.662
  476    HA   HIS  74           HA       HIS  74   7.548 -19.647 -31.572
  477   1HB   HIS  74          1HB       HIS  74   6.508 -18.124 -33.244
  478   2HB   HIS  74          2HB       HIS  74   7.152 -19.123 -34.531
  479    HD1  HIS  74           HD1      HIS  74   5.162 -19.939 -31.338
  480    HD2  HIS  74           HD2      HIS  74   5.157 -20.718 -35.460
  481    HE1  HIS  74           HE1      HIS  74   3.178 -21.484 -31.771
  482    H    ASP  75           H        ASP  75   8.331 -21.634 -31.053
  483    HA   ASP  75           HA       ASP  75   9.350 -23.553 -31.230
  484   1HB   ASP  75          1HB       ASP  75   7.673 -23.419 -33.746
  485   2HB   ASP  75          2HB       ASP  75   8.705 -24.813 -33.495
  486    HD2  ASP  75           HD2      ASP  75   7.731 -24.531 -30.352
  Start of MODEL    4
    1    H    MET   1           H        MET   1 -29.119  18.613 -18.938
    2    HA   MET   1           HA       MET   1 -26.537  17.319 -19.092
    3   1HB   MET   1          1HB       MET   1 -27.749  18.988 -17.211
    4   2HB   MET   1          2HB       MET   1 -28.016  17.412 -16.494
    5   1HG   MET   1          1HG       MET   1 -25.885  17.498 -15.707
    6   2HG   MET   1          2HG       MET   1 -25.331  17.310 -17.359
    7   1HE   MET   1          1HE       MET   1 -26.842  21.011 -15.568
    8   2HE   MET   1          2HE       MET   1 -26.677  19.438 -14.751
    9   3HE   MET   1          3HE       MET   1 -25.417  20.679 -14.554
   10    H    GLU   2           H        GLU   2 -26.207  15.110 -18.781
   11    HA   GLU   2           HA       GLU   2 -28.663  13.563 -18.646
   12   1HB   GLU   2          1HB       GLU   2 -26.619  13.414 -20.457
   13   2HB   GLU   2          2HB       GLU   2 -26.075  12.219 -19.297
   14   1HG   GLU   2          1HG       GLU   2 -28.974  12.080 -20.032
   15   2HG   GLU   2          2HG       GLU   2 -27.850  11.682 -21.315
   16    HE2  GLU   2           HE2      GLU   2 -29.577  10.104 -19.233
   17    H    VAL   3           H        VAL   3 -28.836  13.873 -16.287
   18    HA   VAL   3           HA       VAL   3 -27.037  12.033 -14.883
   19    HB   VAL   3           HB       VAL   3 -27.979  14.737 -13.906
   20   1HG1  VAL   3          1HG1      VAL   3 -27.898  13.341 -12.005
   21   2HG1  VAL   3          2HG1      VAL   3 -26.431  12.508 -12.571
   22   3HG1  VAL   3          3HG1      VAL   3 -26.337  14.196 -12.013
   23   1HG2  VAL   3          1HG2      VAL   3 -26.166  15.571 -14.901
   24   2HG2  VAL   3          2HG2      VAL   3 -25.159  14.543 -13.854
   25   3HG2  VAL   3          3HG2      VAL   3 -25.674  13.952 -15.452
   26    H    ALA   4           H        ALA   4 -28.047  11.246 -12.783
   27    HA   ALA   4           HA       ALA   4 -30.822  10.631 -13.342
   28   1HB   ALA   4          1HB       ALA   4 -28.996   9.651 -11.113
   29   2HB   ALA   4          2HB       ALA   4 -30.530   8.923 -11.647
   30   3HB   ALA   4          3HB       ALA   4 -29.110   8.894 -12.720
   31    H    MET   5           H        MET   5 -32.564  11.451 -12.240
   32    HA   MET   5           HA       MET   5 -32.388  13.799 -10.927
   33   1HB   MET   5          1HB       MET   5 -34.388  11.933 -11.626
   34   2HB   MET   5          2HB       MET   5 -34.545  12.041  -9.884
   35   1HG   MET   5          1HG       MET   5 -34.378  14.545 -11.611
   36   2HG   MET   5          2HG       MET   5 -35.905  13.733 -11.331
   37   1HE   MET   5          1HE       MET   5 -35.754  16.971  -9.150
   38   2HE   MET   5          2HE       MET   5 -35.852  16.370 -10.823
   39   3HE   MET   5          3HE       MET   5 -37.087  15.893  -9.633
   40    H    VAL   6           H        VAL   6 -32.348  14.508  -8.734
   41    HA   VAL   6           HA       VAL   6 -31.169  12.540  -6.936
   42    HB   VAL   6           HB       VAL   6 -31.444  15.478  -6.394
   43   1HG1  VAL   6          1HG1      VAL   6 -30.157  14.979  -4.644
   44   2HG1  VAL   6          2HG1      VAL   6 -30.183  13.265  -5.122
   45   3HG1  VAL   6          3HG1      VAL   6 -28.899  14.338  -5.728
   46   1HG2  VAL   6          1HG2      VAL   6 -29.034  15.512  -7.492
   47   2HG2  VAL   6          2HG2      VAL   6 -29.698  14.165  -8.447
   48   3HG2  VAL   6          3HG2      VAL   6 -30.499  15.755  -8.474
   49    H    SER   7           H        SER   7 -31.908  12.457  -4.656
   50    HA   SER   7           HA       SER   7 -34.212  13.677  -3.802
   51   1HB   SER   7          1HB       SER   7 -35.869  11.835  -3.935
   52   2HB   SER   7          2HB       SER   7 -35.404  12.400  -5.527
   53    HG   SER   7           HG       SER   7 -33.660  10.472  -4.995
   54    H    ALA   8           H        ALA   8 -35.102  12.489  -1.745
   55    HA   ALA   8           HA       ALA   8 -32.800  11.525  -0.307
   56   1HB   ALA   8          1HB       ALA   8 -34.593  13.212   0.489
   57   2HB   ALA   8          2HB       ALA   8 -35.634  11.789   0.731
   58   3HB   ALA   8          3HB       ALA   8 -34.102  11.933   1.625
   59    H    GLU   9           H        GLU   9 -32.807   9.604  -1.972
   60    HA   GLU   9           HA       GLU   9 -33.068   7.482  -2.345
   61   1HB   GLU   9          1HB       GLU   9 -32.272   7.022  -0.148
   62   2HB   GLU   9          2HB       GLU   9 -33.764   7.550   0.606
   63   1HG   GLU   9          1HG       GLU   9 -33.751   5.130   0.675
   64   2HG   GLU   9          2HG       GLU   9 -34.954   5.604  -0.507
   65    HE2  GLU   9           HE2      GLU   9 -31.613   3.699  -1.399
   66    H    SER  10           H        SER  10 -34.649   5.771  -2.881
   67    HA   SER  10           HA       SER  10 -36.565   5.121  -3.665
   68   1HB   SER  10          1HB       SER  10 -38.399   5.004  -2.186
   69   2HB   SER  10          2HB       SER  10 -37.026   5.160  -1.108
   70    HG   SER  10           HG       SER  10 -37.478   7.524  -1.091
   71    H    SER  11           H        SER  11 -38.873   5.904  -4.481
   72    HA   SER  11           HA       SER  11 -38.428   8.571  -5.544
   73   1HB   SER  11          1HB       SER  11 -40.034   7.909  -7.319
   74   2HB   SER  11          2HB       SER  11 -38.680   6.802  -7.226
   75    HG   SER  11           HG       SER  11 -41.183   6.091  -7.213
   76    H    GLY  12           H        GLY  12 -39.203   9.624  -3.550
   77   1HA   GLY  12          1HA       GLY  12 -40.809  10.756  -2.446
   78   2HA   GLY  12          2HA       GLY  12 -41.981  10.203  -3.626
   79    H    CYS  13           H        CYS  13 -43.140   8.203  -3.294
   80    HA   CYS  13           HA       CYS  13 -42.623   6.427  -1.252
   81   1HB   CYS  13          1HB       CYS  13 -44.339   7.022   0.426
   82   2HB   CYS  13          2HB       CYS  13 -43.035   8.191   0.354
   83    HG   CYS  13           HG       CYS  13 -44.663   9.358  -1.795
   84    H    ASN  14           H        ASN  14 -43.231   5.901  -3.770
   85    HA   ASN  14           HA       ASN  14 -46.112   5.659  -3.963
   86   1HB   ASN  14          1HB       ASN  14 -43.911   6.017  -5.862
   87   2HB   ASN  14          2HB       ASN  14 -44.842   4.598  -6.300
   88   1HD2  ASN  14          1HD2      ASN  14 -46.547   4.888  -7.510
   89   2HD2  ASN  14          2HD2      ASN  14 -47.463   6.345  -7.705
   90    H    SER  15           H        SER  15 -44.248   4.011  -2.178
   91    HA   SER  15           HA       SER  15 -45.417   1.566  -2.526
   92   1HB   SER  15          1HB       SER  15 -43.463   0.184  -3.303
   93   2HB   SER  15          2HB       SER  15 -44.123   1.228  -4.547
   94    HG   SER  15           HG       SER  15 -41.952   1.599  -4.700
   95    H    HIS  16           H        HIS  16 -45.575   1.974  -0.232
   96    HA   HIS  16           HA       HIS  16 -43.503   0.835   1.264
   97   1HB   HIS  16          1HB       HIS  16 -42.384   2.977   0.851
   98   2HB   HIS  16          2HB       HIS  16 -43.760   3.846   1.502
   99    HD1  HIS  16           HD1      HIS  16 -42.979   4.801   3.678
  100    HD2  HIS  16           HD2      HIS  16 -41.800   0.805   3.191
  101    HE1  HIS  16           HE1      HIS  16 -41.846   4.119   5.860
  102    H    MET  17           H        MET  17 -45.995  -0.022   1.130
  103    HA   MET  17           HA       MET  17 -47.738   1.328   2.897
  104   1HB   MET  17          1HB       MET  17 -47.834  -0.815   0.991
  105   2HB   MET  17          2HB       MET  17 -48.339  -1.520   2.513
  106   1HG   MET  17          1HG       MET  17 -49.990   0.402   2.783
  107   2HG   MET  17          2HG       MET  17 -49.549   0.949   1.178
  108   1HE   MET  17          1HE       MET  17 -52.126  -0.649  -0.800
  109   2HE   MET  17          2HE       MET  17 -52.358   0.557   0.488
  110   3HE   MET  17          3HE       MET  17 -50.905   0.619  -0.537
  111    HA   PRO  18           HA       PRO  18 -46.391  -2.178   5.798
  112   1HB   PRO  18          1HB       PRO  18 -44.268  -3.764   5.133
  113   2HB   PRO  18          2HB       PRO  18 -45.934  -4.218   4.833
  114   1HG   PRO  18          1HG       PRO  18 -43.894  -3.276   2.912
  115   2HG   PRO  18          2HG       PRO  18 -45.394  -4.124   2.592
  116   1HD   PRO  18          1HD       PRO  18 -44.890  -1.325   2.216
  117   2HD   PRO  18          2HD       PRO  18 -46.422  -2.152   2.008
  118    H    TYR  19           H        TYR  19 -44.632  -2.585   7.473
  119    HA   TYR  19           HA       TYR  19 -43.503  -0.133   8.073
  120   1HB   TYR  19          1HB       TYR  19 -43.029  -3.074   8.774
  121   2HB   TYR  19          2HB       TYR  19 -41.985  -1.858   9.482
  122    HD1  TYR  19           HD1      TYR  19 -43.531   0.294  10.376
  123    HD2  TYR  19           HD2      TYR  19 -44.692  -3.820  10.195
  124    HE1  TYR  19           HE1      TYR  19 -45.248   0.690  12.209
  125    HE2  TYR  19           HE2      TYR  19 -46.404  -3.410  12.028
  126    HH   TYR  19           HH       TYR  19 -46.384  -0.633  13.924
  127    H    GLY  20           H        GLY  20 -41.171   0.441   8.282
  128   1HA   GLY  20          1HA       GLY  20 -39.306  -0.960   6.567
  129   2HA   GLY  20          2HA       GLY  20 -39.817   0.604   5.964
  130    H    TYR  21           H        TYR  21 -38.852   2.455   6.756
  131    HA   TYR  21           HA       TYR  21 -36.736   2.072   8.680
  132   1HB   TYR  21          1HB       TYR  21 -37.897   4.413   7.048
  133   2HB   TYR  21          2HB       TYR  21 -36.472   4.585   8.053
  134    HD1  TYR  21           HD1      TYR  21 -34.322   3.806   7.318
  135    HD2  TYR  21           HD2      TYR  21 -37.825   2.942   5.020
  136    HE1  TYR  21           HE1      TYR  21 -32.869   3.040   5.377
  137    HE2  TYR  21           HE2      TYR  21 -36.361   2.179   3.087
  138    HH   TYR  21           HH       TYR  21 -32.823   2.382   3.317
  139    H    ALA  22           H        ALA  22 -39.162   1.536   9.952
  140    HA   ALA  22           HA       ALA  22 -39.970   3.985  11.282
  141   1HB   ALA  22          1HB       ALA  22 -40.944   1.220  11.985
  142   2HB   ALA  22          2HB       ALA  22 -41.824   2.768  11.999
  143   3HB   ALA  22          3HB       ALA  22 -41.453   1.968  10.452
  144    H    ALA  23           H        ALA  23 -39.121   0.661  12.485
  145    HA   ALA  23           HA       ALA  23 -37.989   1.907  14.851
  146   1HB   ALA  23          1HB       ALA  23 -39.497   0.059  15.212
  147   2HB   ALA  23          2HB       ALA  23 -38.611  -0.962  14.054
  148   3HB   ALA  23          3HB       ALA  23 -37.854  -0.505  15.599
  149    H    GLN  24           H        GLN  24 -36.821   1.858  11.934
  150    HA   GLN  24           HA       GLN  24 -34.444   0.321  12.351
  151   1HB   GLN  24          1HB       GLN  24 -35.800   0.924  10.108
  152   2HB   GLN  24          2HB       GLN  24 -34.711   2.297  10.097
  153   1HG   GLN  24          1HG       GLN  24 -33.657   0.514   8.828
  154   2HG   GLN  24          2HG       GLN  24 -32.760   0.703  10.322
  155   1HE2  GLN  24          1HE2      GLN  24 -34.766  -1.319   8.400
  156   2HE2  GLN  24          2HE2      GLN  24 -34.746  -2.741   9.388
  157    H    ALA  25           H        ALA  25 -35.534   3.210  13.572
  158    HA   ALA  25           HA       ALA  25 -33.436   4.986  13.097
  159   1HB   ALA  25          1HB       ALA  25 -35.773   5.363  14.129
  160   2HB   ALA  25          2HB       ALA  25 -35.047   4.819  15.660
  161   3HB   ALA  25          3HB       ALA  25 -34.412   6.264  14.838
  162    H    ARG  26           H        ARG  26 -33.624   2.037  14.952
  163    HA   ARG  26           HA       ARG  26 -31.652   2.721  16.825
  164   1HB   ARG  26          1HB       ARG  26 -33.421   0.570  16.396
  165   2HB   ARG  26          2HB       ARG  26 -31.841  -0.156  16.174
  166   1HG   ARG  26          1HG       ARG  26 -31.228   0.150  18.384
  167   2HG   ARG  26          2HG       ARG  26 -32.080   1.675  18.526
  168   1HD   ARG  26          1HD       ARG  26 -34.206  -0.047  18.193
  169   2HD   ARG  26          2HD       ARG  26 -33.071  -1.102  19.013
  170    HE   ARG  26           HE       ARG  26 -34.522   1.065  20.214
  171   1HH1  ARG  26          2HH2      ARG  26 -31.311  -0.431  20.279
  172   2HH1  ARG  26          1HH2      ARG  26 -30.976   0.067  21.904
  173   1HH2  ARG  26          1HH       ARG  26 -32.618   1.331  23.107
  174    H    ALA  27           H        ALA  27 -31.680   1.435  13.509
  175    HA   ALA  27           HA       ALA  27 -29.033   0.426  13.541
  176   1HB   ALA  27          1HB       ALA  27 -30.861  -0.255  11.964
  177   2HB   ALA  27          2HB       ALA  27 -30.742   1.346  11.196
  178   3HB   ALA  27          3HB       ALA  27 -29.359   0.227  11.139
  179    H    ARG  28           H        ARG  28 -30.539   3.607  13.045
  180    HA   ARG  28           HA       ARG  28 -28.444   4.793  11.704
  181   1HB   ARG  28          1HB       ARG  28 -30.939   5.587  12.538
  182   2HB   ARG  28          2HB       ARG  28 -29.951   6.461  13.691
  183   1HG   ARG  28          1HG       ARG  28 -28.543   7.121  11.513
  184   2HG   ARG  28          2HG       ARG  28 -30.034   6.726  10.681
  185   1HD   ARG  28          1HD       ARG  28 -31.173   8.280  12.494
  186   2HD   ARG  28          2HD       ARG  28 -29.552   8.890  12.754
  187    HE   ARG  28           HE       ARG  28 -30.340   8.808   9.926
  188   1HH1  ARG  28          2HH2      ARG  28 -30.331  10.755  12.887
  189   2HH1  ARG  28          1HH2      ARG  28 -30.489  12.261  12.045
  190   1HH2  ARG  28          1HH       ARG  28 -30.616  12.260   9.652
  191    H    GLU  29           H        GLU  29 -28.966   4.001  15.131
  192    HA   GLU  29           HA       GLU  29 -26.866   5.714  16.015
  193   1HB   GLU  29          1HB       GLU  29 -28.537   3.576  17.397
  194   2HB   GLU  29          2HB       GLU  29 -27.279   4.473  18.225
  195   1HG   GLU  29          1HG       GLU  29 -28.593   6.578  17.157
  196   2HG   GLU  29          2HG       GLU  29 -29.929   5.445  17.173
  197    HE2  GLU  29           HE2      GLU  29 -28.354   6.693  20.649
  198    H    ARG  30           H        ARG  30 -27.228   2.429  14.821
  199    HA   ARG  30           HA       ARG  30 -24.720   1.634  15.966
  200   1HB   ARG  30          1HB       ARG  30 -27.003   0.299  14.579
  201   2HB   ARG  30          2HB       ARG  30 -25.435  -0.399  14.225
  202   1HG   ARG  30          1HG       ARG  30 -25.040  -0.379  16.804
  203   2HG   ARG  30          2HG       ARG  30 -26.761  -0.076  16.946
  204   1HD   ARG  30          1HD       ARG  30 -26.551  -2.221  15.094
  205   2HD   ARG  30          2HD       ARG  30 -25.374  -2.586  16.340
  206    HE   ARG  30           HE       ARG  30 -28.290  -2.509  16.657
  207   1HH1  ARG  30          2HH2      ARG  30 -25.184  -2.364  18.357
  208   2HH1  ARG  30          1HH2      ARG  30 -25.852  -2.861  19.876
  209   1HH2  ARG  30          1HH       ARG  30 -28.198  -3.325  20.031
  210    H    GLU  31           H        GLU  31 -26.114   2.832  12.938
  211    HA   GLU  31           HA       GLU  31 -24.234   1.915  11.161
  212   1HB   GLU  31          1HB       GLU  31 -26.159   4.212  11.261
  213   2HB   GLU  31          2HB       GLU  31 -24.900   4.298  10.044
  214   1HG   GLU  31          1HG       GLU  31 -25.844   1.623   9.928
  215   2HG   GLU  31          2HG       GLU  31 -27.286   2.600  10.117
  216    HE2  GLU  31           HE2      GLU  31 -25.141   1.513   7.874
  217    H    ARG  32           H        ARG  32 -24.041   4.410  13.642
  218    HA   ARG  32           HA       ARG  32 -22.044   5.957  12.573
  219   1HB   ARG  32          1HB       ARG  32 -23.492   6.090  14.837
  220   2HB   ARG  32          2HB       ARG  32 -22.068   5.347  15.537
  221   1HG   ARG  32          1HG       ARG  32 -21.538   7.613  15.773
  222   2HG   ARG  32          2HG       ARG  32 -20.753   7.251  14.248
  223   1HD   ARG  32          1HD       ARG  32 -22.501   8.278  12.965
  224   2HD   ARG  32          2HD       ARG  32 -23.624   8.255  14.310
  225    HE   ARG  32           HE       ARG  32 -21.464  10.207  13.859
  226   1HH1  ARG  32          2HH2      ARG  32 -23.775   8.877  16.192
  227   2HH1  ARG  32          1HH2      ARG  32 -23.726  10.269  17.221
  228   1HH2  ARG  32          1HH       ARG  32 -22.322  12.119  16.628
  229    H    LEU  33           H        LEU  33 -21.992   2.748  14.091
  230    HA   LEU  33           HA       LEU  33 -19.101   2.804  14.341
  231   1HB   LEU  33          1HB       LEU  33 -21.186   1.562  15.725
  232   2HB   LEU  33          2HB       LEU  33 -20.394   0.262  14.858
  233    HG   LEU  33           HG       LEU  33 -18.882   2.229  16.589
  234   1HD1  LEU  33          1HD1      LEU  33 -19.433  -0.507  17.608
  235   2HD1  LEU  33          2HD1      LEU  33 -19.250   1.035  18.478
  236   3HD1  LEU  33          3HD1      LEU  33 -20.779   0.657  17.647
  237   1HD2  LEU  33          1HD2      LEU  33 -17.765   0.760  14.757
  238   2HD2  LEU  33          2HD2      LEU  33 -17.042   0.844  16.381
  239   3HD2  LEU  33          3HD2      LEU  33 -18.020  -0.569  15.914
  240    H    ALA  34           H        ALA  34 -21.504   2.129  11.989
  241    HA   ALA  34           HA       ALA  34 -20.029   0.025  10.689
  242   1HB   ALA  34          1HB       ALA  34 -22.299   1.627   9.494
  243   2HB   ALA  34          2HB       ALA  34 -21.871  -0.080   9.232
  244   3HB   ALA  34          3HB       ALA  34 -22.604   0.427  10.773
  245    H    HIS  35           H        HIS  35 -19.303   3.171  11.181
  246    HA   HIS  35           HA       HIS  35 -18.647   3.802   8.432
  247   1HB   HIS  35          1HB       HIS  35 -19.498   5.340  10.511
  248   2HB   HIS  35          2HB       HIS  35 -17.767   5.585  10.628
  249    HD1  HIS  35           HD1      HIS  35 -18.641   8.126   9.942
  250    HD2  HIS  35           HD2      HIS  35 -18.674   5.185   6.950
  251    HE1  HIS  35           HE1      HIS  35 -18.755   9.370   7.717
  252    H    SER  36           H        SER  36 -17.313   2.107  11.081
  253    HA   SER  36           HA       SER  36 -14.609   2.840  10.431
  254   1HB   SER  36          1HB       SER  36 -15.732   0.845  12.448
  255   2HB   SER  36          2HB       SER  36 -14.033   1.240  12.286
  256    HG   SER  36           HG       SER  36 -16.021   3.278  12.761
  257    H    ARG  37           H        ARG  37 -17.032   0.494   9.565
  258    HA   ARG  37           HA       ARG  37 -15.075  -1.446   8.762
  259   1HB   ARG  37          1HB       ARG  37 -17.684  -1.665   9.637
  260   2HB   ARG  37          2HB       ARG  37 -17.926  -1.762   7.904
  261   1HG   ARG  37          1HG       ARG  37 -15.640  -3.405   8.677
  262   2HG   ARG  37          2HG       ARG  37 -17.034  -3.834   9.647
  263   1HD   ARG  37          1HD       ARG  37 -18.242  -3.672   7.203
  264   2HD   ARG  37          2HD       ARG  37 -16.625  -4.102   6.685
  265    HE   ARG  37           HE       ARG  37 -17.073  -5.905   8.712
  266   1HH1  ARG  37          2HH2      ARG  37 -18.981  -4.997   5.869
  267   2HH1  ARG  37          1HH2      ARG  37 -19.724  -6.554   5.716
  268   1HH2  ARG  37          1HH       ARG  37 -19.163  -8.281   7.281
  269    H    ALA  38           H        ALA  38 -15.671   1.439   7.553
  270    HA   ALA  38           HA       ALA  38 -16.642   1.026   4.954
  271   1HB   ALA  38          1HB       ALA  38 -16.715   3.243   5.593
  272   2HB   ALA  38          2HB       ALA  38 -15.159   3.160   6.452
  273   3HB   ALA  38          3HB       ALA  38 -15.191   3.254   4.675
  274    H    ALA  39           H        ALA  39 -13.236   1.564   6.125
  275    HA   ALA  39           HA       ALA  39 -12.225   0.589   3.614
  276   1HB   ALA  39          1HB       ALA  39 -10.017   1.043   4.753
  277   2HB   ALA  39          2HB       ALA  39 -11.105   2.450   4.677
  278   3HB   ALA  39          3HB       ALA  39 -10.930   1.542   6.197
  279    H    ALA  40           H        ALA  40 -13.515  -1.528   4.027
  280    HA   ALA  40           HA       ALA  40 -12.226  -3.282   5.938
  281   1HB   ALA  40          1HB       ALA  40 -14.092  -4.656   4.273
  282   2HB   ALA  40          2HB       ALA  40 -14.298  -4.145   5.965
  283   3HB   ALA  40          3HB       ALA  40 -14.789  -3.060   4.643
  284    H    ALA  41           H        ALA  41 -12.992  -3.381   2.379
  285    HA   ALA  41           HA       ALA  41 -11.824  -4.148   0.660
  286   1HB   ALA  41          1HB       ALA  41  -9.677  -3.478   0.667
  287   2HB   ALA  41          2HB       ALA  41  -9.870  -3.092   2.393
  288   3HB   ALA  41          3HB       ALA  41  -9.246  -4.685   1.902
  289    H    ALA  42           H        ALA  42 -13.460  -5.954   1.565
  290    HA   ALA  42           HA       ALA  42 -11.894  -8.346   2.212
  291   1HB   ALA  42          1HB       ALA  42 -14.882  -7.785   2.404
  292   2HB   ALA  42          2HB       ALA  42 -14.064  -9.276   2.927
  293   3HB   ALA  42          3HB       ALA  42 -13.726  -7.739   3.757
  294    H    ALA  43           H        ALA  43 -15.024  -7.834   0.461
  295    HA   ALA  43           HA       ALA  43 -14.719  -9.921  -1.278
  296   1HB   ALA  43          1HB       ALA  43 -16.058  -7.286  -1.977
  297   2HB   ALA  43          2HB       ALA  43 -16.514  -8.926  -2.497
  298   3HB   ALA  43          3HB       ALA  43 -16.748  -8.433  -0.803
  299    H    VAL  44           H        VAL  44 -13.042  -6.846  -1.194
  300    HA   VAL  44           HA       VAL  44 -12.192  -7.124  -3.962
  301    HB   VAL  44           HB       VAL  44 -12.386  -5.000  -1.964
  302   1HG1  VAL  44          1HG1      VAL  44 -10.441  -3.711  -2.986
  303   2HG1  VAL  44          2HG1      VAL  44 -10.015  -5.016  -1.852
  304   3HG1  VAL  44          3HG1      VAL  44  -9.857  -5.274  -3.607
  305   1HG2  VAL  44          1HG2      VAL  44 -12.485  -3.614  -4.072
  306   2HG2  VAL  44          2HG2      VAL  44 -12.280  -5.124  -4.992
  307   3HG2  VAL  44          3HG2      VAL  44 -13.709  -4.901  -3.954
  308    H    ALA  45           H        ALA  45 -11.105  -7.628  -0.617
  309    HA   ALA  45           HA       ALA  45  -8.402  -7.646  -0.877
  310   1HB   ALA  45          1HB       ALA  45 -10.362  -8.575   0.949
  311   2HB   ALA  45          2HB       ALA  45  -9.271  -9.949   0.650
  312   3HB   ALA  45          3HB       ALA  45  -8.613  -8.400   1.229
  313    H    ALA  46           H        ALA  46 -10.542 -10.558  -1.331
  314    HA   ALA  46           HA       ALA  46  -8.550 -12.195  -2.334
  315   1HB   ALA  46          1HB       ALA  46 -11.157 -12.719  -3.522
  316   2HB   ALA  46          2HB       ALA  46 -10.261 -13.656  -2.303
  317   3HB   ALA  46          3HB       ALA  46 -11.311 -12.312  -1.796
  318    H    ALA  47           H        ALA  47 -11.046 -10.272  -4.155
  319    HA   ALA  47           HA       ALA  47  -9.983 -10.852  -6.672
  320   1HB   ALA  47          1HB       ALA  47 -11.359  -8.854  -7.355
  321   2HB   ALA  47          2HB       ALA  47 -12.251 -10.053  -6.388
  322   3HB   ALA  47          3HB       ALA  47 -11.676  -8.548  -5.630
  323    H    THR  48           H        THR  48  -9.526  -8.466  -8.005
  324    HA   THR  48           HA       THR  48  -7.898  -7.042  -8.516
  325    HB   THR  48           HB       THR  48  -7.938  -6.733  -5.473
  326    HG1  THR  48           HG1      THR  48  -8.957  -5.388  -7.871
  327   1HG2  THR  48          1HG2      THR  48  -6.316  -5.345  -7.611
  328   2HG2  THR  48          2HG2      THR  48  -7.060  -4.336  -6.348
  329   3HG2  THR  48          3HG2      THR  48  -5.916  -5.623  -5.899
  330    H    ALA  49           H        ALA  49  -6.672  -8.776  -9.454
  331    HA   ALA  49           HA       ALA  49  -4.938 -10.424  -8.157
  332   1HB   ALA  49          1HB       ALA  49  -4.637 -11.006 -10.303
  333   2HB   ALA  49          2HB       ALA  49  -5.452  -9.514 -10.829
  334   3HB   ALA  49          3HB       ALA  49  -3.691  -9.523 -10.573
  335    H    ALA  50           H        ALA  50  -2.925 -10.274  -7.202
  336    HA   ALA  50           HA       ALA  50  -2.015  -7.590  -6.647
  337   1HB   ALA  50          1HB       ALA  50  -2.223  -9.409  -4.914
  338   2HB   ALA  50          2HB       ALA  50  -0.898 -10.270  -5.735
  339   3HB   ALA  50          3HB       ALA  50  -0.604  -8.673  -5.005
  340    H    VAL  51           H        VAL  51  -1.795  -7.899  -9.340
  341    HA   VAL  51           HA       VAL  51   1.072  -7.864  -9.665
  342    HB   VAL  51           HB       VAL  51  -0.681  -9.770 -11.229
  343   1HG1  VAL  51          1HG1      VAL  51   2.236  -8.999 -11.520
  344   2HG1  VAL  51          2HG1      VAL  51   1.542 -10.480 -12.224
  345   3HG1  VAL  51          3HG1      VAL  51   0.940  -8.884 -12.735
  346   1HG2  VAL  51          1HG2      VAL  51   1.492 -10.249  -9.167
  347   2HG2  VAL  51          2HG2      VAL  51  -0.225 -10.709  -9.067
  348   3HG2  VAL  51          3HG2      VAL  51   0.844 -11.510 -10.243
  349    H    GLU  52           H        GLU  52  -0.043  -5.581  -9.680
  350    HA   GLU  52           HA       GLU  52  -1.657  -4.817 -11.743
  351   1HB   GLU  52          1HB       GLU  52  -0.596  -3.557  -9.608
  352   2HB   GLU  52          2HB       GLU  52   0.491  -2.923 -10.827
  353   1HG   GLU  52          1HG       GLU  52  -1.168  -1.700 -11.884
  354   2HG   GLU  52          2HG       GLU  52  -2.412  -2.889 -11.552
  355    HE2  GLU  52           HE2      GLU  52  -3.571  -0.784  -9.085
  356    H    GLY  53           H        GLY  53  -0.928  -3.190 -13.568
  357   1HA   GLY  53          1HA       GLY  53   1.682  -3.768 -14.698
  358   2HA   GLY  53          2HA       GLY  53   0.323  -4.436 -15.581
  359    H    THR  54           H        THR  54   1.627  -1.363 -14.191
  360    HA   THR  54           HA       THR  54  -0.063   0.143 -16.045
  361    HB   THR  54           HB       THR  54   0.367   1.993 -14.570
  362    HG1  THR  54           HG1      THR  54   2.422   0.253 -13.411
  363   1HG2  THR  54          1HG2      THR  54   0.484  -0.537 -12.843
  364   2HG2  THR  54          2HG2      THR  54   0.115   1.097 -12.241
  365   3HG2  THR  54          3HG2      THR  54  -1.003   0.289 -13.367
  366    H    GLY  55           H        GLY  55   1.194   2.268 -16.839
  367   1HA   GLY  55          1HA       GLY  55   3.761   1.347 -17.982
  368   2HA   GLY  55          2HA       GLY  55   2.514   2.086 -18.966
  369    H    GLY  56           H        GLY  56   5.380   2.721 -17.406
  370   1HA   GLY  56          1HA       GLY  56   4.646   5.542 -16.887
  371   2HA   GLY  56          2HA       GLY  56   5.878   4.659 -16.009
  372    H    SER  57           H        SER  57   7.318   6.481 -16.701
  373    HA   SER  57           HA       SER  57   7.838   7.077 -19.312
  374   1HB   SER  57          1HB       SER  57   9.062   7.538 -16.713
  375   2HB   SER  57          2HB       SER  57  10.313   7.252 -17.907
  376    HG   SER  57           HG       SER  57   8.348   9.333 -17.805
  377    H    GLY  58           H        GLY  58   9.611   6.430 -20.768
  378   1HA   GLY  58          1HA       GLY  58  10.707   3.750 -20.169
  379   2HA   GLY  58          2HA       GLY  58   9.958   4.122 -21.709
  380    H    GLY  59           H        GLY  59  12.136   3.485 -22.591
  381   1HA   GLY  59          1HA       GLY  59  14.463   4.965 -22.033
  382   2HA   GLY  59          2HA       GLY  59  14.153   3.982 -23.451
  383    H    GLY  60           H        GLY  60  15.610   6.398 -23.628
  384   1HA   GLY  60          1HA       GLY  60  13.697   8.109 -25.101
  385   2HA   GLY  60          2HA       GLY  60  14.982   8.761 -24.103
  386    HA   PRO  61           HA       PRO  61  16.848   8.441 -28.166
  387   1HB   PRO  61          1HB       PRO  61  18.203  10.812 -28.083
  388   2HB   PRO  61          2HB       PRO  61  16.588  10.654 -28.746
  389   1HG   PRO  61          1HG       PRO  61  17.425  11.820 -26.162
  390   2HG   PRO  61          2HG       PRO  61  15.912  12.028 -27.021
  391   1HD   PRO  61          1HD       PRO  61  16.367  10.372 -24.724
  392   2HD   PRO  61          2HD       PRO  61  14.886  10.491 -25.653
  393    H    HIS  62           H        HIS  62  19.262   8.770 -28.910
  394    HA   HIS  62           HA       HIS  62  20.903   7.959 -26.634
  395   1HB   HIS  62          1HB       HIS  62  21.875   6.150 -27.832
  396   2HB   HIS  62          2HB       HIS  62  20.135   5.956 -27.904
  397    HD1  HIS  62           HD1      HIS  62  22.726   5.217 -29.994
  398    HD2  HIS  62           HD2      HIS  62  19.393   7.704 -30.544
  399    HE1  HIS  62           HE1      HIS  62  22.392   5.418 -32.516
  400    H    HIS  63           H        HIS  63  23.007   8.781 -26.644
  401    HA   HIS  63           HA       HIS  63  23.527  11.132 -27.783
  402   1HB   HIS  63          1HB       HIS  63  25.565  10.920 -26.861
  403   2HB   HIS  63          2HB       HIS  63  24.892   9.452 -26.179
  404    HD1  HIS  63           HD1      HIS  63  27.934  10.377 -27.445
  405    HD2  HIS  63           HD2      HIS  63  25.287   7.334 -28.596
  406    HE1  HIS  63           HE1      HIS  63  29.332   8.650 -28.700
  407    H    HIS  64           H        HIS  64  24.770  11.905 -29.631
  408    HA   HIS  64           HA       HIS  64  25.462  10.093 -31.696
  409   1HB   HIS  64          1HB       HIS  64  23.064  10.024 -32.047
  410   2HB   HIS  64          2HB       HIS  64  22.967  11.773 -32.052
  411    HD1  HIS  64           HD1      HIS  64  21.940  11.694 -34.472
  412    HD2  HIS  64           HD2      HIS  64  25.844  10.190 -34.172
  413    HE1  HIS  64           HE1      HIS  64  22.818  11.503 -36.860
  414    H    HIS  65           H        HIS  65  27.129  11.002 -32.820
  415    HA   HIS  65           HA       HIS  65  27.354  13.420 -33.872
  416   1HB   HIS  65          1HB       HIS  65  27.528  13.668 -30.953
  417   2HB   HIS  65          2HB       HIS  65  28.909  14.359 -31.782
  418    HD1  HIS  65           HD1      HIS  65  28.047  15.969 -33.993
  419    HD2  HIS  65           HD2      HIS  65  25.514  15.478 -30.685
  420    HE1  HIS  65           HE1      HIS  65  26.388  17.907 -34.069
  421    H    GLN  66           H        GLN  66  29.734  14.097 -34.244
  422    HA   GLN  66           HA       GLN  66  31.577  11.982 -33.603
  423   1HB   GLN  66          1HB       GLN  66  30.344  11.458 -35.834
  424   2HB   GLN  66          2HB       GLN  66  31.250  12.796 -36.512
  425   1HG   GLN  66          1HG       GLN  66  33.289  11.684 -36.371
  426   2HG   GLN  66          2HG       GLN  66  32.828  10.783 -34.941
  427   1HE2  GLN  66          1HE2      GLN  66  33.461   8.824 -35.731
  428   2HE2  GLN  66          2HE2      GLN  66  32.637   7.970 -36.993
  429    H    THR  67           H        THR  67  33.850  12.630 -34.738
  430    HA   THR  67           HA       THR  67  34.589  15.071 -33.614
  431    HB   THR  67           HB       THR  67  36.065  13.671 -35.881
  432    HG1  THR  67           HG1      THR  67  35.711  12.961 -33.053
  433   1HG2  THR  67          1HG2      THR  67  37.025  14.667 -33.154
  434   2HG2  THR  67          2HG2      THR  67  38.028  14.180 -34.542
  435   3HG2  THR  67          3HG2      THR  67  37.072  15.680 -34.617
  436    H    ARG  68           H        ARG  68  35.573  16.963 -34.744
  437    HA   ARG  68           HA       ARG  68  33.652  18.130 -36.325
  438   1HB   ARG  68          1HB       ARG  68  36.547  18.786 -35.685
  439   2HB   ARG  68          2HB       ARG  68  35.678  19.776 -36.841
  440   1HG   ARG  68          1HG       ARG  68  34.388  20.760 -35.224
  441   2HG   ARG  68          2HG       ARG  68  34.120  19.248 -34.379
  442   1HD   ARG  68          1HD       ARG  68  36.887  19.839 -34.018
  443   2HD   ARG  68          2HD       ARG  68  36.050  21.361 -33.788
  444    HE   ARG  68           HE       ARG  68  35.806  18.949 -32.109
  445   1HH1  ARG  68          2HH2      ARG  68  34.431  22.108 -32.933
  446   2HH1  ARG  68          1HH2      ARG  68  33.565  22.260 -31.440
  447   1HH2  ARG  68          1HH       ARG  68  33.717  20.507 -29.812
  448    H    GLY  69           H        GLY  69  34.247  19.192 -38.592
  449   1HA   GLY  69          1HA       GLY  69  34.500  17.172 -40.486
  450   2HA   GLY  69          2HA       GLY  69  34.660  18.892 -40.779
  451    H    ALA  70           H        ALA  70  36.727  19.865 -40.941
  452    HA   ALA  70           HA       ALA  70  39.027  18.144 -40.451
  453   1HB   ALA  70          1HB       ALA  70  39.893  18.940 -42.757
  454   2HB   ALA  70          2HB       ALA  70  38.676  17.642 -42.735
  455   3HB   ALA  70          3HB       ALA  70  38.190  19.311 -43.118
  456    H    TYR  71           H        TYR  71  40.939  19.322 -39.975
  457    HA   TYR  71           HA       TYR  71  40.555  22.234 -39.834
  458   1HB   TYR  71          1HB       TYR  71  40.749  20.265 -37.762
  459   2HB   TYR  71          2HB       TYR  71  42.355  20.962 -37.843
  460    HD1  TYR  71           HD1      TYR  71  38.775  22.103 -37.778
  461    HD2  TYR  71           HD2      TYR  71  42.799  22.803 -36.503
  462    HE1  TYR  71           HE1      TYR  71  37.996  24.077 -36.378
  463    HE2  TYR  71           HE2      TYR  71  42.006  24.774 -35.107
  464    HH   TYR  71           HH       TYR  71  40.116  26.354 -35.138
  465    H    SER  72           H        SER  72  41.892  23.006 -41.420
  466    HA   SER  72           HA       SER  72  44.669  22.521 -41.069
  467   1HB   SER  72          1HB       SER  72  43.156  21.151 -43.219
  468   2HB   SER  72          2HB       SER  72  44.545  22.044 -43.804
  469    HG   SER  72           HG       SER  72  45.222  19.935 -43.256
  470    H    SER  73           H        SER  73  45.975  24.106 -42.281
  471    HA   SER  73           HA       SER  73  46.383  26.051 -43.150
  472   1HB   SER  73          1HB       SER  73  44.761  24.981 -44.993
  473   2HB   SER  73          2HB       SER  73  43.693  26.277 -44.493
  474    HG   SER  73           HG       SER  73  44.884  27.221 -46.094
  475    H    HIS  74           H        HIS  74  46.145  28.283 -42.578
  476    HA   HIS  74           HA       HIS  74  45.447  30.001 -41.407
  477   1HB   HIS  74          1HB       HIS  74  43.364  29.529 -42.883
  478   2HB   HIS  74          2HB       HIS  74  42.629  28.934 -41.408
  479    HD1  HIS  74           HD1      HIS  74  42.169  31.720 -43.230
  480    HD2  HIS  74           HD2      HIS  74  43.631  31.290 -39.322
  481    HE1  HIS  74           HE1      HIS  74  41.777  33.958 -42.070
  482    H    ASP  75           H        ASP  75  45.697  30.460 -39.256
  483    HA   ASP  75           HA       ASP  75  45.770  30.202 -37.104
  484   1HB   ASP  75          1HB       ASP  75  43.285  29.839 -37.298
  485   2HB   ASP  75          2HB       ASP  75  43.565  28.117 -37.459
  486    HD2  ASP  75           HD2      ASP  75  42.511  28.280 -34.327
  Start of MODEL    5
    1    H    MET   1           H        MET   1 -32.649 -13.809  15.394
    2    HA   MET   1           HA       MET   1 -33.548 -11.507  14.421
    3   1HB   MET   1          1HB       MET   1 -34.623 -13.221  16.719
    4   2HB   MET   1          2HB       MET   1 -35.569 -11.917  16.029
    5   1HG   MET   1          1HG       MET   1 -36.312 -13.475  14.531
    6   2HG   MET   1          2HG       MET   1 -34.758 -13.275  13.745
    7   1HE   MET   1          1HE       MET   1 -36.764 -15.237  16.450
    8   2HE   MET   1          2HE       MET   1 -37.125 -15.790  14.797
    9   3HE   MET   1          3HE       MET   1 -36.323 -16.886  15.947
   10    H    GLU   2           H        GLU   2 -34.483  -9.511  15.370
   11    HA   GLU   2           HA       GLU   2 -32.662  -8.343  17.146
   12   1HB   GLU   2          1HB       GLU   2 -34.420  -6.432  17.091
   13   2HB   GLU   2          2HB       GLU   2 -33.638  -6.867  15.584
   14   1HG   GLU   2          1HG       GLU   2 -35.575  -7.684  14.658
   15   2HG   GLU   2          2HG       GLU   2 -36.086  -8.452  16.148
   16    HE2  GLU   2           HE2      GLU   2 -37.872  -7.175  14.776
   17    H    VAL   3           H        VAL   3 -33.011 -10.195  18.817
   18    HA   VAL   3           HA       VAL   3 -33.840 -10.948  20.731
   19    HB   VAL   3           HB       VAL   3 -32.947  -8.639  21.257
   20   1HG1  VAL   3          1HG1      VAL   3 -35.873  -8.013  20.962
   21   2HG1  VAL   3          2HG1      VAL   3 -34.894  -7.122  22.152
   22   3HG1  VAL   3          3HG1      VAL   3 -34.451  -7.085  20.429
   23   1HG2  VAL   3          1HG2      VAL   3 -34.051 -10.547  22.855
   24   2HG2  VAL   3          2HG2      VAL   3 -33.260  -9.069  23.454
   25   3HG2  VAL   3          3HG2      VAL   3 -35.032  -9.130  23.299
   26    H    ALA   4           H        ALA   4 -35.947 -10.715  22.326
   27    HA   ALA   4           HA       ALA   4 -38.067 -11.679  20.770
   28   1HB   ALA   4          1HB       ALA   4 -37.462 -12.130  23.232
   29   2HB   ALA   4          2HB       ALA   4 -38.275 -10.588  23.593
   30   3HB   ALA   4          3HB       ALA   4 -39.189 -11.923  22.851
   31    H    MET   5           H        MET   5 -40.304 -10.739  20.684
   32    HA   MET   5           HA       MET   5 -40.233  -8.258  19.506
   33   1HB   MET   5          1HB       MET   5 -42.033 -10.287  19.641
   34   2HB   MET   5          2HB       MET   5 -42.760  -9.251  20.853
   35   1HG   MET   5          1HG       MET   5 -43.540  -7.786  19.284
   36   2HG   MET   5          2HG       MET   5 -41.994  -7.718  18.460
   37   1HE   MET   5          1HE       MET   5 -45.523 -10.475  17.769
   38   2HE   MET   5          2HE       MET   5 -44.348 -11.173  18.909
   39   3HE   MET   5          3HE       MET   5 -45.078  -9.585  19.245
   40    H    VAL   6           H        VAL   6 -41.578  -6.283  20.209
   41    HA   VAL   6           HA       VAL   6 -40.739  -5.601  22.891
   42    HB   VAL   6           HB       VAL   6 -42.228  -3.818  20.988
   43   1HG1  VAL   6          1HG1      VAL   6 -40.871  -3.510  23.496
   44   2HG1  VAL   6          2HG1      VAL   6 -40.011  -2.565  22.256
   45   3HG1  VAL   6          3HG1      VAL   6 -41.747  -2.291  22.538
   46   1HG2  VAL   6          1HG2      VAL   6 -40.630  -4.617  19.485
   47   2HG2  VAL   6          2HG2      VAL   6 -39.848  -3.174  20.173
   48   3HG2  VAL   6          3HG2      VAL   6 -39.386  -4.795  20.745
   49    H    SER   7           H        SER   7 -42.269  -4.527  24.415
   50    HA   SER   7           HA       SER   7 -44.468  -6.146  24.828
   51   1HB   SER   7          1HB       SER   7 -43.566  -3.486  25.964
   52   2HB   SER   7          2HB       SER   7 -45.109  -4.163  26.447
   53    HG   SER   7           HG       SER   7 -43.474  -6.210  26.687
   54    H    ALA   8           H        ALA   8 -46.684  -5.926  24.352
   55    HA   ALA   8           HA       ALA   8 -47.297  -4.078  22.234
   56   1HB   ALA   8          1HB       ALA   8 -48.021  -6.589  22.594
   57   2HB   ALA   8          2HB       ALA   8 -49.301  -5.869  23.600
   58   3HB   ALA   8          3HB       ALA   8 -49.165  -5.426  21.881
   59    H    GLU   9           H        GLU   9 -47.376  -1.968  22.993
   60    HA   GLU   9           HA       GLU   9 -48.342  -1.266  25.477
   61   1HB   GLU   9          1HB       GLU   9 -47.250   0.038  23.205
   62   2HB   GLU   9          2HB       GLU   9 -48.786   0.831  23.495
   63   1HG   GLU   9          1HG       GLU   9 -47.721   0.551  26.076
   64   2HG   GLU   9          2HG       GLU   9 -46.308   0.902  25.101
   65    HE2  GLU   9           HE2      GLU   9 -48.519   2.876  26.779
   66    H    SER  10           H        SER  10 -50.338   0.179  25.875
   67    HA   SER  10           HA       SER  10 -52.570  -1.158  24.608
   68   1HB   SER  10          1HB       SER  10 -53.897  -0.306  26.495
   69   2HB   SER  10          2HB       SER  10 -52.470  -1.135  27.084
   70    HG   SER  10           HG       SER  10 -52.428   1.712  26.658
   71    H    SER  11           H        SER  11 -53.505  -0.141  22.875
   72    HA   SER  11           HA       SER  11 -54.351   1.408  21.610
   73   1HB   SER  11          1HB       SER  11 -55.074   2.290  24.070
   74   2HB   SER  11          2HB       SER  11 -54.071   3.645  23.591
   75    HG   SER  11           HG       SER  11 -55.482   3.332  21.452
   76    H    GLY  12           H        GLY  12 -53.696   3.255  20.217
   77   1HA   GLY  12          1HA       GLY  12 -52.150   5.016  19.765
   78   2HA   GLY  12          2HA       GLY  12 -50.933   4.174  20.704
   79    H    CYS  13           H        CYS  13 -52.056   4.807  17.568
   80    HA   CYS  13           HA       CYS  13 -51.722   3.918  15.577
   81   1HB   CYS  13          1HB       CYS  13 -49.149   3.744  17.010
   82   2HB   CYS  13          2HB       CYS  13 -49.255   2.697  15.609
   83    HG   CYS  13           HG       CYS  13 -48.120   4.952  14.917
   84    H    ASN  14           H        ASN  14 -53.495   2.333  16.822
   85    HA   ASN  14           HA       ASN  14 -52.421  -0.361  16.697
   86   1HB   ASN  14          1HB       ASN  14 -54.436   0.985  18.335
   87   2HB   ASN  14          2HB       ASN  14 -55.165  -0.389  17.527
   88   1HD2  ASN  14          1HD2      ASN  14 -54.574  -2.445  18.023
   89   2HD2  ASN  14          2HD2      ASN  14 -53.538  -2.878  19.342
   90    H    SER  15           H        SER  15 -53.134   1.488  14.363
   91    HA   SER  15           HA       SER  15 -55.173  -0.241  13.197
   92   1HB   SER  15          1HB       SER  15 -54.847   2.770  12.999
   93   2HB   SER  15          2HB       SER  15 -55.692   1.879  11.748
   94    HG   SER  15           HG       SER  15 -56.965   0.936  13.672
   95    H    HIS  16           H        HIS  16 -52.986  -1.397  12.701
   96    HA   HIS  16           HA       HIS  16 -51.343  -1.911  11.331
   97   1HB   HIS  16          1HB       HIS  16 -53.132  -2.323   9.800
   98   2HB   HIS  16          2HB       HIS  16 -53.275  -0.625   9.393
   99    HD1  HIS  16           HD1      HIS  16 -52.753  -0.785   6.907
  100    HD2  HIS  16           HD2      HIS  16 -49.808  -2.547   9.319
  101    HE1  HIS  16           HE1      HIS  16 -50.801  -1.341   5.361
  102    H    MET  17           H        MET  17 -49.827  -0.509  12.465
  103    HA   MET  17           HA       MET  17 -49.408   2.077  11.273
  104   1HB   MET  17          1HB       MET  17 -47.754   2.330  13.135
  105   2HB   MET  17          2HB       MET  17 -49.298   1.776  13.754
  106   1HG   MET  17          1HG       MET  17 -48.509  -0.494  13.994
  107   2HG   MET  17          2HG       MET  17 -47.091  -0.189  13.011
  108   1HE   MET  17          1HE       MET  17 -46.661  -0.633  17.149
  109   2HE   MET  17          2HE       MET  17 -48.360  -0.355  16.695
  110   3HE   MET  17          3HE       MET  17 -47.374  -1.523  15.782
  111    HA   PRO  18           HA       PRO  18 -46.038   0.831   8.840
  112   1HB   PRO  18          1HB       PRO  18 -44.577   3.134   8.658
  113   2HB   PRO  18          2HB       PRO  18 -46.012   2.830   7.699
  114   1HG   PRO  18          1HG       PRO  18 -45.691   4.600  10.045
  115   2HG   PRO  18          2HG       PRO  18 -46.959   4.600   8.835
  116   1HD   PRO  18          1HD       PRO  18 -47.136   3.570  11.506
  117   2HD   PRO  18          2HD       PRO  18 -48.363   3.467  10.259
  118    H    TYR  19           H        TYR  19 -45.382  -0.750  10.470
  119    HA   TYR  19           HA       TYR  19 -43.176   0.171  12.112
  120   1HB   TYR  19          1HB       TYR  19 -45.228  -1.562  12.508
  121   2HB   TYR  19          2HB       TYR  19 -44.157  -2.693  11.706
  122    HD1  TYR  19           HD1      TYR  19 -42.897  -4.048  13.094
  123    HD2  TYR  19           HD2      TYR  19 -43.906  -0.111  14.430
  124    HE1  TYR  19           HE1      TYR  19 -41.717  -4.487  15.303
  125    HE2  TYR  19           HE2      TYR  19 -42.723  -0.563  16.634
  126    HH   TYR  19           HH       TYR  19 -40.567  -2.590  17.137
  127    H    GLY  20           H        GLY  20 -41.532   0.650  10.554
  128   1HA   GLY  20          1HA       GLY  20 -40.081  -1.701   9.688
  129   2HA   GLY  20          2HA       GLY  20 -40.719  -0.717   8.385
  130    H    TYR  21           H        TYR  21 -39.614   1.115   7.750
  131    HA   TYR  21           HA       TYR  21 -37.031   1.550   8.651
  132   1HB   TYR  21          1HB       TYR  21 -37.325   3.638   7.260
  133   2HB   TYR  21          2HB       TYR  21 -38.047   2.258   6.455
  134    HD1  TYR  21           HD1      TYR  21 -40.374   2.202   5.948
  135    HD2  TYR  21           HD2      TYR  21 -38.821   5.270   8.493
  136    HE1  TYR  21           HE1      TYR  21 -42.584   3.451   5.803
  137    HE2  TYR  21           HE2      TYR  21 -41.036   6.509   8.340
  138    HH   TYR  21           HH       TYR  21 -42.916   6.676   7.041
  139    H    ALA  22           H        ALA  22 -40.050   2.425  10.113
  140    HA   ALA  22           HA       ALA  22 -39.187   4.826  11.353
  141   1HB   ALA  22          1HB       ALA  22 -41.225   4.007  12.905
  142   2HB   ALA  22          2HB       ALA  22 -41.482   4.707  11.289
  143   3HB   ALA  22          3HB       ALA  22 -41.507   2.941  11.508
  144    H    ALA  23           H        ALA  23 -39.199   1.333  12.224
  145    HA   ALA  23           HA       ALA  23 -38.035   1.963  14.808
  146   1HB   ALA  23          1HB       ALA  23 -38.173  -0.860  14.095
  147   2HB   ALA  23          2HB       ALA  23 -38.988   0.017  15.413
  148   3HB   ALA  23          3HB       ALA  23 -39.727  -0.044  13.794
  149    H    GLN  24           H        GLN  24 -36.826   2.171  11.842
  150    HA   GLN  24           HA       GLN  24 -34.555   0.444  12.228
  151   1HB   GLN  24          1HB       GLN  24 -35.580   2.175   9.973
  152   2HB   GLN  24          2HB       GLN  24 -33.899   1.678   9.967
  153   1HG   GLN  24          1HG       GLN  24 -36.149  -0.335  10.361
  154   2HG   GLN  24          2HG       GLN  24 -35.618   0.140   8.760
  155   1HE2  GLN  24          1HE2      GLN  24 -35.370  -2.230  10.854
  156   2HE2  GLN  24          2HE2      GLN  24 -33.752  -2.800  10.611
  157    H    ALA  25           H        ALA  25 -35.513   3.387  13.435
  158    HA   ALA  25           HA       ALA  25 -33.329   5.058  12.968
  159   1HB   ALA  25          1HB       ALA  25 -35.032   6.247  13.910
  160   2HB   ALA  25          2HB       ALA  25 -35.613   4.859  14.861
  161   3HB   ALA  25          3HB       ALA  25 -34.221   5.809  15.433
  162    H    ARG  26           H        ARG  26 -33.668   2.126  14.827
  163    HA   ARG  26           HA       ARG  26 -31.679   2.721  16.713
  164   1HB   ARG  26          1HB       ARG  26 -33.557   0.685  16.331
  165   2HB   ARG  26          2HB       ARG  26 -32.046  -0.145  16.019
  166   1HG   ARG  26          1HG       ARG  26 -31.825  -0.343  18.272
  167   2HG   ARG  26          2HG       ARG  26 -31.452   1.369  18.296
  168   1HD   ARG  26          1HD       ARG  26 -33.512   1.946  19.154
  169   2HD   ARG  26          2HD       ARG  26 -34.367   0.765  18.182
  170    HE   ARG  26           HE       ARG  26 -32.707  -0.388  20.326
  171   1HH1  ARG  26          2HH2      ARG  26 -35.925   0.778  19.412
  172   2HH1  ARG  26          1HH2      ARG  26 -36.735  -0.100  20.666
  173   1HH2  ARG  26          1HH       ARG  26 -35.452  -1.459  22.165
  174    H    ALA  27           H        ALA  27 -31.745   1.427  13.400
  175    HA   ALA  27           HA       ALA  27 -29.149   0.295  13.451
  176   1HB   ALA  27          1HB       ALA  27 -29.518   0.553  10.877
  177   2HB   ALA  27          2HB       ALA  27 -30.586  -0.538  11.793
  178   3HB   ALA  27          3HB       ALA  27 -31.155   1.085  11.332
  179    H    ARG  28           H        ARG  28 -30.500   3.543  12.937
  180    HA   ARG  28           HA       ARG  28 -28.342   4.627  11.610
  181   1HB   ARG  28          1HB       ARG  28 -30.761   5.574  12.236
  182   2HB   ARG  28          2HB       ARG  28 -29.930   6.244  13.625
  183   1HG   ARG  28          1HG       ARG  28 -29.263   7.970  12.315
  184   2HG   ARG  28          2HG       ARG  28 -28.234   6.849  11.446
  185   1HD   ARG  28          1HD       ARG  28 -30.454   6.252  10.116
  186   2HD   ARG  28          2HD       ARG  28 -31.027   7.790  10.730
  187    HE   ARG  28           HE       ARG  28 -29.594   8.883   9.242
  188   1HH1  ARG  28          2HH2      ARG  28 -28.471   5.546   9.638
  189   2HH1  ARG  28          1HH2      ARG  28 -27.254   5.679   8.413
  190   1HH2  ARG  28          1HH       ARG  28 -26.987   7.754   7.243
  191    H    GLU  29           H        GLU  29 -28.924   3.867  15.034
  192    HA   GLU  29           HA       GLU  29 -26.751   5.480  15.931
  193   1HB   GLU  29          1HB       GLU  29 -29.005   4.513  17.141
  194   2HB   GLU  29          2HB       GLU  29 -27.840   3.326  17.692
  195   1HG   GLU  29          1HG       GLU  29 -26.829   4.809  19.100
  196   2HG   GLU  29          2HG       GLU  29 -26.760   6.058  17.873
  197    HE2  GLU  29           HE2      GLU  29 -29.859   6.316  17.678
  198    H    ARG  30           H        ARG  30 -27.259   2.214  14.738
  199    HA   ARG  30           HA       ARG  30 -24.799   1.303  15.901
  200   1HB   ARG  30          1HB       ARG  30 -27.133   0.075  14.499
  201   2HB   ARG  30          2HB       ARG  30 -25.597  -0.697  14.157
  202   1HG   ARG  30          1HG       ARG  30 -26.172  -1.865  16.078
  203   2HG   ARG  30          2HG       ARG  30 -25.292  -0.541  16.814
  204   1HD   ARG  30          1HD       ARG  30 -27.400   0.677  17.250
  205   2HD   ARG  30          2HD       ARG  30 -28.320  -0.546  16.396
  206    HE   ARG  30           HE       ARG  30 -28.251  -1.875  18.312
  207   1HH1  ARG  30          2HH2      ARG  30 -25.598   0.468  18.487
  208   2HH1  ARG  30          1HH2      ARG  30 -25.125  -0.001  20.086
  209   1HH2  ARG  30          1HH       ARG  30 -26.331  -1.744  21.204
  210    H    GLU  31           H        GLU  31 -26.115   2.562  12.862
  211    HA   GLU  31           HA       GLU  31 -24.144   1.563  11.168
  212   1HB   GLU  31          1HB       GLU  31 -26.455   2.691  10.653
  213   2HB   GLU  31          2HB       GLU  31 -25.570   4.202  10.722
  214   1HG   GLU  31          1HG       GLU  31 -24.375   2.001   9.056
  215   2HG   GLU  31          2HG       GLU  31 -25.826   2.764   8.437
  216    HE2  GLU  31           HE2      GLU  31 -22.317   4.561   8.556
  217    H    ARG  32           H        ARG  32 -24.182   4.157  13.531
  218    HA   ARG  32           HA       ARG  32 -22.290   5.814  12.438
  219   1HB   ARG  32          1HB       ARG  32 -23.783   5.906  14.678
  220   2HB   ARG  32          2HB       ARG  32 -22.311   5.310  15.420
  221   1HG   ARG  32          1HG       ARG  32 -22.265   7.724  13.569
  222   2HG   ARG  32          2HG       ARG  32 -22.660   7.898  15.267
  223   1HD   ARG  32          1HD       ARG  32 -20.427   6.474  15.625
  224   2HD   ARG  32          2HD       ARG  32 -20.044   7.038  14.011
  225    HE   ARG  32           HE       ARG  32 -20.952   9.223  15.695
  226   1HH1  ARG  32          2HH2      ARG  32 -18.127   7.212  14.969
  227   2HH1  ARG  32          1HH2      ARG  32 -16.987   8.403  15.499
  228   1HH2  ARG  32          1HH       ARG  32 -17.787  10.503  16.333
  229    H    LEU  33           H        LEU  33 -22.025   2.667  14.054
  230    HA   LEU  33           HA       LEU  33 -19.152   2.949  14.358
  231   1HB   LEU  33          1HB       LEU  33 -21.167   1.590  15.736
  232   2HB   LEU  33          2HB       LEU  33 -20.260   0.331  14.921
  233    HG   LEU  33           HG       LEU  33 -19.423   0.706  17.176
  234   1HD1  LEU  33          1HD1      LEU  33 -17.053   1.767  15.989
  235   2HD1  LEU  33          2HD1      LEU  33 -17.440   0.082  16.411
  236   3HD1  LEU  33          3HD1      LEU  33 -17.860   0.716  14.801
  237   1HD2  LEU  33          1HD2      LEU  33 -18.520   3.471  16.379
  238   2HD2  LEU  33          2HD2      LEU  33 -20.090   3.179  17.164
  239   3HD2  LEU  33          3HD2      LEU  33 -18.581   2.732  17.997
  240    H    ALA  34           H        ALA  34 -21.447   2.030  11.979
  241    HA   ALA  34           HA       ALA  34 -19.789   0.010  10.768
  242   1HB   ALA  34          1HB       ALA  34 -22.142  -0.294  10.556
  243   2HB   ALA  34          2HB       ALA  34 -22.393   1.393  10.048
  244   3HB   ALA  34          3HB       ALA  34 -21.588   0.244   8.953
  245    H    HIS  35           H        HIS  35 -19.314   3.214  11.185
  246    HA   HIS  35           HA       HIS  35 -18.649   3.818   8.432
  247   1HB   HIS  35          1HB       HIS  35 -19.759   5.556   9.653
  248   2HB   HIS  35          2HB       HIS  35 -18.627   5.439  10.986
  249    HD1  HIS  35           HD1      HIS  35 -18.497   6.277   7.240
  250    HD2  HIS  35           HD2      HIS  35 -16.627   7.291  10.855
  251    HE1  HIS  35           HE1      HIS  35 -16.843   8.141   6.691
  252    H    SER  36           H        SER  36 -17.247   2.303  11.154
  253    HA   SER  36           HA       SER  36 -14.593   3.222  10.535
  254   1HB   SER  36          1HB       SER  36 -15.794   2.443  12.882
  255   2HB   SER  36          2HB       SER  36 -14.975   0.959  12.440
  256    HG   SER  36           HG       SER  36 -13.067   1.843  12.887
  257    H    ARG  37           H        ARG  37 -16.813   0.676   9.690
  258    HA   ARG  37           HA       ARG  37 -14.699  -1.132   8.983
  259   1HB   ARG  37          1HB       ARG  37 -17.303  -1.523   9.810
  260   2HB   ARG  37          2HB       ARG  37 -17.498  -1.684   8.076
  261   1HG   ARG  37          1HG       ARG  37 -16.863  -3.855   8.422
  262   2HG   ARG  37          2HG       ARG  37 -15.237  -3.202   8.450
  263   1HD   ARG  37          1HD       ARG  37 -15.253  -3.055  10.890
  264   2HD   ARG  37          2HD       ARG  37 -16.962  -3.435  10.958
  265    HE   ARG  37           HE       ARG  37 -15.910  -5.618   9.632
  266   1HH1  ARG  37          2HH2      ARG  37 -15.099  -4.026  12.691
  267   2HH1  ARG  37          1HH2      ARG  37 -14.512  -5.477  13.433
  268   1HH2  ARG  37          1HH       ARG  37 -14.543  -7.526  12.191
  269    H    ALA  38           H        ALA  38 -15.480   1.667   7.680
  270    HA   ALA  38           HA       ALA  38 -16.289   1.018   5.040
  271   1HB   ALA  38          1HB       ALA  38 -15.991   3.348   4.627
  272   2HB   ALA  38          2HB       ALA  38 -16.554   3.228   6.311
  273   3HB   ALA  38          3HB       ALA  38 -14.831   3.515   5.967
  274    H    ALA  39           H        ALA  39 -13.124   2.208   6.394
  275    HA   ALA  39           HA       ALA  39 -11.654   1.840   4.097
  276   1HB   ALA  39          1HB       ALA  39  -9.713   1.865   5.615
  277   2HB   ALA  39          2HB       ALA  39 -10.918   3.078   6.109
  278   3HB   ALA  39          3HB       ALA  39 -10.782   1.543   7.000
  279    H    ALA  40           H        ALA  40 -11.943  -0.427   6.931
  280    HA   ALA  40           HA       ALA  40 -10.480  -2.493   5.999
  281   1HB   ALA  40          1HB       ALA  40 -11.266  -3.242   7.965
  282   2HB   ALA  40          2HB       ALA  40 -12.584  -2.046   7.933
  283   3HB   ALA  40          3HB       ALA  40 -12.805  -3.634   7.161
  284    H    ALA  41           H        ALA  41 -14.082  -2.246   5.527
  285    HA   ALA  41           HA       ALA  41 -15.397  -2.957   3.896
  286   1HB   ALA  41          1HB       ALA  41 -12.929  -2.974   2.119
  287   2HB   ALA  41          2HB       ALA  41 -14.627  -2.792   1.619
  288   3HB   ALA  41          3HB       ALA  41 -13.828  -1.498   2.543
  289    H    ALA  42           H        ALA  42 -14.693  -4.884   5.676
  290    HA   ALA  42           HA       ALA  42 -13.529  -7.142   4.356
  291   1HB   ALA  42          1HB       ALA  42 -13.396  -7.963   6.465
  292   2HB   ALA  42          2HB       ALA  42 -13.858  -6.320   6.970
  293   3HB   ALA  42          3HB       ALA  42 -15.099  -7.586   6.818
  294    H    ALA  43           H        ALA  43 -16.822  -6.489   5.769
  295    HA   ALA  43           HA       ALA  43 -18.096  -8.675   4.769
  296   1HB   ALA  43          1HB       ALA  43 -19.825  -6.372   4.574
  297   2HB   ALA  43          2HB       ALA  43 -19.784  -7.638   5.825
  298   3HB   ALA  43          3HB       ALA  43 -18.761  -6.191   5.990
  299    H    VAL  44           H        VAL  44 -16.817  -5.895   3.042
  300    HA   VAL  44           HA       VAL  44 -18.361  -6.596   0.668
  301    HB   VAL  44           HB       VAL  44 -17.076  -4.208   1.753
  302   1HG1  VAL  44          1HG1      VAL  44 -16.586  -3.283  -0.571
  303   2HG1  VAL  44          2HG1      VAL  44 -15.410  -4.449   0.082
  304   3HG1  VAL  44          3HG1      VAL  44 -16.596  -4.970  -1.138
  305   1HG2  VAL  44          1HG2      VAL  44 -18.991  -3.240   1.067
  306   2HG2  VAL  44          2HG2      VAL  44 -18.905  -3.982  -0.549
  307   3HG2  VAL  44          3HG2      VAL  44 -19.557  -4.910   0.823
  308    H    ALA  45           H        ALA  45 -15.123  -6.741   2.122
  309    HA   ALA  45           HA       ALA  45 -13.561  -7.108  -0.095
  310   1HB   ALA  45          1HB       ALA  45 -13.483  -8.272   2.705
  311   2HB   ALA  45          2HB       ALA  45 -12.196  -8.581   1.515
  312   3HB   ALA  45          3HB       ALA  45 -12.540  -6.916   2.042
  313    H    ALA  46           H        ALA  46 -15.709  -9.446   1.607
  314    HA   ALA  46           HA       ALA  46 -14.894 -11.636  -0.021
  315   1HB   ALA  46          1HB       ALA  46 -17.478 -11.428   1.544
  316   2HB   ALA  46          2HB       ALA  46 -16.472 -12.864   1.232
  317   3HB   ALA  46          3HB       ALA  46 -15.911 -11.613   2.367
  318    H    ALA  47           H        ALA  47 -17.485  -9.157  -0.081
  319    HA   ALA  47           HA       ALA  47 -18.930 -10.405  -2.181
  320   1HB   ALA  47          1HB       ALA  47 -19.239  -7.501  -1.918
  321   2HB   ALA  47          2HB       ALA  47 -20.431  -8.800  -1.671
  322   3HB   ALA  47          3HB       ALA  47 -19.330  -8.338  -0.350
  323    H    THR  48           H        THR  48 -19.346  -8.295  -4.020
  324    HA   THR  48           HA       THR  48 -18.510  -7.854  -6.069
  325    HB   THR  48           HB       THR  48 -18.030  -5.842  -4.667
  326    HG1  THR  48           HG1      THR  48 -16.226  -5.173  -6.126
  327   1HG2  THR  48          1HG2      THR  48 -15.454  -5.606  -4.152
  328   2HG2  THR  48          2HG2      THR  48 -16.468  -6.488  -2.984
  329   3HG2  THR  48          3HG2      THR  48 -15.460  -7.386  -4.144
  330    H    ALA  49           H        ALA  49 -17.894 -10.482  -5.495
  331    HA   ALA  49           HA       ALA  49 -15.316 -11.286  -5.466
  332   1HB   ALA  49          1HB       ALA  49 -16.648 -12.868  -7.426
  333   2HB   ALA  49          2HB       ALA  49 -16.448 -13.211  -5.691
  334   3HB   ALA  49          3HB       ALA  49 -17.883 -12.329  -6.263
  335    H    ALA  50           H        ALA  50 -13.811 -11.975  -7.211
  336    HA   ALA  50           HA       ALA  50 -13.646  -9.882  -9.194
  337   1HB   ALA  50          1HB       ALA  50 -11.514 -10.204  -8.490
  338   2HB   ALA  50          2HB       ALA  50 -11.860 -11.843  -7.888
  339   3HB   ALA  50          3HB       ALA  50 -11.520 -11.582  -9.616
  340    H    VAL  51           H        VAL  51 -15.936 -11.241  -9.748
  341    HA   VAL  51           HA       VAL  51 -16.996 -12.560 -11.191
  342    HB   VAL  51           HB       VAL  51 -16.205 -10.733 -12.597
  343   1HG1  VAL  51          1HG1      VAL  51 -14.216 -11.196 -14.120
  344   2HG1  VAL  51          2HG1      VAL  51 -13.841 -10.831 -12.418
  345   3HG1  VAL  51          3HG1      VAL  51 -13.788 -12.512 -13.002
  346   1HG2  VAL  51          1HG2      VAL  51 -16.880 -11.675 -14.581
  347   2HG2  VAL  51          2HG2      VAL  51 -15.883 -13.133 -14.360
  348   3HG2  VAL  51          3HG2      VAL  51 -17.401 -12.946 -13.448
  349    H    GLU  52           H        GLU  52 -15.730 -14.186  -9.467
  350    HA   GLU  52           HA       GLU  52 -13.922 -15.908 -10.811
  351   1HB   GLU  52          1HB       GLU  52 -14.151 -15.375  -8.249
  352   2HB   GLU  52          2HB       GLU  52 -15.401 -16.603  -8.258
  353   1HG   GLU  52          1HG       GLU  52 -13.904 -18.337  -8.738
  354   2HG   GLU  52          2HG       GLU  52 -12.785 -17.287  -9.584
  355    HE2  GLU  52           HE2      GLU  52 -11.105 -18.346  -7.143
  356    H    GLY  53           H        GLY  53 -14.392 -18.378 -10.873
  357   1HA   GLY  53          1HA       GLY  53 -17.221 -18.950 -11.419
  358   2HA   GLY  53          2HA       GLY  53 -16.049 -19.193 -12.699
  359    H    THR  54           H        THR  54 -16.549 -19.981  -9.185
  360    HA   THR  54           HA       THR  54 -15.956 -22.752  -9.753
  361    HB   THR  54           HB       THR  54 -14.175 -20.987  -7.996
  362    HG1  THR  54           HG1      THR  54 -13.895 -22.754 -10.324
  363   1HG2  THR  54          1HG2      THR  54 -12.899 -23.340  -7.982
  364   2HG2  THR  54          2HG2      THR  54 -14.138 -22.991  -6.752
  365   3HG2  THR  54          3HG2      THR  54 -14.546 -23.989  -8.168
  366    H    GLY  55           H        GLY  55 -17.936 -23.430  -9.070
  367   1HA   GLY  55          1HA       GLY  55 -18.479 -23.004  -6.207
  368   2HA   GLY  55          2HA       GLY  55 -19.726 -22.666  -7.391
  369    H    GLY  56           H        GLY  56 -19.781 -24.619  -9.203
  370   1HA   GLY  56          1HA       GLY  56 -20.929 -26.800  -7.934
  371   2HA   GLY  56          2HA       GLY  56 -20.378 -26.748  -9.597
  372    H    SER  57           H        SER  57 -18.430 -27.747 -10.201
  373    HA   SER  57           HA       SER  57 -16.984 -28.976  -7.986
  374   1HB   SER  57          1HB       SER  57 -18.494 -30.433  -9.655
  375   2HB   SER  57          2HB       SER  57 -17.085 -30.303 -10.690
  376    HG   SER  57           HG       SER  57 -16.149 -31.813  -9.512
  377    H    GLY  58           H        GLY  58 -14.646 -29.481  -8.527
  378   1HA   GLY  58          1HA       GLY  58 -13.104 -28.981 -10.567
  379   2HA   GLY  58          2HA       GLY  58 -13.554 -27.329 -10.196
  380    H    GLY  59           H        GLY  59 -12.106 -30.319  -8.781
  381   1HA   GLY  59          1HA       GLY  59 -10.642 -28.587  -6.878
  382   2HA   GLY  59          2HA       GLY  59 -11.189 -30.212  -6.513
  383    H    GLY  60           H        GLY  60  -9.965 -32.004  -7.147
  384   1HA   GLY  60          1HA       GLY  60  -8.219 -32.259  -9.216
  385   2HA   GLY  60          2HA       GLY  60  -7.266 -31.459  -7.982
  386    HA   PRO  61           HA       PRO  61  -7.171 -35.916  -7.078
  387   1HB   PRO  61          1HB       PRO  61  -4.461 -36.264  -7.151
  388   2HB   PRO  61          2HB       PRO  61  -5.505 -36.578  -8.523
  389   1HG   PRO  61          1HG       PRO  61  -3.681 -34.297  -8.066
  390   2HG   PRO  61          2HG       PRO  61  -4.394 -34.848  -9.569
  391   1HD   PRO  61          1HD       PRO  61  -5.212 -32.584  -8.010
  392   2HD   PRO  61          2HD       PRO  61  -5.996 -33.203  -9.450
  393    H    HIS  62           H        HIS  62  -5.808 -37.149  -5.313
  394    HA   HIS  62           HA       HIS  62  -5.664 -35.210  -3.120
  395   1HB   HIS  62          1HB       HIS  62  -7.473 -37.089  -3.187
  396   2HB   HIS  62          2HB       HIS  62  -6.155 -38.157  -2.743
  397    HD1  HIS  62           HD1      HIS  62  -7.166 -38.626  -0.396
  398    HD2  HIS  62           HD2      HIS  62  -6.298 -34.585  -1.111
  399    HE1  HIS  62           HE1      HIS  62  -7.331 -37.449   1.862
  400    H    HIS  63           H        HIS  63  -4.423 -38.526  -3.975
  401    HA   HIS  63           HA       HIS  63  -1.748 -37.676  -3.923
  402   1HB   HIS  63          1HB       HIS  63  -2.535 -37.680  -1.423
  403   2HB   HIS  63          2HB       HIS  63  -2.385 -39.421  -1.558
  404    HD1  HIS  63           HD1      HIS  63  -0.454 -36.486  -0.721
  405    HD2  HIS  63           HD2      HIS  63   0.379 -40.176  -2.534
  406    HE1  HIS  63           HE1      HIS  63   2.071 -36.809  -0.557
  407    H    HIS  64           H        HIS  64  -0.270 -39.475  -4.419
  408    HA   HIS  64           HA       HIS  64  -1.750 -41.606  -5.722
  409   1HB   HIS  64          1HB       HIS  64   0.772 -40.182  -6.181
  410   2HB   HIS  64          2HB       HIS  64   0.929 -41.919  -6.356
  411    HD1  HIS  64           HD1      HIS  64  -0.258 -43.049  -8.364
  412    HD2  HIS  64           HD2      HIS  64  -0.940 -38.919  -8.087
  413    HE1  HIS  64           HE1      HIS  64  -1.335 -42.353 -10.570
  414    H    HIS  65           H        HIS  65   1.356 -41.352  -3.840
  415    HA   HIS  65           HA       HIS  65   2.181 -42.602  -2.231
  416   1HB   HIS  65          1HB       HIS  65  -0.401 -42.505  -1.525
  417   2HB   HIS  65          2HB       HIS  65  -0.290 -44.227  -1.826
  418    HD1  HIS  65           HD1      HIS  65  -0.087 -42.014   0.892
  419    HD2  HIS  65           HD2      HIS  65   2.323 -45.203  -0.380
  420    HE1  HIS  65           HE1      HIS  65   1.241 -42.767   2.937
  421    H    GLN  66           H        GLN  66   3.347 -44.574  -2.088
  422    HA   GLN  66           HA       GLN  66   2.848 -46.304  -4.378
  423   1HB   GLN  66          1HB       GLN  66   5.125 -44.957  -3.869
  424   2HB   GLN  66          2HB       GLN  66   5.459 -46.369  -2.886
  425   1HG   GLN  66          1HG       GLN  66   5.978 -47.578  -4.731
  426   2HG   GLN  66          2HG       GLN  66   4.388 -47.284  -5.407
  427   1HE2  GLN  66          1HE2      GLN  66   5.095 -47.054  -7.482
  428   2HE2  GLN  66          2HE2      GLN  66   6.003 -45.696  -8.058
  429    H    THR  67           H        THR  67   4.576 -48.459  -3.439
  430    HA   THR  67           HA       THR  67   3.640 -49.294  -0.865
  431    HB   THR  67           HB       THR  67   2.496 -50.525  -3.426
  432    HG1  THR  67           HG1      THR  67   1.561 -49.186  -0.992
  433   1HG2  THR  67          1HG2      THR  67   2.380 -51.434  -0.505
  434   2HG2  THR  67          2HG2      THR  67   1.226 -51.977  -1.747
  435   3HG2  THR  67          3HG2      THR  67   2.952 -52.383  -1.898
  436    H    ARG  68           H        ARG  68   4.332 -51.695  -0.501
  437    HA   ARG  68           HA       ARG  68   7.003 -51.792  -0.699
  438   1HB   ARG  68          1HB       ARG  68   4.843 -53.845  -0.314
  439   2HB   ARG  68          2HB       ARG  68   6.438 -54.472  -0.679
  440   1HG   ARG  68          1HG       ARG  68   6.183 -52.329   1.438
  441   2HG   ARG  68          2HG       ARG  68   5.700 -53.965   1.842
  442   1HD   ARG  68          1HD       ARG  68   8.042 -54.640   0.794
  443   2HD   ARG  68          2HD       ARG  68   8.445 -52.952   1.038
  444    HE   ARG  68           HE       ARG  68   7.288 -53.922   3.457
  445   1HH1  ARG  68          2HH2      ARG  68  10.220 -54.389   1.523
  446   2HH1  ARG  68          1HH2      ARG  68  11.197 -54.830   2.884
  447   1HH2  ARG  68          1HH       ARG  68  10.210 -54.890   5.067
  448    H    GLY  69           H        GLY  69   8.476 -53.262  -1.990
  449   1HA   GLY  69          1HA       GLY  69   7.732 -54.596  -4.307
  450   2HA   GLY  69          2HA       GLY  69   8.048 -52.937  -4.774
  451    H    ALA  70           H        ALA  70   9.442 -56.001  -4.001
  452    HA   ALA  70           HA       ALA  70  12.031 -55.079  -4.705
  453   1HB   ALA  70          1HB       ALA  70  11.660 -54.435  -2.193
  454   2HB   ALA  70          2HB       ALA  70  11.865 -56.178  -1.896
  455   3HB   ALA  70          3HB       ALA  70  13.172 -55.247  -2.666
  456    H    TYR  71           H        TYR  71  12.138 -56.686  -6.248
  457    HA   TYR  71           HA       TYR  71  11.198 -59.317  -5.730
  458   1HB   TYR  71          1HB       TYR  71  12.812 -57.776  -7.815
  459   2HB   TYR  71          2HB       TYR  71  12.766 -59.524  -7.938
  460    HD1  TYR  71           HD1      TYR  71  10.146 -56.960  -7.104
  461    HD2  TYR  71           HD2      TYR  71  11.363 -60.158  -9.671
  462    HE1  TYR  71           HE1      TYR  71   7.930 -56.819  -8.342
  463    HE2  TYR  71           HE2      TYR  71   9.143 -60.007 -10.901
  464    HH   TYR  71           HH       TYR  71   6.513 -58.355  -9.673
  465    H    SER  72           H        SER  72  12.296 -61.170  -5.129
  466    HA   SER  72           HA       SER  72  15.171 -60.930  -4.864
  467   1HB   SER  72          1HB       SER  72  15.094 -61.942  -2.591
  468   2HB   SER  72          2HB       SER  72  14.315 -60.373  -2.638
  469    HG   SER  72           HG       SER  72  12.665 -62.642  -3.122
  470    H    SER  73           H        SER  73  16.259 -62.866  -5.350
  471    HA   SER  73           HA       SER  73  15.022 -65.357  -5.139
  472   1HB   SER  73          1HB       SER  73  13.909 -64.237  -7.244
  473   2HB   SER  73          2HB       SER  73  15.439 -64.561  -8.035
  474    HG   SER  73           HG       SER  73  14.368 -66.743  -6.602
  475    H    HIS  74           H        HIS  74  16.591 -67.034  -5.392
  476    HA   HIS  74           HA       HIS  74  18.581 -67.940  -5.570
  477   1HB   HIS  74          1HB       HIS  74  18.337 -66.509  -7.897
  478   2HB   HIS  74          2HB       HIS  74  19.843 -65.878  -7.262
  479    HD1  HIS  74           HD1      HIS  74  21.280 -68.264  -6.149
  480    HD2  HIS  74           HD2      HIS  74  18.997 -68.473  -9.662
  481    HE1  HIS  74           HE1      HIS  74  22.152 -70.278  -7.450
  482    H    ASP  75           H        ASP  75  19.657 -67.909  -3.660
  483    HA   ASP  75           HA       ASP  75  21.423 -65.723  -3.188
  484   1HB   ASP  75          1HB       ASP  75  18.973 -65.346  -2.109
  485   2HB   ASP  75          2HB       ASP  75  19.624 -66.392  -0.863
  486    HD2  ASP  75           HD2      ASP  75  21.369 -64.071   0.671
  Start of MODEL    6
    1    H    MET   1           H        MET   1 -63.059  37.224 -10.912
    2    HA   MET   1           HA       MET   1 -62.110  36.975  -8.219
    3   1HB   MET   1          1HB       MET   1 -64.363  35.446  -9.145
    4   2HB   MET   1          2HB       MET   1 -63.007  34.336  -9.121
    5   1HG   MET   1          1HG       MET   1 -62.933  34.296  -6.835
    6   2HG   MET   1          2HG       MET   1 -63.075  36.038  -6.711
    7   1HE   MET   1          1HE       MET   1 -65.968  33.943  -4.720
    8   2HE   MET   1          2HE       MET   1 -64.863  32.894  -5.640
    9   3HE   MET   1          3HE       MET   1 -64.216  34.254  -4.692
   10    H    GLU   2           H        GLU   2 -59.996  37.284  -9.011
   11    HA   GLU   2           HA       GLU   2 -58.968  36.290 -11.300
   12   1HB   GLU   2          1HB       GLU   2 -56.773  36.648 -10.312
   13   2HB   GLU   2          2HB       GLU   2 -57.852  37.906  -9.742
   14   1HG   GLU   2          1HG       GLU   2 -57.716  37.209  -7.568
   15   2HG   GLU   2          2HG       GLU   2 -57.892  35.520  -8.001
   16    HE2  GLU   2           HE2      GLU   2 -55.108  37.811  -7.342
   17    H    VAL   3           H        VAL   3 -57.294  34.494 -11.605
   18    HA   VAL   3           HA       VAL   3 -58.362  32.046 -11.270
   19    HB   VAL   3           HB       VAL   3 -55.423  32.759 -11.249
   20   1HG1  VAL   3          1HG1      VAL   3 -56.919  30.189 -11.689
   21   2HG1  VAL   3          2HG1      VAL   3 -55.392  30.482 -12.555
   22   3HG1  VAL   3          3HG1      VAL   3 -55.422  30.492 -10.775
   23   1HG2  VAL   3          1HG2      VAL   3 -56.065  33.776 -13.189
   24   2HG2  VAL   3          2HG2      VAL   3 -55.897  32.114 -13.805
   25   3HG2  VAL   3          3HG2      VAL   3 -57.505  32.750 -13.385
   26    H    ALA   4           H        ALA   4 -57.663  30.169  -9.874
   27    HA   ALA   4           HA       ALA   4 -57.739  31.041  -7.119
   28   1HB   ALA   4          1HB       ALA   4 -57.930  28.326  -8.482
   29   2HB   ALA   4          2HB       ALA   4 -58.061  28.576  -6.724
   30   3HB   ALA   4          3HB       ALA   4 -59.268  29.294  -7.817
   31    H    MET   5           H        MET   5 -55.895  31.441  -6.013
   32    HA   MET   5           HA       MET   5 -53.638  29.701  -6.614
   33   1HB   MET   5          1HB       MET   5 -53.541  32.144  -7.586
   34   2HB   MET   5          2HB       MET   5 -53.361  32.668  -5.923
   35   1HG   MET   5          1HG       MET   5 -51.268  31.532  -5.662
   36   2HG   MET   5          2HG       MET   5 -51.541  30.514  -7.062
   37   1HE   MET   5          1HE       MET   5 -48.799  32.363  -8.835
   38   2HE   MET   5          2HE       MET   5 -48.892  31.427  -7.323
   39   3HE   MET   5          3HE       MET   5 -49.780  30.880  -8.765
   40    H    VAL   6           H        VAL   6 -54.188  28.450  -4.721
   41    HA   VAL   6           HA       VAL   6 -53.590  29.887  -2.230
   42    HB   VAL   6           HB       VAL   6 -55.568  27.627  -2.569
   43   1HG1  VAL   6          1HG1      VAL   6 -54.702  27.613  -0.353
   44   2HG1  VAL   6          2HG1      VAL   6 -54.790  29.386  -0.228
   45   3HG1  VAL   6          3HG1      VAL   6 -56.285  28.421  -0.265
   46   1HG2  VAL   6          1HG2      VAL   6 -57.167  29.079  -3.129
   47   2HG2  VAL   6          2HG2      VAL   6 -56.750  30.142  -1.764
   48   3HG2  VAL   6          3HG2      VAL   6 -55.906  30.321  -3.321
   49    H    SER   7           H        SER   7 -52.861  28.267  -0.464
   50    HA   SER   7           HA       SER   7 -50.655  26.914  -1.499
   51   1HB   SER   7          1HB       SER   7 -50.389  26.097   0.875
   52   2HB   SER   7          2HB       SER   7 -50.559  27.835   0.732
   53    HG   SER   7           HG       SER   7 -52.999  26.465   1.030
   54    H    ALA   8           H        ALA   8 -51.204  25.247  -2.955
   55    HA   ALA   8           HA       ALA   8 -53.292  23.414  -2.418
   56   1HB   ALA   8          1HB       ALA   8 -51.644  22.215  -4.283
   57   2HB   ALA   8          2HB       ALA   8 -52.938  23.380  -4.654
   58   3HB   ALA   8          3HB       ALA   8 -51.257  23.940  -4.489
   59    H    GLU   9           H        GLU   9 -52.826  22.725  -0.213
   60    HA   GLU   9           HA       GLU   9 -50.468  21.687   0.633
   61   1HB   GLU   9          1HB       GLU   9 -52.773  22.112   1.850
   62   2HB   GLU   9          2HB       GLU   9 -53.091  20.431   1.473
   63   1HG   GLU   9          1HG       GLU   9 -51.593  19.666   3.027
   64   2HG   GLU   9          2HG       GLU   9 -50.385  20.859   2.594
   65    HE2  GLU   9           HE2      GLU   9 -52.294  19.953   4.962
   66    H    SER  10           H        SER  10 -50.179  19.211   1.284
   67    HA   SER  10           HA       SER  10 -50.724  17.710  -1.156
   68   1HB   SER  10          1HB       SER  10 -48.681  16.398  -0.615
   69   2HB   SER  10          2HB       SER  10 -48.329  18.103  -0.820
   70    HG   SER  10           HG       SER  10 -47.267  17.588   1.052
   71    H    SER  11           H        SER  11 -52.841  17.064  -0.260
   72    HA   SER  11           HA       SER  11 -54.206  15.764   0.818
   73   1HB   SER  11          1HB       SER  11 -51.813  14.142   0.357
   74   2HB   SER  11          2HB       SER  11 -52.673  13.588   1.780
   75    HG   SER  11           HG       SER  11 -53.416  13.478  -0.928
   76    H    GLY  12           H        GLY  12 -54.606  14.516   3.054
   77   1HA   GLY  12          1HA       GLY  12 -54.352  16.289   5.129
   78   2HA   GLY  12          2HA       GLY  12 -54.613  14.565   5.304
   79    H    CYS  13           H        CYS  13 -52.257  13.404   4.405
   80    HA   CYS  13           HA       CYS  13 -50.282  12.805   5.161
   81   1HB   CYS  13          1HB       CYS  13 -49.582  14.750   3.820
   82   2HB   CYS  13          2HB       CYS  13 -49.749  15.794   5.217
   83    HG   CYS  13           HG       CYS  13 -47.506  15.527   5.910
   84    H    ASN  14           H        ASN  14 -51.699  12.160   7.143
   85    HA   ASN  14           HA       ASN  14 -51.213  13.844   9.428
   86   1HB   ASN  14          1HB       ASN  14 -53.165  11.800   8.658
   87   2HB   ASN  14          2HB       ASN  14 -52.474  11.398  10.218
   88   1HD2  ASN  14          1HD2      ASN  14 -55.071  12.651   9.034
   89   2HD2  ASN  14          2HD2      ASN  14 -55.436  13.955  10.114
   90    H    SER  15           H        SER  15 -49.047  12.271   7.941
   91    HA   SER  15           HA       SER  15 -47.327  11.008   8.341
   92   1HB   SER  15          1HB       SER  15 -47.952  12.241  10.947
   93   2HB   SER  15          2HB       SER  15 -47.044  10.752  11.116
   94    HG   SER  15           HG       SER  15 -45.496  12.342  10.868
   95    H    HIS  16           H        HIS  16 -48.140   9.017   7.517
   96    HA   HIS  16           HA       HIS  16 -49.553   7.305   9.378
   97   1HB   HIS  16          1HB       HIS  16 -50.201   6.034   7.532
   98   2HB   HIS  16          2HB       HIS  16 -50.240   7.687   6.952
   99    HD1  HIS  16           HD1      HIS  16 -49.873   5.104   5.119
  100    HD2  HIS  16           HD2      HIS  16 -46.814   7.669   6.409
  101    HE1  HIS  16           HE1      HIS  16 -47.964   4.838   3.447
  102    H    MET  17           H        MET  17 -46.965   7.864  10.258
  103    HA   MET  17           HA       MET  17 -44.870   6.497   9.466
  104   1HB   MET  17          1HB       MET  17 -46.073   6.893  12.235
  105   2HB   MET  17          2HB       MET  17 -44.572   6.000  12.082
  106   1HG   MET  17          1HG       MET  17 -43.640   7.991  10.750
  107   2HG   MET  17          2HG       MET  17 -45.088   8.874  11.189
  108   1HE   MET  17          1HE       MET  17 -46.036   8.832  13.353
  109   2HE   MET  17          2HE       MET  17 -45.243   8.440  14.898
  110   3HE   MET  17          3HE       MET  17 -45.074  10.068  14.199
  111    HA   PRO  18           HA       PRO  18 -46.543   2.375   9.410
  112   1HB   PRO  18          1HB       PRO  18 -44.907   1.404   7.447
  113   2HB   PRO  18          2HB       PRO  18 -46.453   2.162   7.119
  114   1HG   PRO  18          1HG       PRO  18 -43.733   3.260   6.745
  115   2HG   PRO  18          2HG       PRO  18 -45.244   3.808   6.046
  116   1HD   PRO  18          1HD       PRO  18 -43.821   5.019   8.222
  117   2HD   PRO  18          2HD       PRO  18 -45.387   5.497   7.598
  118    H    TYR  19           H        TYR  19 -46.125   0.770  10.799
  119    HA   TYR  19           HA       TYR  19 -43.776   0.903  12.297
  120   1HB   TYR  19          1HB       TYR  19 -45.820  -0.168  13.123
  121   2HB   TYR  19          2HB       TYR  19 -45.962  -1.159  11.685
  122    HD1  TYR  19           HD1      TYR  19 -43.901  -0.657  14.752
  123    HD2  TYR  19           HD2      TYR  19 -45.028  -3.333  11.609
  124    HE1  TYR  19           HE1      TYR  19 -42.715  -2.566  15.941
  125    HE2  TYR  19           HE2      TYR  19 -43.838  -5.232  12.809
  126    HH   TYR  19           HH       TYR  19 -41.903  -5.384  14.460
  127    H    GLY  20           H        GLY  20 -42.067   1.023  10.631
  128   1HA   GLY  20          1HA       GLY  20 -41.029  -1.621  10.063
  129   2HA   GLY  20          2HA       GLY  20 -41.467  -0.687   8.647
  130    H    TYR  21           H        TYR  21 -40.050   0.848   7.862
  131    HA   TYR  21           HA       TYR  21 -37.445   0.929   8.792
  132   1HB   TYR  21          1HB       TYR  21 -37.273   2.655   7.075
  133   2HB   TYR  21          2HB       TYR  21 -38.571   1.612   6.529
  134    HD1  TYR  21           HD1      TYR  21 -37.887   4.819   8.304
  135    HD2  TYR  21           HD2      TYR  21 -40.745   2.469   6.156
  136    HE1  TYR  21           HE1      TYR  21 -39.455   6.817   8.189
  137    HE2  TYR  21           HE2      TYR  21 -42.304   4.475   6.049
  138    HH   TYR  21           HH       TYR  21 -41.817   7.136   6.119
  139    H    ALA  22           H        ALA  22 -40.285   2.462  10.068
  140    HA   ALA  22           HA       ALA  22 -39.130   4.822  11.052
  141   1HB   ALA  22          1HB       ALA  22 -41.636   3.356  11.204
  142   2HB   ALA  22          2HB       ALA  22 -41.194   4.011  12.799
  143   3HB   ALA  22          3HB       ALA  22 -41.334   5.100  11.398
  144    H    ALA  23           H        ALA  23 -39.238   1.440  12.210
  145    HA   ALA  23           HA       ALA  23 -38.038   2.215  14.734
  146   1HB   ALA  23          1HB       ALA  23 -39.562   0.519  15.110
  147   2HB   ALA  23          2HB       ALA  23 -39.262  -0.249  13.532
  148   3HB   ALA  23          3HB       ALA  23 -38.091  -0.450  14.857
  149    H    GLN  24           H        GLN  24 -36.809   2.366  11.822
  150    HA   GLN  24           HA       GLN  24 -34.578   0.588  12.201
  151   1HB   GLN  24          1HB       GLN  24 -35.898   1.440   9.952
  152   2HB   GLN  24          2HB       GLN  24 -34.549   2.557   9.960
  153   1HG   GLN  24          1HG       GLN  24 -33.470   0.848   8.867
  154   2HG   GLN  24          2HG       GLN  24 -33.195   0.253  10.492
  155   1HE2  GLN  24          1HE2      GLN  24 -33.942  -1.663  11.057
  156   2HE2  GLN  24          2HE2      GLN  24 -35.049  -2.647  10.158
  157    H    ALA  25           H        ALA  25 -35.476   3.535  13.437
  158    HA   ALA  25           HA       ALA  25 -33.255   5.165  12.994
  159   1HB   ALA  25          1HB       ALA  25 -35.237   6.137  13.874
  160   2HB   ALA  25          2HB       ALA  25 -35.329   4.950  15.197
  161   3HB   ALA  25          3HB       ALA  25 -34.061   6.199  15.209
  162    H    ARG  26           H        ARG  26 -33.668   2.224  14.827
  163    HA   ARG  26           HA       ARG  26 -31.673   2.756  16.724
  164   1HB   ARG  26          1HB       ARG  26 -33.566   0.702  16.203
  165   2HB   ARG  26          2HB       ARG  26 -32.009  -0.095  16.098
  166   1HG   ARG  26          1HG       ARG  26 -32.526   1.782  18.413
  167   2HG   ARG  26          2HG       ARG  26 -33.246   0.185  18.448
  168   1HD   ARG  26          1HD       ARG  26 -30.817  -0.667  17.856
  169   2HD   ARG  26          2HD       ARG  26 -30.299   0.918  18.392
  170    HE   ARG  26           HE       ARG  26 -32.104  -0.395  20.287
  171   1HH1  ARG  26          2HH2      ARG  26 -28.723  -0.060  19.283
  172   2HH1  ARG  26          1HH2      ARG  26 -28.089  -0.540  20.822
  173   1HH2  ARG  26          1HH       ARG  26 -29.604  -1.105  22.591
  174    H    ALA  27           H        ALA  27 -31.754   1.495  13.399
  175    HA   ALA  27           HA       ALA  27 -29.184   0.305  13.449
  176   1HB   ALA  27          1HB       ALA  27 -29.513   0.504  10.903
  177   2HB   ALA  27          2HB       ALA  27 -30.721  -0.446  11.800
  178   3HB   ALA  27          3HB       ALA  27 -31.101   1.214  11.281
  179    H    ARG  28           H        ARG  28 -30.460   3.587  12.961
  180    HA   ARG  28           HA       ARG  28 -28.274   4.634  11.652
  181   1HB   ARG  28          1HB       ARG  28 -30.710   5.599  12.432
  182   2HB   ARG  28          2HB       ARG  28 -29.708   6.366  13.648
  183   1HG   ARG  28          1HG       ARG  28 -28.174   7.046  11.605
  184   2HG   ARG  28          2HG       ARG  28 -29.587   6.683  10.633
  185   1HD   ARG  28          1HD       ARG  28 -30.409   8.742  11.122
  186   2HD   ARG  28          2HD       ARG  28 -30.556   8.257  12.800
  187    HE   ARG  28           HE       ARG  28 -28.593   9.449  13.313
  188   1HH1  ARG  28          2HH2      ARG  28 -28.904   9.152   9.796
  189   2HH1  ARG  28          1HH2      ARG  28 -27.617  10.262   9.464
  190   1HH2  ARG  28          1HH       ARG  28 -26.449  11.285  11.290
  191    H    GLU  29           H        GLU  29 -28.885   3.856  15.067
  192    HA   GLU  29           HA       GLU  29 -26.680   5.410  15.986
  193   1HB   GLU  29          1HB       GLU  29 -28.974   4.312  17.154
  194   2HB   GLU  29          2HB       GLU  29 -27.684   3.324  17.812
  195   1HG   GLU  29          1HG       GLU  29 -26.449   5.465  18.428
  196   2HG   GLU  29          2HG       GLU  29 -27.857   6.372  17.911
  197    HE2  GLU  29           HE2      GLU  29 -26.644   4.265  20.267
  198    H    ARG  30           H        ARG  30 -27.258   2.168  14.760
  199    HA   ARG  30           HA       ARG  30 -24.824   1.190  15.924
  200   1HB   ARG  30          1HB       ARG  30 -27.180   0.030  14.504
  201   2HB   ARG  30          2HB       ARG  30 -25.662  -0.772  14.156
  202   1HG   ARG  30          1HG       ARG  30 -25.956  -0.194  17.030
  203   2HG   ARG  30          2HG       ARG  30 -27.280  -1.171  16.426
  204   1HD   ARG  30          1HD       ARG  30 -25.185  -2.456  15.218
  205   2HD   ARG  30          2HD       ARG  30 -24.366  -1.844  16.641
  206    HE   ARG  30           HE       ARG  30 -26.875  -3.022  17.416
  207   1HH1  ARG  30          2HH2      ARG  30 -23.637  -3.937  16.308
  208   2HH1  ARG  30          1HH2      ARG  30 -23.676  -5.488  17.078
  209   1HH2  ARG  30          1HH       ARG  30 -25.620  -6.132  18.323
  210    H    GLU  31           H        GLU  31 -26.099   2.506  12.891
  211    HA   GLU  31           HA       GLU  31 -24.117   1.483  11.212
  212   1HB   GLU  31          1HB       GLU  31 -26.340   2.440  10.492
  213   2HB   GLU  31          2HB       GLU  31 -25.743   4.042  10.880
  214   1HG   GLU  31          1HG       GLU  31 -23.843   3.691   9.252
  215   2HG   GLU  31          2HG       GLU  31 -24.527   2.135   8.825
  216    HE2  GLU  31           HE2      GLU  31 -25.325   4.012   6.335
  217    H    ARG  32           H        ARG  32 -24.162   4.050  13.590
  218    HA   ARG  32           HA       ARG  32 -22.288   5.738  12.512
  219   1HB   ARG  32          1HB       ARG  32 -23.764   5.724  14.797
  220   2HB   ARG  32          2HB       ARG  32 -22.231   5.222  15.481
  221   1HG   ARG  32          1HG       ARG  32 -22.029   7.546  15.630
  222   2HG   ARG  32          2HG       ARG  32 -21.242   7.252  14.092
  223   1HD   ARG  32          1HD       ARG  32 -23.626   7.600  13.041
  224   2HD   ARG  32          2HD       ARG  32 -24.052   8.306  14.588
  225    HE   ARG  32           HE       ARG  32 -22.748  10.185  14.071
  226   1HH1  ARG  32          2HH2      ARG  32 -21.883   7.547  11.869
  227   2HH1  ARG  32          1HH2      ARG  32 -20.880   8.544  10.869
  228   1HH2  ARG  32          1HH       ARG  32 -20.625  10.866  11.408
  229    H    LEU  33           H        LEU  33 -21.991   2.561  14.060
  230    HA   LEU  33           HA       LEU  33 -19.122   2.861  14.369
  231   1HB   LEU  33          1HB       LEU  33 -21.125   1.446  15.708
  232   2HB   LEU  33          2HB       LEU  33 -20.206   0.217  14.861
  233    HG   LEU  33           HG       LEU  33 -18.411   2.087  16.152
  234   1HD1  LEU  33          1HD1      LEU  33 -19.000   1.349  18.511
  235   2HD1  LEU  33          2HD1      LEU  33 -20.052   2.581  17.772
  236   3HD1  LEU  33          3HD1      LEU  33 -20.592   0.887  17.863
  237   1HD2  LEU  33          1HD2      LEU  33 -17.589  -0.020  15.511
  238   2HD2  LEU  33          2HD2      LEU  33 -17.690  -0.081  17.287
  239   3HD2  LEU  33          3HD2      LEU  33 -18.933  -0.883  16.296
  240    H    ALA  34           H        ALA  34 -21.406   1.986  11.965
  241    HA   ALA  34           HA       ALA  34 -19.730   0.015  10.701
  242   1HB   ALA  34          1HB       ALA  34 -22.064  -0.326  10.456
  243   2HB   ALA  34          2HB       ALA  34 -22.356   1.382  10.046
  244   3HB   ALA  34          3HB       ALA  34 -21.535   0.314   8.882
  245    H    HIS  35           H        HIS  35 -19.284   3.210  11.204
  246    HA   HIS  35           HA       HIS  35 -18.622   3.895   8.470
  247   1HB   HIS  35          1HB       HIS  35 -18.614   6.080   9.138
  248   2HB   HIS  35          2HB       HIS  35 -19.749   5.407  10.290
  249    HD1  HIS  35           HD1      HIS  35 -17.876   7.998  10.705
  250    HD2  HIS  35           HD2      HIS  35 -17.256   4.170  12.305
  251    HE1  HIS  35           HE1      HIS  35 -16.410   8.315  12.770
  252    H    SER  36           H        SER  36 -17.209   2.318  11.150
  253    HA   SER  36           HA       SER  36 -14.563   3.278  10.560
  254   1HB   SER  36          1HB       SER  36 -15.870   1.715  12.728
  255   2HB   SER  36          2HB       SER  36 -14.236   1.206  12.355
  256    HG   SER  36           HG       SER  36 -14.795   3.140  13.955
  257    H    ARG  37           H        ARG  37 -16.759   0.736   9.643
  258    HA   ARG  37           HA       ARG  37 -14.628  -1.032   8.888
  259   1HB   ARG  37          1HB       ARG  37 -17.228  -1.470   9.702
  260   2HB   ARG  37          2HB       ARG  37 -17.421  -1.585   7.965
  261   1HG   ARG  37          1HG       ARG  37 -15.496  -3.243   7.916
  262   2HG   ARG  37          2HG       ARG  37 -15.461  -3.193   9.668
  263   1HD   ARG  37          1HD       ARG  37 -18.165  -3.693   8.519
  264   2HD   ARG  37          2HD       ARG  37 -16.995  -4.950   8.172
  265    HE   ARG  37           HE       ARG  37 -16.845  -5.459  10.487
  266   1HH1  ARG  37          2HH2      ARG  37 -18.849  -2.583   9.970
  267   2HH1  ARG  37          1HH2      ARG  37 -19.481  -2.582  11.583
  268   1HH2  ARG  37          1HH       ARG  37 -18.780  -4.281  13.120
  269    H    ALA  38           H        ALA  38 -15.435   1.794   7.662
  270    HA   ALA  38           HA       ALA  38 -16.138   1.113   4.966
  271   1HB   ALA  38          1HB       ALA  38 -15.881   3.495   6.654
  272   2HB   ALA  38          2HB       ALA  38 -15.217   3.748   5.022
  273   3HB   ALA  38          3HB       ALA  38 -16.904   3.218   5.225
  274    H    ALA  39           H        ALA  39 -13.200   2.345   6.704
  275    HA   ALA  39           HA       ALA  39 -11.589   2.290   4.382
  276   1HB   ALA  39          1HB       ALA  39 -11.247   2.688   7.327
  277   2HB   ALA  39          2HB       ALA  39  -9.800   2.238   6.393
  278   3HB   ALA  39          3HB       ALA  39 -10.714   3.704   5.967
  279    H    ALA  40           H        ALA  40 -11.925   0.078   7.244
  280    HA   ALA  40           HA       ALA  40 -10.073  -1.780   6.684
  281   1HB   ALA  40          1HB       ALA  40 -12.737  -2.903   7.352
  282   2HB   ALA  40          2HB       ALA  40 -11.195  -3.013   8.233
  283   3HB   ALA  40          3HB       ALA  40 -12.205  -1.556   8.387
  284    H    ALA  41           H        ALA  41 -13.488  -1.964   5.431
  285    HA   ALA  41           HA       ALA  41 -14.322  -2.842   3.580
  286   1HB   ALA  41          1HB       ALA  41 -12.896  -1.294   2.382
  287   2HB   ALA  41          2HB       ALA  41 -11.492  -2.372   2.565
  288   3HB   ALA  41          3HB       ALA  41 -12.856  -2.856   1.530
  289    H    ALA  42           H        ALA  42 -14.180  -4.715   5.352
  290    HA   ALA  42           HA       ALA  42 -12.526  -6.887   4.296
  291   1HB   ALA  42          1HB       ALA  42 -12.221  -7.378   6.465
  292   2HB   ALA  42          2HB       ALA  42 -13.220  -5.975   6.911
  293   3HB   ALA  42          3HB       ALA  42 -13.976  -7.570   6.687
  294    H    ALA  43           H        ALA  43 -15.888  -6.319   5.574
  295    HA   ALA  43           HA       ALA  43 -17.017  -8.642   4.699
  296   1HB   ALA  43          1HB       ALA  43 -19.091  -6.966   4.425
  297   2HB   ALA  43          2HB       ALA  43 -18.424  -7.386   6.021
  298   3HB   ALA  43          3HB       ALA  43 -17.968  -5.852   5.241
  299    H    VAL  44           H        VAL  44 -15.810  -5.933   2.825
  300    HA   VAL  44           HA       VAL  44 -17.277  -6.818   0.468
  301    HB   VAL  44           HB       VAL  44 -16.024  -4.356   1.419
  302   1HG1  VAL  44          1HG1      VAL  44 -15.465  -5.324  -1.391
  303   2HG1  VAL  44          2HG1      VAL  44 -15.516  -3.595  -0.974
  304   3HG1  VAL  44          3HG1      VAL  44 -14.327  -4.665  -0.193
  305   1HG2  VAL  44          1HG2      VAL  44 -18.003  -3.547   0.773
  306   2HG2  VAL  44          2HG2      VAL  44 -17.758  -4.118  -0.895
  307   3HG2  VAL  44          3HG2      VAL  44 -18.465  -5.206   0.323
  308    H    ALA  45           H        ALA  45 -14.070  -6.846   1.996
  309    HA   ALA  45           HA       ALA  45 -12.415  -7.308  -0.101
  310   1HB   ALA  45          1HB       ALA  45 -11.925  -7.169   2.410
  311   2HB   ALA  45          2HB       ALA  45 -12.331  -8.901   2.483
  312   3HB   ALA  45          3HB       ALA  45 -10.965  -8.348   1.484
  313    H    ALA  46           H        ALA  46 -14.912  -9.448   1.269
  314    HA   ALA  46           HA       ALA  46 -13.988 -11.680  -0.330
  315   1HB   ALA  46          1HB       ALA  46 -16.587 -12.010   0.928
  316   2HB   ALA  46          2HB       ALA  46 -15.062 -12.872   1.245
  317   3HB   ALA  46          3HB       ALA  46 -15.412 -11.342   2.086
  318    H    ALA  47           H        ALA  47 -16.462  -9.111  -0.317
  319    HA   ALA  47           HA       ALA  47 -17.794 -10.313  -2.600
  320   1HB   ALA  47          1HB       ALA  47 -19.573  -9.142  -1.864
  321   2HB   ALA  47          2HB       ALA  47 -18.601  -8.745  -0.427
  322   3HB   ALA  47          3HB       ALA  47 -18.642  -7.626  -1.811
  323    H    THR  48           H        THR  48 -14.895  -9.172  -2.500
  324    HA   THR  48           HA       THR  48 -14.520  -6.824  -3.714
  325    HB   THR  48           HB       THR  48 -13.263  -9.557  -3.948
  326    HG1  THR  48           HG1      THR  48 -12.878  -7.924  -2.229
  327   1HG2  THR  48          1HG2      THR  48 -12.312  -7.103  -5.514
  328   2HG2  THR  48          2HG2      THR  48 -11.497  -8.683  -5.419
  329   3HG2  THR  48          3HG2      THR  48 -13.053  -8.533  -6.271
  330    H    ALA  49           H        ALA  49 -15.732  -5.795  -5.181
  331    HA   ALA  49           HA       ALA  49 -17.399  -6.941  -7.007
  332   1HB   ALA  49          1HB       ALA  49 -15.843  -4.386  -7.520
  333   2HB   ALA  49          2HB       ALA  49 -17.513  -4.779  -7.997
  334   3HB   ALA  49          3HB       ALA  49 -17.120  -4.490  -6.285
  335    H    ALA  50           H        ALA  50 -17.112  -8.215  -8.765
  336    HA   ALA  50           HA       ALA  50 -14.421  -8.578  -9.751
  337   1HB   ALA  50          1HB       ALA  50 -15.232 -10.655 -10.017
  338   2HB   ALA  50          2HB       ALA  50 -16.862 -10.100  -9.566
  339   3HB   ALA  50          3HB       ALA  50 -16.340 -10.043 -11.267
  340    H    VAL  51           H        VAL  51 -15.032  -5.969 -10.220
  341    HA   VAL  51           HA       VAL  51 -15.356  -5.980 -13.118
  342    HB   VAL  51           HB       VAL  51 -16.822  -4.105 -11.252
  343   1HG1  VAL  51          1HG1      VAL  51 -17.544  -4.253 -14.120
  344   2HG1  VAL  51          2HG1      VAL  51 -17.422  -2.848 -13.034
  345   3HG1  VAL  51          3HG1      VAL  51 -15.954  -3.537 -13.767
  346   1HG2  VAL  51          1HG2      VAL  51 -17.631  -6.628 -12.636
  347   2HG2  VAL  51          2HG2      VAL  51 -18.142  -5.967 -11.064
  348   3HG2  VAL  51          3HG2      VAL  51 -18.810  -5.296 -12.571
  349    H    GLU  52           H        GLU  52 -12.899  -6.003 -12.097
  350    HA   GLU  52           HA       GLU  52 -12.173  -3.192 -11.843
  351   1HB   GLU  52          1HB       GLU  52 -11.569  -4.884  -9.985
  352   2HB   GLU  52          2HB       GLU  52 -10.423  -5.573 -11.117
  353   1HG   GLU  52          1HG       GLU  52  -9.502  -3.154 -11.399
  354   2HG   GLU  52          2HG       GLU  52 -10.444  -2.750  -9.978
  355    HE2  GLU  52           HE2      GLU  52  -7.757  -4.355 -11.127
  356    H    GLY  53           H        GLY  53 -10.302  -2.405 -13.061
  357   1HA   GLY  53          1HA       GLY  53  -8.816  -2.384 -14.778
  358   2HA   GLY  53          2HA       GLY  53  -9.074  -4.098 -15.034
  359    H    THR  54           H        THR  54 -10.194  -0.814 -15.813
  360    HA   THR  54           HA       THR  54 -12.501  -1.210 -17.160
  361    HB   THR  54           HB       THR  54 -11.203   0.951 -16.780
  362    HG1  THR  54           HG1      THR  54 -12.531   1.626 -18.424
  363   1HG2  THR  54          1HG2      THR  54  -9.075  -0.138 -18.000
  364   2HG2  THR  54          2HG2      THR  54  -9.909   0.428 -19.466
  365   3HG2  THR  54          3HG2      THR  54  -9.440   1.592 -18.204
  366    H    GLY  55           H        GLY  55 -13.204  -2.571 -18.669
  367   1HA   GLY  55          1HA       GLY  55 -11.645  -4.404 -20.003
  368   2HA   GLY  55          2HA       GLY  55 -13.237  -3.870 -20.504
  369    H    GLY  56           H        GLY  56 -10.451  -4.446 -21.886
  370   1HA   GLY  56          1HA       GLY  56 -10.485  -1.990 -23.535
  371   2HA   GLY  56          2HA       GLY  56  -9.000  -2.791 -23.063
  372    H    SER  57           H        SER  57  -9.549  -2.416 -25.772
  373    HA   SER  57           HA       SER  57 -10.443  -5.057 -26.615
  374   1HB   SER  57          1HB       SER  57 -10.744  -3.990 -28.872
  375   2HB   SER  57          2HB       SER  57 -11.763  -3.293 -27.628
  376    HG   SER  57           HG       SER  57 -10.255  -1.527 -27.426
  377    H    GLY  58           H        GLY  58  -8.854  -6.466 -27.253
  378   1HA   GLY  58          1HA       GLY  58  -6.291  -5.298 -28.163
  379   2HA   GLY  58          2HA       GLY  58  -6.420  -6.742 -27.179
  380    H    GLY  59           H        GLY  59  -5.116  -7.700 -29.017
  381   1HA   GLY  59          1HA       GLY  59  -6.045  -9.607 -30.422
  382   2HA   GLY  59          2HA       GLY  59  -6.799  -8.332 -31.358
  383    H    GLY  60           H        GLY  60  -3.742  -9.906 -30.475
  384   1HA   GLY  60          1HA       GLY  60  -2.434  -8.447 -32.690
  385   2HA   GLY  60          2HA       GLY  60  -1.628  -8.748 -31.163
  386    HA   PRO  61           HA       PRO  61  -2.085 -12.794 -33.645
  387   1HB   PRO  61          1HB       PRO  61  -2.119 -12.520 -36.364
  388   2HB   PRO  61          2HB       PRO  61  -3.567 -12.759 -35.407
  389   1HG   PRO  61          1HG       PRO  61  -2.577 -10.284 -36.683
  390   2HG   PRO  61          2HG       PRO  61  -4.189 -10.649 -36.100
  391   1HD   PRO  61          1HD       PRO  61  -2.232  -8.995 -34.811
  392   2HD   PRO  61          2HD       PRO  61  -3.799  -9.455 -34.175
  393    H    HIS  62           H        HIS  62  -0.443 -14.184 -34.552
  394    HA   HIS  62           HA       HIS  62   1.809 -12.939 -35.710
  395   1HB   HIS  62          1HB       HIS  62   1.938 -12.290 -33.224
  396   2HB   HIS  62          2HB       HIS  62   2.296 -13.978 -32.917
  397    HD1  HIS  62           HD1      HIS  62   4.742 -13.859 -32.297
  398    HD2  HIS  62           HD2      HIS  62   3.884 -11.849 -35.878
  399    HE1  HIS  62           HE1      HIS  62   6.991 -13.178 -33.291
  400    H    HIS  63           H        HIS  63   3.666 -14.637 -35.901
  401    HA   HIS  63           HA       HIS  63   4.211 -16.574 -36.798
  402   1HB   HIS  63          1HB       HIS  63   4.581 -17.428 -34.704
  403   2HB   HIS  63          2HB       HIS  63   2.910 -17.259 -34.205
  404    HD1  HIS  63           HD1      HIS  63   1.572 -19.376 -34.141
  405    HD2  HIS  63           HD2      HIS  63   4.909 -19.685 -36.663
  406    HE1  HIS  63           HE1      HIS  63   1.648 -21.800 -34.931
  407    H    HIS  64           H        HIS  64   2.974 -16.184 -38.760
  408    HA   HIS  64           HA       HIS  64   0.383 -17.489 -38.846
  409   1HB   HIS  64          1HB       HIS  64   1.330 -15.152 -39.947
  410   2HB   HIS  64          2HB       HIS  64   1.436 -16.254 -41.304
  411    HD1  HIS  64           HD1      HIS  64  -0.577 -13.997 -41.507
  412    HD2  HIS  64           HD2      HIS  64  -1.516 -17.739 -39.859
  413    HE1  HIS  64           HE1      HIS  64  -3.110 -14.241 -41.685
  414    H    HIS  65           H        HIS  65   3.404 -17.412 -40.878
  415    HA   HIS  65           HA       HIS  65   4.439 -18.982 -42.007
  416   1HB   HIS  65          1HB       HIS  65   3.963 -20.134 -39.596
  417   2HB   HIS  65          2HB       HIS  65   3.157 -21.284 -40.644
  418    HD1  HIS  65           HD1      HIS  65   4.728 -22.286 -42.667
  419    HD2  HIS  65           HD2      HIS  65   6.693 -20.435 -39.456
  420    HE1  HIS  65           HE1      HIS  65   7.156 -23.062 -42.772
  421    H    GLN  66           H        GLN  66   3.881 -19.155 -44.115
  422    HA   GLN  66           HA       GLN  66   1.404 -20.590 -44.661
  423   1HB   GLN  66          1HB       GLN  66   1.410 -17.975 -44.997
  424   2HB   GLN  66          2HB       GLN  66   2.346 -18.324 -46.437
  425   1HG   GLN  66          1HG       GLN  66   0.517 -19.076 -47.565
  426   2HG   GLN  66          2HG       GLN  66   0.033 -20.116 -46.241
  427   1HE2  GLN  66          1HE2      GLN  66  -0.434 -17.154 -47.878
  428   2HE2  GLN  66          2HE2      GLN  66  -1.713 -16.497 -46.912
  429    H    THR  67           H        THR  67   1.438 -21.053 -47.282
  430    HA   THR  67           HA       THR  67   3.510 -22.902 -47.641
  431    HB   THR  67           HB       THR  67   1.690 -21.608 -49.736
  432    HG1  THR  67           HG1      THR  67   0.165 -22.566 -48.451
  433   1HG2  THR  67          1HG2      THR  67   1.724 -24.256 -50.296
  434   2HG2  THR  67          2HG2      THR  67   2.938 -23.148 -50.981
  435   3HG2  THR  67          3HG2      THR  67   3.336 -24.130 -49.550
  436    H    ARG  68           H        ARG  68   4.875 -22.885 -49.778
  437    HA   ARG  68           HA       ARG  68   6.929 -21.261 -49.435
  438   1HB   ARG  68          1HB       ARG  68   7.538 -21.689 -51.813
  439   2HB   ARG  68          2HB       ARG  68   6.892 -23.135 -51.062
  440   1HG   ARG  68          1HG       ARG  68   4.568 -22.249 -52.009
  441   2HG   ARG  68          2HG       ARG  68   5.578 -21.307 -53.087
  442   1HD   ARG  68          1HD       ARG  68   5.971 -23.129 -54.385
  443   2HD   ARG  68          2HD       ARG  68   6.609 -24.014 -53.013
  444    HE   ARG  68           HE       ARG  68   3.665 -23.843 -53.120
  445   1HH1  ARG  68          2HH2      ARG  68   6.538 -25.748 -53.938
  446   2HH1  ARG  68          1HH2      ARG  68   5.661 -27.234 -54.095
  447   1HH2  ARG  68          1HH       ARG  68   3.292 -27.242 -53.731
  448    H    GLY  69           H        GLY  69   7.774 -19.347 -50.742
  449   1HA   GLY  69          1HA       GLY  69   5.585 -17.424 -51.182
  450   2HA   GLY  69          2HA       GLY  69   7.242 -17.041 -50.757
  451    H    ALA  70           H        ALA  70   8.904 -18.197 -52.476
  452    HA   ALA  70           HA       ALA  70   8.020 -18.406 -55.130
  453   1HB   ALA  70          1HB       ALA  70   7.611 -15.989 -54.909
  454   2HB   ALA  70          2HB       ALA  70   9.286 -15.745 -54.359
  455   3HB   ALA  70          3HB       ALA  70   8.967 -16.297 -56.021
  456    H    TYR  71           H        TYR  71   9.383 -20.113 -55.479
  457    HA   TYR  71           HA       TYR  71  12.239 -19.574 -55.037
  458   1HB   TYR  71          1HB       TYR  71  10.387 -21.573 -53.943
  459   2HB   TYR  71          2HB       TYR  71  11.562 -22.399 -54.948
  460    HD1  TYR  71           HD1      TYR  71  11.638 -19.614 -52.417
  461    HD2  TYR  71           HD2      TYR  71  13.358 -23.282 -53.792
  462    HE1  TYR  71           HE1      TYR  71  13.321 -19.548 -50.513
  463    HE2  TYR  71           HE2      TYR  71  15.035 -23.203 -51.884
  464    HH   TYR  71           HH       TYR  71  15.319 -20.385 -49.850
  465    H    SER  72           H        SER  72  13.476 -19.816 -56.836
  466    HA   SER  72           HA       SER  72  12.572 -21.693 -58.830
  467   1HB   SER  72          1HB       SER  72  12.831 -20.053 -60.669
  468   2HB   SER  72          2HB       SER  72  11.562 -19.573 -59.560
  469    HG   SER  72           HG       SER  72  14.133 -18.585 -58.930
  470    H    SER  73           H        SER  73  14.354 -22.034 -60.542
  471    HA   SER  73           HA       SER  73  16.931 -21.068 -59.804
  472   1HB   SER  73          1HB       SER  73  16.249 -23.256 -58.402
  473   2HB   SER  73          2HB       SER  73  16.739 -24.073 -59.873
  474    HG   SER  73           HG       SER  73  18.759 -22.601 -59.643
  475    H    HIS  74           H        HIS  74  18.619 -21.823 -61.435
  476    HA   HIS  74           HA       HIS  74  17.669 -23.190 -63.744
  477   1HB   HIS  74          1HB       HIS  74  16.663 -21.007 -64.164
  478   2HB   HIS  74          2HB       HIS  74  18.207 -20.213 -63.929
  479    HD1  HIS  74           HD1      HIS  74  19.749 -20.027 -65.938
  480    HD2  HIS  74           HD2      HIS  74  16.554 -22.670 -66.572
  481    HE1  HIS  74           HE1      HIS  74  19.816 -20.649 -68.411
  482    H    ASP  75           H        ASP  75  19.500 -24.426 -62.701
  483    HA   ASP  75           HA       ASP  75  22.064 -23.228 -62.834
  484   1HB   ASP  75          1HB       ASP  75  21.015 -26.028 -62.298
  485   2HB   ASP  75          2HB       ASP  75  22.736 -25.755 -62.483
  486    HD2  ASP  75           HD2      ASP  75  21.245 -26.598 -60.233
  Start of MODEL    7
    1    H    MET   1           H        MET   1 -18.951   1.653  -5.061
    2    HA   MET   1           HA       MET   1 -19.980   4.222  -5.991
    3   1HB   MET   1          1HB       MET   1 -18.000   2.303  -7.046
    4   2HB   MET   1          2HB       MET   1 -19.259   2.609  -8.226
    5   1HG   MET   1          1HG       MET   1 -18.502   4.723  -8.639
    6   2HG   MET   1          2HG       MET   1 -18.388   5.103  -6.933
    7   1HE   MET   1          1HE       MET   1 -16.494   4.376  -5.393
    8   2HE   MET   1          2HE       MET   1 -14.840   4.669  -5.984
    9   3HE   MET   1          3HE       MET   1 -16.086   5.928  -6.165
   10    H    GLU   2           H        GLU   2 -22.195   3.825  -5.502
   11    HA   GLU   2           HA       GLU   2 -23.355   1.395  -6.473
   12   1HB   GLU   2          1HB       GLU   2 -24.033   2.470  -4.299
   13   2HB   GLU   2          2HB       GLU   2 -24.689   3.824  -5.197
   14   1HG   GLU   2          1HG       GLU   2 -26.627   2.581  -5.069
   15   2HG   GLU   2          2HG       GLU   2 -25.971   1.833  -6.511
   16    HE2  GLU   2           HE2      GLU   2 -25.878  -0.223  -6.398
   17    H    VAL   3           H        VAL   3 -22.810   1.761  -8.784
   18    HA   VAL   3           HA       VAL   3 -23.973   3.998 -10.118
   19    HB   VAL   3           HB       VAL   3 -22.867   1.419 -11.243
   20   1HG1  VAL   3          1HG1      VAL   3 -22.434   2.746 -13.256
   21   2HG1  VAL   3          2HG1      VAL   3 -24.165   2.769 -12.843
   22   3HG1  VAL   3          3HG1      VAL   3 -23.144   4.181 -12.479
   23   1HG2  VAL   3          1HG2      VAL   3 -20.781   2.946 -11.552
   24   2HG2  VAL   3          2HG2      VAL   3 -21.499   3.910 -10.240
   25   3HG2  VAL   3          3HG2      VAL   3 -21.083   2.202  -9.964
   26    H    ALA   4           H        ALA   4 -25.606   3.770 -11.889
   27    HA   ALA   4           HA       ALA   4 -27.922   2.555 -10.911
   28   1HB   ALA   4          1HB       ALA   4 -28.110   4.465 -12.324
   29   2HB   ALA   4          2HB       ALA   4 -27.112   3.719 -13.595
   30   3HB   ALA   4          3HB       ALA   4 -28.752   3.104 -13.275
   31    H    MET   5           H        MET   5 -28.610   0.475 -10.970
   32    HA   MET   5           HA       MET   5 -27.011  -1.509 -12.038
   33   1HB   MET   5          1HB       MET   5 -29.037  -2.968 -11.554
   34   2HB   MET   5          2HB       MET   5 -28.613  -1.923 -10.212
   35   1HG   MET   5          1HG       MET   5 -30.461  -0.579 -12.066
   36   2HG   MET   5          2HG       MET   5 -31.131  -2.090 -11.483
   37   1HE   MET   5          1HE       MET   5 -30.424   1.670 -10.497
   38   2HE   MET   5          2HE       MET   5 -31.915   0.948 -11.149
   39   3HE   MET   5          3HE       MET   5 -31.874   1.546  -9.473
   40    H    VAL   6           H        VAL   6 -27.450  -3.046 -13.807
   41    HA   VAL   6           HA       VAL   6 -27.974  -1.804 -16.212
   42    HB   VAL   6           HB       VAL   6 -28.310  -4.745 -15.621
   43   1HG1  VAL   6          1HG1      VAL   6 -27.859  -3.091 -18.064
   44   2HG1  VAL   6          2HG1      VAL   6 -27.026  -4.661 -17.968
   45   3HG1  VAL   6          3HG1      VAL   6 -28.801  -4.585 -17.847
   46   1HG2  VAL   6          1HG2      VAL   6 -26.263  -4.469 -14.630
   47   2HG2  VAL   6          2HG2      VAL   6 -25.744  -4.646 -16.323
   48   3HG2  VAL   6          3HG2      VAL   6 -25.862  -3.027 -15.593
   49    H    SER   7           H        SER   7 -29.762  -2.467 -17.808
   50    HA   SER   7           HA       SER   7 -31.854  -2.473 -18.383
   51   1HB   SER   7          1HB       SER   7 -31.914  -4.632 -17.078
   52   2HB   SER   7          2HB       SER   7 -32.457  -3.736 -15.672
   53    HG   SER   7           HG       SER   7 -33.837  -3.945 -18.213
   54    H    ALA   8           H        ALA   8 -33.995  -1.351 -18.009
   55    HA   ALA   8           HA       ALA   8 -33.536   1.041 -16.462
   56   1HB   ALA   8          1HB       ALA   8 -34.441   1.144 -18.754
   57   2HB   ALA   8          2HB       ALA   8 -35.840   0.166 -18.252
   58   3HB   ALA   8          3HB       ALA   8 -35.607   1.797 -17.578
   59    H    GLU   9           H        GLU   9 -33.475  -0.632 -14.498
   60    HA   GLU   9           HA       GLU   9 -35.919  -1.654 -13.637
   61   1HB   GLU   9          1HB       GLU   9 -33.461  -2.202 -12.900
   62   2HB   GLU   9          2HB       GLU   9 -33.663  -0.883 -11.764
   63   1HG   GLU   9          1HG       GLU   9 -35.293  -2.007 -10.518
   64   2HG   GLU   9          2HG       GLU   9 -35.859  -2.940 -11.889
   65    HE2  GLU   9           HE2      GLU   9 -34.818  -5.311 -10.230
   66    H    SER  10           H        SER  10 -37.219  -0.944 -11.739
   67    HA   SER  10           HA       SER  10 -36.876   1.528 -10.570
   68   1HB   SER  10          1HB       SER  10 -37.809   1.822 -13.200
   69   2HB   SER  10          2HB       SER  10 -39.269   1.936 -12.238
   70    HG   SER  10           HG       SER  10 -38.682   3.935 -11.781
   71    H    SER  11           H        SER  11 -38.620   1.972  -9.013
   72    HA   SER  11           HA       SER  11 -40.194  -0.418  -8.574
   73   1HB   SER  11          1HB       SER  11 -39.504   1.936  -6.763
   74   2HB   SER  11          2HB       SER  11 -40.560   0.624  -6.280
   75    HG   SER  11           HG       SER  11 -38.494   0.091  -5.547
   76    H    GLY  12           H        GLY  12 -42.286  -0.401  -9.303
   77   1HA   GLY  12          1HA       GLY  12 -43.596   2.196  -9.711
   78   2HA   GLY  12          2HA       GLY  12 -44.047   0.661 -10.425
   79    H    CYS  13           H        CYS  13 -43.770   2.320  -7.210
   80    HA   CYS  13           HA       CYS  13 -45.068   2.300  -5.441
   81   1HB   CYS  13          1HB       CYS  13 -47.131   1.246  -7.392
   82   2HB   CYS  13          2HB       CYS  13 -47.498   1.545  -5.704
   83    HG   CYS  13           HG       CYS  13 -48.357   3.575  -7.069
   84    H    ASN  14           H        ASN  14 -43.647   0.766  -4.392
   85    HA   ASN  14           HA       ASN  14 -44.315  -2.015  -4.731
   86   1HB   ASN  14          1HB       ASN  14 -41.975  -0.470  -3.885
   87   2HB   ASN  14          2HB       ASN  14 -42.348  -1.683  -2.676
   88   1HD2  ASN  14          1HD2      ASN  14 -42.066  -3.809  -3.085
   89   2HD2  ASN  14          2HD2      ASN  14 -41.358  -4.456  -4.527
   90    H    SER  15           H        SER  15 -46.118   0.050  -3.368
   91    HA   SER  15           HA       SER  15 -47.289   0.352  -1.556
   92   1HB   SER  15          1HB       SER  15 -48.092  -1.694  -0.396
   93   2HB   SER  15          2HB       SER  15 -48.107  -1.886  -2.138
   94    HG   SER  15           HG       SER  15 -47.141  -3.748  -1.434
   95    H    HIS  16           H        HIS  16 -45.843   1.747  -0.393
   96    HA   HIS  16           HA       HIS  16 -44.110   0.403   1.531
   97   1HB   HIS  16          1HB       HIS  16 -43.160   2.748   1.799
   98   2HB   HIS  16          2HB       HIS  16 -42.848   1.923   0.285
   99    HD1  HIS  16           HD1      HIS  16 -42.691   3.866  -1.321
  100    HD2  HIS  16           HD2      HIS  16 -46.135   4.023   1.069
  101    HE1  HIS  16           HE1      HIS  16 -44.103   5.788  -2.227
  102    H    MET  17           H        MET  17 -46.725   0.049   2.189
  103    HA   MET  17           HA       MET  17 -47.739   2.206   3.696
  104   1HB   MET  17          1HB       MET  17 -48.557  -0.430   2.810
  105   2HB   MET  17          2HB       MET  17 -48.804  -0.365   4.544
  106   1HG   MET  17          1HG       MET  17 -49.761   2.130   3.636
  107   2HG   MET  17          2HG       MET  17 -50.288   1.006   2.399
  108   1HE   MET  17          1HE       MET  17 -52.954  -0.212   3.000
  109   2HE   MET  17          2HE       MET  17 -53.515   1.109   4.053
  110   3HE   MET  17          3HE       MET  17 -52.433   1.460   2.684
  111    HA   PRO  18           HA       PRO  18 -46.070  -0.392   7.300
  112   1HB   PRO  18          1HB       PRO  18 -44.397  -2.496   6.808
  113   2HB   PRO  18          2HB       PRO  18 -46.122  -2.681   7.053
  114   1HG   PRO  18          1HG       PRO  18 -44.583  -2.823   4.534
  115   2HG   PRO  18          2HG       PRO  18 -46.199  -3.412   4.867
  116   1HD   PRO  18          1HD       PRO  18 -45.503  -1.037   3.418
  117   2HD   PRO  18          2HD       PRO  18 -47.117  -1.565   3.851
  118    H    TYR  19           H        TYR  19 -45.124   1.734   7.386
  119    HA   TYR  19           HA       TYR  19 -42.459   2.000   6.415
  120   1HB   TYR  19          1HB       TYR  19 -44.531   3.482   8.071
  121   2HB   TYR  19          2HB       TYR  19 -42.874   4.028   8.233
  122    HD1  TYR  19           HD1      TYR  19 -41.651   4.202   5.759
  123    HD2  TYR  19           HD2      TYR  19 -45.822   4.687   6.580
  124    HE1  TYR  19           HE1      TYR  19 -41.911   5.596   3.649
  125    HE2  TYR  19           HE2      TYR  19 -46.068   6.080   4.468
  126    HH   TYR  19           HH       TYR  19 -44.792   6.202   2.235
  127    H    GLY  20           H        GLY  20 -41.877  -0.176   7.620
  128   1HA   GLY  20          1HA       GLY  20 -41.519  -0.068  10.439
  129   2HA   GLY  20          2HA       GLY  20 -40.836  -1.231   9.320
  130    H    TYR  21           H        TYR  21 -40.004   1.672   7.951
  131    HA   TYR  21           HA       TYR  21 -37.301   1.443   8.620
  132   1HB   TYR  21          1HB       TYR  21 -39.226   3.367   7.281
  133   2HB   TYR  21          2HB       TYR  21 -37.657   4.026   7.698
  134    HD1  TYR  21           HD1      TYR  21 -35.584   3.065   6.675
  135    HD2  TYR  21           HD2      TYR  21 -39.493   1.837   5.445
  136    HE1  TYR  21           HE1      TYR  21 -34.610   2.076   4.545
  137    HE2  TYR  21           HE2      TYR  21 -38.506   0.852   3.319
  138    HH   TYR  21           HH       TYR  21 -35.926  -0.093   2.803
  139    H    ALA  22           H        ALA  22 -39.996   3.081  10.200
  140    HA   ALA  22           HA       ALA  22 -38.520   5.045  11.554
  141   1HB   ALA  22          1HB       ALA  22 -41.183   4.316  11.255
  142   2HB   ALA  22          2HB       ALA  22 -40.860   3.962  12.969
  143   3HB   ALA  22          3HB       ALA  22 -40.570   5.597  12.329
  144    H    ALA  23           H        ALA  23 -39.243   1.592  12.200
  145    HA   ALA  23           HA       ALA  23 -38.106   1.708  14.831
  146   1HB   ALA  23          1HB       ALA  23 -39.025  -0.556  13.018
  147   2HB   ALA  23          2HB       ALA  23 -38.435  -0.789  14.681
  148   3HB   ALA  23          3HB       ALA  23 -39.910   0.161  14.386
  149    H    GLN  24           H        GLN  24 -36.826   1.870  11.719
  150    HA   GLN  24           HA       GLN  24 -34.550   0.213  12.319
  151   1HB   GLN  24          1HB       GLN  24 -35.727   1.476   9.906
  152   2HB   GLN  24          2HB       GLN  24 -33.975   1.509   9.937
  153   1HG   GLN  24          1HG       GLN  24 -35.373  -1.071  10.658
  154   2HG   GLN  24          2HG       GLN  24 -35.306  -0.605   8.970
  155   1HE2  GLN  24          1HE2      GLN  24 -33.812  -2.321  11.311
  156   2HE2  GLN  24          2HE2      GLN  24 -32.187  -2.381  10.717
  157    H    ALA  25           H        ALA  25 -35.560   3.243  13.223
  158    HA   ALA  25           HA       ALA  25 -33.378   4.885  12.647
  159   1HB   ALA  25          1HB       ALA  25 -35.498   4.840  14.815
  160   2HB   ALA  25          2HB       ALA  25 -34.261   6.117  14.733
  161   3HB   ALA  25          3HB       ALA  25 -35.398   5.891  13.382
  162    H    ARG  26           H        ARG  26 -33.748   2.147  14.780
  163    HA   ARG  26           HA       ARG  26 -31.809   2.938  16.643
  164   1HB   ARG  26          1HB       ARG  26 -33.680   0.922  16.513
  165   2HB   ARG  26          2HB       ARG  26 -32.228   0.012  16.145
  166   1HG   ARG  26          1HG       ARG  26 -31.770  -0.047  18.365
  167   2HG   ARG  26          2HG       ARG  26 -31.483   1.681  18.307
  168   1HD   ARG  26          1HD       ARG  26 -34.317   1.394  18.355
  169   2HD   ARG  26          2HD       ARG  26 -33.714   0.231  19.518
  170    HE   ARG  26           HE       ARG  26 -32.387   2.805  19.798
  171   1HH1  ARG  26          2HH2      ARG  26 -35.341   1.036  20.633
  172   2HH1  ARG  26          1HH2      ARG  26 -35.680   2.011  22.024
  173   1HH2  ARG  26          1HH       ARG  26 -34.192   3.801  22.593
  174    H    ALA  27           H        ALA  27 -31.783   1.327  13.472
  175    HA   ALA  27           HA       ALA  27 -29.182   0.228  13.696
  176   1HB   ALA  27          1HB       ALA  27 -30.477   0.992  11.082
  177   2HB   ALA  27          2HB       ALA  27 -29.526  -0.455  11.493
  178   3HB   ALA  27          3HB       ALA  27 -31.198  -0.292  12.081
  179    H    ARG  28           H        ARG  28 -30.541   3.399  12.835
  180    HA   ARG  28           HA       ARG  28 -28.358   4.367  11.462
  181   1HB   ARG  28          1HB       ARG  28 -30.856   5.336  12.259
  182   2HB   ARG  28          2HB       ARG  28 -29.758   6.355  13.168
  183   1HG   ARG  28          1HG       ARG  28 -28.487   6.501  10.800
  184   2HG   ARG  28          2HG       ARG  28 -30.075   6.095  10.180
  185   1HD   ARG  28          1HD       ARG  28 -30.058   8.482  10.239
  186   2HD   ARG  28          2HD       ARG  28 -30.992   8.022  11.649
  187    HE   ARG  28           HE       ARG  28 -28.134   8.295  12.220
  188   1HH1  ARG  28          2HH2      ARG  28 -31.200  10.053  11.963
  189   2HH1  ARG  28          1HH2      ARG  28 -30.687  11.347  12.994
  190   1HH2  ARG  28          1HH       ARG  28 -28.483  11.296  13.934
  191    H    GLU  29           H        GLU  29 -29.019   3.939  14.928
  192    HA   GLU  29           HA       GLU  29 -26.880   5.651  15.715
  193   1HB   GLU  29          1HB       GLU  29 -29.131   4.363  16.970
  194   2HB   GLU  29          2HB       GLU  29 -27.688   3.888  17.843
  195   1HG   GLU  29          1HG       GLU  29 -27.165   6.088  18.475
  196   2HG   GLU  29          2HG       GLU  29 -27.988   6.796  17.099
  197    HE2  GLU  29           HE2      GLU  29 -29.416   6.825  20.497
  198    H    ARG  30           H        ARG  30 -27.337   2.280  14.834
  199    HA   ARG  30           HA       ARG  30 -24.901   1.508  16.139
  200   1HB   ARG  30          1HB       ARG  30 -27.192   0.130  14.808
  201   2HB   ARG  30          2HB       ARG  30 -25.643  -0.657  14.577
  202   1HG   ARG  30          1HG       ARG  30 -25.460  -0.158  17.246
  203   2HG   ARG  30          2HG       ARG  30 -27.205  -0.238  17.108
  204   1HD   ARG  30          1HD       ARG  30 -27.201  -2.498  16.492
  205   2HD   ARG  30          2HD       ARG  30 -25.618  -2.408  15.747
  206    HE   ARG  30           HE       ARG  30 -25.035  -1.945  18.396
  207   1HH1  ARG  30          2HH2      ARG  30 -26.896  -4.483  16.768
  208   2HH1  ARG  30          1HH2      ARG  30 -26.543  -5.683  17.965
  209   1HH2  ARG  30          1HH       ARG  30 -25.173  -5.100  19.843
  210    H    GLU  31           H        GLU  31 -26.149   2.453  12.960
  211    HA   GLU  31           HA       GLU  31 -24.118   1.315  11.427
  212   1HB   GLU  31          1HB       GLU  31 -26.444   2.944  11.015
  213   2HB   GLU  31          2HB       GLU  31 -25.108   3.747  10.215
  214   1HG   GLU  31          1HG       GLU  31 -25.192   0.796   9.803
  215   2HG   GLU  31          2HG       GLU  31 -26.563   1.659   9.133
  216    HE2  GLU  31           HE2      GLU  31 -23.739   1.107   7.064
  217    H    ARG  32           H        ARG  32 -24.174   4.005  13.619
  218    HA   ARG  32           HA       ARG  32 -22.369   5.684  12.410
  219   1HB   ARG  32          1HB       ARG  32 -23.723   5.525  14.884
  220   2HB   ARG  32          2HB       ARG  32 -22.030   5.519  15.337
  221   1HG   ARG  32          1HG       ARG  32 -22.914   7.519  13.260
  222   2HG   ARG  32          2HG       ARG  32 -23.385   7.812  14.922
  223   1HD   ARG  32          1HD       ARG  32 -20.778   7.234  15.368
  224   2HD   ARG  32          2HD       ARG  32 -20.628   7.774  13.707
  225    HE   ARG  32           HE       ARG  32 -22.167   9.763  14.826
  226   1HH1  ARG  32          2HH2      ARG  32 -19.096   8.286  15.796
  227   2HH1  ARG  32          1HH2      ARG  32 -18.512   9.717  16.578
  228   1HH2  ARG  32          1HH       ARG  32 -19.882  11.684  16.601
  229    H    LEU  33           H        LEU  33 -21.965   2.585  14.068
  230    HA   LEU  33           HA       LEU  33 -19.101   2.970  14.335
  231   1HB   LEU  33          1HB       LEU  33 -21.053   1.549  15.744
  232   2HB   LEU  33          2HB       LEU  33 -20.107   0.319  14.931
  233    HG   LEU  33           HG       LEU  33 -18.072   1.737  15.912
  234   1HD1  LEU  33          1HD1      LEU  33 -18.558   3.270  17.438
  235   2HD1  LEU  33          2HD1      LEU  33 -20.288   3.032  17.093
  236   3HD1  LEU  33          3HD1      LEU  33 -19.499   2.089  18.380
  237   1HD2  LEU  33          1HD2      LEU  33 -19.313  -0.682  16.499
  238   2HD2  LEU  33          2HD2      LEU  33 -17.717  -0.133  17.064
  239   3HD2  LEU  33          3HD2      LEU  33 -19.157   0.127  18.077
  240    H    ALA  34           H        ALA  34 -21.388   1.954  11.990
  241    HA   ALA  34           HA       ALA  34 -19.675  -0.016  10.775
  242   1HB   ALA  34          1HB       ALA  34 -21.472  -0.336   9.268
  243   2HB   ALA  34          2HB       ALA  34 -22.259   0.048  10.818
  244   3HB   ALA  34          3HB       ALA  34 -22.119   1.297   9.557
  245    H    HIS  35           H        HIS  35 -19.308   3.205  11.163
  246    HA   HIS  35           HA       HIS  35 -18.694   3.812   8.399
  247   1HB   HIS  35          1HB       HIS  35 -19.656   5.304  10.529
  248   2HB   HIS  35          2HB       HIS  35 -17.980   5.807  10.425
  249    HD1  HIS  35           HD1      HIS  35 -18.801   8.174   9.593
  250    HD2  HIS  35           HD2      HIS  35 -19.715   4.983   7.028
  251    HE1  HIS  35           HE1      HIS  35 -19.484   9.219   7.367
  252    H    SER  36           H        SER  36 -17.211   2.366  11.115
  253    HA   SER  36           HA       SER  36 -14.597   3.374  10.462
  254   1HB   SER  36          1HB       SER  36 -13.840   2.167  12.422
  255   2HB   SER  36          2HB       SER  36 -15.325   2.996  12.841
  256    HG   SER  36           HG       SER  36 -16.484   0.982  12.511
  257    H    ARG  37           H        ARG  37 -16.735   0.745   9.657
  258    HA   ARG  37           HA       ARG  37 -14.566  -0.991   8.940
  259   1HB   ARG  37          1HB       ARG  37 -17.142  -1.472   9.800
  260   2HB   ARG  37          2HB       ARG  37 -17.356  -1.645   8.070
  261   1HG   ARG  37          1HG       ARG  37 -16.718  -3.818   8.579
  262   2HG   ARG  37          2HG       ARG  37 -15.136  -3.133   8.268
  263   1HD   ARG  37          1HD       ARG  37 -15.991  -2.706  11.061
  264   2HD   ARG  37          2HD       ARG  37 -15.954  -4.406  10.639
  265    HE   ARG  37           HE       ARG  37 -13.575  -2.956   9.739
  266   1HH1  ARG  37          2HH2      ARG  37 -15.040  -4.679  12.466
  267   2HH1  ARG  37          1HH2      ARG  37 -13.520  -5.057  13.205
  268   1HH2  ARG  37          1HH       ARG  37 -11.492  -4.327  12.156
  269    H    ALA  38           H        ALA  38 -15.461   1.768   7.626
  270    HA   ALA  38           HA       ALA  38 -16.428   1.300   5.084
  271   1HB   ALA  38          1HB       ALA  38 -15.273   3.486   4.565
  272   2HB   ALA  38          2HB       ALA  38 -16.296   3.522   6.022
  273   3HB   ALA  38          3HB       ALA  38 -14.526   3.407   6.179
  274    H    ALA  39           H        ALA  39 -12.966   1.615   6.160
  275    HA   ALA  39           HA       ALA  39 -11.977   0.817   3.627
  276   1HB   ALA  39          1HB       ALA  39 -10.649   2.235   5.049
  277   2HB   ALA  39          2HB       ALA  39 -10.745   1.075   6.395
  278   3HB   ALA  39          3HB       ALA  39  -9.810   0.669   4.936
  279    H    ALA  40           H        ALA  40 -10.514  -1.164   3.377
  280    HA   ALA  40           HA       ALA  40 -12.017  -3.459   3.769
  281   1HB   ALA  40          1HB       ALA  40  -9.865  -4.606   3.108
  282   2HB   ALA  40          2HB       ALA  40 -10.366  -3.294   2.015
  283   3HB   ALA  40          3HB       ALA  40  -9.062  -3.020   3.196
  284    H    ALA  41           H        ALA  41  -8.927  -2.484   5.430
  285    HA   ALA  41           HA       ALA  41  -8.292  -2.758   7.547
  286   1HB   ALA  41          1HB       ALA  41 -10.843  -2.407   7.986
  287   2HB   ALA  41          2HB       ALA  41 -10.873  -4.167   8.247
  288   3HB   ALA  41          3HB       ALA  41  -9.844  -3.133   9.267
  289    H    ALA  42           H        ALA  42 -10.438  -5.642   7.000
  290    HA   ALA  42           HA       ALA  42  -8.723  -7.496   8.050
  291   1HB   ALA  42          1HB       ALA  42 -10.258  -8.388   5.682
  292   2HB   ALA  42          2HB       ALA  42 -10.330  -8.949   7.370
  293   3HB   ALA  42          3HB       ALA  42 -11.212  -7.482   6.880
  294    H    ALA  43           H        ALA  43  -9.040  -6.477   4.576
  295    HA   ALA  43           HA       ALA  43  -7.146  -8.092   3.483
  296   1HB   ALA  43          1HB       ALA  43  -8.730  -6.313   2.446
  297   2HB   ALA  43          2HB       ALA  43  -7.396  -5.169   2.734
  298   3HB   ALA  43          3HB       ALA  43  -7.148  -6.578   1.675
  299    H    VAL  44           H        VAL  44  -6.726  -5.452   5.766
  300    HA   VAL  44           HA       VAL  44  -3.859  -5.381   5.222
  301    HB   VAL  44           HB       VAL  44  -5.873  -3.555   6.288
  302   1HG1  VAL  44          1HG1      VAL  44  -4.967  -3.808   8.433
  303   2HG1  VAL  44          2HG1      VAL  44  -3.309  -4.004   7.816
  304   3HG1  VAL  44          3HG1      VAL  44  -4.092  -2.406   7.771
  305   1HG2  VAL  44          1HG2      VAL  44  -3.778  -3.555   4.408
  306   2HG2  VAL  44          2HG2      VAL  44  -4.860  -2.206   4.828
  307   3HG2  VAL  44          3HG2      VAL  44  -3.299  -2.387   5.663
  308    H    ALA  45           H        ALA  45  -6.313  -6.487   7.541
  309    HA   ALA  45           HA       ALA  45  -4.929  -6.811   9.828
  310   1HB   ALA  45          1HB       ALA  45  -7.285  -7.429   9.500
  311   2HB   ALA  45          2HB       ALA  45  -6.797  -8.806   8.484
  312   3HB   ALA  45          3HB       ALA  45  -6.381  -8.786  10.214
  313    H    ALA  46           H        ALA  46  -5.034  -9.286   7.158
  314    HA   ALA  46           HA       ALA  46  -3.009 -10.859   8.293
  315   1HB   ALA  46          1HB       ALA  46  -3.882 -10.646   5.385
  316   2HB   ALA  46          2HB       ALA  46  -3.066 -12.026   6.157
  317   3HB   ALA  46          3HB       ALA  46  -4.728 -11.598   6.628
  318    H    ALA  47           H        ALA  47  -2.974  -8.428   5.593
  319    HA   ALA  47           HA       ALA  47  -0.273  -8.602   5.038
  320   1HB   ALA  47          1HB       ALA  47  -2.531  -6.824   4.486
  321   2HB   ALA  47          2HB       ALA  47  -0.995  -5.933   4.612
  322   3HB   ALA  47          3HB       ALA  47  -1.155  -7.270   3.448
  323    H    THR  48           H        THR  48   0.932  -6.132   5.359
  324    HA   THR  48           HA       THR  48   2.392  -5.296   6.867
  325    HB   THR  48           HB       THR  48   1.168  -3.749   8.421
  326    HG1  THR  48           HG1      THR  48  -0.733  -4.651   9.106
  327   1HG2  THR  48          1HG2      THR  48   0.319  -4.117   5.562
  328   2HG2  THR  48          2HG2      THR  48  -0.744  -3.114   6.578
  329   3HG2  THR  48          3HG2      THR  48   0.967  -2.669   6.369
  330    H    ALA  49           H        ALA  49   2.843  -7.773   7.311
  331    HA   ALA  49           HA       ALA  49   2.007  -9.093   9.508
  332   1HB   ALA  49          1HB       ALA  49   4.923  -9.188   9.243
  333   2HB   ALA  49          2HB       ALA  49   3.711 -10.454   8.936
  334   3HB   ALA  49          3HB       ALA  49   4.101  -9.269   7.667
  335    H    ALA  50           H        ALA  50   3.094  -9.396  11.685
  336    HA   ALA  50           HA       ALA  50   3.403  -6.784  12.880
  337   1HB   ALA  50          1HB       ALA  50   3.418  -8.173  14.995
  338   2HB   ALA  50          2HB       ALA  50   1.961  -8.365  13.992
  339   3HB   ALA  50          3HB       ALA  50   3.226  -9.617  13.972
  340    H    VAL  51           H        VAL  51   5.477  -7.047  11.140
  341    HA   VAL  51           HA       VAL  51   7.685  -7.420  10.904
  342    HB   VAL  51           HB       VAL  51   7.147  -5.284  12.313
  343   1HG1  VAL  51          1HG1      VAL  51   9.060  -6.216  14.333
  344   2HG1  VAL  51          2HG1      VAL  51   7.563  -5.273  14.519
  345   3HG1  VAL  51          3HG1      VAL  51   7.489  -7.048  14.412
  346   1HG2  VAL  51          1HG2      VAL  51  10.018  -6.229  12.346
  347   2HG2  VAL  51          2HG2      VAL  51   9.171  -5.840  10.829
  348   3HG2  VAL  51          3HG2      VAL  51   9.383  -4.588  12.076
  349    H    GLU  52           H        GLU  52   6.537  -9.819  11.732
  350    HA   GLU  52           HA       GLU  52   8.612 -10.764  13.549
  351   1HB   GLU  52          1HB       GLU  52   6.023 -10.652  14.313
  352   2HB   GLU  52          2HB       GLU  52   5.970 -12.192  13.478
  353   1HG   GLU  52          1HG       GLU  52   8.167 -12.719  14.875
  354   2HG   GLU  52          2HG       GLU  52   7.611 -11.413  15.903
  355    HE2  GLU  52           HE2      GLU  52   6.121 -13.063  17.746
  356    H    GLY  53           H        GLY  53   9.277 -13.042  13.190
  357   1HA   GLY  53          1HA       GLY  53   9.248 -15.009  11.910
  358   2HA   GLY  53          2HA       GLY  53   8.448 -14.161  10.601
  359    H    THR  54           H        THR  54  11.541 -14.834  12.203
  360    HA   THR  54           HA       THR  54  13.058 -13.085  10.507
  361    HB   THR  54           HB       THR  54  13.710 -13.685  12.854
  362    HG1  THR  54           HG1      THR  54  15.392 -14.832  10.737
  363   1HG2  THR  54          1HG2      THR  54  13.192 -16.370  11.935
  364   2HG2  THR  54          2HG2      THR  54  14.937 -16.239  12.260
  365   3HG2  THR  54          3HG2      THR  54  13.761 -15.861  13.542
  366    H    GLY  55           H        GLY  55  13.979 -13.455   8.569
  367   1HA   GLY  55          1HA       GLY  55  13.466 -16.096   7.378
  368   2HA   GLY  55          2HA       GLY  55  13.736 -14.592   6.521
  369    H    GLY  56           H        GLY  56  15.286 -16.303   5.419
  370   1HA   GLY  56          1HA       GLY  56  17.619 -16.072   4.964
  371   2HA   GLY  56          2HA       GLY  56  17.931 -15.965   6.685
  372    H    SER  57           H        SER  57  17.214 -18.119   3.963
  373    HA   SER  57           HA       SER  57  16.833 -20.438   5.450
  374   1HB   SER  57          1HB       SER  57  16.144 -20.410   3.151
  375   2HB   SER  57          2HB       SER  57  17.728 -19.908   2.596
  376    HG   SER  57           HG       SER  57  17.801 -22.305   4.031
  377    H    GLY  58           H        GLY  58  18.308 -21.376   6.815
  378   1HA   GLY  58          1HA       GLY  58  21.167 -20.952   6.278
  379   2HA   GLY  58          2HA       GLY  58  20.439 -21.422   7.801
  380    H    GLY  59           H        GLY  59  22.651 -22.738   6.304
  381   1HA   GLY  59          1HA       GLY  59  22.598 -25.255   6.789
  382   2HA   GLY  59          2HA       GLY  59  21.386 -25.282   5.524
  383    H    GLY  60           H        GLY  60  23.853 -26.706   5.330
  384   1HA   GLY  60          1HA       GLY  60  24.959 -25.410   2.948
  385   2HA   GLY  60          2HA       GLY  60  26.060 -25.801   4.253
  386    HA   PRO  61           HA       PRO  61  25.169 -29.529   1.611
  387   1HB   PRO  61          1HB       PRO  61  27.228 -29.480  -0.185
  388   2HB   PRO  61          2HB       PRO  61  25.616 -28.902  -0.559
  389   1HG   PRO  61          1HG       PRO  61  28.062 -27.339  -0.003
  390   2HG   PRO  61          2HG       PRO  61  26.580 -26.819  -0.780
  391   1HD   PRO  61          1HD       PRO  61  27.398 -26.250   1.910
  392   2HD   PRO  61          2HD       PRO  61  25.867 -25.830   1.169
  393    H    HIS  62           H        HIS  62  25.988 -31.586   1.967
  394    HA   HIS  62           HA       HIS  62  28.621 -31.568   3.213
  395   1HB   HIS  62          1HB       HIS  62  27.873 -32.927   5.068
  396   2HB   HIS  62          2HB       HIS  62  27.001 -31.407   5.041
  397    HD1  HIS  62           HD1      HIS  62  25.596 -33.430   6.631
  398    HD2  HIS  62           HD2      HIS  62  25.152 -33.287   2.462
  399    HE1  HIS  62           HE1      HIS  62  23.407 -34.632   6.104
  400    H    HIS  63           H        HIS  63  29.302 -32.438   1.138
  401    HA   HIS  63           HA       HIS  63  28.252 -34.438  -0.272
  402   1HB   HIS  63          1HB       HIS  63  30.393 -33.160  -0.675
  403   2HB   HIS  63          2HB       HIS  63  31.198 -34.277   0.408
  404    HD1  HIS  63           HD1      HIS  63  32.633 -35.628  -1.157
  405    HD2  HIS  63           HD2      HIS  63  28.671 -35.302  -2.495
  406    HE1  HIS  63           HE1      HIS  63  32.442 -37.143  -3.201
  407    H    HIS  64           H        HIS  64  28.352 -36.761  -0.320
  408    HA   HIS  64           HA       HIS  64  28.267 -37.869   2.323
  409   1HB   HIS  64          1HB       HIS  64  27.677 -39.976   0.981
  410   2HB   HIS  64          2HB       HIS  64  26.541 -38.642   0.981
  411    HD1  HIS  64           HD1      HIS  64  26.612 -37.056  -1.241
  412    HD2  HIS  64           HD2      HIS  64  28.519 -40.781  -1.519
  413    HE1  HIS  64           HE1      HIS  64  26.913 -37.521  -3.732
  414    H    HIS  65           H        HIS  65  30.074 -38.615  -0.747
  415    HA   HIS  65           HA       HIS  65  31.931 -39.772  -1.067
  416   1HB   HIS  65          1HB       HIS  65  33.904 -38.889   0.113
  417   2HB   HIS  65          2HB       HIS  65  32.856 -37.626  -0.501
  418    HD1  HIS  65           HD1      HIS  65  31.598 -36.136   1.238
  419    HD2  HIS  65           HD2      HIS  65  34.083 -39.057   2.937
  420    HE1  HIS  65           HE1      HIS  65  31.826 -35.532   3.707
  421    H    GLN  66           H        GLN  66  31.221 -41.904  -0.613
  422    HA   GLN  66           HA       GLN  66  31.521 -42.790   2.115
  423   1HB   GLN  66          1HB       GLN  66  29.568 -43.382   0.460
  424   2HB   GLN  66          2HB       GLN  66  30.694 -44.541  -0.219
  425   1HG   GLN  66          1HG       GLN  66  30.547 -45.941   1.591
  426   2HG   GLN  66          2HG       GLN  66  30.590 -44.621   2.743
  427   1HE2  GLN  66          1HE2      GLN  66  28.932 -45.171   4.017
  428   2HE2  GLN  66          2HE2      GLN  66  27.274 -45.271   3.527
  429    H    THR  67           H        THR  67  32.442 -45.283   2.137
  430    HA   THR  67           HA       THR  67  35.194 -45.001   1.557
  431    HB   THR  67           HB       THR  67  34.937 -47.610   2.175
  432    HG1  THR  67           HG1      THR  67  32.848 -47.831   3.265
  433   1HG2  THR  67          1HG2      THR  67  34.700 -47.014   4.582
  434   2HG2  THR  67          2HG2      THR  67  35.819 -45.888   3.777
  435   3HG2  THR  67          3HG2      THR  67  34.149 -45.383   4.128
  436    H    ARG  68           H        ARG  68  36.525 -45.933   0.011
  437    HA   ARG  68           HA       ARG  68  35.632 -47.781  -1.826
  438   1HB   ARG  68          1HB       ARG  68  34.298 -45.644  -2.533
  439   2HB   ARG  68          2HB       ARG  68  35.836 -45.011  -3.085
  440   1HG   ARG  68          1HG       ARG  68  35.334 -47.779  -4.011
  441   2HG   ARG  68          2HG       ARG  68  34.120 -46.645  -4.567
  442   1HD   ARG  68          1HD       ARG  68  36.768 -45.447  -4.833
  443   2HD   ARG  68          2HD       ARG  68  36.752 -47.018  -5.611
  444    HE   ARG  68           HE       ARG  68  35.170 -44.652  -6.393
  445   1HH1  ARG  68          2HH2      ARG  68  35.642 -48.142  -6.783
  446   2HH1  ARG  68          1HH2      ARG  68  34.803 -48.212  -8.297
  447   1HH2  ARG  68          1HH       ARG  68  33.883 -46.202  -9.223
  448    H    GLY  69           H        GLY  69  37.656 -48.757  -1.803
  449   1HA   GLY  69          1HA       GLY  69  39.805 -47.559  -3.213
  450   2HA   GLY  69          2HA       GLY  69  40.096 -47.474  -1.488
  451    H    ALA  70           H        ALA  70  38.881 -49.859  -3.956
  452    HA   ALA  70           HA       ALA  70  39.852 -52.049  -2.372
  453   1HB   ALA  70          1HB       ALA  70  39.036 -53.358  -4.386
  454   2HB   ALA  70          2HB       ALA  70  37.803 -52.343  -3.601
  455   3HB   ALA  70          3HB       ALA  70  38.565 -51.805  -5.117
  456    H    TYR  71           H        TYR  71  41.982 -52.546  -2.281
  457    HA   TYR  71           HA       TYR  71  43.703 -51.693  -4.452
  458   1HB   TYR  71          1HB       TYR  71  45.425 -52.574  -2.771
  459   2HB   TYR  71          2HB       TYR  71  44.361 -51.367  -2.076
  460    HD1  TYR  71           HD1      TYR  71  44.932 -55.041  -2.321
  461    HD2  TYR  71           HD2      TYR  71  43.017 -51.865  -0.188
  462    HE1  TYR  71           HE1      TYR  71  44.291 -56.661  -0.469
  463    HE2  TYR  71           HE2      TYR  71  42.382 -53.496   1.656
  464    HH   TYR  71           HH       TYR  71  43.071 -55.566   2.541
  465    H    SER  72           H        SER  72  45.090 -53.111  -5.646
  466    HA   SER  72           HA       SER  72  43.840 -55.614  -6.155
  467   1HB   SER  72          1HB       SER  72  44.865 -54.069  -7.908
  468   2HB   SER  72          2HB       SER  72  46.445 -54.530  -7.306
  469    HG   SER  72           HG       SER  72  45.355 -55.768  -9.209
  470    H    SER  73           H        SER  73  47.236 -54.602  -5.293
  471    HA   SER  73           HA       SER  73  48.795 -55.566  -4.132
  472   1HB   SER  73          1HB       SER  73  46.875 -55.671  -2.407
  473   2HB   SER  73          2HB       SER  73  46.711 -57.363  -2.833
  474    HG   SER  73           HG       SER  73  48.351 -56.383  -1.025
  475    H    HIS  74           H        HIS  74  50.241 -57.410  -4.215
  476    HA   HIS  74           HA       HIS  74  49.217 -59.805  -5.464
  477   1HB   HIS  74          1HB       HIS  74  50.162 -57.882  -7.133
  478   2HB   HIS  74          2HB       HIS  74  51.652 -58.733  -6.776
  479    HD1  HIS  74           HD1      HIS  74  52.130 -60.388  -8.572
  480    HD2  HIS  74           HD2      HIS  74  48.028 -60.136  -7.729
  481    HE1  HIS  74           HE1      HIS  74  50.981 -62.081 -10.096
  482    H    ASP  75           H        ASP  75  49.691 -60.566  -3.264
  483    HA   ASP  75           HA       ASP  75  52.451 -61.358  -3.120
  484   1HB   ASP  75          1HB       ASP  75  52.131 -59.196  -1.761
  485   2HB   ASP  75          2HB       ASP  75  51.054 -60.101  -0.716
  486    HD2  ASP  75           HD2      ASP  75  52.346 -60.872   1.173
  Start of MODEL    8
    1    H    MET   1           H        MET   1 -22.711 -20.059  14.168
    2    HA   MET   1           HA       MET   1 -24.276 -19.160  12.005
    3   1HB   MET   1          1HB       MET   1 -26.145 -20.119  13.347
    4   2HB   MET   1          2HB       MET   1 -24.774 -21.210  13.371
    5   1HG   MET   1          1HG       MET   1 -24.305 -19.497  15.563
    6   2HG   MET   1          2HG       MET   1 -26.037 -19.759  15.601
    7   1HE   MET   1          1HE       MET   1 -25.145 -20.544  17.906
    8   2HE   MET   1          2HE       MET   1 -24.732 -22.242  18.244
    9   3HE   MET   1          3HE       MET   1 -23.465 -21.103  17.726
   10    H    GLU   2           H        GLU   2 -26.176 -17.684  12.169
   11    HA   GLU   2           HA       GLU   2 -25.399 -15.321  13.528
   12   1HB   GLU   2          1HB       GLU   2 -27.246 -16.090  11.400
   13   2HB   GLU   2          2HB       GLU   2 -28.031 -14.996  12.522
   14   1HG   GLU   2          1HG       GLU   2 -26.166 -13.373  12.289
   15   2HG   GLU   2          2HG       GLU   2 -25.309 -14.479  11.233
   16    HE2  GLU   2           HE2      GLU   2 -25.736 -14.310   9.209
   17    H    VAL   3           H        VAL   3 -27.183 -14.031  14.800
   18    HA   VAL   3           HA       VAL   3 -27.888 -15.645  17.029
   19    HB   VAL   3           HB       VAL   3 -27.141 -13.199  16.940
   20   1HG1  VAL   3          1HG1      VAL   3 -29.873 -12.201  16.954
   21   2HG1  VAL   3          2HG1      VAL   3 -28.452 -11.621  16.052
   22   3HG1  VAL   3          3HG1      VAL   3 -29.455 -12.932  15.386
   23   1HG2  VAL   3          1HG2      VAL   3 -28.395 -14.642  18.845
   24   2HG2  VAL   3          2HG2      VAL   3 -27.892 -12.950  19.069
   25   3HG2  VAL   3          3HG2      VAL   3 -29.577 -13.328  18.639
   26    H    ALA   4           H        ALA   4 -30.333 -14.996  17.924
   27    HA   ALA   4           HA       ALA   4 -32.022 -16.528  16.255
   28   1HB   ALA   4          1HB       ALA   4 -32.195 -15.084  18.876
   29   2HB   ALA   4          2HB       ALA   4 -33.720 -15.504  18.059
   30   3HB   ALA   4          3HB       ALA   4 -32.555 -16.782  18.482
   31    H    MET   5           H        MET   5 -34.211 -15.751  15.483
   32    HA   MET   5           HA       MET   5 -33.790 -13.227  14.144
   33   1HB   MET   5          1HB       MET   5 -35.694 -15.590  13.815
   34   2HB   MET   5          2HB       MET   5 -36.019 -14.082  12.983
   35   1HG   MET   5          1HG       MET   5 -33.302 -15.440  12.768
   36   2HG   MET   5          2HG       MET   5 -34.629 -15.900  11.721
   37   1HE   MET   5          1HE       MET   5 -32.953 -14.418   9.212
   38   2HE   MET   5          2HE       MET   5 -34.244 -15.502   9.785
   39   3HE   MET   5          3HE       MET   5 -34.659 -13.943   9.033
   40    H    VAL   6           H        VAL   6 -34.344 -11.518  15.485
   41    HA   VAL   6           HA       VAL   6 -36.551 -11.720  17.278
   42    HB   VAL   6           HB       VAL   6 -34.964  -9.306  16.386
   43   1HG1  VAL   6          1HG1      VAL   6 -36.879  -8.522  17.515
   44   2HG1  VAL   6          2HG1      VAL   6 -36.820  -9.837  18.714
   45   3HG1  VAL   6          3HG1      VAL   6 -35.599  -8.541  18.753
   46   1HG2  VAL   6          1HG2      VAL   6 -33.397  -9.724  18.092
   47   2HG2  VAL   6          2HG2      VAL   6 -34.430 -10.949  18.867
   48   3HG2  VAL   6          3HG2      VAL   6 -33.639 -11.306  17.312
   49    H    SER   7           H        SER   7 -38.302  -9.912  17.226
   50    HA   SER   7           HA       SER   7 -40.025  -9.016  16.259
   51   1HB   SER   7          1HB       SER   7 -38.229  -8.853  13.800
   52   2HB   SER   7          2HB       SER   7 -39.806  -8.097  13.903
   53    HG   SER   7           HG       SER   7 -37.538  -7.003  14.640
   54    H    ALA   8           H        ALA   8 -41.377 -10.870  16.413
   55    HA   ALA   8           HA       ALA   8 -41.229 -13.040  14.651
   56   1HB   ALA   8          1HB       ALA   8 -42.537 -12.429  16.993
   57   2HB   ALA   8          2HB       ALA   8 -43.873 -12.404  15.818
   58   3HB   ALA   8          3HB       ALA   8 -42.867 -13.862  15.990
   59    H    GLU   9           H        GLU   9 -41.270 -12.640  12.461
   60    HA   GLU   9           HA       GLU   9 -42.451 -10.640  11.162
   61   1HB   GLU   9          1HB       GLU   9 -41.013 -12.376  10.119
   62   2HB   GLU   9          2HB       GLU   9 -42.313 -13.544  10.237
   63   1HG   GLU   9          1HG       GLU   9 -43.322 -12.753   8.358
   64   2HG   GLU   9          2HG       GLU   9 -43.253 -11.098   8.930
   65    HE2  GLU   9           HE2      GLU   9 -41.775 -13.413   7.041
   66    H    SER  10           H        SER  10 -44.493 -10.197  10.155
   67    HA   SER  10           HA       SER  10 -46.633 -11.986  10.979
   68   1HB   SER  10          1HB       SER  10 -46.218  -9.626  12.283
   69   2HB   SER  10          2HB       SER  10 -47.230  -9.052  10.972
   70    HG   SER  10           HG       SER  10 -48.501  -9.704  12.814
   71    H    SER  11           H        SER  11 -48.370 -12.145   9.462
   72    HA   SER  11           HA       SER  11 -47.917 -10.623   7.015
   73   1HB   SER  11          1HB       SER  11 -47.655 -13.381   7.300
   74   2HB   SER  11          2HB       SER  11 -49.292 -13.225   6.695
   75    HG   SER  11           HG       SER  11 -48.568 -12.273   4.816
   76    H    GLY  12           H        GLY  12 -49.553  -9.111   6.963
   77   1HA   GLY  12          1HA       GLY  12 -51.910  -8.962   6.309
   78   2HA   GLY  12          2HA       GLY  12 -52.277 -10.062   7.623
   79    H    CYS  13           H        CYS  13 -52.056  -6.789   6.703
   80    HA   CYS  13           HA       CYS  13 -52.634  -5.975   9.383
   81   1HB   CYS  13          1HB       CYS  13 -49.955  -5.901   8.736
   82   2HB   CYS  13          2HB       CYS  13 -50.471  -4.280   8.315
   83    HG   CYS  13           HG       CYS  13 -49.975  -3.647  10.582
   84    H    ASN  14           H        ASN  14 -54.665  -5.521   8.244
   85    HA   ASN  14           HA       ASN  14 -54.462  -3.514   6.175
   86   1HB   ASN  14          1HB       ASN  14 -56.337  -5.657   6.861
   87   2HB   ASN  14          2HB       ASN  14 -57.202  -4.140   6.720
   88   1HD2  ASN  14          1HD2      ASN  14 -57.640  -6.199   4.981
   89   2HD2  ASN  14          2HD2      ASN  14 -57.074  -5.803   3.393
   90    H    SER  15           H        SER  15 -53.947  -3.070   9.160
   91    HA   SER  15           HA       SER  15 -55.801  -0.873   9.431
   92   1HB   SER  15          1HB       SER  15 -56.255  -1.403  11.806
   93   2HB   SER  15          2HB       SER  15 -56.834  -2.676  10.751
   94    HG   SER  15           HG       SER  15 -55.406  -3.138  12.811
   95    H    HIS  16           H        HIS  16 -53.845   0.335   8.806
   96    HA   HIS  16           HA       HIS  16 -52.077   1.557   9.242
   97   1HB   HIS  16          1HB       HIS  16 -52.992   2.515  11.125
   98   2HB   HIS  16          2HB       HIS  16 -53.081   1.000  12.001
   99    HD1  HIS  16           HD1      HIS  16 -51.175   0.446  13.584
  100    HD2  HIS  16           HD2      HIS  16 -50.300   3.664  11.040
  101    HE1  HIS  16           HE1      HIS  16 -48.979   1.441  14.420
  102    H    MET  17           H        MET  17 -50.611   0.229   8.107
  103    HA   MET  17           HA       MET  17 -49.595  -2.122   8.784
  104   1HB   MET  17          1HB       MET  17 -48.722   0.231   7.239
  105   2HB   MET  17          2HB       MET  17 -47.337  -0.619   7.895
  106   1HG   MET  17          1HG       MET  17 -48.578  -2.787   6.984
  107   2HG   MET  17          2HG       MET  17 -49.450  -1.647   5.979
  108   1HE   MET  17          1HE       MET  17 -47.219  -0.810   3.216
  109   2HE   MET  17          2HE       MET  17 -48.844  -1.087   3.888
  110   3HE   MET  17          3HE       MET  17 -47.886   0.315   4.424
  111    HA   PRO  18           HA       PRO  18 -47.094  -1.706  12.305
  112   1HB   PRO  18          1HB       PRO  18 -45.178  -3.617  11.923
  113   2HB   PRO  18          2HB       PRO  18 -46.798  -3.982  12.483
  114   1HG   PRO  18          1HG       PRO  18 -45.620  -4.420   9.808
  115   2HG   PRO  18          2HG       PRO  18 -47.054  -5.144  10.508
  116   1HD   PRO  18          1HD       PRO  18 -46.970  -3.040   8.561
  117   2HD   PRO  18          2HD       PRO  18 -48.398  -3.684   9.346
  118    H    TYR  19           H        TYR  19 -44.758  -1.473  13.197
  119    HA   TYR  19           HA       TYR  19 -43.736   0.808  11.897
  120   1HB   TYR  19          1HB       TYR  19 -42.798  -1.191  14.035
  121   2HB   TYR  19          2HB       TYR  19 -41.810   0.193  13.611
  122    HD1  TYR  19           HD1      TYR  19 -42.337   2.396  14.411
  123    HD2  TYR  19           HD2      TYR  19 -45.044  -0.846  15.095
  124    HE1  TYR  19           HE1      TYR  19 -43.636   3.821  16.068
  125    HE2  TYR  19           HE2      TYR  19 -46.334   0.590  16.749
  126    HH   TYR  19           HH       TYR  19 -45.173   3.179  18.174
  127    H    GLY  20           H        GLY  20 -41.496   1.079  11.068
  128   1HA   GLY  20          1HA       GLY  20 -40.122  -1.300  10.152
  129   2HA   GLY  20          2HA       GLY  20 -40.887  -0.365   8.883
  130    H    TYR  21           H        TYR  21 -39.858   1.444   8.077
  131    HA   TYR  21           HA       TYR  21 -37.228   1.919   8.502
  132   1HB   TYR  21          1HB       TYR  21 -39.150   2.859   6.868
  133   2HB   TYR  21          2HB       TYR  21 -39.273   4.151   8.045
  134    HD1  TYR  21           HD1      TYR  21 -37.873   3.338   5.001
  135    HD2  TYR  21           HD2      TYR  21 -36.776   5.094   8.746
  136    HE1  TYR  21           HE1      TYR  21 -35.948   4.558   3.874
  137    HE2  TYR  21           HE2      TYR  21 -34.854   6.307   7.606
  138    HH   TYR  21           HH       TYR  21 -34.572   7.065   4.875
  139    H    ALA  22           H        ALA  22 -40.005   3.174  10.386
  140    HA   ALA  22           HA       ALA  22 -38.537   5.130  11.784
  141   1HB   ALA  22          1HB       ALA  22 -40.952   5.230  11.625
  142   2HB   ALA  22          2HB       ALA  22 -41.115   3.633  12.393
  143   3HB   ALA  22          3HB       ALA  22 -40.516   5.017  13.338
  144    H    ALA  23           H        ALA  23 -39.302   1.656  12.375
  145    HA   ALA  23           HA       ALA  23 -38.036   1.667  14.934
  146   1HB   ALA  23          1HB       ALA  23 -38.364  -0.827  14.694
  147   2HB   ALA  23          2HB       ALA  23 -39.850   0.132  14.498
  148   3HB   ALA  23          3HB       ALA  23 -39.020  -0.525  13.067
  149    H    GLN  24           H        GLN  24 -36.858   1.963  11.796
  150    HA   GLN  24           HA       GLN  24 -34.576   0.269  12.224
  151   1HB   GLN  24          1HB       GLN  24 -35.870   1.587   9.944
  152   2HB   GLN  24          2HB       GLN  24 -34.135   1.833   9.919
  153   1HG   GLN  24          1HG       GLN  24 -35.151  -0.944  10.518
  154   2HG   GLN  24          2HG       GLN  24 -35.268  -0.370   8.866
  155   1HE2  GLN  24          1HE2      GLN  24 -33.261  -1.590  11.326
  156   2HE2  GLN  24          2HE2      GLN  24 -31.737  -1.542  10.505
  157    H    ALA  25           H        ALA  25 -35.528   3.239  13.364
  158    HA   ALA  25           HA       ALA  25 -33.351   4.901  12.839
  159   1HB   ALA  25          1HB       ALA  25 -35.204   5.989  13.721
  160   2HB   ALA  25          2HB       ALA  25 -35.514   4.715  14.924
  161   3HB   ALA  25          3HB       ALA  25 -34.175   5.861  15.167
  162    H    ARG  26           H        ARG  26 -33.673   2.016  14.776
  163    HA   ARG  26           HA       ARG  26 -31.668   2.660  16.628
  164   1HB   ARG  26          1HB       ARG  26 -33.561   0.674  16.423
  165   2HB   ARG  26          2HB       ARG  26 -32.135  -0.219  15.934
  166   1HG   ARG  26          1HG       ARG  26 -31.309   1.295  18.189
  167   2HG   ARG  26          2HG       ARG  26 -32.908   0.709  18.602
  168   1HD   ARG  26          1HD       ARG  26 -32.231  -1.496  18.680
  169   2HD   ARG  26          2HD       ARG  26 -31.152  -1.326  17.309
  170    HE   ARG  26           HE       ARG  26 -29.395  -0.773  18.770
  171   1HH1  ARG  26          2HH2      ARG  26 -32.469  -0.612  20.525
  172   2HH1  ARG  26          1HH2      ARG  26 -31.716  -0.430  22.075
  173   1HH2  ARG  26          1HH       ARG  26 -29.325  -0.387  22.221
  174    H    ALA  27           H        ALA  27 -31.761   1.285  13.350
  175    HA   ALA  27           HA       ALA  27 -29.163   0.155  13.408
  176   1HB   ALA  27          1HB       ALA  27 -30.149  -0.764  11.603
  177   2HB   ALA  27          2HB       ALA  27 -31.390   0.511  11.548
  178   3HB   ALA  27          3HB       ALA  27 -29.818   0.763  10.752
  179    H    ARG  28           H        ARG  28 -30.521   3.388  12.825
  180    HA   ARG  28           HA       ARG  28 -28.375   4.437  11.451
  181   1HB   ARG  28          1HB       ARG  28 -30.831   5.368  12.284
  182   2HB   ARG  28          2HB       ARG  28 -29.783   6.241  13.385
  183   1HG   ARG  28          1HG       ARG  28 -28.398   6.942  11.330
  184   2HG   ARG  28          2HG       ARG  28 -29.675   6.269  10.336
  185   1HD   ARG  28          1HD       ARG  28 -30.383   8.263  12.509
  186   2HD   ARG  28          2HD       ARG  28 -29.721   8.843  10.994
  187    HE   ARG  28           HE       ARG  28 -31.735   7.091  10.207
  188   1HH1  ARG  28          2HH2      ARG  28 -31.616   9.956  12.287
  189   2HH1  ARG  28          1HH2      ARG  28 -33.253  10.416  11.957
  190   1HH2  ARG  28          1HH       ARG  28 -34.574   9.074  10.475
  191    H    GLU  29           H        GLU  29 -28.928   3.766  14.898
  192    HA   GLU  29           HA       GLU  29 -26.750   5.403  15.734
  193   1HB   GLU  29          1HB       GLU  29 -28.823   4.925  17.120
  194   2HB   GLU  29          2HB       GLU  29 -28.261   3.276  17.311
  195   1HG   GLU  29          1HG       GLU  29 -26.099   4.194  18.292
  196   2HG   GLU  29          2HG       GLU  29 -26.802   5.798  18.225
  197    HE2  GLU  29           HE2      GLU  29 -27.380   3.576  21.269
  198    H    ARG  30           H        ARG  30 -27.266   2.107  14.632
  199    HA   ARG  30           HA       ARG  30 -24.795   1.227  15.798
  200   1HB   ARG  30          1HB       ARG  30 -27.141  -0.038  14.448
  201   2HB   ARG  30          2HB       ARG  30 -25.607  -0.817  14.113
  202   1HG   ARG  30          1HG       ARG  30 -25.305  -1.503  16.311
  203   2HG   ARG  30          2HG       ARG  30 -26.113  -0.099  16.980
  204   1HD   ARG  30          1HD       ARG  30 -28.143  -1.152  17.027
  205   2HD   ARG  30          2HD       ARG  30 -27.959  -1.770  15.398
  206    HE   ARG  30           HE       ARG  30 -27.203  -3.142  17.892
  207   1HH1  ARG  30          2HH2      ARG  30 -26.853  -3.067  14.367
  208   2HH1  ARG  30          1HH2      ARG  30 -26.374  -4.728  14.255
  209   1HH2  ARG  30          1HH       ARG  30 -26.215  -6.041  16.254
  210    H    GLU  31           H        GLU  31 -26.137   2.405  12.738
  211    HA   GLU  31           HA       GLU  31 -24.117   1.376  11.090
  212   1HB   GLU  31          1HB       GLU  31 -26.487   3.034  10.829
  213   2HB   GLU  31          2HB       GLU  31 -25.171   3.761   9.928
  214   1HG   GLU  31          1HG       GLU  31 -24.745   1.543   8.809
  215   2HG   GLU  31          2HG       GLU  31 -26.110   0.864   9.674
  216    HE2  GLU  31           HE2      GLU  31 -26.794   3.540   6.750
  217    H    ARG  32           H        ARG  32 -24.368   4.150  13.250
  218    HA   ARG  32           HA       ARG  32 -22.532   5.809  12.068
  219   1HB   ARG  32          1HB       ARG  32 -24.067   6.268  14.085
  220   2HB   ARG  32          2HB       ARG  32 -22.897   5.423  15.079
  221   1HG   ARG  32          1HG       ARG  32 -21.645   7.304  15.228
  222   2HG   ARG  32          2HG       ARG  32 -21.427   7.310  13.489
  223   1HD   ARG  32          1HD       ARG  32 -22.656   9.223  13.434
  224   2HD   ARG  32          2HD       ARG  32 -24.061   8.252  13.824
  225    HE   ARG  32           HE       ARG  32 -22.962   8.661  16.305
  226   1HH1  ARG  32          2HH2      ARG  32 -23.745  10.894  13.668
  227   2HH1  ARG  32          1HH2      ARG  32 -24.043  12.234  14.724
  228   1HH2  ARG  32          1HH       ARG  32 -23.807  11.937  17.091
  229    H    LEU  33           H        LEU  33 -22.151   2.837  13.974
  230    HA   LEU  33           HA       LEU  33 -19.306   3.303  14.315
  231   1HB   LEU  33          1HB       LEU  33 -21.285   1.970  15.769
  232   2HB   LEU  33          2HB       LEU  33 -20.291   0.692  15.098
  233    HG   LEU  33           HG       LEU  33 -18.860   2.966  16.386
  234   1HD1  LEU  33          1HD1      LEU  33 -20.629   1.040  17.879
  235   2HD1  LEU  33          2HD1      LEU  33 -19.163   1.722  18.624
  236   3HD1  LEU  33          3HD1      LEU  33 -20.464   2.803  18.067
  237   1HD2  LEU  33          1HD2      LEU  33 -18.361   0.201  15.635
  238   2HD2  LEU  33          2HD2      LEU  33 -17.218   1.517  15.995
  239   3HD2  LEU  33          3HD2      LEU  33 -17.887   0.533  17.319
  240    H    ALA  34           H        ALA  34 -21.483   2.043  11.983
  241    HA   ALA  34           HA       ALA  34 -19.689   0.013  11.006
  242   1HB   ALA  34          1HB       ALA  34 -21.435  -0.087   9.165
  243   2HB   ALA  34          2HB       ALA  34 -22.052  -0.387  10.807
  244   3HB   ALA  34          3HB       ALA  34 -22.316   1.193  10.032
  245    H    HIS  35           H        HIS  35 -19.393   3.262  11.129
  246    HA   HIS  35           HA       HIS  35 -18.684   3.643   8.348
  247   1HB   HIS  35          1HB       HIS  35 -19.952   5.328   9.810
  248   2HB   HIS  35          2HB       HIS  35 -18.418   5.642  10.598
  249    HD1  HIS  35           HD1      HIS  35 -19.007   5.136   6.848
  250    HD2  HIS  35           HD2      HIS  35 -17.773   8.098   9.550
  251    HE1  HIS  35           HE1      HIS  35 -18.253   7.123   5.436
  252    H    SER  36           H        SER  36 -17.282   2.466  11.231
  253    HA   SER  36           HA       SER  36 -14.663   3.467  10.590
  254   1HB   SER  36          1HB       SER  36 -15.944   2.710  12.963
  255   2HB   SER  36          2HB       SER  36 -14.835   1.385  12.672
  256    HG   SER  36           HG       SER  36 -14.287   4.123  13.223
  257    H    ARG  37           H        ARG  37 -16.722   0.736   9.936
  258    HA   ARG  37           HA       ARG  37 -14.498  -1.010   9.451
  259   1HB   ARG  37          1HB       ARG  37 -17.099  -1.466  10.253
  260   2HB   ARG  37          2HB       ARG  37 -17.238  -1.797   8.538
  261   1HG   ARG  37          1HG       ARG  37 -15.940  -3.697   8.655
  262   2HG   ARG  37          2HG       ARG  37 -14.835  -3.000   9.824
  263   1HD   ARG  37          1HD       ARG  37 -17.561  -3.428  10.915
  264   2HD   ARG  37          2HD       ARG  37 -16.791  -4.911  10.387
  265    HE   ARG  37           HE       ARG  37 -16.068  -3.347  12.704
  266   1HH1  ARG  37          2HH2      ARG  37 -14.637  -5.354  10.158
  267   2HH1  ARG  37          1HH2      ARG  37 -13.263  -5.803  11.111
  268   1HH2  ARG  37          1HH       ARG  37 -13.059  -4.960  13.346
  269    H    ALA  38           H        ALA  38 -15.390   1.608   7.873
  270    HA   ALA  38           HA       ALA  38 -16.205   0.823   5.326
  271   1HB   ALA  38          1HB       ALA  38 -15.915   3.171   6.589
  272   2HB   ALA  38          2HB       ALA  38 -14.383   3.174   5.683
  273   3HB   ALA  38          3HB       ALA  38 -15.932   3.051   4.814
  274    H    ALA  39           H        ALA  39 -12.871   1.754   6.457
  275    HA   ALA  39           HA       ALA  39 -11.618   0.859   4.124
  276   1HB   ALA  39          1HB       ALA  39 -10.232   0.880   6.797
  277   2HB   ALA  39          2HB       ALA  39  -9.658   1.462   5.216
  278   3HB   ALA  39          3HB       ALA  39 -10.855   2.408   6.131
  279    H    ALA  40           H        ALA  40 -12.115  -1.218   3.446
  280    HA   ALA  40           HA       ALA  40 -12.198  -3.373   5.327
  281   1HB   ALA  40          1HB       ALA  40 -12.922  -4.654   3.495
  282   2HB   ALA  40          2HB       ALA  40 -13.520  -3.023   3.106
  283   3HB   ALA  40          3HB       ALA  40 -12.049  -3.643   2.319
  284    H    ALA  41           H        ALA  41 -10.174  -2.849   2.348
  285    HA   ALA  41           HA       ALA  41  -8.311  -4.724   2.715
  286   1HB   ALA  41          1HB       ALA  41  -7.070  -3.540   1.177
  287   2HB   ALA  41          2HB       ALA  41  -8.614  -2.669   1.018
  288   3HB   ALA  41          3HB       ALA  41  -7.307  -1.988   2.015
  289    H    ALA  42           H        ALA  42  -7.670  -5.328   4.776
  290    HA   ALA  42           HA       ALA  42  -6.576  -3.225   6.485
  291   1HB   ALA  42          1HB       ALA  42  -6.679  -5.035   8.223
  292   2HB   ALA  42          2HB       ALA  42  -8.261  -4.647   7.505
  293   3HB   ALA  42          3HB       ALA  42  -7.389  -6.113   6.997
  294    H    ALA  43           H        ALA  43  -5.725  -6.713   5.973
  295    HA   ALA  43           HA       ALA  43  -3.047  -6.391   6.541
  296   1HB   ALA  43          1HB       ALA  43  -3.466  -8.475   4.578
  297   2HB   ALA  43          2HB       ALA  43  -3.162  -8.623   6.326
  298   3HB   ALA  43          3HB       ALA  43  -4.827  -8.445   5.724
  299    H    VAL  44           H        VAL  44  -4.882  -5.388   3.756
  300    HA   VAL  44           HA       VAL  44  -2.526  -5.301   2.062
  301    HB   VAL  44           HB       VAL  44  -5.432  -5.235   1.745
  302   1HG1  VAL  44          1HG1      VAL  44  -3.741  -3.395   0.018
  303   2HG1  VAL  44          2HG1      VAL  44  -5.434  -3.846  -0.294
  304   3HG1  VAL  44          3HG1      VAL  44  -5.018  -2.899   1.154
  305   1HG2  VAL  44          1HG2      VAL  44  -3.074  -6.005   0.003
  306   2HG2  VAL  44          2HG2      VAL  44  -4.186  -7.080   0.883
  307   3HG2  VAL  44          3HG2      VAL  44  -4.770  -6.149  -0.518
  308    H    ALA  45           H        ALA  45  -4.550  -3.249   4.132
  309    HA   ALA  45           HA       ALA  45  -4.143  -0.760   3.234
  310   1HB   ALA  45          1HB       ALA  45  -5.238  -1.664   5.409
  311   2HB   ALA  45          2HB       ALA  45  -3.628  -1.447   6.137
  312   3HB   ALA  45          3HB       ALA  45  -4.492  -0.049   5.455
  313    H    ALA  46           H        ALA  46  -1.713  -2.900   4.792
  314    HA   ALA  46           HA       ALA  46   0.278  -0.794   4.621
  315   1HB   ALA  46          1HB       ALA  46   1.634  -2.257   5.938
  316   2HB   ALA  46          2HB       ALA  46  -0.013  -2.384   6.600
  317   3HB   ALA  46          3HB       ALA  46   0.623  -3.667   5.543
  318    H    ALA  47           H        ALA  47   0.281  -4.312   3.707
  319    HA   ALA  47           HA       ALA  47   2.128  -3.745   1.585
  320   1HB   ALA  47          1HB       ALA  47   2.554  -5.972   1.706
  321   2HB   ALA  47          2HB       ALA  47   1.626  -5.894   3.223
  322   3HB   ALA  47          3HB       ALA  47   0.827  -6.401   1.715
  323    H    THR  48           H        THR  48   1.462  -2.871  -0.310
  324    HA   THR  48           HA       THR  48  -1.020  -2.410  -1.177
  325    HB   THR  48           HB       THR  48   1.172  -1.730  -2.251
  326    HG1  THR  48           HG1      THR  48  -0.695  -3.184  -3.984
  327   1HG2  THR  48          1HG2      THR  48   2.259  -3.973  -2.420
  328   2HG2  THR  48          2HG2      THR  48   0.942  -4.529  -3.481
  329   3HG2  THR  48          3HG2      THR  48   2.053  -3.253  -4.035
  330    H    ALA  49           H        ALA  49  -2.529  -3.368  -2.680
  331    HA   ALA  49           HA       ALA  49  -3.419  -5.818  -1.958
  332   1HB   ALA  49          1HB       ALA  49  -3.630  -4.676  -4.768
  333   2HB   ALA  49          2HB       ALA  49  -4.800  -5.719  -3.925
  334   3HB   ALA  49          3HB       ALA  49  -4.548  -4.043  -3.381
  335    H    ALA  50           H        ALA  50  -3.110  -7.971  -2.577
  336    HA   ALA  50           HA       ALA  50  -0.553  -8.486  -3.816
  337   1HB   ALA  50          1HB       ALA  50  -0.673 -10.081  -2.228
  338   2HB   ALA  50          2HB       ALA  50  -2.419  -9.821  -2.001
  339   3HB   ALA  50          3HB       ALA  50  -1.841 -10.913  -3.282
  340    H    VAL  51           H        VAL  51  -2.046  -7.226  -5.708
  341    HA   VAL  51           HA       VAL  51  -2.457  -9.373  -7.604
  342    HB   VAL  51           HB       VAL  51  -4.613  -7.350  -6.963
  343   1HG1  VAL  51          1HG1      VAL  51  -5.916  -8.827  -8.623
  344   2HG1  VAL  51          2HG1      VAL  51  -4.728  -7.680  -9.287
  345   3HG1  VAL  51          3HG1      VAL  51  -4.320  -9.408  -9.155
  346   1HG2  VAL  51          1HG2      VAL  51  -4.374 -10.319  -6.424
  347   2HG2  VAL  51          2HG2      VAL  51  -4.705  -9.003  -5.271
  348   3HG2  VAL  51          3HG2      VAL  51  -5.941  -9.475  -6.463
  349    H    GLU  52           H        GLU  52  -0.265  -8.092  -7.877
  350    HA   GLU  52           HA       GLU  52  -0.659  -5.553  -9.145
  351   1HB   GLU  52          1HB       GLU  52   1.327  -6.327  -7.602
  352   2HB   GLU  52          2HB       GLU  52   1.964  -7.068  -9.056
  353   1HG   GLU  52          1HG       GLU  52   2.090  -4.950 -10.209
  354   2HG   GLU  52          2HG       GLU  52   1.092  -4.151  -9.010
  355    HE2  GLU  52           HE2      GLU  52   4.651  -4.192  -9.383
  356    H    GLY  53           H        GLY  53   0.304  -5.113 -11.357
  357   1HA   GLY  53          1HA       GLY  53  -0.096  -7.465 -13.109
  358   2HA   GLY  53          2HA       GLY  53  -0.563  -5.826 -13.516
  359    H    THR  54           H        THR  54   1.043  -4.250 -14.100
  360    HA   THR  54           HA       THR  54   3.701  -5.427 -14.588
  361    HB   THR  54           HB       THR  54   2.276  -5.104 -16.649
  362    HG1  THR  54           HG1      THR  54   4.001  -3.555 -17.563
  363   1HG2  THR  54          1HG2      THR  54   2.145  -2.617 -17.380
  364   2HG2  THR  54          2HG2      THR  54   0.941  -3.144 -16.180
  365   3HG2  THR  54          3HG2      THR  54   2.367  -2.215 -15.660
  366    H    GLY  55           H        GLY  55   5.532  -4.174 -14.202
  367   1HA   GLY  55          1HA       GLY  55   4.994  -1.811 -12.516
  368   2HA   GLY  55          2HA       GLY  55   6.391  -2.864 -12.401
  369    H    GLY  56           H        GLY  56   7.740  -3.044 -14.557
  370   1HA   GLY  56          1HA       GLY  56   7.759  -1.312 -16.617
  371   2HA   GLY  56          2HA       GLY  56   8.407  -0.332 -15.317
  372    H    SER  57           H        SER  57   9.797  -1.276 -17.754
  373    HA   SER  57           HA       SER  57  11.425  -3.446 -17.100
  374   1HB   SER  57          1HB       SER  57  12.622  -2.925 -19.098
  375   2HB   SER  57          2HB       SER  57  10.962  -2.461 -19.416
  376    HG   SER  57           HG       SER  57  11.483  -0.329 -19.376
  377    H    GLY  58           H        GLY  58  13.770  -3.412 -16.589
  378   1HA   GLY  58          1HA       GLY  58  14.412  -1.182 -14.789
  379   2HA   GLY  58          2HA       GLY  58  15.126  -2.782 -14.786
  380    H    GLY  59           H        GLY  59  17.154  -2.959 -15.633
  381   1HA   GLY  59          1HA       GLY  59  17.917  -1.708 -18.064
  382   2HA   GLY  59          2HA       GLY  59  18.558  -0.821 -16.695
  383    H    GLY  60           H        GLY  60  20.425  -1.919 -18.328
  384   1HA   GLY  60          1HA       GLY  60  21.691  -3.858 -16.599
  385   2HA   GLY  60          2HA       GLY  60  21.232  -4.488 -18.168
  386    HA   PRO  61           HA       PRO  61  25.247  -2.305 -18.562
  387   1HB   PRO  61          1HB       PRO  61  26.859  -4.444 -19.107
  388   2HB   PRO  61          2HB       PRO  61  26.688  -3.756 -17.504
  389   1HG   PRO  61          1HG       PRO  61  25.550  -6.266 -18.576
  390   2HG   PRO  61          2HG       PRO  61  25.751  -5.777 -16.905
  391   1HD   PRO  61          1HD       PRO  61  23.310  -5.775 -18.412
  392   2HD   PRO  61          2HD       PRO  61  23.535  -5.179 -16.779
  393    H    HIS  62           H        HIS  62  25.975  -1.389 -20.421
  394    HA   HIS  62           HA       HIS  62  24.549  -2.187 -22.728
  395   1HB   HIS  62          1HB       HIS  62  26.882  -0.271 -22.444
  396   2HB   HIS  62          2HB       HIS  62  25.827  -0.406 -23.837
  397    HD1  HIS  62           HD1      HIS  62  23.215   0.242 -23.384
  398    HD2  HIS  62           HD2      HIS  62  25.985   1.430 -20.466
  399    HE1  HIS  62           HE1      HIS  62  22.056   2.035 -21.986
  400    H    HIS  63           H        HIS  63  28.119  -2.090 -22.015
  401    HA   HIS  63           HA       HIS  63  29.795  -3.208 -22.905
  402   1HB   HIS  63          1HB       HIS  63  29.191  -4.960 -21.491
  403   2HB   HIS  63          2HB       HIS  63  27.741  -5.341 -22.398
  404    HD1  HIS  63           HD1      HIS  63  27.935  -7.442 -23.720
  405    HD2  HIS  63           HD2      HIS  63  31.640  -5.527 -23.273
  406    HE1  HIS  63           HE1      HIS  63  29.655  -8.936 -24.869
  407    H    HIS  64           H        HIS  64  30.094  -2.218 -24.915
  408    HA   HIS  64           HA       HIS  64  28.543  -3.287 -27.129
  409   1HB   HIS  64          1HB       HIS  64  30.282  -0.850 -26.762
  410   2HB   HIS  64          2HB       HIS  64  29.816  -1.398 -28.360
  411    HD1  HIS  64           HD1      HIS  64  28.445   0.214 -25.256
  412    HD2  HIS  64           HD2      HIS  64  27.067  -1.062 -29.006
  413    HE1  HIS  64           HE1      HIS  64  26.120   1.224 -25.544
  414    H    HIS  65           H        HIS  65  31.998  -2.628 -26.213
  415    HA   HIS  65           HA       HIS  65  33.065  -4.998 -26.712
  416   1HB   HIS  65          1HB       HIS  65  32.188  -3.835 -29.257
  417   2HB   HIS  65          2HB       HIS  65  33.887  -4.262 -29.256
  418    HD1  HIS  65           HD1      HIS  65  33.892  -6.868 -27.636
  419    HD2  HIS  65           HD2      HIS  65  30.997  -5.943 -30.526
  420    HE1  HIS  65           HE1      HIS  65  32.910  -9.095 -28.402
  421    H    GLN  66           H        GLN  66  35.302  -4.914 -26.375
  422    HA   GLN  66           HA       GLN  66  36.260  -2.365 -25.627
  423   1HB   GLN  66          1HB       GLN  66  36.835  -4.490 -24.433
  424   2HB   GLN  66          2HB       GLN  66  37.734  -5.029 -25.838
  425   1HG   GLN  66          1HG       GLN  66  39.208  -4.001 -24.087
  426   2HG   GLN  66          2HG       GLN  66  39.315  -3.172 -25.627
  427   1HE2  GLN  66          1HE2      GLN  66  40.116  -1.373 -24.452
  428   2HE2  GLN  66          2HE2      GLN  66  39.052  -0.274 -23.640
  429    H    THR  67           H        THR  67  38.507  -1.571 -26.390
  430    HA   THR  67           HA       THR  67  38.389  -1.122 -29.164
  431    HB   THR  67           HB       THR  67  39.365   0.540 -27.702
  432    HG1  THR  67           HG1      THR  67  41.559  -0.974 -28.919
  433   1HG2  THR  67          1HG2      THR  67  40.528  -1.772 -26.376
  434   2HG2  THR  67          2HG2      THR  67  41.836  -0.683 -26.899
  435   3HG2  THR  67          3HG2      THR  67  40.539  -0.074 -25.842
  436    H    ARG  68           H        ARG  68  40.519  -1.444 -30.539
  437    HA   ARG  68           HA       ARG  68  42.058  -3.667 -30.092
  438   1HB   ARG  68          1HB       ARG  68  39.418  -4.393 -30.892
  439   2HB   ARG  68          2HB       ARG  68  40.407  -4.609 -32.322
  440   1HG   ARG  68          1HG       ARG  68  41.961  -5.667 -30.194
  441   2HG   ARG  68          2HG       ARG  68  40.327  -6.212 -29.872
  442   1HD   ARG  68          1HD       ARG  68  41.090  -6.449 -32.729
  443   2HD   ARG  68          2HD       ARG  68  42.102  -7.404 -31.664
  444    HE   ARG  68           HE       ARG  68  40.227  -8.729 -31.061
  445   1HH1  ARG  68          2HH2      ARG  68  39.224  -6.005 -33.093
  446   2HH1  ARG  68          1HH2      ARG  68  37.642  -6.647 -33.388
  447   1HH2  ARG  68          1HH       ARG  68  37.027  -8.748 -32.412
  448    H    GLY  69           H        GLY  69  43.758  -3.634 -31.605
  449   1HA   GLY  69          1HA       GLY  69  43.417  -2.709 -34.281
  450   2HA   GLY  69          2HA       GLY  69  44.118  -1.466 -33.265
  451    H    ALA  70           H        ALA  70  44.617  -4.574 -34.844
  452    HA   ALA  70           HA       ALA  70  46.883  -5.481 -33.572
  453   1HB   ALA  70          1HB       ALA  70  47.218  -6.796 -35.534
  454   2HB   ALA  70          2HB       ALA  70  45.458  -6.564 -35.406
  455   3HB   ALA  70          3HB       ALA  70  46.401  -5.599 -36.567
  456    H    TYR  71           H        TYR  71  48.732  -4.402 -33.115
  457    HA   TYR  71           HA       TYR  71  49.588  -2.344 -35.022
  458   1HB   TYR  71          1HB       TYR  71  49.507  -2.802 -32.092
  459   2HB   TYR  71          2HB       TYR  71  51.135  -2.398 -32.601
  460    HD1  TYR  71           HD1      TYR  71  47.763  -1.164 -33.714
  461    HD2  TYR  71           HD2      TYR  71  51.586  -0.188 -32.059
  462    HE1  TYR  71           HE1      TYR  71  47.151   1.303 -33.734
  463    HE2  TYR  71           HE2      TYR  71  50.960   2.276 -32.085
  464    HH   TYR  71           HH       TYR  71  48.911   3.611 -32.038
  465    H    SER  72           H        SER  72  51.720  -2.307 -35.843
  466    HA   SER  72           HA       SER  72  53.659  -3.076 -36.457
  467   1HB   SER  72          1HB       SER  72  53.412  -4.164 -33.781
  468   2HB   SER  72          2HB       SER  72  54.220  -5.341 -34.797
  469    HG   SER  72           HG       SER  72  55.633  -3.482 -35.504
  470    H    SER  73           H        SER  73  51.785  -5.963 -35.252
  471    HA   SER  73           HA       SER  73  52.606  -7.824 -36.938
  472   1HB   SER  73          1HB       SER  73  50.421  -8.902 -36.697
  473   2HB   SER  73          2HB       SER  73  50.865  -8.132 -35.186
  474    HG   SER  73           HG       SER  73  49.526  -6.261 -35.913
  475    H    HIS  74           H        HIS  74  52.419  -8.380 -39.125
  476    HA   HIS  74           HA       HIS  74  50.529  -6.884 -40.734
  477   1HB   HIS  74          1HB       HIS  74  53.472  -6.537 -40.811
  478   2HB   HIS  74          2HB       HIS  74  52.697  -6.743 -42.369
  479    HD1  HIS  74           HD1      HIS  74  54.011  -4.044 -41.117
  480    HD2  HIS  74           HD2      HIS  74  49.933  -4.936 -41.525
  481    HE1  HIS  74           HE1      HIS  74  52.789  -1.804 -41.150
  482    H    ASP  75           H        ASP  75  49.833  -8.030 -42.578
  483    HA   ASP  75           HA       ASP  75  49.316  -9.828 -43.681
  484   1HB   ASP  75          1HB       ASP  75  52.308  -9.816 -43.656
  485   2HB   ASP  75          2HB       ASP  75  51.573 -11.328 -44.151
  486    HD2  ASP  75           HD2      ASP  75  52.900  -8.868 -45.351
  Start of MODEL    9
    1    H    MET   1           H        MET   1 -63.828   1.127 -10.344
    2    HA   MET   1           HA       MET   1 -61.915   2.097 -10.728
    3   1HB   MET   1          1HB       MET   1 -62.657   3.408  -8.725
    4   2HB   MET   1          2HB       MET   1 -61.868   2.259  -7.662
    5   1HG   MET   1          1HG       MET   1 -60.035   3.610  -7.786
    6   2HG   MET   1          2HG       MET   1 -59.801   2.971  -9.401
    7   1HE   MET   1          1HE       MET   1 -60.467   7.196  -8.326
    8   2HE   MET   1          2HE       MET   1 -61.194   5.973  -7.257
    9   3HE   MET   1          3HE       MET   1 -59.461   5.891  -7.654
   10    H    GLU   2           H        GLU   2 -60.535   0.578 -11.650
   11    HA   GLU   2           HA       GLU   2 -59.166  -1.226  -9.871
   12   1HB   GLU   2          1HB       GLU   2 -60.172  -1.542 -12.404
   13   2HB   GLU   2          2HB       GLU   2 -58.493  -1.203 -12.778
   14   1HG   GLU   2          1HG       GLU   2 -57.895  -3.300 -12.162
   15   2HG   GLU   2          2HG       GLU   2 -58.540  -3.041 -10.554
   16    HE2  GLU   2           HE2      GLU   2 -60.026  -5.821 -11.641
   17    H    VAL   3           H        VAL   3 -57.308  -0.560  -8.891
   18    HA   VAL   3           HA       VAL   3 -55.751   1.520 -10.221
   19    HB   VAL   3           HB       VAL   3 -55.346   0.420  -7.448
   20   1HG1  VAL   3          1HG1      VAL   3 -54.930   3.227  -7.643
   21   2HG1  VAL   3          2HG1      VAL   3 -53.722   1.945  -7.383
   22   3HG1  VAL   3          3HG1      VAL   3 -54.120   2.471  -9.037
   23   1HG2  VAL   3          1HG2      VAL   3 -57.742   1.064  -7.748
   24   2HG2  VAL   3          2HG2      VAL   3 -56.875   2.062  -6.556
   25   3HG2  VAL   3          3HG2      VAL   3 -57.205   2.704  -8.183
   26    H    ALA   4           H        ALA   4 -53.421   1.288 -10.462
   27    HA   ALA   4           HA       ALA   4 -52.743  -1.430 -11.165
   28   1HB   ALA   4          1HB       ALA   4 -52.062   0.084 -12.802
   29   2HB   ALA   4          2HB       ALA   4 -51.591   1.320 -11.612
   30   3HB   ALA   4          3HB       ALA   4 -50.567  -0.115 -11.857
   31    H    MET   5           H        MET   5 -50.494  -2.258 -10.526
   32    HA   MET   5           HA       MET   5 -50.267  -1.853  -7.672
   33   1HB   MET   5          1HB       MET   5 -49.613  -4.005  -9.664
   34   2HB   MET   5          2HB       MET   5 -48.487  -3.874  -8.327
   35   1HG   MET   5          1HG       MET   5 -51.266  -3.709  -7.383
   36   2HG   MET   5          2HG       MET   5 -50.999  -5.178  -8.300
   37   1HE   MET   5          1HE       MET   5 -50.637  -7.254  -6.125
   38   2HE   MET   5          2HE       MET   5 -50.041  -6.963  -7.777
   39   3HE   MET   5          3HE       MET   5 -48.896  -7.367  -6.475
   40    H    VAL   6           H        VAL   6 -49.084   0.077  -7.422
   41    HA   VAL   6           HA       VAL   6 -46.721   0.516  -8.979
   42    HB   VAL   6           HB       VAL   6 -47.751   1.965  -6.533
   43   1HG1  VAL   6          1HG1      VAL   6 -46.511   3.896  -7.586
   44   2HG1  VAL   6          2HG1      VAL   6 -45.481   2.583  -6.966
   45   3HG1  VAL   6          3HG1      VAL   6 -45.786   2.725  -8.714
   46   1HG2  VAL   6          1HG2      VAL   6 -49.508   1.898  -8.210
   47   2HG2  VAL   6          2HG2      VAL   6 -48.807   3.533  -8.140
   48   3HG2  VAL   6          3HG2      VAL   6 -48.370   2.432  -9.469
   49    H    SER   7           H        SER   7 -44.593   1.054  -7.786
   50    HA   SER   7           HA       SER   7 -44.137  -1.158  -5.966
   51   1HB   SER   7          1HB       SER   7 -42.775  -0.608  -8.183
   52   2HB   SER   7          2HB       SER   7 -41.934   0.536  -7.156
   53    HG   SER   7           HG       SER   7 -40.735  -1.189  -6.679
   54    H    ALA   8           H        ALA   8 -42.756  -0.793  -4.024
   55    HA   ALA   8           HA       ALA   8 -43.397   1.764  -2.828
   56   1HB   ALA   8          1HB       ALA   8 -42.719  -0.980  -1.948
   57   2HB   ALA   8          2HB       ALA   8 -42.020   0.313  -0.943
   58   3HB   ALA   8          3HB       ALA   8 -43.781   0.235  -1.195
   59    H    GLU   9           H        GLU   9 -42.037   3.291  -3.821
   60    HA   GLU   9           HA       GLU   9 -39.353   2.797  -4.330
   61   1HB   GLU   9          1HB       GLU   9 -41.177   4.824  -4.883
   62   2HB   GLU   9          2HB       GLU   9 -40.061   5.621  -3.792
   63   1HG   GLU   9          1HG       GLU   9 -38.569   5.832  -5.482
   64   2HG   GLU   9          2HG       GLU   9 -38.451   4.087  -5.590
   65    HE2  GLU   9           HE2      GLU   9 -39.136   6.095  -8.295
   66    H    SER  10           H        SER  10 -37.559   4.336  -3.301
   67    HA   SER  10           HA       SER  10 -37.931   4.156  -0.413
   68   1HB   SER  10          1HB       SER  10 -36.136   2.699  -1.815
   69   2HB   SER  10          2HB       SER  10 -35.174   4.149  -1.608
   70    HG   SER  10           HG       SER  10 -34.693   3.130   0.250
   71    H    SER  11           H        SER  11 -38.025   6.147   0.554
   72    HA   SER  11           HA       SER  11 -37.769   8.268   0.933
   73   1HB   SER  11          1HB       SER  11 -35.240   7.352   0.701
   74   2HB   SER  11          2HB       SER  11 -35.211   8.489  -0.632
   75    HG   SER  11           HG       SER  11 -34.968   9.013   2.009
   76    H    GLY  12           H        GLY  12 -39.382   9.353  -0.191
   77   1HA   GLY  12          1HA       GLY  12 -38.640  10.808  -2.546
   78   2HA   GLY  12          2HA       GLY  12 -39.759   9.506  -2.896
   79    H    CYS  13           H        CYS  13 -41.793  10.338  -3.104
   80    HA   CYS  13           HA       CYS  13 -42.868  11.770  -0.853
   81   1HB   CYS  13          1HB       CYS  13 -41.802  13.370  -2.775
   82   2HB   CYS  13          2HB       CYS  13 -43.419  13.165  -3.418
   83    HG   CYS  13           HG       CYS  13 -42.900  13.717  -0.214
   84    H    ASN  14           H        ASN  14 -43.679   9.354  -1.157
   85    HA   ASN  14           HA       ASN  14 -45.686   9.205  -3.226
   86   1HB   ASN  14          1HB       ASN  14 -44.060   7.300  -1.706
   87   2HB   ASN  14          2HB       ASN  14 -45.753   6.868  -1.574
   88   1HD2  ASN  14          1HD2      ASN  14 -46.946   6.332  -3.390
   89   2HD2  ASN  14          2HD2      ASN  14 -46.225   5.903  -4.906
   90    H    SER  15           H        SER  15 -45.834  10.991  -0.743
   91    HA   SER  15           HA       SER  15 -47.329  11.661   0.679
   92   1HB   SER  15          1HB       SER  15 -49.140   9.540  -0.558
   93   2HB   SER  15          2HB       SER  15 -49.687  10.788   0.544
   94    HG   SER  15           HG       SER  15 -49.096  10.951  -2.178
   95    H    HIS  16           H        HIS  16 -46.229  11.040   2.585
   96    HA   HIS  16           HA       HIS  16 -45.825   9.941   4.440
   97   1HB   HIS  16          1HB       HIS  16 -48.112  10.210   4.978
   98   2HB   HIS  16          2HB       HIS  16 -48.617   8.950   3.870
   99    HD1  HIS  16           HD1      HIS  16 -48.346   6.462   4.652
  100    HD2  HIS  16           HD2      HIS  16 -47.198   9.319   7.501
  101    HE1  HIS  16           HE1      HIS  16 -48.118   5.213   6.865
  102    H    MET  17           H        MET  17 -43.995   8.848   3.514
  103    HA   MET  17           HA       MET  17 -43.920   6.706   1.968
  104   1HB   MET  17          1HB       MET  17 -41.791   6.118   3.140
  105   2HB   MET  17          2HB       MET  17 -41.935   7.856   2.969
  106   1HG   MET  17          1HG       MET  17 -43.034   7.797   5.353
  107   2HG   MET  17          2HG       MET  17 -42.372   6.179   5.470
  108   1HE   MET  17          1HE       MET  17 -41.138   7.685   7.724
  109   2HE   MET  17          2HE       MET  17 -40.668   6.109   7.045
  110   3HE   MET  17          3HE       MET  17 -39.426   7.338   7.383
  111    HA   PRO  18           HA       PRO  18 -45.653   3.311   4.041
  112   1HB   PRO  18          1HB       PRO  18 -44.315   1.202   2.931
  113   2HB   PRO  18          2HB       PRO  18 -45.640   2.024   2.131
  114   1HG   PRO  18          1HG       PRO  18 -42.742   2.203   1.576
  115   2HG   PRO  18          2HG       PRO  18 -44.086   2.663   0.551
  116   1HD   PRO  18          1HD       PRO  18 -42.393   4.424   2.054
  117   2HD   PRO  18          2HD       PRO  18 -43.808   4.872   1.121
  118    H    TYR  19           H        TYR  19 -45.417   1.516   5.571
  119    HA   TYR  19           HA       TYR  19 -43.396   2.239   7.443
  120   1HB   TYR  19          1HB       TYR  19 -44.623   0.650   8.789
  121   2HB   TYR  19          2HB       TYR  19 -45.846   1.258   7.691
  122    HD1  TYR  19           HD1      TYR  19 -43.764  -1.632   8.582
  123    HD2  TYR  19           HD2      TYR  19 -46.726  -0.142   5.879
  124    HE1  TYR  19           HE1      TYR  19 -44.253  -4.001   7.802
  125    HE2  TYR  19           HE2      TYR  19 -47.205  -2.517   5.107
  126    HH   TYR  19           HH       TYR  19 -46.824  -4.963   6.468
  127    H    GLY  20           H        GLY  20 -41.352   1.465   7.639
  128   1HA   GLY  20          1HA       GLY  20 -40.733  -1.243   6.824
  129   2HA   GLY  20          2HA       GLY  20 -40.006   0.003   5.828
  130    H    TYR  21           H        TYR  21 -38.142   1.014   6.521
  131    HA   TYR  21           HA       TYR  21 -37.077   0.116   9.062
  132   1HB   TYR  21          1HB       TYR  21 -35.048   1.346   8.064
  133   2HB   TYR  21          2HB       TYR  21 -35.673   0.084   7.022
  134    HD1  TYR  21           HD1      TYR  21 -35.437   3.736   7.519
  135    HD2  TYR  21           HD2      TYR  21 -36.707   0.605   4.895
  136    HE1  TYR  21           HE1      TYR  21 -35.697   5.416   5.629
  137    HE2  TYR  21           HE2      TYR  21 -36.963   2.296   3.013
  138    HH   TYR  21           HH       TYR  21 -36.312   5.743   3.587
  139    H    ALA  22           H        ALA  22 -39.368   1.908   9.230
  140    HA   ALA  22           HA       ALA  22 -38.494   4.562   9.627
  141   1HB   ALA  22          1HB       ALA  22 -40.703   4.958  10.214
  142   2HB   ALA  22          2HB       ALA  22 -40.882   3.465   9.263
  143   3HB   ALA  22          3HB       ALA  22 -40.877   3.392  11.041
  144    H    ALA  23           H        ALA  23 -38.993   1.714  11.797
  145    HA   ALA  23           HA       ALA  23 -37.995   3.264  14.040
  146   1HB   ALA  23          1HB       ALA  23 -39.321   0.586  13.633
  147   2HB   ALA  23          2HB       ALA  23 -38.415   0.901  15.132
  148   3HB   ALA  23          3HB       ALA  23 -39.795   1.935  14.693
  149    H    GLN  24           H        GLN  24 -36.431   2.300  11.487
  150    HA   GLN  24           HA       GLN  24 -34.511   0.572  12.757
  151   1HB   GLN  24          1HB       GLN  24 -35.425   0.875  10.128
  152   2HB   GLN  24          2HB       GLN  24 -33.829   1.598  10.077
  153   1HG   GLN  24          1HG       GLN  24 -33.668  -0.809   9.587
  154   2HG   GLN  24          2HG       GLN  24 -32.850  -0.457  11.096
  155   1HE2  GLN  24          1HE2      GLN  24 -33.170  -1.920  12.571
  156   2HE2  GLN  24          2HE2      GLN  24 -34.622  -2.813  12.878
  157    H    ALA  25           H        ALA  25 -35.153   3.829  12.828
  158    HA   ALA  25           HA       ALA  25 -32.703   5.022  12.236
  159   1HB   ALA  25          1HB       ALA  25 -35.126   5.956  12.787
  160   2HB   ALA  25          2HB       ALA  25 -34.475   6.042  14.442
  161   3HB   ALA  25          3HB       ALA  25 -33.675   6.931  13.124
  162    H    ARG  26           H        ARG  26 -33.706   2.908  14.825
  163    HA   ARG  26           HA       ARG  26 -31.891   3.872  16.734
  164   1HB   ARG  26          1HB       ARG  26 -33.998   2.042  16.704
  165   2HB   ARG  26          2HB       ARG  26 -32.610   0.989  16.893
  166   1HG   ARG  26          1HG       ARG  26 -32.177   1.726  19.022
  167   2HG   ARG  26          2HG       ARG  26 -32.485   3.402  18.612
  168   1HD   ARG  26          1HD       ARG  26 -34.872   1.576  18.653
  169   2HD   ARG  26          2HD       ARG  26 -34.144   1.943  20.204
  170    HE   ARG  26           HE       ARG  26 -35.534   3.836  18.425
  171   1HH1  ARG  26          2HH2      ARG  26 -33.384   3.474  21.217
  172   2HH1  ARG  26          1HH2      ARG  26 -33.719   5.056  21.837
  173   1HH2  ARG  26          1HH       ARG  26 -35.246   6.479  20.660
  174    H    ALA  27           H        ALA  27 -31.750   1.586  14.013
  175    HA   ALA  27           HA       ALA  27 -29.382   0.265  14.831
  176   1HB   ALA  27          1HB       ALA  27 -29.795  -0.995  12.993
  177   2HB   ALA  27          2HB       ALA  27 -31.337  -0.107  12.921
  178   3HB   ALA  27          3HB       ALA  27 -29.954   0.430  11.938
  179    H    ARG  28           H        ARG  28 -30.153   3.292  13.134
  180    HA   ARG  28           HA       ARG  28 -27.712   3.651  11.908
  181   1HB   ARG  28          1HB       ARG  28 -30.040   5.007  11.861
  182   2HB   ARG  28          2HB       ARG  28 -29.219   6.021  13.032
  183   1HG   ARG  28          1HG       ARG  28 -27.580   5.330  10.640
  184   2HG   ARG  28          2HG       ARG  28 -29.000   6.295  10.289
  185   1HD   ARG  28          1HD       ARG  28 -28.287   7.927  12.092
  186   2HD   ARG  28          2HD       ARG  28 -26.827   6.986  12.326
  187    HE   ARG  28           HE       ARG  28 -25.966   7.819  10.297
  188   1HH1  ARG  28          2HH2      ARG  28 -29.405   8.636  10.552
  189   2HH1  ARG  28          1HH2      ARG  28 -29.377   9.711   9.194
  190   1HH2  ARG  28          1HH       ARG  28 -27.324  10.050   8.006
  191    H    GLU  29           H        GLU  29 -28.811   4.116  15.257
  192    HA   GLU  29           HA       GLU  29 -26.542   5.693  15.956
  193   1HB   GLU  29          1HB       GLU  29 -29.081   5.239  17.052
  194   2HB   GLU  29          2HB       GLU  29 -28.007   4.439  18.183
  195   1HG   GLU  29          1HG       GLU  29 -26.577   6.619  18.096
  196   2HG   GLU  29          2HG       GLU  29 -27.962   7.356  17.316
  197    HE2  GLU  29           HE2      GLU  29 -28.612   8.496  20.064
  198    H    ARG  30           H        ARG  30 -27.394   2.291  15.756
  199    HA   ARG  30           HA       ARG  30 -25.262   1.552  17.530
  200   1HB   ARG  30          1HB       ARG  30 -27.569   0.190  16.209
  201   2HB   ARG  30          2HB       ARG  30 -26.139  -0.809  16.374
  202   1HG   ARG  30          1HG       ARG  30 -26.673   0.714  18.834
  203   2HG   ARG  30          2HG       ARG  30 -28.052  -0.267  18.378
  204   1HD   ARG  30          1HD       ARG  30 -25.518  -1.743  18.071
  205   2HD   ARG  30          2HD       ARG  30 -25.736  -1.163  19.710
  206    HE   ARG  30           HE       ARG  30 -28.210  -2.219  19.152
  207   1HH1  ARG  30          2HH2      ARG  30 -24.936  -3.528  18.806
  208   2HH1  ARG  30          1HH2      ARG  30 -25.434  -5.170  19.041
  209   1HH2  ARG  30          1HH       ARG  30 -27.750  -5.650  19.425
  210    H    GLU  31           H        GLU  31 -25.991   1.883  14.078
  211    HA   GLU  31           HA       GLU  31 -23.657   0.363  13.351
  212   1HB   GLU  31          1HB       GLU  31 -25.990   1.573  11.888
  213   2HB   GLU  31          2HB       GLU  31 -24.512   1.314  10.983
  214   1HG   GLU  31          1HG       GLU  31 -24.556  -1.040  11.325
  215   2HG   GLU  31          2HG       GLU  31 -25.627  -0.918  12.707
  216    HE2  GLU  31           HE2      GLU  31 -27.044  -2.055   9.566
  217    H    ARG  32           H        ARG  32 -23.784   3.136  14.834
  218    HA   ARG  32           HA       ARG  32 -22.839   5.060  13.125
  219   1HB   ARG  32          1HB       ARG  32 -21.846   6.076  15.258
  220   2HB   ARG  32          2HB       ARG  32 -23.552   5.687  15.347
  221   1HG   ARG  32          1HG       ARG  32 -23.042   4.518  17.233
  222   2HG   ARG  32          2HG       ARG  32 -22.372   3.300  16.166
  223   1HD   ARG  32          1HD       ARG  32 -20.218   3.797  16.760
  224   2HD   ARG  32          2HD       ARG  32 -20.485   5.524  16.632
  225    HE   ARG  32           HE       ARG  32 -21.736   4.254  18.981
  226   1HH1  ARG  32          2HH2      ARG  32 -18.896   5.955  17.721
  227   2HH1  ARG  32          1HH2      ARG  32 -18.351   6.461  19.285
  228   1HH2  ARG  32          1HH       ARG  32 -19.614   5.842  21.225
  229    H    LEU  33           H        LEU  33 -21.246   2.288  14.674
  230    HA   LEU  33           HA       LEU  33 -18.612   3.285  13.977
  231   1HB   LEU  33          1HB       LEU  33 -19.647   1.665  16.005
  232   2HB   LEU  33          2HB       LEU  33 -18.742   0.568  14.980
  233    HG   LEU  33           HG       LEU  33 -16.764   2.105  15.183
  234   1HD1  LEU  33          1HD1      LEU  33 -18.243   3.405  17.470
  235   2HD1  LEU  33          2HD1      LEU  33 -16.694   3.873  16.730
  236   3HD1  LEU  33          3HD1      LEU  33 -18.214   4.101  15.832
  237   1HD2  LEU  33          1HD2      LEU  33 -16.229   1.424  17.527
  238   2HD2  LEU  33          2HD2      LEU  33 -17.906   0.850  17.690
  239   3HD2  LEU  33          3HD2      LEU  33 -16.822   0.103  16.492
  240    H    ALA  34           H        ALA  34 -21.206   1.551  12.551
  241    HA   ALA  34           HA       ALA  34 -19.540  -0.146  10.928
  242   1HB   ALA  34          1HB       ALA  34 -21.486  -1.268  10.902
  243   2HB   ALA  34          2HB       ALA  34 -22.334   0.106  11.651
  244   3HB   ALA  34          3HB       ALA  34 -22.168   0.021   9.881
  245    H    HIS  35           H        HIS  35 -19.836   3.104  11.038
  246    HA   HIS  35           HA       HIS  35 -20.265   3.502   8.202
  247   1HB   HIS  35          1HB       HIS  35 -20.223   5.202  10.637
  248   2HB   HIS  35          2HB       HIS  35 -19.644   5.958   9.166
  249    HD1  HIS  35           HD1      HIS  35 -21.509   5.146   7.009
  250    HD2  HIS  35           HD2      HIS  35 -22.854   5.819  10.925
  251    HE1  HIS  35           HE1      HIS  35 -24.006   5.637   6.832
  252    H    SER  36           H        SER  36 -17.721   2.721  10.344
  253    HA   SER  36           HA       SER  36 -15.749   4.167   8.830
  254   1HB   SER  36          1HB       SER  36 -15.878   3.463  11.467
  255   2HB   SER  36          2HB       SER  36 -14.923   2.127  10.855
  256    HG   SER  36           HG       SER  36 -13.563   3.880   9.790
  257    H    ARG  37           H        ARG  37 -17.351   1.075   8.883
  258    HA   ARG  37           HA       ARG  37 -15.167  -0.243   7.569
  259   1HB   ARG  37          1HB       ARG  37 -17.167  -1.143   9.245
  260   2HB   ARG  37          2HB       ARG  37 -17.849  -1.566   7.687
  261   1HG   ARG  37          1HG       ARG  37 -15.860  -2.868   7.091
  262   2HG   ARG  37          2HG       ARG  37 -15.006  -2.308   8.515
  263   1HD   ARG  37          1HD       ARG  37 -16.355  -3.600   9.995
  264   2HD   ARG  37          2HD       ARG  37 -17.648  -3.771   8.825
  265    HE   ARG  37           HE       ARG  37 -15.628  -5.052   7.529
  266   1HH1  ARG  37          2HH2      ARG  37 -16.731  -5.303  10.886
  267   2HH1  ARG  37          1HH2      ARG  37 -16.238  -6.955  11.055
  268   1HH2  ARG  37          1HH       ARG  37 -15.209  -8.068   9.199
  269    H    ALA  38           H        ALA  38 -17.046   2.097   6.505
  270    HA   ALA  38           HA       ALA  38 -18.322   0.857   4.250
  271   1HB   ALA  38          1HB       ALA  38 -18.347   3.400   5.651
  272   2HB   ALA  38          2HB       ALA  38 -18.166   3.657   3.899
  273   3HB   ALA  38          3HB       ALA  38 -19.546   2.722   4.523
  274    H    ALA  39           H        ALA  39 -15.663   3.309   4.666
  275    HA   ALA  39           HA       ALA  39 -14.841   3.269   2.024
  276   1HB   ALA  39          1HB       ALA  39 -13.681   4.956   2.954
  277   2HB   ALA  39          2HB       ALA  39 -13.954   4.309   4.590
  278   3HB   ALA  39          3HB       ALA  39 -12.566   3.744   3.629
  279    H    ALA  40           H        ALA  40 -12.942   2.267   1.018
  280    HA   ALA  40           HA       ALA  40 -12.702  -0.488   1.878
  281   1HB   ALA  40          1HB       ALA  40 -11.093   0.053  -0.400
  282   2HB   ALA  40          2HB       ALA  40 -12.679  -0.755  -0.352
  283   3HB   ALA  40          3HB       ALA  40 -12.584   1.006  -0.595
  284    H    ALA  41           H        ALA  41 -10.365   2.089   0.804
  285    HA   ALA  41           HA       ALA  41  -8.367   2.658   1.575
  286   1HB   ALA  41          1HB       ALA  41  -9.798   2.152   3.862
  287   2HB   ALA  41          2HB       ALA  41  -8.422   1.038   4.054
  288   3HB   ALA  41          3HB       ALA  41  -8.133   2.780   3.831
  289    H    ALA  42           H        ALA  42  -8.260   0.862  -0.353
  290    HA   ALA  42           HA       ALA  42  -6.542  -1.301   0.650
  291   1HB   ALA  42          1HB       ALA  42  -7.999  -1.129  -2.014
  292   2HB   ALA  42          2HB       ALA  42  -7.208  -2.553  -1.296
  293   3HB   ALA  42          3HB       ALA  42  -8.690  -1.893  -0.562
  294    H    ALA  43           H        ALA  43  -6.999   0.778  -2.305
  295    HA   ALA  43           HA       ALA  43  -4.507   0.474  -3.358
  296   1HB   ALA  43          1HB       ALA  43  -5.868   1.663  -4.760
  297   2HB   ALA  43          2HB       ALA  43  -6.652   2.543  -3.427
  298   3HB   ALA  43          3HB       ALA  43  -5.048   3.051  -4.006
  299    H    VAL  44           H        VAL  44  -5.464   2.133  -0.413
  300    HA   VAL  44           HA       VAL  44  -2.896   3.511  -0.290
  301    HB   VAL  44           HB       VAL  44  -5.579   3.881   0.806
  302   1HG1  VAL  44          1HG1      VAL  44  -4.578   5.057   2.891
  303   2HG1  VAL  44          2HG1      VAL  44  -4.808   3.293   2.933
  304   3HG1  VAL  44          3HG1      VAL  44  -3.188   3.973   2.644
  305   1HG2  VAL  44          1HG2      VAL  44  -5.191   5.984   0.139
  306   2HG2  VAL  44          2HG2      VAL  44  -3.669   6.082   1.057
  307   3HG2  VAL  44          3HG2      VAL  44  -3.680   5.366  -0.573
  308    H    ALA  45           H        ALA  45  -4.741   0.782   1.041
  309    HA   ALA  45           HA       ALA  45  -3.554   0.241   3.379
  310   1HB   ALA  45          1HB       ALA  45  -5.285  -1.146   2.326
  311   2HB   ALA  45          2HB       ALA  45  -4.117  -1.707   1.107
  312   3HB   ALA  45          3HB       ALA  45  -3.902  -2.153   2.816
  313    H    ALA  46           H        ALA  46  -2.227  -0.862   0.173
  314    HA   ALA  46           HA       ALA  46   0.169  -1.811   1.214
  315   1HB   ALA  46          1HB       ALA  46  -1.108  -1.744  -1.236
  316   2HB   ALA  46          2HB       ALA  46   0.292  -0.678  -1.507
  317   3HB   ALA  46          3HB       ALA  46   0.541  -2.351  -0.953
  318    H    ALA  47           H        ALA  47  -0.718   1.418  -0.171
  319    HA   ALA  47           HA       ALA  47   1.821   2.539   0.034
  320   1HB   ALA  47          1HB       ALA  47  -0.486   4.334   0.502
  321   2HB   ALA  47          2HB       ALA  47   0.756   4.374  -0.773
  322   3HB   ALA  47          3HB       ALA  47  -0.644   3.286  -0.928
  323    H    THR  48           H        THR  48   1.974   4.697   1.574
  324    HA   THR  48           HA       THR  48   2.479   5.369   3.634
  325    HB   THR  48           HB       THR  48  -0.052   3.853   4.450
  326    HG1  THR  48           HG1      THR  48  -0.940   6.050   3.779
  327   1HG2  THR  48          1HG2      THR  48  -0.150   5.288   6.266
  328   2HG2  THR  48          2HG2      THR  48   1.614   5.368   6.036
  329   3HG2  THR  48          3HG2      THR  48   0.568   6.638   5.355
  330    H    ALA  49           H        ALA  49   4.444   4.300   3.882
  331    HA   ALA  49           HA       ALA  49   4.815   1.661   4.466
  332   1HB   ALA  49          1HB       ALA  49   6.995   2.289   5.046
  333   2HB   ALA  49          2HB       ALA  49   6.467   3.647   4.023
  334   3HB   ALA  49          3HB       ALA  49   6.465   3.814   5.795
  335    H    ALA  50           H        ALA  50   3.425   4.199   6.462
  336    HA   ALA  50           HA       ALA  50   3.836   2.723   8.910
  337   1HB   ALA  50          1HB       ALA  50   3.842   5.282   8.613
  338   2HB   ALA  50          2HB       ALA  50   2.072   5.152   8.475
  339   3HB   ALA  50          3HB       ALA  50   2.890   4.627   9.966
  340    H    VAL  51           H        VAL  51   2.640   0.984   7.194
  341    HA   VAL  51           HA       VAL  51   0.039   0.692   8.431
  342    HB   VAL  51           HB       VAL  51   0.478   1.033   5.470
  343   1HG1  VAL  51          1HG1      VAL  51  -2.119   0.370   5.545
  344   2HG1  VAL  51          2HG1      VAL  51  -0.829  -0.826   5.274
  345   3HG1  VAL  51          3HG1      VAL  51  -1.541  -0.636   6.894
  346   1HG2  VAL  51          1HG2      VAL  51  -0.101   3.096   6.410
  347   2HG2  VAL  51          2HG2      VAL  51  -1.659   2.450   5.842
  348   3HG2  VAL  51          3HG2      VAL  51  -1.235   2.361   7.568
  349    H    GLU  52           H        GLU  52   1.859  -0.823   9.382
  350    HA   GLU  52           HA       GLU  52   2.234  -3.108   7.650
  351   1HB   GLU  52          1HB       GLU  52   3.905  -1.853   9.475
  352   2HB   GLU  52          2HB       GLU  52   3.334  -3.228  10.401
  353   1HG   GLU  52          1HG       GLU  52   3.943  -4.709   8.399
  354   2HG   GLU  52          2HG       GLU  52   4.700  -3.305   7.673
  355    HE2  GLU  52           HE2      GLU  52   6.922  -4.862   8.272
  356    H    GLY  53           H        GLY  53   1.942  -5.352   8.707
  357   1HA   GLY  53          1HA       GLY  53   0.421  -5.835  10.951
  358   2HA   GLY  53          2HA       GLY  53  -0.736  -5.550   9.665
  359    H    THR  54           H        THR  54   2.467  -7.258  10.000
  360    HA   THR  54           HA       THR  54   3.171  -9.167   9.046
  361    HB   THR  54           HB       THR  54   0.524  -9.929  10.377
  362    HG1  THR  54           HG1      THR  54   2.239 -10.551  11.997
  363   1HG2  THR  54          1HG2      THR  54   2.813 -11.628   9.290
  364   2HG2  THR  54          2HG2      THR  54   1.817 -12.177  10.660
  365   3HG2  THR  54          3HG2      THR  54   1.065 -11.879   9.074
  366    H    GLY  55           H        GLY  55   3.012  -8.220   6.860
  367   1HA   GLY  55          1HA       GLY  55   1.354  -9.947   5.205
  368   2HA   GLY  55          2HA       GLY  55   1.017  -8.230   5.100
  369    H    GLY  56           H        GLY  56   1.942  -9.686   2.860
  370   1HA   GLY  56          1HA       GLY  56   3.884  -8.129   1.785
  371   2HA   GLY  56          2HA       GLY  56   4.797  -9.379   2.607
  372    H    SER  57           H        SER  57   3.984  -8.637  -0.377
  373    HA   SER  57           HA       SER  57   3.072 -11.322  -1.052
  374   1HB   SER  57          1HB       SER  57   1.955  -8.924  -1.797
  375   2HB   SER  57          2HB       SER  57   3.035  -9.201  -3.149
  376    HG   SER  57           HG       SER  57   1.984 -11.527  -2.976
  377    H    GLY  58           H        GLY  58   3.999 -12.168  -3.211
  378   1HA   GLY  58          1HA       GLY  58   6.766 -11.200  -3.602
  379   2HA   GLY  58          2HA       GLY  58   6.392 -12.902  -3.422
  380    H    GLY  59           H        GLY  59   6.895 -13.692  -5.466
  381   1HA   GLY  59          1HA       GLY  59   5.197 -13.865  -7.487
  382   2HA   GLY  59          2HA       GLY  59   5.882 -12.286  -7.814
  383    H    GLY  60           H        GLY  60   6.450 -15.769  -7.767
  384   1HA   GLY  60          1HA       GLY  60   8.275 -15.912  -9.747
  385   2HA   GLY  60          2HA       GLY  60   9.274 -15.559  -8.351
  386    HA   PRO  61           HA       PRO  61   7.224 -19.835  -7.858
  387   1HB   PRO  61          1HB       PRO  61   6.513 -21.118 -10.164
  388   2HB   PRO  61          2HB       PRO  61   5.370 -20.254  -9.157
  389   1HG   PRO  61          1HG       PRO  61   6.536 -19.446 -11.750
  390   2HG   PRO  61          2HG       PRO  61   5.107 -18.825 -10.948
  391   1HD   PRO  61          1HD       PRO  61   7.679 -17.564 -11.090
  392   2HD   PRO  61          2HD       PRO  61   6.284 -17.001 -10.192
  393    H    HIS  62           H        HIS  62   8.568 -21.460  -7.314
  394    HA   HIS  62           HA       HIS  62  11.031 -21.454  -8.813
  395   1HB   HIS  62          1HB       HIS  62  11.183 -21.416  -6.413
  396   2HB   HIS  62          2HB       HIS  62  10.151 -22.824  -6.262
  397    HD1  HIS  62           HD1      HIS  62  11.213 -25.160  -6.666
  398    HD2  HIS  62           HD2      HIS  62  13.870 -21.958  -7.194
  399    HE1  HIS  62           HE1      HIS  62  13.548 -26.182  -6.790
  400    H    HIS  63           H        HIS  63   8.703 -24.001  -7.650
  401    HA   HIS  63           HA       HIS  63   9.616 -26.117  -8.986
  402   1HB   HIS  63          1HB       HIS  63   7.740 -26.302  -7.530
  403   2HB   HIS  63          2HB       HIS  63   6.767 -25.229  -8.516
  404    HD1  HIS  63           HD1      HIS  63   5.299 -26.300 -10.265
  405    HD2  HIS  63           HD2      HIS  63   8.281 -28.893  -8.858
  406    HE1  HIS  63           HE1      HIS  63   4.804 -28.582 -11.292
  407    H    HIS  64           H        HIS  64  10.142 -26.589 -11.057
  408    HA   HIS  64           HA       HIS  64   8.579 -25.269 -13.143
  409   1HB   HIS  64          1HB       HIS  64  10.899 -24.221 -12.638
  410   2HB   HIS  64          2HB       HIS  64  11.557 -25.653 -13.403
  411    HD1  HIS  64           HD1      HIS  64  11.542 -22.542 -14.450
  412    HD2  HIS  64           HD2      HIS  64   9.294 -25.768 -15.910
  413    HE1  HIS  64           HE1      HIS  64  10.915 -21.948 -16.851
  414    H    HIS  65           H        HIS  65  11.228 -27.719 -12.652
  415    HA   HIS  65           HA       HIS  65  10.864 -29.267 -14.777
  416   1HB   HIS  65          1HB       HIS  65  12.494 -29.598 -12.917
  417   2HB   HIS  65          2HB       HIS  65  11.218 -30.321 -11.958
  418    HD1  HIS  65           HD1      HIS  65  12.234 -32.671 -11.848
  419    HD2  HIS  65           HD2      HIS  65  11.694 -31.272 -15.765
  420    HE1  HIS  65           HE1      HIS  65  12.643 -34.668 -13.383
  421    H    GLN  66           H        GLN  66   9.583 -31.127 -15.374
  422    HA   GLN  66           HA       GLN  66   6.882 -30.768 -14.788
  423   1HB   GLN  66          1HB       GLN  66   6.531 -32.752 -16.197
  424   2HB   GLN  66          2HB       GLN  66   7.722 -31.696 -16.929
  425   1HG   GLN  66          1HG       GLN  66   9.562 -33.103 -16.155
  426   2HG   GLN  66          2HG       GLN  66   8.484 -34.063 -15.161
  427   1HE2  GLN  66          1HE2      GLN  66   9.876 -33.600 -18.223
  428   2HE2  GLN  66          2HE2      GLN  66   9.068 -34.854 -19.103
  429    H    THR  67           H        THR  67   5.455 -32.781 -14.091
  430    HA   THR  67           HA       THR  67   5.950 -33.280 -11.414
  431    HB   THR  67           HB       THR  67   4.320 -35.077 -13.264
  432    HG1  THR  67           HG1      THR  67   2.734 -33.251 -12.951
  433   1HG2  THR  67          1HG2      THR  67   3.528 -35.760 -11.223
  434   2HG2  THR  67          2HG2      THR  67   4.414 -34.468 -10.379
  435   3HG2  THR  67          3HG2      THR  67   2.809 -34.139 -11.075
  436    H    ARG  68           H        ARG  68   6.311 -35.377 -10.306
  437    HA   ARG  68           HA       ARG  68   7.546 -37.090  -9.855
  438   1HB   ARG  68          1HB       ARG  68   6.395 -38.111 -11.867
  439   2HB   ARG  68          2HB       ARG  68   7.727 -37.577 -12.872
  440   1HG   ARG  68          1HG       ARG  68   9.295 -38.910 -11.349
  441   2HG   ARG  68          2HG       ARG  68   7.873 -39.561 -10.557
  442   1HD   ARG  68          1HD       ARG  68   8.152 -41.214 -12.159
  443   2HD   ARG  68          2HD       ARG  68   7.154 -40.121 -13.097
  444    HE   ARG  68           HE       ARG  68   9.688 -39.180 -13.617
  445   1HH1  ARG  68          2HH2      ARG  68   8.257 -42.417 -13.789
  446   2HH1  ARG  68          1HH2      ARG  68   9.307 -42.949 -15.060
  447   1HH2  ARG  68          1HH       ARG  68  10.956 -41.442 -15.928
  448    H    GLY  69           H        GLY  69   9.444 -36.236  -8.980
  449   1HA   GLY  69          1HA       GLY  69  11.762 -36.119 -10.744
  450   2HA   GLY  69          2HA       GLY  69  11.311 -34.625  -9.948
  451    H    ALA  70           H        ALA  70  11.957 -38.127  -9.260
  452    HA   ALA  70           HA       ALA  70  13.557 -37.323  -6.989
  453   1HB   ALA  70          1HB       ALA  70  10.892 -38.694  -6.786
  454   2HB   ALA  70          2HB       ALA  70  12.193 -39.200  -5.681
  455   3HB   ALA  70          3HB       ALA  70  11.646 -37.506  -5.697
  456    H    TYR  71           H        TYR  71  15.318 -38.656  -6.805
  457    HA   TYR  71           HA       TYR  71  15.451 -40.856  -8.695
  458   1HB   TYR  71          1HB       TYR  71  17.224 -39.041  -7.065
  459   2HB   TYR  71          2HB       TYR  71  17.855 -40.663  -7.276
  460    HD1  TYR  71           HD1      TYR  71  17.486 -37.427  -8.758
  461    HD2  TYR  71           HD2      TYR  71  18.055 -41.562  -9.695
  462    HE1  TYR  71           HE1      TYR  71  18.368 -36.792 -11.056
  463    HE2  TYR  71           HE2      TYR  71  18.934 -40.914 -11.990
  464    HH   TYR  71           HH       TYR  71  18.756 -39.083 -13.532
  465    H    SER  72           H        SER  72  15.547 -43.016  -8.164
  466    HA   SER  72           HA       SER  72  15.300 -43.563  -5.312
  467   1HB   SER  72          1HB       SER  72  14.327 -45.150  -7.728
  468   2HB   SER  72          2HB       SER  72  14.221 -45.727  -6.077
  469    HG   SER  72           HG       SER  72  12.637 -43.861  -7.418
  470    H    SER  73           H        SER  73  17.258 -44.211  -4.482
  471    HA   SER  73           HA       SER  73  18.517 -46.460  -5.657
  472   1HB   SER  73          1HB       SER  73  19.584 -43.741  -6.151
  473   2HB   SER  73          2HB       SER  73  20.770 -44.841  -5.477
  474    HG   SER  73           HG       SER  73  20.963 -45.329  -7.591
  475    H    HIS  74           H        HIS  74  17.938 -47.272  -3.518
  476    HA   HIS  74           HA       HIS  74  20.000 -46.926  -1.639
  477   1HB   HIS  74          1HB       HIS  74  19.053 -44.902  -0.951
  478   2HB   HIS  74          2HB       HIS  74  17.410 -45.477  -1.153
  479    HD1  HIS  74           HD1      HIS  74  20.423 -46.102   1.128
  480    HD2  HIS  74           HD2      HIS  74  16.238 -46.380   1.158
  481    HE1  HIS  74           HE1      HIS  74  19.765 -46.714   3.516
  482    H    ASP  75           H        ASP  75  19.906 -48.559   0.014
  483    HA   ASP  75           HA       ASP  75  19.538 -50.637   0.576
  484   1HB   ASP  75          1HB       ASP  75  17.573 -49.167   1.598
  485   2HB   ASP  75          2HB       ASP  75  16.560 -50.074   0.494
  486    HD2  ASP  75           HD2      ASP  75  17.292 -51.264   3.965
  Start of MODEL   10
    1    H    MET   1           H        MET   1 -26.309   8.246 -35.854
    2    HA   MET   1           HA       MET   1 -23.477   8.958 -35.859
    3   1HB   MET   1          1HB       MET   1 -25.564  10.614 -36.479
    4   2HB   MET   1          2HB       MET   1 -25.580  10.816 -34.738
    5   1HG   MET   1          1HG       MET   1 -23.411  11.764 -34.687
    6   2HG   MET   1          2HG       MET   1 -22.941  11.034 -36.209
    7   1HE   MET   1          1HE       MET   1 -22.721  13.929 -38.094
    8   2HE   MET   1          2HE       MET   1 -22.338  12.232 -37.717
    9   3HE   MET   1          3HE       MET   1 -23.677  12.617 -38.824
   10    H    GLU   2           H        GLU   2 -22.846  10.056 -33.625
   11    HA   GLU   2           HA       GLU   2 -23.362   8.076 -31.680
   12   1HB   GLU   2          1HB       GLU   2 -21.333   9.922 -32.176
   13   2HB   GLU   2          2HB       GLU   2 -22.087  10.571 -30.734
   14   1HG   GLU   2          1HG       GLU   2 -21.735   8.523 -29.501
   15   2HG   GLU   2          2HG       GLU   2 -21.338   7.627 -30.954
   16    HE2  GLU   2           HE2      GLU   2 -19.439   8.462 -32.071
   17    H    VAL   3           H        VAL   3 -25.419   8.013 -30.813
   18    HA   VAL   3           HA       VAL   3 -26.980  10.324 -30.433
   19    HB   VAL   3           HB       VAL   3 -27.206   7.561 -29.221
   20   1HG1  VAL   3          1HG1      VAL   3 -29.611   8.111 -28.994
   21   2HG1  VAL   3          2HG1      VAL   3 -28.574   9.172 -28.012
   22   3HG1  VAL   3          3HG1      VAL   3 -29.267   9.770 -29.539
   23   1HG2  VAL   3          1HG2      VAL   3 -29.070   8.057 -31.347
   24   2HG2  VAL   3          2HG2      VAL   3 -27.423   8.401 -31.928
   25   3HG2  VAL   3          3HG2      VAL   3 -27.806   6.809 -31.231
   26    H    ALA   4           H        ALA   4 -27.822  11.069 -28.263
   27    HA   ALA   4           HA       ALA   4 -25.596  11.706 -26.612
   28   1HB   ALA   4          1HB       ALA   4 -28.438  12.451 -26.921
   29   2HB   ALA   4          2HB       ALA   4 -27.858  12.487 -25.238
   30   3HB   ALA   4          3HB       ALA   4 -27.034  13.454 -26.485
   31    H    MET   5           H        MET   5 -24.785  10.561 -24.929
   32    HA   MET   5           HA       MET   5 -26.123   8.166 -24.183
   33   1HB   MET   5          1HB       MET   5 -23.573   8.562 -24.401
   34   2HB   MET   5          2HB       MET   5 -23.663   9.483 -22.913
   35   1HG   MET   5          1HG       MET   5 -24.781   7.376 -21.867
   36   2HG   MET   5          2HG       MET   5 -24.257   6.519 -23.303
   37   1HE   MET   5          1HE       MET   5 -23.040   6.675 -19.732
   38   2HE   MET   5          2HE       MET   5 -23.576   5.433 -20.888
   39   3HE   MET   5          3HE       MET   5 -21.870   5.503 -20.385
   40    H    VAL   6           H        VAL   6 -27.942   8.379 -22.912
   41    HA   VAL   6           HA       VAL   6 -27.709  10.184 -20.607
   42    HB   VAL   6           HB       VAL   6 -30.281   9.117 -21.738
   43   1HG1  VAL   6          1HG1      VAL   6 -30.415  10.169 -19.556
   44   2HG1  VAL   6          2HG1      VAL   6 -29.548  11.603 -20.156
   45   3HG1  VAL   6          3HG1      VAL   6 -31.175  11.225 -20.771
   46   1HG2  VAL   6          1HG2      VAL   6 -30.060  11.693 -22.741
   47   2HG2  VAL   6          2HG2      VAL   6 -28.445  11.001 -23.022
   48   3HG2  VAL   6          3HG2      VAL   6 -29.888  10.185 -23.670
   49    H    SER   7           H        SER   7 -28.870   9.407 -18.603
   50    HA   SER   7           HA       SER   7 -27.993   6.778 -18.079
   51   1HB   SER   7          1HB       SER   7 -29.184   9.043 -16.548
   52   2HB   SER   7          2HB       SER   7 -29.512   7.453 -15.889
   53    HG   SER   7           HG       SER   7 -26.988   8.764 -16.273
   54    H    ALA   8           H        ALA   8 -29.166   5.228 -19.265
   55    HA   ALA   8           HA       ALA   8 -32.008   5.394 -19.471
   56   1HB   ALA   8          1HB       ALA   8 -30.723   2.801 -20.029
   57   2HB   ALA   8          2HB       ALA   8 -31.694   3.848 -21.093
   58   3HB   ALA   8          3HB       ALA   8 -29.957   4.169 -20.871
   59    H    GLU   9           H        GLU   9 -32.767   5.492 -17.285
   60    HA   GLU   9           HA       GLU   9 -33.109   2.913 -16.173
   61   1HB   GLU   9          1HB       GLU   9 -30.796   3.991 -15.320
   62   2HB   GLU   9          2HB       GLU   9 -31.865   4.822 -14.208
   63   1HG   GLU   9          1HG       GLU   9 -32.772   2.140 -14.188
   64   2HG   GLU   9          2HG       GLU   9 -31.024   2.010 -14.218
   65    HE2  GLU   9           HE2      GLU   9 -32.637   4.136 -11.208
   66    H    SER  10           H        SER  10 -34.466   3.135 -14.021
   67    HA   SER  10           HA       SER  10 -36.581   4.888 -14.663
   68   1HB   SER  10          1HB       SER  10 -36.041   2.940 -12.399
   69   2HB   SER  10          2HB       SER  10 -37.456   3.974 -12.369
   70    HG   SER  10           HG       SER  10 -36.801   1.853 -14.179
   71    H    SER  11           H        SER  11 -37.070   6.906 -13.803
   72    HA   SER  11           HA       SER  11 -35.043   8.113 -12.223
   73   1HB   SER  11          1HB       SER  11 -36.127   9.402 -13.990
   74   2HB   SER  11          2HB       SER  11 -37.711   9.122 -13.295
   75    HG   SER  11           HG       SER  11 -36.997  10.335 -11.387
   76    H    GLY  12           H        GLY  12 -34.990   8.201 -10.004
   77   1HA   GLY  12          1HA       GLY  12 -36.325   8.855  -8.040
   78   2HA   GLY  12          2HA       GLY  12 -37.533   7.702  -8.572
   79    H    CYS  13           H        CYS  13 -37.392   5.579  -7.902
   80    HA   CYS  13           HA       CYS  13 -36.720   3.934  -6.585
   81   1HB   CYS  13          1HB       CYS  13 -34.664   4.305  -8.659
   82   2HB   CYS  13          2HB       CYS  13 -34.097   3.402  -7.269
   83    HG   CYS  13           HG       CYS  13 -36.194   1.766  -7.176
   84    H    ASN  14           H        ASN  14 -36.827   5.926  -4.905
   85    HA   ASN  14           HA       ASN  14 -34.185   6.375  -3.808
   86   1HB   ASN  14          1HB       ASN  14 -36.694   7.881  -3.916
   87   2HB   ASN  14          2HB       ASN  14 -36.177   7.718  -2.250
   88   1HD2  ASN  14          1HD2      ASN  14 -34.162   8.508  -1.593
   89   2HD2  ASN  14          2HD2      ASN  14 -33.305   9.723  -2.481
   90    H    SER  15           H        SER  15 -35.800   3.777  -3.669
   91    HA   SER  15           HA       SER  15 -36.237   2.201  -2.244
   92   1HB   SER  15          1HB       SER  15 -34.016   3.192  -1.219
   93   2HB   SER  15          2HB       SER  15 -35.062   3.778   0.059
   94    HG   SER  15           HG       SER  15 -35.851   1.329  -0.089
   95    H    HIS  16           H        HIS  16 -38.544   2.694  -2.487
   96    HA   HIS  16           HA       HIS  16 -39.694   4.351  -0.407
   97   1HB   HIS  16          1HB       HIS  16 -41.835   3.788  -1.716
   98   2HB   HIS  16          2HB       HIS  16 -40.655   4.854  -2.453
   99    HD1  HIS  16           HD1      HIS  16 -42.222   1.463  -2.805
  100    HD2  HIS  16           HD2      HIS  16 -39.270   3.767  -4.695
  101    HE1  HIS  16           HE1      HIS  16 -41.721   0.304  -5.023
  102    H    MET  17           H        MET  17 -38.379   2.043   0.572
  103    HA   MET  17           HA       MET  17 -39.674  -0.255   0.790
  104   1HB   MET  17          1HB       MET  17 -38.181   1.462   2.804
  105   2HB   MET  17          2HB       MET  17 -38.892  -0.040   3.361
  106   1HG   MET  17          1HG       MET  17 -37.161  -0.018   0.864
  107   2HG   MET  17          2HG       MET  17 -36.412  -0.043   2.448
  108   1HE   MET  17          1HE       MET  17 -36.446  -2.397   4.062
  109   2HE   MET  17          2HE       MET  17 -36.002  -3.601   2.828
  110   3HE   MET  17          3HE       MET  17 -35.353  -1.946   2.731
  111    HA   PRO  18           HA       PRO  18 -43.430   0.314   2.888
  112   1HB   PRO  18          1HB       PRO  18 -43.711  -1.987   4.336
  113   2HB   PRO  18          2HB       PRO  18 -44.039  -1.890   2.617
  114   1HG   PRO  18          1HG       PRO  18 -41.719  -3.095   3.996
  115   2HG   PRO  18          2HG       PRO  18 -42.275  -3.352   2.354
  116   1HD   PRO  18          1HD       PRO  18 -40.043  -1.750   3.180
  117   2HD   PRO  18          2HD       PRO  18 -40.670  -1.915   1.552
  118    H    TYR  19           H        TYR  19 -44.454  -0.447   5.340
  119    HA   TYR  19           HA       TYR  19 -43.233   1.586   6.936
  120   1HB   TYR  19          1HB       TYR  19 -45.225  -0.571   7.807
  121   2HB   TYR  19          2HB       TYR  19 -45.169   1.099   8.335
  122    HD1  TYR  19           HD1      TYR  19 -45.901   2.926   6.739
  123    HD2  TYR  19           HD2      TYR  19 -46.524  -1.226   5.920
  124    HE1  TYR  19           HE1      TYR  19 -47.666   3.525   5.010
  125    HE2  TYR  19           HE2      TYR  19 -48.287  -0.614   4.193
  126    HH   TYR  19           HH       TYR  19 -49.890   1.804   4.038
  127    H    GLY  20           H        GLY  20 -42.055   1.373   8.862
  128   1HA   GLY  20          1HA       GLY  20 -41.521  -0.310  10.654
  129   2HA   GLY  20          2HA       GLY  20 -40.988  -1.342   9.342
  130    H    TYR  21           H        TYR  21 -40.310   1.696   8.200
  131    HA   TYR  21           HA       TYR  21 -37.526   1.402   8.688
  132   1HB   TYR  21          1HB       TYR  21 -39.218   2.577   6.824
  133   2HB   TYR  21          2HB       TYR  21 -38.804   3.990   7.775
  134    HD1  TYR  21           HD1      TYR  21 -36.959   1.035   6.349
  135    HD2  TYR  21           HD2      TYR  21 -37.095   5.276   6.901
  136    HE1  TYR  21           HE1      TYR  21 -34.788   1.281   5.050
  137    HE2  TYR  21           HE2      TYR  21 -34.923   5.507   5.600
  138    HH   TYR  21           HH       TYR  21 -32.886   3.844   5.190
  139    H    ALA  22           H        ALA  22 -40.177   3.046  10.312
  140    HA   ALA  22           HA       ALA  22 -38.641   5.082  11.525
  141   1HB   ALA  22          1HB       ALA  22 -40.850   5.620  11.675
  142   2HB   ALA  22          2HB       ALA  22 -41.369   3.918  11.723
  143   3HB   ALA  22          3HB       ALA  22 -40.762   4.706  13.199
  144    H    ALA  23           H        ALA  23 -39.133   1.635  12.125
  145    HA   ALA  23           HA       ALA  23 -38.073   1.842  14.815
  146   1HB   ALA  23          1HB       ALA  23 -39.860   0.143  13.529
  147   2HB   ALA  23          2HB       ALA  23 -38.377  -0.835  13.639
  148   3HB   ALA  23          3HB       ALA  23 -39.101  -0.147  15.113
  149    H    GLN  24           H        GLN  24 -36.810   2.003  11.729
  150    HA   GLN  24           HA       GLN  24 -34.563   0.289  12.274
  151   1HB   GLN  24          1HB       GLN  24 -35.810   1.470   9.913
  152   2HB   GLN  24          2HB       GLN  24 -34.087   1.788   9.912
  153   1HG   GLN  24          1HG       GLN  24 -34.576  -0.361   8.786
  154   2HG   GLN  24          2HG       GLN  24 -33.606  -0.624  10.222
  155   1HE2  GLN  24          1HE2      GLN  24 -36.099  -1.786   8.519
  156   2HE2  GLN  24          2HE2      GLN  24 -37.038  -2.573   9.743
  157    H    ALA  25           H        ALA  25 -35.510   3.316  13.261
  158    HA   ALA  25           HA       ALA  25 -33.305   4.933  12.717
  159   1HB   ALA  25          1HB       ALA  25 -34.477   6.428  13.953
  160   2HB   ALA  25          2HB       ALA  25 -35.752   5.186  13.965
  161   3HB   ALA  25          3HB       ALA  25 -34.622   5.314  15.334
  162    H    ARG  26           H        ARG  26 -33.697   2.135  14.763
  163    HA   ARG  26           HA       ARG  26 -31.727   2.838  16.633
  164   1HB   ARG  26          1HB       ARG  26 -33.636   0.884  16.506
  165   2HB   ARG  26          2HB       ARG  26 -32.242  -0.060  16.023
  166   1HG   ARG  26          1HG       ARG  26 -31.791   1.718  18.377
  167   2HG   ARG  26          2HG       ARG  26 -32.955   0.435  18.640
  168   1HD   ARG  26          1HD       ARG  26 -31.209  -1.193  17.664
  169   2HD   ARG  26          2HD       ARG  26 -30.058   0.127  17.729
  170    HE   ARG  26           HE       ARG  26 -31.362  -0.133  20.284
  171   1HH1  ARG  26          2HH2      ARG  26 -28.940  -1.739  18.257
  172   2HH1  ARG  26          1HH2      ARG  26 -28.103  -2.444  19.599
  173   1HH2  ARG  26          1HH       ARG  26 -28.895  -2.032  21.823
  174    H    ALA  27           H        ALA  27 -31.761   1.327  13.414
  175    HA   ALA  27           HA       ALA  27 -29.176   0.178  13.579
  176   1HB   ALA  27          1HB       ALA  27 -31.160   0.822  11.394
  177   2HB   ALA  27          2HB       ALA  27 -29.517   0.277  10.982
  178   3HB   ALA  27          3HB       ALA  27 -30.581  -0.763  11.958
  179    H    ARG  28           H        ARG  28 -30.492   3.393  12.826
  180    HA   ARG  28           HA       ARG  28 -28.307   4.365  11.456
  181   1HB   ARG  28          1HB       ARG  28 -30.745   5.362  12.046
  182   2HB   ARG  28          2HB       ARG  28 -29.855   6.173  13.319
  183   1HG   ARG  28          1HG       ARG  28 -28.831   7.602  11.858
  184   2HG   ARG  28          2HG       ARG  28 -28.464   6.322  10.719
  185   1HD   ARG  28          1HD       ARG  28 -31.048   6.388  10.172
  186   2HD   ARG  28          2HD       ARG  28 -31.014   7.955  10.955
  187    HE   ARG  28           HE       ARG  28 -28.859   7.945   9.127
  188   1HH1  ARG  28          2HH2      ARG  28 -32.391   7.707   8.982
  189   2HH1  ARG  28          1HH2      ARG  28 -32.498   8.411   7.403
  190   1HH2  ARG  28          1HH       ARG  28 -30.491   9.089   6.282
  191    H    GLU  29           H        GLU  29 -28.942   3.849  14.916
  192    HA   GLU  29           HA       GLU  29 -26.767   5.504  15.728
  193   1HB   GLU  29          1HB       GLU  29 -28.943   4.984  17.043
  194   2HB   GLU  29          2HB       GLU  29 -28.209   3.442  17.435
  195   1HG   GLU  29          1HG       GLU  29 -26.408   5.763  17.876
  196   2HG   GLU  29          2HG       GLU  29 -27.851   5.795  18.870
  197    HE2  GLU  29           HE2      GLU  29 -26.898   3.946  21.077
  198    H    ARG  30           H        ARG  30 -27.289   2.167  14.759
  199    HA   ARG  30           HA       ARG  30 -24.852   1.320  16.017
  200   1HB   ARG  30          1HB       ARG  30 -27.179   0.015  14.673
  201   2HB   ARG  30          2HB       ARG  30 -25.646  -0.790  14.405
  202   1HG   ARG  30          1HG       ARG  30 -26.163   0.052  17.227
  203   2HG   ARG  30          2HG       ARG  30 -27.230  -1.195  16.614
  204   1HD   ARG  30          1HD       ARG  30 -25.330  -2.327  17.599
  205   2HD   ARG  30          2HD       ARG  30 -25.172  -2.497  15.862
  206    HE   ARG  30           HE       ARG  30 -23.805  -0.137  16.964
  207   1HH1  ARG  30          2HH2      ARG  30 -23.491  -3.563  16.115
  208   2HH1  ARG  30          1HH2      ARG  30 -21.764  -3.502  15.994
  209   1HH2  ARG  30          1HH       ARG  30 -20.631  -1.430  16.402
  210    H    GLU  31           H        GLU  31 -26.117   2.373  12.879
  211    HA   GLU  31           HA       GLU  31 -24.066   1.257  11.326
  212   1HB   GLU  31          1HB       GLU  31 -26.288   3.216  10.941
  213   2HB   GLU  31          2HB       GLU  31 -24.949   3.365   9.820
  214   1HG   GLU  31          1HG       GLU  31 -25.250   1.182   8.951
  215   2HG   GLU  31          2HG       GLU  31 -26.104   0.621  10.375
  216    HE2  GLU  31           HE2      GLU  31 -26.628   1.116   7.421
  217    H    ARG  32           H        ARG  32 -24.238   3.974  13.491
  218    HA   ARG  32           HA       ARG  32 -22.471   5.689  12.268
  219   1HB   ARG  32          1HB       ARG  32 -23.954   5.920  14.453
  220   2HB   ARG  32          2HB       ARG  32 -22.537   5.310  15.283
  221   1HG   ARG  32          1HG       ARG  32 -21.386   7.271  15.024
  222   2HG   ARG  32          2HG       ARG  32 -21.887   7.456  13.355
  223   1HD   ARG  32          1HD       ARG  32 -24.014   7.855  15.440
  224   2HD   ARG  32          2HD       ARG  32 -22.770   9.086  15.348
  225    HE   ARG  32           HE       ARG  32 -23.453   8.796  12.709
  226   1HH1  ARG  32          2HH2      ARG  32 -25.424   9.265  15.615
  227   2HH1  ARG  32          1HH2      ARG  32 -26.692  10.091  14.773
  228   1HH2  ARG  32          1HH       ARG  32 -26.495  10.445  12.410
  229    H    LEU  33           H        LEU  33 -21.997   2.670  14.072
  230    HA   LEU  33           HA       LEU  33 -19.148   3.150  14.335
  231   1HB   LEU  33          1HB       LEU  33 -21.068   1.740  15.796
  232   2HB   LEU  33          2HB       LEU  33 -20.082   0.500  15.046
  233    HG   LEU  33           HG       LEU  33 -19.267   1.051  17.272
  234   1HD1  LEU  33          1HD1      LEU  33 -16.980   1.153  16.781
  235   2HD1  LEU  33          2HD1      LEU  33 -17.717   0.440  15.326
  236   3HD1  LEU  33          3HD1      LEU  33 -17.239   2.154  15.332
  237   1HD2  LEU  33          1HD2      LEU  33 -19.643   3.165  17.931
  238   2HD2  LEU  33          2HD2      LEU  33 -18.041   3.478  17.220
  239   3HD2  LEU  33          3HD2      LEU  33 -19.514   3.818  16.279
  240    H    ALA  34           H        ALA  34 -21.384   1.957  12.024
  241    HA   ALA  34           HA       ALA  34 -19.602  -0.015  10.914
  242   1HB   ALA  34          1HB       ALA  34 -22.328   1.110  10.261
  243   2HB   ALA  34          2HB       ALA  34 -21.449   0.133   9.060
  244   3HB   ALA  34          3HB       ALA  34 -21.862  -0.565  10.645
  245    H    HIS  35           H        HIS  35 -19.334   3.231  11.153
  246    HA   HIS  35           HA       HIS  35 -18.716   3.726   8.369
  247   1HB   HIS  35          1HB       HIS  35 -19.115   5.384  10.817
  248   2HB   HIS  35          2HB       HIS  35 -18.045   6.021   9.583
  249    HD1  HIS  35           HD1      HIS  35 -21.652   4.912  10.070
  250    HD2  HIS  35           HD2      HIS  35 -19.305   7.054   7.331
  251    HE1  HIS  35           HE1      HIS  35 -23.278   5.984   8.420
  252    H    SER  36           H        SER  36 -17.213   2.454  11.160
  253    HA   SER  36           HA       SER  36 -14.625   3.508  10.477
  254   1HB   SER  36          1HB       SER  36 -15.815   2.670  12.860
  255   2HB   SER  36          2HB       SER  36 -14.736   1.342  12.485
  256    HG   SER  36           HG       SER  36 -13.218   3.414  12.016
  257    H    ARG  37           H        ARG  37 -16.677   0.781   9.784
  258    HA   ARG  37           HA       ARG  37 -14.453  -0.921   9.163
  259   1HB   ARG  37          1HB       ARG  37 -17.022  -1.435  10.027
  260   2HB   ARG  37          2HB       ARG  37 -17.212  -1.704   8.306
  261   1HG   ARG  37          1HG       ARG  37 -15.498  -3.406   8.276
  262   2HG   ARG  37          2HG       ARG  37 -14.926  -2.966   9.873
  263   1HD   ARG  37          1HD       ARG  37 -16.340  -4.497  10.774
  264   2HD   ARG  37          2HD       ARG  37 -17.700  -3.558  10.190
  265    HE   ARG  37           HE       ARG  37 -16.980  -4.925   7.931
  266   1HH1  ARG  37          2HH2      ARG  37 -17.532  -6.018  11.256
  267   2HH1  ARG  37          1HH2      ARG  37 -18.053  -7.600  10.782
  268   1HH2  ARG  37          1HH       ARG  37 -18.125  -8.163   8.453
  269    H    ALA  38           H        ALA  38 -15.420   1.745   7.714
  270    HA   ALA  38           HA       ALA  38 -16.316   1.060   5.170
  271   1HB   ALA  38          1HB       ALA  38 -16.170   3.303   4.823
  272   2HB   ALA  38          2HB       ALA  38 -15.833   3.365   6.570
  273   3HB   ALA  38          3HB       ALA  38 -14.489   3.386   5.403
  274    H    ALA  39           H        ALA  39 -12.956   1.628   6.428
  275    HA   ALA  39           HA       ALA  39 -11.882   0.651   3.920
  276   1HB   ALA  39          1HB       ALA  39  -9.697   1.212   5.092
  277   2HB   ALA  39          2HB       ALA  39 -10.809   2.583   4.861
  278   3HB   ALA  39          3HB       ALA  39 -10.672   1.807   6.458
  279    H    ALA  40           H        ALA  40 -12.913  -1.524   4.206
  280    HA   ALA  40           HA       ALA  40 -11.793  -3.134   6.337
  281   1HB   ALA  40          1HB       ALA  40 -13.650  -3.905   4.052
  282   2HB   ALA  40          2HB       ALA  40 -13.350  -4.817   5.551
  283   3HB   ALA  40          3HB       ALA  40 -14.202  -3.256   5.615
  284    H    ALA  41           H        ALA  41 -12.041  -3.424   2.715
  285    HA   ALA  41           HA       ALA  41 -10.700  -4.387   1.237
  286   1HB   ALA  41          1HB       ALA  41  -8.305  -3.821   1.413
  287   2HB   ALA  41          2HB       ALA  41  -9.322  -2.423   1.833
  288   3HB   ALA  41          3HB       ALA  41  -8.532  -3.366   3.118
  289    H    ALA  42           H        ALA  42 -11.856  -6.308   2.664
  290    HA   ALA  42           HA       ALA  42  -9.746  -8.004   3.758
  291   1HB   ALA  42          1HB       ALA  42 -11.355  -8.607   5.203
  292   2HB   ALA  42          2HB       ALA  42 -12.477  -7.481   4.401
  293   3HB   ALA  42          3HB       ALA  42 -12.376  -9.173   3.859
  294    H    ALA  43           H        ALA  43 -12.587  -8.256   1.494
  295    HA   ALA  43           HA       ALA  43 -12.002 -10.682   0.408
  296   1HB   ALA  43          1HB       ALA  43 -13.100  -8.208  -0.990
  297   2HB   ALA  43          2HB       ALA  43 -13.292  -9.889  -1.542
  298   3HB   ALA  43          3HB       ALA  43 -14.045  -9.362  -0.018
  299    H    VAL  44           H        VAL  44 -10.252  -7.652   0.089
  300    HA   VAL  44           HA       VAL  44  -8.770  -8.690  -2.199
  301    HB   VAL  44           HB       VAL  44  -9.445  -6.069  -1.099
  302   1HG1  VAL  44          1HG1      VAL  44  -7.363  -4.944  -1.762
  303   2HG1  VAL  44          2HG1      VAL  44  -7.085  -6.088  -0.427
  304   3HG1  VAL  44          3HG1      VAL  44  -6.608  -6.523  -2.086
  305   1HG2  VAL  44          1HG2      VAL  44  -9.506  -5.431  -3.346
  306   2HG2  VAL  44          2HG2      VAL  44  -8.305  -6.653  -3.830
  307   3HG2  VAL  44          3HG2      VAL  44  -9.959  -7.152  -3.401
  308    H    ALA  45           H        ALA  45  -8.563  -8.039   1.288
  309    HA   ALA  45           HA       ALA  45  -5.938  -7.889   1.791
  310   1HB   ALA  45          1HB       ALA  45  -7.983  -9.654   3.198
  311   2HB   ALA  45          2HB       ALA  45  -6.436  -9.113   3.893
  312   3HB   ALA  45          3HB       ALA  45  -7.700  -7.923   3.501
  313    H    ALA  46           H        ALA  46  -7.752 -10.985   1.210
  314    HA   ALA  46           HA       ALA  46  -5.437 -12.580   1.299
  315   1HB   ALA  46          1HB       ALA  46  -7.934 -13.288  -0.246
  316   2HB   ALA  46          2HB       ALA  46  -6.893 -14.331   0.753
  317   3HB   ALA  46          3HB       ALA  46  -7.983 -13.156   1.528
  318    H    ALA  47           H        ALA  47  -7.428 -11.320  -1.471
  319    HA   ALA  47           HA       ALA  47  -5.685 -12.312  -3.436
  320   1HB   ALA  47          1HB       ALA  47  -7.026 -11.010  -4.947
  321   2HB   ALA  47          2HB       ALA  47  -8.116 -11.616  -3.678
  322   3HB   ALA  47          3HB       ALA  47  -7.559  -9.926  -3.640
  323    H    THR  48           H        THR  48  -5.019 -10.242  -5.134
  324    HA   THR  48           HA       THR  48  -3.336  -8.838  -5.531
  325    HB   THR  48           HB       THR  48  -4.386  -7.664  -2.903
  326    HG1  THR  48           HG1      THR  48  -4.821  -7.346  -5.786
  327   1HG2  THR  48          1HG2      THR  48  -2.061  -6.817  -3.897
  328   2HG2  THR  48          2HG2      THR  48  -3.093  -6.093  -5.152
  329   3HG2  THR  48          3HG2      THR  48  -3.308  -5.630  -3.447
  330    H    ALA  49           H        ALA  49  -2.125 -11.009  -5.032
  331    HA   ALA  49           HA       ALA  49  -0.739 -11.435  -2.727
  332   1HB   ALA  49          1HB       ALA  49   0.266 -11.806  -5.578
  333   2HB   ALA  49          2HB       ALA  49   0.836 -12.675  -4.132
  334   3HB   ALA  49          3HB       ALA  49  -0.825 -12.922  -4.723
  335    H    ALA  50           H        ALA  50   1.464 -10.926  -2.042
  336    HA   ALA  50           HA       ALA  50   2.079  -8.160  -2.603
  337   1HB   ALA  50          1HB       ALA  50   2.686  -8.263  -0.445
  338   2HB   ALA  50          2HB       ALA  50   2.386 -10.018  -0.431
  339   3HB   ALA  50          3HB       ALA  50   3.993  -9.393  -0.874
  340    H    VAL  51           H        VAL  51   2.371  -9.474  -4.967
  341    HA   VAL  51           HA       VAL  51   5.280  -9.510  -5.243
  342    HB   VAL  51           HB       VAL  51   3.407 -11.554  -6.452
  343   1HG1  VAL  51          1HG1      VAL  51   5.680 -10.707  -7.582
  344   2HG1  VAL  51          2HG1      VAL  51   6.374 -11.884  -6.442
  345   3HG1  VAL  51          3HG1      VAL  51   5.163 -12.409  -7.637
  346   1HG2  VAL  51          1HG2      VAL  51   5.056 -13.038  -4.946
  347   2HG2  VAL  51          2HG2      VAL  51   5.054 -11.553  -3.965
  348   3HG2  VAL  51          3HG2      VAL  51   3.522 -12.382  -4.329
  349    H    GLU  52           H        GLU  52   4.005  -7.220  -5.711
  350    HA   GLU  52           HA       GLU  52   3.433  -7.278  -8.570
  351   1HB   GLU  52          1HB       GLU  52   1.794  -6.338  -6.610
  352   2HB   GLU  52          2HB       GLU  52   2.704  -4.877  -6.936
  353   1HG   GLU  52          1HG       GLU  52   0.850  -4.778  -8.435
  354   2HG   GLU  52          2HG       GLU  52   2.202  -5.269  -9.436
  355    HE2  GLU  52           HE2      GLU  52   0.221  -7.861 -10.506
  356    H    GLY  53           H        GLY  53   4.142  -5.245  -9.788
  357   1HA   GLY  53          1HA       GLY  53   5.827  -3.307  -8.998
  358   2HA   GLY  53          2HA       GLY  53   6.900  -4.689  -9.098
  359    H    THR  54           H        THR  54   6.328  -6.130 -11.247
  360    HA   THR  54           HA       THR  54   6.523  -6.234 -13.459
  361    HB   THR  54           HB       THR  54   4.697  -3.788 -13.230
  362    HG1  THR  54           HG1      THR  54   3.579  -5.614 -12.556
  363   1HG2  THR  54          1HG2      THR  54   6.000  -4.793 -15.577
  364   2HG2  THR  54          2HG2      THR  54   4.334  -5.420 -15.613
  365   3HG2  THR  54          3HG2      THR  54   4.624  -3.666 -15.510
  366    H    GLY  55           H        GLY  55   7.887  -5.625 -15.149
  367   1HA   GLY  55          1HA       GLY  55   9.356  -3.098 -14.730
  368   2HA   GLY  55          2HA       GLY  55  10.207  -4.616 -14.936
  369    H    GLY  56           H        GLY  56  10.979  -2.946 -16.791
  370   1HA   GLY  56          1HA       GLY  56   9.492  -3.757 -19.204
  371   2HA   GLY  56          2HA       GLY  56   9.922  -2.078 -18.952
  372    H    SER  57           H        SER  57  11.633  -1.547 -20.239
  373    HA   SER  57           HA       SER  57  13.585  -1.590 -21.184
  374   1HB   SER  57          1HB       SER  57  14.275  -3.542 -18.947
  375   2HB   SER  57          2HB       SER  57  15.466  -2.894 -20.058
  376    HG   SER  57           HG       SER  57  13.764  -1.321 -18.316
  377    H    GLY  58           H        GLY  58  14.669  -2.684 -22.914
  378   1HA   GLY  58          1HA       GLY  58  14.945  -5.358 -23.349
  379   2HA   GLY  58          2HA       GLY  58  13.309  -5.024 -23.882
  380    H    GLY  59           H        GLY  59  15.052  -5.903 -25.798
  381   1HA   GLY  59          1HA       GLY  59  14.991  -3.830 -27.713
  382   2HA   GLY  59          2HA       GLY  59  16.623  -4.003 -27.100
  383    H    GLY  60           H        GLY  60  17.172  -4.695 -29.342
  384   1HA   GLY  60          1HA       GLY  60  16.844  -7.596 -29.599
  385   2HA   GLY  60          2HA       GLY  60  16.307  -6.585 -30.926
  386    HA   PRO  61           HA       PRO  61  20.921  -7.255 -31.035
  387   1HB   PRO  61          1HB       PRO  61  21.173  -9.472 -32.613
  388   2HB   PRO  61          2HB       PRO  61  21.265  -9.526 -30.864
  389   1HG   PRO  61          1HG       PRO  61  19.052 -10.376 -32.631
  390   2HG   PRO  61          2HG       PRO  61  19.345 -10.800 -30.956
  391   1HD   PRO  61          1HD       PRO  61  17.421  -8.913 -31.938
  392   2HD   PRO  61          2HD       PRO  61  17.794  -9.252 -30.259
  393    H    HIS  62           H        HIS  62  20.767  -5.246 -32.100
  394    HA   HIS  62           HA       HIS  62  21.357  -5.560 -34.861
  395   1HB   HIS  62          1HB       HIS  62  19.099  -5.657 -35.347
  396   2HB   HIS  62          2HB       HIS  62  18.645  -4.615 -34.014
  397    HD1  HIS  62           HD1      HIS  62  21.096  -3.902 -36.881
  398    HD2  HIS  62           HD2      HIS  62  17.511  -2.456 -35.252
  399    HE1  HIS  62           HE1      HIS  62  20.515  -1.792 -38.192
  400    H    HIS  63           H        HIS  63  23.000  -4.150 -35.166
  401    HA   HIS  63           HA       HIS  63  22.749  -1.443 -34.468
  402   1HB   HIS  63          1HB       HIS  63  23.258  -2.703 -32.227
  403   2HB   HIS  63          2HB       HIS  63  24.894  -2.791 -32.849
  404    HD1  HIS  63           HD1      HIS  63  26.335  -0.696 -32.697
  405    HD2  HIS  63           HD2      HIS  63  22.301   0.015 -31.796
  406    HE1  HIS  63           HE1      HIS  63  26.216   1.682 -31.779
  407    H    HIS  64           H        HIS  64  25.367  -3.966 -34.667
  408    HA   HIS  64           HA       HIS  64  26.577  -2.318 -36.750
  409   1HB   HIS  64          1HB       HIS  64  28.619  -3.036 -36.065
  410   2HB   HIS  64          2HB       HIS  64  27.757  -3.182 -34.546
  411    HD1  HIS  64           HD1      HIS  64  26.323  -5.876 -34.885
  412    HD2  HIS  64           HD2      HIS  64  30.294  -5.198 -36.055
  413    HE1  HIS  64           HE1      HIS  64  27.454  -8.162 -34.933
  414    H    HIS  65           H        HIS  65  27.598  -3.535 -38.618
  415    HA   HIS  65           HA       HIS  65  27.254  -6.061 -39.328
  416   1HB   HIS  65          1HB       HIS  65  24.619  -4.758 -39.243
  417   2HB   HIS  65          2HB       HIS  65  24.963  -5.535 -40.775
  418    HD1  HIS  65           HD1      HIS  65  23.003  -6.402 -38.210
  419    HD2  HIS  65           HD2      HIS  65  26.500  -8.242 -39.619
  420    HE1  HIS  65           HE1      HIS  65  22.901  -8.828 -37.424
  421    H    GLN  66           H        GLN  66  29.160  -5.266 -40.392
  422    HA   GLN  66           HA       GLN  66  28.588  -4.404 -43.035
  423   1HB   GLN  66          1HB       GLN  66  28.835  -2.305 -41.357
  424   2HB   GLN  66          2HB       GLN  66  30.539  -2.585 -41.651
  425   1HG   GLN  66          1HG       GLN  66  30.337  -1.473 -43.615
  426   2HG   GLN  66          2HG       GLN  66  29.325  -2.775 -44.207
  427   1HE2  GLN  66          1HE2      GLN  66  27.089  -2.622 -44.119
  428   2HE2  GLN  66          2HE2      GLN  66  26.253  -1.121 -43.903
  429    H    THR  67           H        THR  67  30.972  -3.912 -44.129
  430    HA   THR  67           HA       THR  67  33.074  -5.461 -42.935
  431    HB   THR  67           HB       THR  67  31.831  -6.480 -45.535
  432    HG1  THR  67           HG1      THR  67  30.486  -7.627 -44.182
  433   1HG2  THR  67          1HG2      THR  67  33.858  -7.607 -45.455
  434   2HG2  THR  67          2HG2      THR  67  34.079  -7.280 -43.720
  435   3HG2  THR  67          3HG2      THR  67  33.007  -8.600 -44.248
  436    H    ARG  68           H        ARG  68  35.045  -5.493 -44.363
  437    HA   ARG  68           HA       ARG  68  35.181  -3.985 -46.639
  438   1HB   ARG  68          1HB       ARG  68  34.635  -2.199 -44.708
  439   2HB   ARG  68          2HB       ARG  68  36.354  -2.331 -44.392
  440   1HG   ARG  68          1HG       ARG  68  36.889  -1.694 -46.705
  441   2HG   ARG  68          2HG       ARG  68  35.196  -1.734 -47.153
  442   1HD   ARG  68          1HD       ARG  68  34.684   0.174 -45.724
  443   2HD   ARG  68          2HD       ARG  68  36.268   0.118 -44.977
  444    HE   ARG  68           HE       ARG  68  36.496   0.423 -47.852
  445   1HH1  ARG  68          2HH2      ARG  68  35.793   2.232 -44.886
  446   2HH1  ARG  68          1HH2      ARG  68  36.299   3.751 -45.545
  447   1HH2  ARG  68          1HH       ARG  68  37.102   3.843 -47.802
  448    H    GLY  69           H        GLY  69  36.952  -5.005 -47.522
  449   1HA   GLY  69          1HA       GLY  69  38.987  -6.123 -45.789
  450   2HA   GLY  69          2HA       GLY  69  38.827  -6.315 -47.524
  451    H    ALA  70           H        ALA  70  40.426  -5.377 -48.708
  452    HA   ALA  70           HA       ALA  70  41.171  -2.692 -48.343
  453   1HB   ALA  70          1HB       ALA  70  42.338  -4.220 -46.424
  454   2HB   ALA  70          2HB       ALA  70  43.532  -4.404 -47.731
  455   3HB   ALA  70          3HB       ALA  70  43.109  -2.781 -47.135
  456    H    TYR  71           H        TYR  71  42.262  -1.951 -50.184
  457    HA   TYR  71           HA       TYR  71  42.211  -3.712 -52.410
  458   1HB   TYR  71          1HB       TYR  71  41.931  -1.063 -52.054
  459   2HB   TYR  71          2HB       TYR  71  43.681  -1.037 -52.148
  460    HD1  TYR  71           HD1      TYR  71  44.371  -0.200 -54.194
  461    HD2  TYR  71           HD2      TYR  71  41.035  -2.876 -54.087
  462    HE1  TYR  71           HE1      TYR  71  44.228  -0.134 -56.732
  463    HE2  TYR  71           HE2      TYR  71  40.903  -2.802 -56.625
  464    HH   TYR  71           HH       TYR  71  43.403  -1.496 -58.522
  465    H    SER  72           H        SER  72  44.125  -3.981 -53.916
  466    HA   SER  72           HA       SER  72  46.526  -4.365 -52.303
  467   1HB   SER  72          1HB       SER  72  45.685  -6.011 -54.727
  468   2HB   SER  72          2HB       SER  72  47.050  -6.325 -53.674
  469    HG   SER  72           HG       SER  72  44.346  -6.234 -52.667
  470    H    SER  73           H        SER  73  48.566  -3.845 -53.308
  471    HA   SER  73           HA       SER  73  49.919  -2.732 -54.588
  472   1HB   SER  73          1HB       SER  73  47.937  -3.112 -56.873
  473   2HB   SER  73          2HB       SER  73  49.652  -2.783 -57.021
  474    HG   SER  73           HG       SER  73  49.814  -4.900 -55.645
  475    H    HIS  74           H        HIS  74  50.090  -0.590 -54.023
  476    HA   HIS  74           HA       HIS  74  47.816   1.131 -54.625
  477   1HB   HIS  74          1HB       HIS  74  49.488   0.854 -52.381
  478   2HB   HIS  74          2HB       HIS  74  49.963   2.372 -53.116
  479    HD1  HIS  74           HD1      HIS  74  47.439   3.696 -53.974
  480    HD2  HIS  74           HD2      HIS  74  47.644   1.410 -50.462
  481    HE1  HIS  74           HE1      HIS  74  45.515   4.484 -52.494
  482    H    ASP  75           H        ASP  75  47.965   2.885 -56.024
  483    HA   ASP  75           HA       ASP  75  49.563   2.777 -58.138
  484   1HB   ASP  75          1HB       ASP  75  48.090   4.964 -56.739
  485   2HB   ASP  75          2HB       ASP  75  49.313   5.515 -57.867
  486    HD2  ASP  75           HD2      ASP  75  47.267   6.283 -59.149
  Start of MODEL   11
    1    H    MET   1           H        MET   1 -13.829  30.963  -3.646
    2    HA   MET   1           HA       MET   1 -14.905  33.648  -3.760
    3   1HB   MET   1          1HB       MET   1 -14.649  31.562  -5.627
    4   2HB   MET   1          2HB       MET   1 -16.337  31.450  -5.173
    5   1HG   MET   1          1HG       MET   1 -15.531  34.248  -5.601
    6   2HG   MET   1          2HG       MET   1 -15.212  33.269  -7.019
    7   1HE   MET   1          1HE       MET   1 -17.150  35.642  -6.939
    8   2HE   MET   1          2HE       MET   1 -18.883  35.289  -6.736
    9   3HE   MET   1          3HE       MET   1 -17.820  35.376  -5.311
   10    H    GLU   2           H        GLU   2 -16.181  34.151  -2.013
   11    HA   GLU   2           HA       GLU   2 -17.646  32.089  -0.711
   12   1HB   GLU   2          1HB       GLU   2 -16.560  34.469   0.114
   13   2HB   GLU   2          2HB       GLU   2 -18.238  34.943  -0.069
   14   1HG   GLU   2          1HG       GLU   2 -18.606  34.032   1.979
   15   2HG   GLU   2          2HG       GLU   2 -18.426  32.462   1.222
   16    HE2  GLU   2           HE2      GLU   2 -16.190  31.767   1.048
   17    H    VAL   3           H        VAL   3 -19.328  31.261  -1.944
   18    HA   VAL   3           HA       VAL   3 -21.048  33.148  -3.337
   19    HB   VAL   3           HB       VAL   3 -21.225  30.138  -3.288
   20   1HG1  VAL   3          1HG1      VAL   3 -22.039  32.162  -5.401
   21   2HG1  VAL   3          2HG1      VAL   3 -22.325  30.405  -5.435
   22   3HG1  VAL   3          3HG1      VAL   3 -23.142  31.417  -4.220
   23   1HG2  VAL   3          1HG2      VAL   3 -19.076  31.762  -4.332
   24   2HG2  VAL   3          2HG2      VAL   3 -19.254  29.991  -4.323
   25   3HG2  VAL   3          3HG2      VAL   3 -19.931  30.947  -5.664
   26    H    ALA   4           H        ALA   4 -23.428  32.996  -3.076
   27    HA   ALA   4           HA       ALA   4 -24.264  33.407  -0.539
   28   1HB   ALA   4          1HB       ALA   4 -25.403  33.162  -3.120
   29   2HB   ALA   4          2HB       ALA   4 -26.355  32.094  -2.060
   30   3HB   ALA   4          3HB       ALA   4 -26.171  33.818  -1.654
   31    H    MET   5           H        MET   5 -25.523  32.128   1.010
   32    HA   MET   5           HA       MET   5 -24.292  29.722   1.575
   33   1HB   MET   5          1HB       MET   5 -26.553  31.374   2.592
   34   2HB   MET   5          2HB       MET   5 -26.762  29.665   2.920
   35   1HG   MET   5          1HG       MET   5 -25.560  30.567   4.807
   36   2HG   MET   5          2HG       MET   5 -24.391  29.643   3.884
   37   1HE   MET   5          1HE       MET   5 -23.621  31.221   5.892
   38   2HE   MET   5          2HE       MET   5 -22.187  32.017   5.199
   39   3HE   MET   5          3HE       MET   5 -23.553  32.996   5.783
   40    H    VAL   6           H        VAL   6 -24.779  27.564   1.160
   41    HA   VAL   6           HA       VAL   6 -26.967  27.148  -0.739
   42    HB   VAL   6           HB       VAL   6 -24.610  25.383  -0.051
   43   1HG1  VAL   6          1HG1      VAL   6 -26.860  25.197  -2.037
   44   2HG1  VAL   6          2HG1      VAL   6 -25.273  24.492  -2.428
   45   3HG1  VAL   6          3HG1      VAL   6 -26.162  23.940  -0.988
   46   1HG2  VAL   6          1HG2      VAL   6 -23.335  26.399  -1.625
   47   2HG2  VAL   6          2HG2      VAL   6 -24.725  26.750  -2.681
   48   3HG2  VAL   6          3HG2      VAL   6 -24.387  27.792  -1.277
   49    H    SER   7           H        SER   7 -28.061  24.904  -0.509
   50    HA   SER   7           HA       SER   7 -29.277  23.516   0.636
   51   1HB   SER   7          1HB       SER   7 -27.480  24.018   3.047
   52   2HB   SER   7          2HB       SER   7 -28.524  22.634   2.795
   53    HG   SER   7           HG       SER   7 -26.241  23.351   1.157
   54    H    ALA   8           H        ALA   8 -31.319  24.328   0.969
   55    HA   ALA   8           HA       ALA   8 -31.905  26.735   2.152
   56   1HB   ALA   8          1HB       ALA   8 -33.931  26.147   1.379
   57   2HB   ALA   8          2HB       ALA   8 -33.274  24.541   0.985
   58   3HB   ALA   8          3HB       ALA   8 -34.040  24.825   2.566
   59    H    GLU   9           H        GLU   9 -31.106  27.292   4.147
   60    HA   GLU   9           HA       GLU   9 -30.444  25.737   6.181
   61   1HB   GLU   9          1HB       GLU   9 -30.494  27.653   7.538
   62   2HB   GLU   9          2HB       GLU   9 -30.423  28.337   5.926
   63   1HG   GLU   9          1HG       GLU   9 -33.152  28.071   6.251
   64   2HG   GLU   9          2HG       GLU   9 -32.655  28.374   7.904
   65    HE2  GLU   9           HE2      GLU   9 -32.880  31.711   6.927
   66    H    SER  10           H        SER  10 -31.519  25.268   8.341
   67    HA   SER  10           HA       SER  10 -33.097  24.398   9.551
   68   1HB   SER  10          1HB       SER  10 -34.632  26.293   7.868
   69   2HB   SER  10          2HB       SER  10 -35.603  24.975   8.494
   70    HG   SER  10           HG       SER  10 -34.772  25.511  10.656
   71    H    SER  11           H        SER  11 -35.126  22.792   9.405
   72    HA   SER  11           HA       SER  11 -34.334  20.834   7.504
   73   1HB   SER  11          1HB       SER  11 -35.964  19.392   8.646
   74   2HB   SER  11          2HB       SER  11 -34.974  20.233   9.823
   75    HG   SER  11           HG       SER  11 -37.315  21.614   9.097
   76    H    GLY  12           H        GLY  12 -34.907  21.467   5.395
   77   1HA   GLY  12          1HA       GLY  12 -37.543  22.542   4.863
   78   2HA   GLY  12          2HA       GLY  12 -36.245  22.261   3.720
   79    H    CYS  13           H        CYS  13 -35.810  20.002   2.993
   80    HA   CYS  13           HA       CYS  13 -38.099  18.241   3.429
   81   1HB   CYS  13          1HB       CYS  13 -37.212  19.426   0.860
   82   2HB   CYS  13          2HB       CYS  13 -37.511  17.700   0.821
   83    HG   CYS  13           HG       CYS  13 -39.594  19.342   0.086
   84    H    ASN  14           H        ASN  14 -36.386  17.391   4.993
   85    HA   ASN  14           HA       ASN  14 -34.188  16.102   3.632
   86   1HB   ASN  14          1HB       ASN  14 -34.687  17.148   6.323
   87   2HB   ASN  14          2HB       ASN  14 -34.156  15.481   6.425
   88   1HD2  ASN  14          1HD2      ASN  14 -32.185  14.856   5.401
   89   2HD2  ASN  14          2HD2      ASN  14 -30.894  15.988   5.177
   90    H    SER  15           H        SER  15 -37.131  15.276   3.458
   91    HA   SER  15           HA       SER  15 -38.234  13.407   3.300
   92   1HB   SER  15          1HB       SER  15 -35.567  12.488   3.327
   93   2HB   SER  15          2HB       SER  15 -36.379  11.480   4.508
   94    HG   SER  15           HG       SER  15 -36.459  11.251   1.837
   95    H    HIS  16           H        HIS  16 -39.860  13.755   4.822
   96    HA   HIS  16           HA       HIS  16 -39.232  12.882   7.548
   97   1HB   HIS  16          1HB       HIS  16 -40.395  15.331   6.548
   98   2HB   HIS  16          2HB       HIS  16 -41.547  14.505   7.578
   99    HD1  HIS  16           HD1      HIS  16 -37.808  15.386   7.766
  100    HD2  HIS  16           HD2      HIS  16 -41.221  15.173  10.196
  101    HE1  HIS  16           HE1      HIS  16 -37.089  16.188  10.080
  102    H    MET  17           H        MET  17 -39.733  10.773   6.099
  103    HA   MET  17           HA       MET  17 -42.200  10.163   5.235
  104   1HB   MET  17          1HB       MET  17 -39.835   8.731   6.277
  105   2HB   MET  17          2HB       MET  17 -41.306   7.839   6.611
  106   1HG   MET  17          1HG       MET  17 -41.804   8.511   4.017
  107   2HG   MET  17          2HG       MET  17 -40.053   8.514   3.966
  108   1HE   MET  17          1HE       MET  17 -42.317   5.009   3.064
  109   2HE   MET  17          2HE       MET  17 -42.999   6.629   3.344
  110   3HE   MET  17          3HE       MET  17 -41.660   6.414   2.192
  111    HA   PRO  18           HA       PRO  18 -44.828   9.662   8.657
  112   1HB   PRO  18          1HB       PRO  18 -46.269   7.399   8.136
  113   2HB   PRO  18          2HB       PRO  18 -46.598   8.941   7.372
  114   1HG   PRO  18          1HG       PRO  18 -45.287   6.550   6.231
  115   2HG   PRO  18          2HG       PRO  18 -45.999   7.916   5.395
  116   1HD   PRO  18          1HD       PRO  18 -43.203   7.421   5.802
  117   2HD   PRO  18          2HD       PRO  18 -43.920   8.842   5.069
  118    H    TYR  19           H        TYR  19 -45.780   8.088  10.424
  119    HA   TYR  19           HA       TYR  19 -43.643   7.372  11.990
  120   1HB   TYR  19          1HB       TYR  19 -46.410   6.032  11.816
  121   2HB   TYR  19          2HB       TYR  19 -45.435   6.186  13.265
  122    HD1  TYR  19           HD1      TYR  19 -45.103   8.468  14.298
  123    HD2  TYR  19           HD2      TYR  19 -47.886   7.776  11.123
  124    HE1  TYR  19           HE1      TYR  19 -46.294  10.644  14.858
  125    HE2  TYR  19           HE2      TYR  19 -49.068   9.954  11.693
  126    HH   TYR  19           HH       TYR  19 -49.212  11.350  14.082
  127    H    GLY  20           H        GLY  20 -43.499   4.947  12.927
  128   1HA   GLY  20          1HA       GLY  20 -43.127   2.730  12.539
  129   2HA   GLY  20          2HA       GLY  20 -43.671   2.910  10.883
  130    H    TYR  21           H        TYR  21 -41.575   5.459  11.271
  131    HA   TYR  21           HA       TYR  21 -39.508   4.106   9.818
  132   1HB   TYR  21          1HB       TYR  21 -38.662   6.421   9.666
  133   2HB   TYR  21          2HB       TYR  21 -40.406   6.508   9.521
  134    HD1  TYR  21           HD1      TYR  21 -37.645   6.820  12.024
  135    HD2  TYR  21           HD2      TYR  21 -41.649   7.889  10.960
  136    HE1  TYR  21           HE1      TYR  21 -37.732   8.458  13.966
  137    HE2  TYR  21           HE2      TYR  21 -41.722   9.523  12.906
  138    HH   TYR  21           HH       TYR  21 -39.890  10.857  14.204
  139    H    ALA  22           H        ALA  22 -40.262   4.075  13.050
  140    HA   ALA  22           HA       ALA  22 -37.560   4.496  14.018
  141   1HB   ALA  22          1HB       ALA  22 -39.960   3.511  15.587
  142   2HB   ALA  22          2HB       ALA  22 -38.531   4.393  16.178
  143   3HB   ALA  22          3HB       ALA  22 -39.744   5.231  15.181
  144    H    ALA  23           H        ALA  23 -38.616   2.228  12.101
  145    HA   ALA  23           HA       ALA  23 -38.284  -0.141  13.657
  146   1HB   ALA  23          1HB       ALA  23 -38.300  -1.200  11.357
  147   2HB   ALA  23          2HB       ALA  23 -39.716  -0.183  11.718
  148   3HB   ALA  23          3HB       ALA  23 -38.416   0.439  10.674
  149    H    GLN  24           H        GLN  24 -36.489   0.120  10.629
  150    HA   GLN  24           HA       GLN  24 -34.181  -0.848  11.888
  151   1HB   GLN  24          1HB       GLN  24 -35.166  -0.578   9.238
  152   2HB   GLN  24          2HB       GLN  24 -33.660   0.319   9.266
  153   1HG   GLN  24          1HG       GLN  24 -33.030  -1.922   8.721
  154   2HG   GLN  24          2HG       GLN  24 -32.595  -1.730  10.408
  155   1HE2  GLN  24          1HE2      GLN  24 -33.267  -4.105   8.798
  156   2HE2  GLN  24          2HE2      GLN  24 -34.554  -4.923   9.620
  157    H    ALA  25           H        ALA  25 -35.538   2.232  11.881
  158    HA   ALA  25           HA       ALA  25 -33.482   3.963  11.335
  159   1HB   ALA  25          1HB       ALA  25 -35.373   5.141  11.790
  160   2HB   ALA  25          2HB       ALA  25 -35.960   3.939  12.964
  161   3HB   ALA  25          3HB       ALA  25 -34.750   5.149  13.457
  162    H    ARG  26           H        ARG  26 -33.782   1.588  13.890
  163    HA   ARG  26           HA       ARG  26 -32.093   2.870  15.714
  164   1HB   ARG  26          1HB       ARG  26 -33.755   0.792  15.956
  165   2HB   ARG  26          2HB       ARG  26 -32.333  -0.148  15.549
  166   1HG   ARG  26          1HG       ARG  26 -31.568   0.047  17.672
  167   2HG   ARG  26          2HG       ARG  26 -31.532   1.792  17.518
  168   1HD   ARG  26          1HD       ARG  26 -34.200   1.496  17.894
  169   2HD   ARG  26          2HD       ARG  26 -33.671   0.032  18.700
  170    HE   ARG  26           HE       ARG  26 -32.017   2.165  19.618
  171   1HH1  ARG  26          2HH2      ARG  26 -35.400   1.131  19.829
  172   2HH1  ARG  26          1HH2      ARG  26 -35.666   1.894  21.361
  173   1HH2  ARG  26          1HH       ARG  26 -33.870   3.088  22.406
  174    H    ALA  27           H        ALA  27 -31.624   0.794  12.864
  175    HA   ALA  27           HA       ALA  27 -28.957   0.045  13.449
  176   1HB   ALA  27          1HB       ALA  27 -30.742   0.045  11.006
  177   2HB   ALA  27          2HB       ALA  27 -29.023  -0.400  10.883
  178   3HB   ALA  27          3HB       ALA  27 -30.111  -1.337  11.934
  179    H    ARG  28           H        ARG  28 -30.541   2.873  11.986
  180    HA   ARG  28           HA       ARG  28 -28.351   3.858  10.637
  181   1HB   ARG  28          1HB       ARG  28 -30.999   4.661  11.124
  182   2HB   ARG  28          2HB       ARG  28 -30.060   5.936  11.875
  183   1HG   ARG  28          1HG       ARG  28 -29.406   4.966   9.068
  184   2HG   ARG  28          2HG       ARG  28 -30.659   6.161   9.335
  185   1HD   ARG  28          1HD       ARG  28 -28.892   7.631   9.117
  186   2HD   ARG  28          2HD       ARG  28 -28.698   7.303  10.828
  187    HE   ARG  28           HE       ARG  28 -27.200   5.297   9.758
  188   1HH1  ARG  28          2HH2      ARG  28 -27.292   8.758   9.003
  189   2HH1  ARG  28          1HH2      ARG  28 -25.634   8.820   8.505
  190   1HH2  ARG  28          1HH       ARG  28 -24.313   6.821   8.572
  191    H    GLU  29           H        GLU  29 -29.272   3.896  14.071
  192    HA   GLU  29           HA       GLU  29 -27.390   5.935  14.722
  193   1HB   GLU  29          1HB       GLU  29 -29.407   4.274  16.176
  194   2HB   GLU  29          2HB       GLU  29 -28.045   4.827  17.130
  195   1HG   GLU  29          1HG       GLU  29 -29.299   6.883  15.350
  196   2HG   GLU  29          2HG       GLU  29 -30.293   6.327  16.682
  197    HE2  GLU  29           HE2      GLU  29 -27.151   8.645  17.428
  198    H    ARG  30           H        ARG  30 -27.432   2.440  14.366
  199    HA   ARG  30           HA       ARG  30 -25.057   2.153  15.951
  200   1HB   ARG  30          1HB       ARG  30 -27.072   0.340  14.697
  201   2HB   ARG  30          2HB       ARG  30 -25.439  -0.295  14.710
  202   1HG   ARG  30          1HG       ARG  30 -25.697   0.758  17.286
  203   2HG   ARG  30          2HG       ARG  30 -27.306   0.140  16.968
  204   1HD   ARG  30          1HD       ARG  30 -26.610  -2.017  17.184
  205   2HD   ARG  30          2HD       ARG  30 -25.299  -1.777  16.046
  206    HE   ARG  30           HE       ARG  30 -24.695  -0.526  18.591
  207   1HH1  ARG  30          2HH2      ARG  30 -24.768  -3.670  16.958
  208   2HH1  ARG  30          1HH2      ARG  30 -23.570  -4.373  17.991
  209   1HH2  ARG  30          1HH       ARG  30 -22.610  -3.053  19.746
  210    H    GLU  31           H        GLU  31 -26.104   2.456  12.580
  211    HA   GLU  31           HA       GLU  31 -23.910   1.304  11.355
  212   1HB   GLU  31          1HB       GLU  31 -26.262   2.394  10.499
  213   2HB   GLU  31          2HB       GLU  31 -25.163   3.680  10.042
  214   1HG   GLU  31          1HG       GLU  31 -24.186   2.434   8.383
  215   2HG   GLU  31          2HG       GLU  31 -24.145   0.980   9.360
  216    HE2  GLU  31           HE2      GLU  31 -26.528   0.129   6.878
  217    H    ARG  32           H        ARG  32 -24.241   4.253  13.176
  218    HA   ARG  32           HA       ARG  32 -22.379   5.827  11.915
  219   1HB   ARG  32          1HB       ARG  32 -23.976   6.464  13.818
  220   2HB   ARG  32          2HB       ARG  32 -22.872   5.681  14.930
  221   1HG   ARG  32          1HG       ARG  32 -21.458   7.539  13.139
  222   2HG   ARG  32          2HG       ARG  32 -22.733   8.350  14.026
  223   1HD   ARG  32          1HD       ARG  32 -21.536   8.278  15.959
  224   2HD   ARG  32          2HD       ARG  32 -21.294   6.548  15.814
  225    HE   ARG  32           HE       ARG  32 -19.159   6.948  14.948
  226   1HH1  ARG  32          2HH2      ARG  32 -21.071   9.916  14.649
  227   2HH1  ARG  32          1HH2      ARG  32 -19.732  10.871  14.106
  228   1HH2  ARG  32          1HH       ARG  32 -17.579   9.846  13.868
  229    H    LEU  33           H        LEU  33 -22.047   3.018  14.056
  230    HA   LEU  33           HA       LEU  33 -19.223   3.537  14.474
  231   1HB   LEU  33          1HB       LEU  33 -21.248   2.286  15.937
  232   2HB   LEU  33          2HB       LEU  33 -20.217   0.976  15.399
  233    HG   LEU  33           HG       LEU  33 -18.365   2.792  16.303
  234   1HD1  LEU  33          1HD1      LEU  33 -20.428   4.114  17.147
  235   2HD1  LEU  33          2HD1      LEU  33 -20.501   2.869  18.418
  236   3HD1  LEU  33          3HD1      LEU  33 -19.043   3.875  18.239
  237   1HD2  LEU  33          1HD2      LEU  33 -19.614   0.310  17.331
  238   2HD2  LEU  33          2HD2      LEU  33 -17.907   0.699  17.010
  239   3HD2  LEU  33          3HD2      LEU  33 -18.684   1.271  18.506
  240    H    ALA  34           H        ALA  34 -21.290   2.092  12.150
  241    HA   ALA  34           HA       ALA  34 -19.441   0.019  11.392
  242   1HB   ALA  34          1HB       ALA  34 -21.671   0.929   9.613
  243   2HB   ALA  34          2HB       ALA  34 -21.152  -0.719  10.042
  244   3HB   ALA  34          3HB       ALA  34 -22.111   0.241  11.194
  245    H    HIS  35           H        HIS  35 -19.177   3.272  11.298
  246    HA   HIS  35           HA       HIS  35 -18.357   3.466   8.528
  247   1HB   HIS  35          1HB       HIS  35 -19.619   5.224  10.136
  248   2HB   HIS  35          2HB       HIS  35 -17.964   5.719  10.434
  249    HD1  HIS  35           HD1      HIS  35 -20.653   5.784   7.845
  250    HD2  HIS  35           HD2      HIS  35 -16.586   6.769   8.139
  251    HE1  HIS  35           HE1      HIS  35 -20.110   7.199   5.793
  252    H    SER  36           H        SER  36 -17.066   2.508  11.541
  253    HA   SER  36           HA       SER  36 -14.431   3.493  10.940
  254   1HB   SER  36          1HB       SER  36 -15.821   2.824  13.305
  255   2HB   SER  36          2HB       SER  36 -14.608   1.569  13.147
  256    HG   SER  36           HG       SER  36 -14.302   4.251  13.803
  257    H    ARG  37           H        ARG  37 -16.438   0.700  10.393
  258    HA   ARG  37           HA       ARG  37 -14.183  -1.053  10.126
  259   1HB   ARG  37          1HB       ARG  37 -16.811  -1.480  10.843
  260   2HB   ARG  37          2HB       ARG  37 -16.876  -1.923   9.149
  261   1HG   ARG  37          1HG       ARG  37 -15.123  -3.591   9.430
  262   2HG   ARG  37          2HG       ARG  37 -14.758  -3.024  11.047
  263   1HD   ARG  37          1HD       ARG  37 -16.184  -4.656  11.766
  264   2HD   ARG  37          2HD       ARG  37 -17.473  -3.584  11.255
  265    HE   ARG  37           HE       ARG  37 -16.801  -4.898   8.915
  266   1HH1  ARG  37          2HH2      ARG  37 -17.690  -6.011  12.159
  267   2HH1  ARG  37          1HH2      ARG  37 -18.397  -7.488  11.594
  268   1HH2  ARG  37          1HH       ARG  37 -18.411  -7.958   9.244
  269    H    ALA  38           H        ALA  38 -15.020   1.443   8.333
  270    HA   ALA  38           HA       ALA  38 -15.398   0.162   5.771
  271   1HB   ALA  38          1HB       ALA  38 -16.394   2.135   5.379
  272   2HB   ALA  38          2HB       ALA  38 -15.852   2.745   6.961
  273   3HB   ALA  38          3HB       ALA  38 -14.816   2.945   5.528
  274    H    ALA  39           H        ALA  39 -12.941   2.380   7.287
  275    HA   ALA  39           HA       ALA  39 -11.075   2.317   5.312
  276   1HB   ALA  39          1HB       ALA  39  -9.438   2.736   7.170
  277   2HB   ALA  39          2HB       ALA  39 -10.902   3.744   7.271
  278   3HB   ALA  39          3HB       ALA  39 -10.720   2.329   8.336
  279    H    ALA  40           H        ALA  40  -8.796   1.169   5.571
  280    HA   ALA  40           HA       ALA  40  -9.390  -1.661   5.478
  281   1HB   ALA  40          1HB       ALA  40  -7.457  -1.829   4.201
  282   2HB   ALA  40          2HB       ALA  40  -7.950  -0.157   3.840
  283   3HB   ALA  40          3HB       ALA  40  -6.663  -0.468   5.030
  284    H    ALA  41           H        ALA  41  -9.883  -1.185   7.998
  285    HA   ALA  41           HA       ALA  41  -9.342  -1.805  10.055
  286   1HB   ALA  41          1HB       ALA  41  -7.506  -3.311  10.434
  287   2HB   ALA  41          2HB       ALA  41  -8.176  -3.700   8.832
  288   3HB   ALA  41          3HB       ALA  41  -6.670  -2.760   8.963
  289    H    ALA  42           H        ALA  42  -9.214   0.818   9.634
  290    HA   ALA  42           HA       ALA  42  -6.571   1.734  10.464
  291   1HB   ALA  42          1HB       ALA  42  -9.007   2.958   9.197
  292   2HB   ALA  42          2HB       ALA  42  -7.914   4.003  10.137
  293   3HB   ALA  42          3HB       ALA  42  -7.294   3.098   8.736
  294    H    ALA  43           H        ALA  43 -10.065   2.210  11.370
  295    HA   ALA  43           HA       ALA  43  -9.679   3.501  13.736
  296   1HB   ALA  43          1HB       ALA  43 -11.776   1.344  13.428
  297   2HB   ALA  43          2HB       ALA  43 -11.914   2.944  14.197
  298   3HB   ALA  43          3HB       ALA  43 -11.829   2.812  12.424
  299    H    VAL  44           H        VAL  44  -8.914   0.178  12.892
  300    HA   VAL  44           HA       VAL  44  -8.640  -0.532  15.707
  301    HB   VAL  44           HB       VAL  44  -9.108  -1.927  13.184
  302   1HG1  VAL  44          1HG1      VAL  44  -7.065  -3.053  15.127
  303   2HG1  VAL  44          2HG1      VAL  44  -7.906  -4.009  13.883
  304   3HG1  VAL  44          3HG1      VAL  44  -6.826  -2.678  13.403
  305   1HG2  VAL  44          1HG2      VAL  44 -10.369  -1.766  15.562
  306   2HG2  VAL  44          2HG2      VAL  44 -10.563  -3.138  14.443
  307   3HG2  VAL  44          3HG2      VAL  44  -9.442  -3.264  15.820
  308    H    ALA  45           H        ALA  45  -6.808   0.287  12.777
  309    HA   ALA  45           HA       ALA  45  -4.361  -0.723  13.227
  310   1HB   ALA  45          1HB       ALA  45  -4.973   0.702  11.321
  311   2HB   ALA  45          2HB       ALA  45  -5.062   2.121  12.392
  312   3HB   ALA  45          3HB       ALA  45  -3.500   1.317  12.108
  313    H    ALA  46           H        ALA  46  -5.878   2.083  14.914
  314    HA   ALA  46           HA       ALA  46  -3.544   2.633  16.447
  315   1HB   ALA  46          1HB       ALA  46  -6.423   3.437  17.004
  316   2HB   ALA  46          2HB       ALA  46  -4.938   4.266  17.530
  317   3HB   ALA  46          3HB       ALA  46  -5.390   4.256  15.808
  318    H    ALA  47           H        ALA  47  -6.641   0.849  16.973
  319    HA   ALA  47           HA       ALA  47  -6.102   0.250  19.674
  320   1HB   ALA  47          1HB       ALA  47  -8.201  -0.064  17.806
  321   2HB   ALA  47          2HB       ALA  47  -7.779  -1.709  18.339
  322   3HB   ALA  47          3HB       ALA  47  -8.226  -0.472  19.538
  323    H    THR  48           H        THR  48  -6.609  -2.632  19.625
  324    HA   THR  48           HA       THR  48  -4.174  -3.688  19.909
  325    HB   THR  48           HB       THR  48  -5.290  -5.876  19.429
  326    HG1  THR  48           HG1      THR  48  -7.387  -4.059  18.472
  327   1HG2  THR  48          1HG2      THR  48  -6.091  -4.173  21.403
  328   2HG2  THR  48          2HG2      THR  48  -7.597  -4.243  20.457
  329   3HG2  THR  48          3HG2      THR  48  -6.890  -5.737  21.117
  330    H    ALA  49           H        ALA  49  -2.399  -4.190  18.768
  331    HA   ALA  49           HA       ALA  49  -1.862  -3.221  16.328
  332   1HB   ALA  49          1HB       ALA  49  -0.610  -5.823  16.605
  333   2HB   ALA  49          2HB       ALA  49   0.105  -4.204  16.789
  334   3HB   ALA  49          3HB       ALA  49  -0.672  -4.998  18.180
  335    H    ALA  50           H        ALA  50  -1.893  -3.972  14.140
  336    HA   ALA  50           HA       ALA  50  -4.171  -5.666  13.607
  337   1HB   ALA  50          1HB       ALA  50  -4.283  -4.476  11.689
  338   2HB   ALA  50          2HB       ALA  50  -3.052  -3.419  12.419
  339   3HB   ALA  50          3HB       ALA  50  -2.560  -4.736  11.329
  340    H    VAL  51           H        VAL  51  -2.386  -7.230  14.936
  341    HA   VAL  51           HA       VAL  51  -1.271  -8.857  12.761
  342    HB   VAL  51           HB       VAL  51   0.398  -7.509  14.165
  343   1HG1  VAL  51          1HG1      VAL  51   0.740  -7.945  16.365
  344   2HG1  VAL  51          2HG1      VAL  51  -0.965  -8.451  16.306
  345   3HG1  VAL  51          3HG1      VAL  51   0.329  -9.669  16.201
  346   1HG2  VAL  51          1HG2      VAL  51   0.915  -9.472  12.683
  347   2HG2  VAL  51          2HG2      VAL  51   2.036  -9.262  14.050
  348   3HG2  VAL  51          3HG2      VAL  51   0.777 -10.519  14.116
  349    H    GLU  52           H        GLU  52  -3.836  -9.315  13.410
  350    HA   GLU  52           HA       GLU  52  -3.905 -11.167  15.606
  351   1HB   GLU  52          1HB       GLU  52  -5.759  -9.416  14.581
  352   2HB   GLU  52          2HB       GLU  52  -6.278 -10.907  13.821
  353   1HG   GLU  52          1HG       GLU  52  -5.660 -11.501  16.576
  354   2HG   GLU  52          2HG       GLU  52  -6.662 -10.064  16.555
  355    HE2  GLU  52           HE2      GLU  52  -6.739 -13.241  16.559
  356    H    GLY  53           H        GLY  53  -5.204 -13.328  15.130
  357   1HA   GLY  53          1HA       GLY  53  -5.673 -14.843  13.199
  358   2HA   GLY  53          2HA       GLY  53  -4.032 -14.507  12.682
  359    H    THR  54           H        THR  54  -6.065 -16.098  15.142
  360    HA   THR  54           HA       THR  54  -3.924 -17.061  16.728
  361    HB   THR  54           HB       THR  54  -6.867 -17.790  16.351
  362    HG1  THR  54           HG1      THR  54  -5.185 -16.602  18.445
  363   1HG2  THR  54          1HG2      THR  54  -6.748 -19.290  18.183
  364   2HG2  THR  54          2HG2      THR  54  -5.274 -19.708  17.277
  365   3HG2  THR  54          3HG2      THR  54  -5.170 -18.661  18.713
  366    H    GLY  55           H        GLY  55  -2.410 -18.510  16.249
  367   1HA   GLY  55          1HA       GLY  55  -3.100 -20.943  14.886
  368   2HA   GLY  55          2HA       GLY  55  -2.148 -19.856  13.894
  369    H    GLY  56           H        GLY  56  -1.073 -22.325  14.588
  370   1HA   GLY  56          1HA       GLY  56   1.020 -21.544  16.525
  371   2HA   GLY  56          2HA       GLY  56   0.282 -23.133  16.543
  372    H    SER  57           H        SER  57   3.064 -22.839  16.208
  373    HA   SER  57           HA       SER  57   3.300 -23.941  13.550
  374   1HB   SER  57          1HB       SER  57   4.415 -21.354  14.394
  375   2HB   SER  57          2HB       SER  57   5.666 -22.447  13.835
  376    HG   SER  57           HG       SER  57   4.920 -21.375  12.006
  377    H    GLY  58           H        GLY  58   5.462 -25.125  13.298
  378   1HA   GLY  58          1HA       GLY  58   7.408 -25.614  15.017
  379   2HA   GLY  58          2HA       GLY  58   6.093 -26.445  15.824
  380    H    GLY  59           H        GLY  59   8.019 -28.135  15.186
  381   1HA   GLY  59          1HA       GLY  59   7.019 -30.149  13.742
  382   2HA   GLY  59          2HA       GLY  59   7.720 -29.154  12.482
  383    H    GLY  60           H        GLY  60   8.627 -31.811  13.149
  384   1HA   GLY  60          1HA       GLY  60  11.416 -31.187  13.733
  385   2HA   GLY  60          2HA       GLY  60  10.614 -32.290  14.833
  386    HA   PRO  61           HA       PRO  61  11.020 -34.276  10.517
  387   1HB   PRO  61          1HB       PRO  61  13.076 -33.376   8.959
  388   2HB   PRO  61          2HB       PRO  61  11.417 -32.850   8.754
  389   1HG   PRO  61          1HG       PRO  61  13.689 -31.389   9.955
  390   2HG   PRO  61          2HG       PRO  61  12.168 -30.755   9.360
  391   1HD   PRO  61          1HD       PRO  61  12.905 -31.154  12.103
  392   2HD   PRO  61          2HD       PRO  61  11.344 -30.630  11.502
  393    H    HIS  62           H        HIS  62  12.702 -35.815   9.452
  394    HA   HIS  62           HA       HIS  62  15.101 -36.138  10.850
  395   1HB   HIS  62          1HB       HIS  62  12.880 -37.044  12.309
  396   2HB   HIS  62          2HB       HIS  62  13.583 -38.495  11.620
  397    HD1  HIS  62           HD1      HIS  62  14.324 -35.693  14.035
  398    HD2  HIS  62           HD2      HIS  62  16.119 -39.215  12.631
  399    HE1  HIS  62           HE1      HIS  62  16.295 -36.158  15.587
  400    H    HIS  63           H        HIS  63  12.397 -38.044   9.344
  401    HA   HIS  63           HA       HIS  63  13.755 -40.008   8.162
  402   1HB   HIS  63          1HB       HIS  63  11.233 -39.100   8.008
  403   2HB   HIS  63          2HB       HIS  63  11.789 -38.587   6.427
  404    HD1  HIS  63           HD1      HIS  63  12.635 -41.838   8.276
  405    HD2  HIS  63           HD2      HIS  63  10.744 -40.507   4.777
  406    HE1  HIS  63           HE1      HIS  63  12.038 -43.932   6.945
  407    H    HIS  64           H        HIS  64  15.526 -40.162   6.887
  408    HA   HIS  64           HA       HIS  64  15.848 -38.668   4.572
  409   1HB   HIS  64          1HB       HIS  64  16.765 -37.330   6.973
  410   2HB   HIS  64          2HB       HIS  64  18.115 -37.659   5.906
  411    HD1  HIS  64           HD1      HIS  64  15.391 -35.295   6.440
  412    HD2  HIS  64           HD2      HIS  64  17.647 -36.603   3.155
  413    HE1  HIS  64           HE1      HIS  64  15.072 -33.544   4.612
  414    H    HIS  65           H        HIS  65  16.400 -40.610   3.607
  415    HA   HIS  65           HA       HIS  65  18.909 -41.431   3.414
  416   1HB   HIS  65          1HB       HIS  65  19.399 -41.997   5.577
  417   2HB   HIS  65          2HB       HIS  65  17.756 -42.477   5.955
  418    HD1  HIS  65           HD1      HIS  65  17.180 -44.947   5.786
  419    HD2  HIS  65           HD2      HIS  65  20.902 -44.015   4.092
  420    HE1  HIS  65           HE1      HIS  65  18.299 -47.176   5.248
  421    H    GLN  66           H        GLN  66  18.633 -42.347   1.446
  422    HA   GLN  66           HA       GLN  66  16.538 -44.364   1.266
  423   1HB   GLN  66          1HB       GLN  66  16.061 -42.069   0.115
  424   2HB   GLN  66          2HB       GLN  66  17.266 -42.556  -1.061
  425   1HG   GLN  66          1HG       GLN  66  15.907 -44.158  -1.999
  426   2HG   GLN  66          2HG       GLN  66  15.251 -44.660  -0.453
  427   1HE2  GLN  66          1HE2      GLN  66  13.784 -44.274  -2.829
  428   2HE2  GLN  66          2HE2      GLN  66  12.638 -42.996  -2.592
  429    H    THR  67           H        THR  67  16.946 -45.652  -0.992
  430    HA   THR  67           HA       THR  67  19.280 -47.088  -0.651
  431    HB   THR  67           HB       THR  67  17.750 -46.735  -3.273
  432    HG1  THR  67           HG1      THR  67  16.329 -48.358  -2.163
  433   1HG2  THR  67          1HG2      THR  67  19.688 -48.362  -3.240
  434   2HG2  THR  67          2HG2      THR  67  18.923 -49.189  -1.862
  435   3HG2  THR  67          3HG2      THR  67  18.119 -49.175  -3.450
  436    H    ARG  68           H        ARG  68  21.131 -47.359  -2.162
  437    HA   ARG  68           HA       ARG  68  21.813 -45.372  -3.937
  438   1HB   ARG  68          1HB       ARG  68  21.988 -43.927  -1.903
  439   2HB   ARG  68          2HB       ARG  68  23.118 -45.058  -1.185
  440   1HG   ARG  68          1HG       ARG  68  24.083 -44.402  -3.828
  441   2HG   ARG  68          2HG       ARG  68  23.673 -42.903  -3.019
  442   1HD   ARG  68          1HD       ARG  68  25.099 -43.492  -1.093
  443   2HD   ARG  68          2HD       ARG  68  25.415 -45.079  -1.765
  444    HE   ARG  68           HE       ARG  68  26.212 -43.318  -3.777
  445   1HH1  ARG  68          2HH2      ARG  68  27.076 -43.772  -0.371
  446   2HH1  ARG  68          1HH2      ARG  68  28.691 -43.180  -0.573
  447   1HH2  ARG  68          1HH       ARG  68  29.414 -42.460  -2.741
  448    H    GLY  69           H        GLY  69  23.388 -46.303  -5.236
  449   1HA   GLY  69          1HA       GLY  69  25.647 -47.302  -5.186
  450   2HA   GLY  69          2HA       GLY  69  25.023 -48.448  -4.016
  451    H    ALA  70           H        ALA  70  25.810 -48.109  -7.225
  452    HA   ALA  70           HA       ALA  70  24.421 -50.493  -7.932
  453   1HB   ALA  70          1HB       ALA  70  23.002 -49.635  -9.648
  454   2HB   ALA  70          2HB       ALA  70  22.687 -48.628  -8.215
  455   3HB   ALA  70          3HB       ALA  70  23.716 -48.009  -9.529
  456    H    TYR  71           H        TYR  71  25.451 -51.523  -9.678
  457    HA   TYR  71           HA       TYR  71  27.469 -49.973 -11.108
  458   1HB   TYR  71          1HB       TYR  71  28.596 -51.004  -9.135
  459   2HB   TYR  71          2HB       TYR  71  27.788 -52.532  -9.426
  460    HD1  TYR  71           HD1      TYR  71  29.801 -50.198 -11.582
  461    HD2  TYR  71           HD2      TYR  71  29.278 -54.173 -10.089
  462    HE1  TYR  71           HE1      TYR  71  31.779 -50.987 -12.970
  463    HE2  TYR  71           HE2      TYR  71  31.258 -54.949 -11.482
  464    HH   TYR  71           HH       TYR  71  33.204 -54.058 -12.492
  465    H    SER  72           H        SER  72  27.040 -50.288 -13.231
  466    HA   SER  72           HA       SER  72  26.595 -53.008 -14.077
  467   1HB   SER  72          1HB       SER  72  24.312 -52.269 -13.823
  468   2HB   SER  72          2HB       SER  72  24.651 -50.722 -14.574
  469    HG   SER  72           HG       SER  72  23.802 -51.797 -16.270
  470    H    SER  73           H        SER  73  28.010 -53.367 -15.745
  471    HA   SER  73           HA       SER  73  28.241 -51.451 -17.817
  472   1HB   SER  73          1HB       SER  73  30.711 -51.125 -17.598
  473   2HB   SER  73          2HB       SER  73  29.814 -50.405 -16.275
  474    HG   SER  73           HG       SER  73  31.797 -51.763 -15.754
  475    H    HIS  74           H        HIS  74  28.648 -52.566 -19.719
  476    HA   HIS  74           HA       HIS  74  30.299 -54.877 -19.723
  477   1HB   HIS  74          1HB       HIS  74  27.392 -55.190 -19.439
  478   2HB   HIS  74          2HB       HIS  74  28.045 -56.044 -20.823
  479    HD1  HIS  74           HD1      HIS  74  28.002 -56.056 -17.079
  480    HD2  HIS  74           HD2      HIS  74  29.869 -58.156 -20.193
  481    HE1  HIS  74           HE1      HIS  74  29.022 -58.142 -16.023
  482    H    ASP  75           H        ASP  75  31.405 -54.692 -21.600
  483    HA   ASP  75           HA       ASP  75  30.561 -52.872 -23.543
  484   1HB   ASP  75          1HB       ASP  75  32.583 -53.419 -24.666
  485   2HB   ASP  75          2HB       ASP  75  32.954 -53.663 -22.971
  486    HD2  ASP  75           HD2      ASP  75  32.831 -56.852 -25.394
  Start of MODEL   12
    1    H    MET   1           H        MET   1 -48.905  33.178  28.861
    2    HA   MET   1           HA       MET   1 -47.797  32.774  26.409
    3   1HB   MET   1          1HB       MET   1 -47.760  35.050  28.426
    4   2HB   MET   1          2HB       MET   1 -46.835  35.224  26.948
    5   1HG   MET   1          1HG       MET   1 -48.846  36.079  26.179
    6   2HG   MET   1          2HG       MET   1 -49.149  34.389  25.831
    7   1HE   MET   1          1HE       MET   1 -51.801  37.001  27.916
    8   2HE   MET   1          2HE       MET   1 -50.179  37.351  28.561
    9   3HE   MET   1          3HE       MET   1 -50.445  37.294  26.802
   10    H    GLU   2           H        GLU   2 -46.011  31.469  26.092
   11    HA   GLU   2           HA       GLU   2 -43.784  31.815  27.897
   12   1HB   GLU   2          1HB       GLU   2 -44.863  29.559  26.852
   13   2HB   GLU   2          2HB       GLU   2 -43.667  29.875  25.611
   14   1HG   GLU   2          1HG       GLU   2 -42.248  28.750  27.014
   15   2HG   GLU   2          2HG       GLU   2 -42.136  30.287  27.849
   16    HE2  GLU   2           HE2      GLU   2 -42.592  28.613  30.480
   17    H    VAL   3           H        VAL   3 -41.518  31.926  26.915
   18    HA   VAL   3           HA       VAL   3 -41.341  34.151  25.247
   19    HB   VAL   3           HB       VAL   3 -39.287  32.022  25.880
   20   1HG1  VAL   3          1HG1      VAL   3 -38.466  33.307  24.052
   21   2HG1  VAL   3          2HG1      VAL   3 -39.033  34.832  24.775
   22   3HG1  VAL   3          3HG1      VAL   3 -37.676  33.947  25.513
   23   1HG2  VAL   3          1HG2      VAL   3 -40.129  34.533  27.348
   24   2HG2  VAL   3          2HG2      VAL   3 -40.086  32.860  27.953
   25   3HG2  VAL   3          3HG2      VAL   3 -38.566  33.728  27.626
   26    H    ALA   4           H        ALA   4 -40.235  34.228  23.073
   27    HA   ALA   4           HA       ALA   4 -41.646  33.029  21.137
   28   1HB   ALA   4          1HB       ALA   4 -39.374  33.274  19.805
   29   2HB   ALA   4          2HB       ALA   4 -40.210  34.716  20.430
   30   3HB   ALA   4          3HB       ALA   4 -38.816  34.045  21.309
   31    H    MET   5           H        MET   5 -41.413  31.174  19.751
   32    HA   MET   5           HA       MET   5 -40.427  28.922  21.212
   33   1HB   MET   5          1HB       MET   5 -42.554  29.345  19.506
   34   2HB   MET   5          2HB       MET   5 -41.407  28.649  18.379
   35   1HG   MET   5          1HG       MET   5 -41.315  26.584  19.528
   36   2HG   MET   5          2HG       MET   5 -41.825  27.287  21.050
   37   1HE   MET   5          1HE       MET   5 -44.723  26.844  21.743
   38   2HE   MET   5          2HE       MET   5 -44.772  25.254  20.943
   39   3HE   MET   5          3HE       MET   5 -43.262  25.828  21.690
   40    H    VAL   6           H        VAL   6 -38.348  28.211  21.058
   41    HA   VAL   6           HA       VAL   6 -36.631  29.203  19.029
   42    HB   VAL   6           HB       VAL   6 -36.042  26.866  20.822
   43   1HG1  VAL   6          1HG1      VAL   6 -33.969  28.789  20.796
   44   2HG1  VAL   6          2HG1      VAL   6 -33.992  27.194  20.006
   45   3HG1  VAL   6          3HG1      VAL   6 -34.534  28.637  19.115
   46   1HG2  VAL   6          1HG2      VAL   6 -36.716  29.642  21.633
   47   2HG2  VAL   6          2HG2      VAL   6 -36.810  28.119  22.550
   48   3HG2  VAL   6          3HG2      VAL   6 -35.247  28.948  22.360
   49    H    SER   7           H        SER   7 -35.348  27.782  17.540
   50    HA   SER   7           HA       SER   7 -35.231  26.367  15.900
   51   1HB   SER   7          1HB       SER   7 -36.356  24.768  18.090
   52   2HB   SER   7          2HB       SER   7 -36.843  24.141  16.528
   53    HG   SER   7           HG       SER   7 -34.494  24.270  15.930
   54    H    ALA   8           H        ALA   8 -36.213  26.567  13.914
   55    HA   ALA   8           HA       ALA   8 -39.040  27.216  13.893
   56   1HB   ALA   8          1HB       ALA   8 -38.604  27.952  11.622
   57   2HB   ALA   8          2HB       ALA   8 -37.311  28.574  12.675
   58   3HB   ALA   8          3HB       ALA   8 -37.007  27.166  11.629
   59    H    GLU   9           H        GLU   9 -40.337  25.424  14.048
   60    HA   GLU   9           HA       GLU   9 -40.254  23.622  11.868
   61   1HB   GLU   9          1HB       GLU   9 -38.551  22.806  13.762
   62   2HB   GLU   9          2HB       GLU   9 -40.014  22.221  14.527
   63   1HG   GLU   9          1HG       GLU   9 -38.983  20.477  13.080
   64   2HG   GLU   9          2HG       GLU   9 -40.592  20.898  12.528
   65    HE2  GLU   9           HE2      GLU   9 -39.205  21.386   9.407
   66    H    SER  10           H        SER  10 -42.134  21.999  12.036
   67    HA   SER  10           HA       SER  10 -44.070  22.616  14.035
   68   1HB   SER  10          1HB       SER  10 -44.673  23.256  11.113
   69   2HB   SER  10          2HB       SER  10 -45.844  23.292  12.416
   70    HG   SER  10           HG       SER  10 -44.716  25.389  11.727
   71    H    SER  11           H        SER  11 -45.871  21.046  14.004
   72    HA   SER  11           HA       SER  11 -46.683  19.045  13.791
   73   1HB   SER  11          1HB       SER  11 -46.760  20.018  11.287
   74   2HB   SER  11          2HB       SER  11 -45.651  18.695  10.983
   75    HG   SER  11           HG       SER  11 -48.352  18.559  11.993
   76    H    GLY  12           H        GLY  12 -46.105  16.607  13.214
   77   1HA   GLY  12          1HA       GLY  12 -43.198  16.239  13.639
   78   2HA   GLY  12          2HA       GLY  12 -44.425  15.320  14.487
   79    H    CYS  13           H        CYS  13 -43.531  13.324  13.620
   80    HA   CYS  13           HA       CYS  13 -43.216  11.731  12.123
   81   1HB   CYS  13          1HB       CYS  13 -45.981  12.706  11.746
   82   2HB   CYS  13          2HB       CYS  13 -45.363  11.747  10.416
   83    HG   CYS  13           HG       CYS  13 -46.650  10.781  12.957
   84    H    ASN  14           H        ASN  14 -41.434  13.476  11.398
   85    HA   ASN  14           HA       ASN  14 -42.012  14.270   8.662
   86   1HB   ASN  14          1HB       ASN  14 -40.522  15.468  10.874
   87   2HB   ASN  14          2HB       ASN  14 -39.452  15.257   9.502
   88   1HD2  ASN  14          1HD2      ASN  14 -39.459  16.728   7.977
   89   2HD2  ASN  14          2HD2      ASN  14 -40.679  17.921   7.682
   90    H    SER  15           H        SER  15 -41.294  11.489   9.725
   91    HA   SER  15           HA       SER  15 -39.014  11.110   7.981
   92   1HB   SER  15          1HB       SER  15 -39.224   9.941  10.792
   93   2HB   SER  15          2HB       SER  15 -37.992   9.514   9.621
   94    HG   SER  15           HG       SER  15 -38.390  12.022  10.977
   95    H    HIS  16           H        HIS  16 -40.642  10.289   6.482
   96    HA   HIS  16           HA       HIS  16 -41.833   8.721   5.517
   97   1HB   HIS  16          1HB       HIS  16 -39.819   7.355   6.093
   98   2HB   HIS  16          2HB       HIS  16 -40.638   6.813   7.545
   99    HD1  HIS  16           HD1      HIS  16 -41.487   4.498   7.212
  100    HD2  HIS  16           HD2      HIS  16 -41.859   6.816   3.735
  101    HE1  HIS  16           HE1      HIS  16 -42.595   3.000   5.468
  102    H    MET  17           H        MET  17 -43.823   9.732   6.135
  103    HA   MET  17           HA       MET  17 -45.085   9.601   8.480
  104   1HB   MET  17          1HB       MET  17 -45.754  10.082   5.714
  105   2HB   MET  17          2HB       MET  17 -47.018   9.054   6.360
  106   1HG   MET  17          1HG       MET  17 -47.808  10.685   7.795
  107   2HG   MET  17          2HG       MET  17 -46.207  11.302   8.151
  108   1HE   MET  17          1HE       MET  17 -47.736  13.942   7.776
  109   2HE   MET  17          2HE       MET  17 -48.853  13.900   6.390
  110   3HE   MET  17          3HE       MET  17 -48.947  12.644   7.648
  111    HA   PRO  18           HA       PRO  18 -46.834   5.323   7.401
  112   1HB   PRO  18          1HB       PRO  18 -45.832   3.934   5.271
  113   2HB   PRO  18          2HB       PRO  18 -47.287   4.907   5.182
  114   1HG   PRO  18          1HG       PRO  18 -44.590   5.505   4.128
  115   2HG   PRO  18          2HG       PRO  18 -46.124   6.234   3.696
  116   1HD   PRO  18          1HD       PRO  18 -44.095   7.373   5.373
  117   2HD   PRO  18          2HD       PRO  18 -45.675   8.049   5.035
  118    H    TYR  19           H        TYR  19 -46.232   3.002   7.799
  119    HA   TYR  19           HA       TYR  19 -43.964   3.054   9.493
  120   1HB   TYR  19          1HB       TYR  19 -45.951   1.634   9.899
  121   2HB   TYR  19          2HB       TYR  19 -45.852   0.948   8.289
  122    HD1  TYR  19           HD1      TYR  19 -44.918  -1.167   8.042
  123    HD2  TYR  19           HD2      TYR  19 -43.794   1.207  11.419
  124    HE1  TYR  19           HE1      TYR  19 -43.553  -3.106   8.959
  125    HE2  TYR  19           HE2      TYR  19 -42.433  -0.740  12.325
  126    HH   TYR  19           HH       TYR  19 -41.403  -2.688  11.635
  127    H    GLY  20           H        GLY  20 -41.856   2.822   8.955
  128   1HA   GLY  20          1HA       GLY  20 -41.090   0.896   6.933
  129   2HA   GLY  20          2HA       GLY  20 -40.789   2.567   6.500
  130    H    TYR  21           H        TYR  21 -38.967   3.594   7.278
  131    HA   TYR  21           HA       TYR  21 -37.188   1.994   8.891
  132   1HB   TYR  21          1HB       TYR  21 -37.232   4.564   7.262
  133   2HB   TYR  21          2HB       TYR  21 -35.964   4.415   8.462
  134    HD1  TYR  21           HD1      TYR  21 -37.477   2.518   5.603
  135    HD2  TYR  21           HD2      TYR  21 -33.957   3.380   7.877
  136    HE1  TYR  21           HE1      TYR  21 -36.079   1.162   3.967
  137    HE2  TYR  21           HE2      TYR  21 -32.571   2.021   6.234
  138    HH   TYR  21           HH       TYR  21 -33.070   1.427   3.521
  139    H    ALA  22           H        ALA  22 -39.446   2.579  10.424
  140    HA   ALA  22           HA       ALA  22 -38.820   4.937  11.990
  141   1HB   ALA  22          1HB       ALA  22 -41.119   4.734  11.709
  142   2HB   ALA  22          2HB       ALA  22 -41.080   2.956  11.789
  143   3HB   ALA  22          3HB       ALA  22 -40.897   3.918  13.276
  144    H    ALA  23           H        ALA  23 -39.306   1.379  12.589
  145    HA   ALA  23           HA       ALA  23 -38.022   1.583  15.136
  146   1HB   ALA  23          1HB       ALA  23 -39.877  -0.083  14.069
  147   2HB   ALA  23          2HB       ALA  23 -38.412  -1.060  13.811
  148   3HB   ALA  23          3HB       ALA  23 -38.848  -0.527  15.453
  149    H    GLN  24           H        GLN  24 -36.886   1.679  11.970
  150    HA   GLN  24           HA       GLN  24 -34.577   0.046  12.481
  151   1HB   GLN  24          1HB       GLN  24 -35.993   0.810  10.174
  152   2HB   GLN  24          2HB       GLN  24 -34.490   1.704  10.055
  153   1HG   GLN  24          1HG       GLN  24 -33.839  -0.302   9.066
  154   2HG   GLN  24          2HG       GLN  24 -33.386  -0.626  10.728
  155   1HE2  GLN  24          1HE2      GLN  24 -36.064  -0.920   8.422
  156   2HE2  GLN  24          2HE2      GLN  24 -36.724  -2.402   9.028
  157    H    ALA  25           H        ALA  25 -35.553   3.072  13.436
  158    HA   ALA  25           HA       ALA  25 -33.406   4.724  12.773
  159   1HB   ALA  25          1HB       ALA  25 -35.102   5.972  13.644
  160   2HB   ALA  25          2HB       ALA  25 -35.649   4.665  14.721
  161   3HB   ALA  25          3HB       ALA  25 -34.260   5.677  15.184
  162    H    ARG  26           H        ARG  26 -33.662   1.968  14.898
  163    HA   ARG  26           HA       ARG  26 -31.642   2.757  16.676
  164   1HB   ARG  26          1HB       ARG  26 -33.509   0.731  16.614
  165   2HB   ARG  26          2HB       ARG  26 -32.066  -0.167  16.187
  166   1HG   ARG  26          1HG       ARG  26 -31.740   1.738  18.466
  167   2HG   ARG  26          2HG       ARG  26 -32.826   0.396  18.771
  168   1HD   ARG  26          1HD       ARG  26 -30.971  -1.158  17.879
  169   2HD   ARG  26          2HD       ARG  26 -29.905   0.233  17.900
  170    HE   ARG  26           HE       ARG  26 -31.263  -0.081  20.447
  171   1HH1  ARG  26          2HH2      ARG  26 -28.562  -1.330  18.524
  172   2HH1  ARG  26          1HH2      ARG  26 -27.663  -1.862  19.905
  173   1HH2  ARG  26          1HH       ARG  26 -28.573  -1.530  22.097
  174    H    ALA  27           H        ALA  27 -31.760   1.169  13.495
  175    HA   ALA  27           HA       ALA  27 -29.147   0.078  13.590
  176   1HB   ALA  27          1HB       ALA  27 -30.300   0.792  10.957
  177   2HB   ALA  27          2HB       ALA  27 -29.733  -0.780  11.570
  178   3HB   ALA  27          3HB       ALA  27 -31.361  -0.196  11.990
  179    H    ARG  28           H        ARG  28 -30.557   3.248  12.815
  180    HA   ARG  28           HA       ARG  28 -28.444   4.233  11.346
  181   1HB   ARG  28          1HB       ARG  28 -30.877   5.195  11.994
  182   2HB   ARG  28          2HB       ARG  28 -29.967   6.045  13.227
  183   1HG   ARG  28          1HG       ARG  28 -28.370   6.510  11.036
  184   2HG   ARG  28          2HG       ARG  28 -29.938   6.404  10.260
  185   1HD   ARG  28          1HD       ARG  28 -29.605   8.110  12.750
  186   2HD   ARG  28          2HD       ARG  28 -29.099   8.735  11.193
  187    HE   ARG  28           HE       ARG  28 -31.846   8.324  12.091
  188   1HH1  ARG  28          2HH2      ARG  28 -29.777   8.533   9.221
  189   2HH1  ARG  28          1HH2      ARG  28 -31.073   8.992   8.168
  190   1HH2  ARG  28          1HH       ARG  28 -33.286   9.219   9.059
  191    H    GLU  29           H        GLU  29 -28.941   3.782  14.837
  192    HA   GLU  29           HA       GLU  29 -26.773   5.498  15.532
  193   1HB   GLU  29          1HB       GLU  29 -28.868   3.955  16.930
  194   2HB   GLU  29          2HB       GLU  29 -27.330   3.921  17.769
  195   1HG   GLU  29          1HG       GLU  29 -27.446   6.582  17.106
  196   2HG   GLU  29          2HG       GLU  29 -29.158   6.231  17.244
  197    HE2  GLU  29           HE2      GLU  29 -26.876   7.266  19.739
  198    H    ARG  30           H        ARG  30 -27.260   2.130  14.655
  199    HA   ARG  30           HA       ARG  30 -24.762   1.360  15.841
  200   1HB   ARG  30          1HB       ARG  30 -27.108  -0.020  14.611
  201   2HB   ARG  30          2HB       ARG  30 -25.569  -0.800  14.306
  202   1HG   ARG  30          1HG       ARG  30 -26.074   0.099  17.126
  203   2HG   ARG  30          2HG       ARG  30 -27.037  -1.248  16.554
  204   1HD   ARG  30          1HD       ARG  30 -24.482  -1.924  15.650
  205   2HD   ARG  30          2HD       ARG  30 -24.139  -1.138  17.179
  206    HE   ARG  30           HE       ARG  30 -26.340  -2.987  17.481
  207   1HH1  ARG  30          2HH2      ARG  30 -22.813  -2.893  17.156
  208   2HH1  ARG  30          1HH2      ARG  30 -22.572  -4.393  17.989
  209   1HH2  ARG  30          1HH       ARG  30 -24.474  -5.594  18.817
  210    H    GLU  31           H        GLU  31 -26.161   2.318  12.730
  211    HA   GLU  31           HA       GLU  31 -24.123   1.216  11.139
  212   1HB   GLU  31          1HB       GLU  31 -26.512   1.976  10.461
  213   2HB   GLU  31          2HB       GLU  31 -25.857   3.600  10.398
  214   1HG   GLU  31          1HG       GLU  31 -24.293   3.019   8.657
  215   2HG   GLU  31          2HG       GLU  31 -24.537   1.301   8.901
  216    HE2  GLU  31           HE2      GLU  31 -27.096   3.340   6.625
  217    H    ARG  32           H        ARG  32 -24.485   4.160  13.053
  218    HA   ARG  32           HA       ARG  32 -22.709   5.774  11.726
  219   1HB   ARG  32          1HB       ARG  32 -24.262   5.988  13.993
  220   2HB   ARG  32          2HB       ARG  32 -22.669   5.898  14.719
  221   1HG   ARG  32          1HG       ARG  32 -21.920   7.878  13.658
  222   2HG   ARG  32          2HG       ARG  32 -23.114   7.769  12.380
  223   1HD   ARG  32          1HD       ARG  32 -24.584   9.034  13.566
  224   2HD   ARG  32          2HD       ARG  32 -24.489   7.944  14.935
  225    HE   ARG  32           HE       ARG  32 -22.150   9.315  15.212
  226   1HH1  ARG  32          2HH2      ARG  32 -25.446  10.465  14.604
  227   2HH1  ARG  32          1HH2      ARG  32 -25.196  11.983  15.400
  228   1HH2  ARG  32          1HH       ARG  32 -23.057  12.462  16.368
  229    H    LEU  33           H        LEU  33 -22.221   3.008  13.902
  230    HA   LEU  33           HA       LEU  33 -19.396   3.609  14.188
  231   1HB   LEU  33          1HB       LEU  33 -21.325   2.348  15.769
  232   2HB   LEU  33          2HB       LEU  33 -20.285   1.049  15.219
  233    HG   LEU  33           HG       LEU  33 -18.922   3.478  16.268
  234   1HD1  LEU  33          1HD1      LEU  33 -19.504   1.798  18.511
  235   2HD1  LEU  33          2HD1      LEU  33 -19.852   3.529  18.278
  236   3HD1  LEU  33          3HD1      LEU  33 -21.034   2.306  17.755
  237   1HD2  LEU  33          1HD2      LEU  33 -18.345   0.681  15.788
  238   2HD2  LEU  33          2HD2      LEU  33 -17.237   2.043  16.083
  239   3HD2  LEU  33          3HD2      LEU  33 -17.930   1.146  17.456
  240    H    ALA  34           H        ALA  34 -21.524   2.052  11.994
  241    HA   ALA  34           HA       ALA  34 -19.655   0.006  11.209
  242   1HB   ALA  34          1HB       ALA  34 -22.319   0.107  11.135
  243   2HB   ALA  34          2HB       ALA  34 -22.010   0.839   9.542
  244   3HB   ALA  34          3HB       ALA  34 -21.393  -0.790   9.908
  245    H    HIS  35           H        HIS  35 -19.482   3.261  11.020
  246    HA   HIS  35           HA       HIS  35 -18.787   3.401   8.213
  247   1HB   HIS  35          1HB       HIS  35 -19.432   5.318  10.371
  248   2HB   HIS  35          2HB       HIS  35 -18.189   5.854   9.259
  249    HD1  HIS  35           HD1      HIS  35 -21.805   5.672   9.635
  250    HD2  HIS  35           HD2      HIS  35 -19.115   5.726   6.417
  251    HE1  HIS  35           HE1      HIS  35 -23.168   6.311   7.575
  252    H    SER  36           H        SER  36 -17.342   2.558  11.190
  253    HA   SER  36           HA       SER  36 -14.762   3.590  10.447
  254   1HB   SER  36          1HB       SER  36 -16.045   2.877  12.889
  255   2HB   SER  36          2HB       SER  36 -14.719   1.746  12.700
  256    HG   SER  36           HG       SER  36 -14.223   3.846  13.809
  257    H    ARG  37           H        ARG  37 -16.718   0.735  10.064
  258    HA   ARG  37           HA       ARG  37 -14.430  -0.966   9.740
  259   1HB   ARG  37          1HB       ARG  37 -17.012  -1.440  10.590
  260   2HB   ARG  37          2HB       ARG  37 -17.139  -1.938   8.915
  261   1HG   ARG  37          1HG       ARG  37 -15.008  -3.345   9.304
  262   2HG   ARG  37          2HG       ARG  37 -15.200  -3.005  11.012
  263   1HD   ARG  37          1HD       ARG  37 -16.803  -4.604  11.212
  264   2HD   ARG  37          2HD       ARG  37 -17.756  -3.878   9.934
  265    HE   ARG  37           HE       ARG  37 -15.819  -5.131   8.480
  266   1HH1  ARG  37          2HH2      ARG  37 -17.812  -6.294  11.170
  267   2HH1  ARG  37          1HH2      ARG  37 -17.789  -7.942  10.637
  268   1HH2  ARG  37          1HH       ARG  37 -16.594  -8.514   8.640
  269    H    ALA  38           H        ALA  38 -15.419   1.455   7.922
  270    HA   ALA  38           HA       ALA  38 -16.206   0.404   5.465
  271   1HB   ALA  38          1HB       ALA  38 -15.851   2.892   6.563
  272   2HB   ALA  38          2HB       ALA  38 -14.477   2.811   5.433
  273   3HB   ALA  38          3HB       ALA  38 -16.137   2.586   4.833
  274    H    ALA  39           H        ALA  39 -12.907   1.394   6.639
  275    HA   ALA  39           HA       ALA  39 -11.505   0.614   4.408
  276   1HB   ALA  39          1HB       ALA  39  -9.764   0.097   6.462
  277   2HB   ALA  39          2HB       ALA  39 -10.120   1.723   5.830
  278   3HB   ALA  39          3HB       ALA  39 -10.965   1.127   7.278
  279    H    ALA  40           H        ALA  40  -9.700  -1.312   4.754
  280    HA   ALA  40           HA       ALA  40 -11.332  -3.697   4.722
  281   1HB   ALA  40          1HB       ALA  40  -9.404  -2.919   3.087
  282   2HB   ALA  40          2HB       ALA  40  -8.347  -3.648   4.320
  283   3HB   ALA  40          3HB       ALA  40  -9.585  -4.638   3.509
  284    H    ALA  41           H        ALA  41 -11.602  -2.920   7.232
  285    HA   ALA  41           HA       ALA  41 -11.352  -3.578   9.330
  286   1HB   ALA  41          1HB       ALA  41 -10.916  -5.786   9.638
  287   2HB   ALA  41          2HB       ALA  41 -10.813  -5.836   7.861
  288   3HB   ALA  41          3HB       ALA  41  -9.331  -5.686   8.835
  289    H    ALA  42           H        ALA  42 -10.165  -1.344   9.109
  290    HA   ALA  42           HA       ALA  42  -7.354  -1.723   9.879
  291   1HB   ALA  42          1HB       ALA  42  -7.772  -0.403   7.806
  292   2HB   ALA  42          2HB       ALA  42  -8.754   0.737   8.757
  293   3HB   ALA  42          3HB       ALA  42  -7.014   0.568   9.091
  294    H    ALA  43           H        ALA  43 -10.098   0.606  10.436
  295    HA   ALA  43           HA       ALA  43  -9.208   1.644  12.792
  296   1HB   ALA  43          1HB       ALA  43 -11.253   2.647  12.823
  297   2HB   ALA  43          2HB       ALA  43 -11.418   1.913  11.210
  298   3HB   ALA  43          3HB       ALA  43 -12.126   1.108  12.631
  299    H    VAL  44           H        VAL  44 -10.386  -1.593  12.117
  300    HA   VAL  44           HA       VAL  44 -10.777  -2.112  14.959
  301    HB   VAL  44           HB       VAL  44 -11.729  -3.215  12.426
  302   1HG1  VAL  44          1HG1      VAL  44 -11.897  -5.544  13.165
  303   2HG1  VAL  44          2HG1      VAL  44 -10.194  -5.044  13.031
  304   3HG1  VAL  44          3HG1      VAL  44 -10.964  -5.159  14.632
  305   1HG2  VAL  44          1HG2      VAL  44 -12.779  -2.324  14.862
  306   2HG2  VAL  44          2HG2      VAL  44 -13.678  -3.050  13.508
  307   3HG2  VAL  44          3HG2      VAL  44 -13.101  -4.075  14.844
  308    H    ALA  45           H        ALA  45  -8.562  -2.671  12.237
  309    HA   ALA  45           HA       ALA  45  -7.136  -4.819  12.959
  310   1HB   ALA  45          1HB       ALA  45  -5.258  -3.781  11.838
  311   2HB   ALA  45          2HB       ALA  45  -6.749  -3.258  11.019
  312   3HB   ALA  45          3HB       ALA  45  -5.915  -2.155  12.140
  313    H    ALA  46           H        ALA  46  -6.351  -1.468  14.149
  314    HA   ALA  46           HA       ALA  46  -4.495  -2.285  16.030
  315   1HB   ALA  46          1HB       ALA  46  -4.794  -0.049  16.960
  316   2HB   ALA  46          2HB       ALA  46  -4.864   0.037  15.184
  317   3HB   ALA  46          3HB       ALA  46  -6.364   0.116  16.138
  318    H    ALA  47           H        ALA  47  -8.019  -1.507  16.478
  319    HA   ALA  47           HA       ALA  47  -8.057  -2.273  19.175
  320   1HB   ALA  47          1HB       ALA  47 -10.362  -1.875  19.027
  321   2HB   ALA  47          2HB       ALA  47  -9.707  -0.851  17.726
  322   3HB   ALA  47          3HB       ALA  47 -10.449  -2.421  17.335
  323    H    THR  48           H        THR  48 -10.265  -4.072  19.337
  324    HA   THR  48           HA       THR  48 -10.269  -6.340  17.891
  325    HB   THR  48           HB       THR  48  -7.975  -6.854  18.023
  326    HG1  THR  48           HG1      THR  48  -7.911  -8.448  19.856
  327   1HG2  THR  48          1HG2      THR  48  -6.964  -6.715  20.544
  328   2HG2  THR  48          2HG2      THR  48  -6.859  -5.346  19.412
  329   3HG2  THR  48          3HG2      THR  48  -8.142  -5.384  20.646
  330    H    ALA  49           H        ALA  49 -10.937  -8.348  19.241
  331    HA   ALA  49           HA       ALA  49 -13.146  -7.716  20.691
  332   1HB   ALA  49          1HB       ALA  49 -11.320 -10.143  20.921
  333   2HB   ALA  49          2HB       ALA  49 -12.986 -10.058  21.541
  334   3HB   ALA  49          3HB       ALA  49 -12.681  -9.940  19.792
  335    H    ALA  50           H        ALA  50  -9.757  -7.681  21.695
  336    HA   ALA  50           HA       ALA  50 -10.445  -7.579  24.499
  337   1HB   ALA  50          1HB       ALA  50  -7.797  -7.204  23.042
  338   2HB   ALA  50          2HB       ALA  50  -8.010  -7.414  24.797
  339   3HB   ALA  50          3HB       ALA  50  -8.413  -8.745  23.685
  340    H    VAL  51           H        VAL  51 -11.911  -5.621  23.308
  341    HA   VAL  51           HA       VAL  51 -10.739  -3.271  24.471
  342    HB   VAL  51           HB       VAL  51 -11.272  -3.470  21.504
  343   1HG1  VAL  51          1HG1      VAL  51 -11.258  -1.119  23.337
  344   2HG1  VAL  51          2HG1      VAL  51 -10.417  -0.941  21.779
  345   3HG1  VAL  51          3HG1      VAL  51 -12.141  -1.385  21.815
  346   1HG2  VAL  51          1HG2      VAL  51  -8.802  -2.880  23.156
  347   2HG2  VAL  51          2HG2      VAL  51  -9.063  -4.204  21.994
  348   3HG2  VAL  51          3HG2      VAL  51  -8.915  -2.527  21.415
  349    H    GLU  52           H        GLU  52 -12.722  -4.377  25.684
  350    HA   GLU  52           HA       GLU  52 -15.066  -2.965  24.679
  351   1HB   GLU  52          1HB       GLU  52 -14.971  -5.637  24.567
  352   2HB   GLU  52          2HB       GLU  52 -15.398  -5.510  26.262
  353   1HG   GLU  52          1HG       GLU  52 -17.550  -5.007  25.750
  354   2HG   GLU  52          2HG       GLU  52 -17.050  -3.672  24.732
  355    HE2  GLU  52           HE2      GLU  52 -17.807  -4.005  22.718
  356    H    GLY  53           H        GLY  53 -16.741  -2.615  26.534
  357   1HA   GLY  53          1HA       GLY  53 -15.228  -1.766  28.915
  358   2HA   GLY  53          2HA       GLY  53 -16.735  -1.083  28.337
  359    H    THR  54           H        THR  54 -18.730  -2.483  28.417
  360    HA   THR  54           HA       THR  54 -18.791  -3.871  30.937
  361    HB   THR  54           HB       THR  54 -21.168  -3.712  30.638
  362    HG1  THR  54           HG1      THR  54 -20.330  -3.461  27.837
  363   1HG2  THR  54          1HG2      THR  54 -19.816  -1.408  30.452
  364   2HG2  THR  54          2HG2      THR  54 -20.391  -1.459  28.768
  365   3HG2  THR  54          3HG2      THR  54 -21.562  -1.449  30.109
  366    H    GLY  55           H        GLY  55 -19.505  -6.048  31.283
  367   1HA   GLY  55          1HA       GLY  55 -19.217  -7.804  28.934
  368   2HA   GLY  55          2HA       GLY  55 -18.241  -8.079  30.363
  369    H    GLY  56           H        GLY  56 -19.043  -9.790  31.500
  370   1HA   GLY  56          1HA       GLY  56 -21.593  -9.695  32.699
  371   2HA   GLY  56          2HA       GLY  56 -21.656 -10.754  31.303
  372    H    SER  57           H        SER  57 -20.248 -10.226  34.525
  373    HA   SER  57           HA       SER  57 -19.494 -13.035  34.497
  374   1HB   SER  57          1HB       SER  57 -17.499 -12.449  35.916
  375   2HB   SER  57          2HB       SER  57 -17.399 -11.837  34.278
  376    HG   SER  57           HG       SER  57 -16.924 -10.364  36.270
  377    H    GLY  58           H        GLY  58 -19.331 -13.942  36.797
  378   1HA   GLY  58          1HA       GLY  58 -21.211 -12.507  38.579
  379   2HA   GLY  58          2HA       GLY  58 -21.201 -14.245  38.356
  380    H    GLY  59           H        GLY  59 -19.699 -15.547  39.461
  381   1HA   GLY  59          1HA       GLY  59 -17.696 -14.127  41.099
  382   2HA   GLY  59          2HA       GLY  59 -18.806 -15.272  41.825
  383    H    GLY  60           H        GLY  60 -15.974 -14.851  39.746
  384   1HA   GLY  60          1HA       GLY  60 -15.774 -17.690  39.145
  385   2HA   GLY  60          2HA       GLY  60 -14.702 -16.404  38.626
  386    HA   PRO  61           HA       PRO  61 -12.661 -18.593  42.063
  387   1HB   PRO  61          1HB       PRO  61 -10.413 -19.401  40.736
  388   2HB   PRO  61          2HB       PRO  61 -11.821 -20.423  40.947
  389   1HG   PRO  61          1HG       PRO  61 -10.911 -19.000  38.521
  390   2HG   PRO  61          2HG       PRO  61 -12.038 -20.335  38.652
  391   1HD   PRO  61          1HD       PRO  61 -12.689 -17.575  38.219
  392   2HD   PRO  61          2HD       PRO  61 -13.819 -18.892  38.466
  393    H    HIS  62           H        HIS  62 -10.711 -18.094  43.302
  394    HA   HIS  62           HA       HIS  62  -9.271 -15.819  42.297
  395   1HB   HIS  62          1HB       HIS  62 -11.402 -14.931  43.363
  396   2HB   HIS  62          2HB       HIS  62 -10.795 -15.529  44.894
  397    HD1  HIS  62           HD1      HIS  62  -8.268 -14.523  45.539
  398    HD2  HIS  62           HD2      HIS  62 -10.597 -12.382  42.785
  399    HE1  HIS  62           HE1      HIS  62  -7.300 -12.164  45.466
  400    H    HIS  63           H        HIS  63 -10.027 -17.569  45.399
  401    HA   HIS  63           HA       HIS  63  -7.514 -18.819  45.438
  402   1HB   HIS  63          1HB       HIS  63  -7.060 -16.304  46.020
  403   2HB   HIS  63          2HB       HIS  63  -7.724 -16.726  47.586
  404    HD1  HIS  63           HD1      HIS  63  -5.653 -16.750  49.027
  405    HD2  HIS  63           HD2      HIS  63  -5.198 -18.997  45.515
  406    HE1  HIS  63           HE1      HIS  63  -3.412 -17.953  49.233
  407    H    HIS  64           H        HIS  64  -8.982 -20.593  45.748
  408    HA   HIS  64           HA       HIS  64 -10.414 -20.532  48.290
  409   1HB   HIS  64          1HB       HIS  64 -10.898 -21.724  45.660
  410   2HB   HIS  64          2HB       HIS  64 -11.105 -22.875  46.966
  411    HD1  HIS  64           HD1      HIS  64 -12.767 -21.945  49.004
  412    HD2  HIS  64           HD2      HIS  64 -13.089 -20.142  45.230
  413    HE1  HIS  64           HE1      HIS  64 -15.031 -20.770  48.964
  414    H    HIS  65           H        HIS  65 -10.523 -22.977  49.239
  415    HA   HIS  65           HA       HIS  65  -8.636 -24.815  48.978
  416   1HB   HIS  65          1HB       HIS  65  -6.708 -23.616  49.150
  417   2HB   HIS  65          2HB       HIS  65  -7.425 -22.371  50.152
  418    HD1  HIS  65           HD1      HIS  65  -6.197 -25.982  50.455
  419    HD2  HIS  65           HD2      HIS  65  -6.843 -22.586  52.831
  420    HE1  HIS  65           HE1      HIS  65  -5.264 -26.537  52.765
  421    H    GLN  66           H        GLN  66  -9.380 -26.434  50.261
  422    HA   GLN  66           HA       GLN  66 -11.409 -26.028  52.035
  423   1HB   GLN  66          1HB       GLN  66 -11.052 -28.363  52.717
  424   2HB   GLN  66          2HB       GLN  66 -10.860 -28.205  50.983
  425   1HG   GLN  66          1HG       GLN  66  -8.363 -28.058  51.299
  426   2HG   GLN  66          2HG       GLN  66  -8.585 -28.290  53.021
  427   1HE2  GLN  66          1HE2      GLN  66  -8.876 -29.720  49.844
  428   2HE2  GLN  66          2HE2      GLN  66  -8.951 -31.382  50.326
  429    H    THR  67           H        THR  67 -11.282 -26.839  54.478
  430    HA   THR  67           HA       THR  67  -9.826 -24.930  55.891
  431    HB   THR  67           HB       THR  67 -11.952 -26.261  56.536
  432    HG1  THR  67           HG1      THR  67 -10.780 -24.929  58.057
  433   1HG2  THR  67          1HG2      THR  67 -11.669 -28.353  57.689
  434   2HG2  THR  67          2HG2      THR  67 -10.756 -28.552  56.174
  435   3HG2  THR  67          3HG2      THR  67  -9.896 -28.197  57.691
  436    H    ARG  68           H        ARG  68  -8.693 -26.423  58.065
  437    HA   ARG  68           HA       ARG  68  -6.784 -27.194  58.716
  438   1HB   ARG  68          1HB       ARG  68  -7.521 -29.271  57.495
  439   2HB   ARG  68          2HB       ARG  68  -6.701 -28.704  56.054
  440   1HG   ARG  68          1HG       ARG  68  -4.591 -28.530  57.672
  441   2HG   ARG  68          2HG       ARG  68  -5.500 -29.652  58.666
  442   1HD   ARG  68          1HD       ARG  68  -5.070 -31.398  57.262
  443   2HD   ARG  68          2HD       ARG  68  -5.543 -30.478  55.847
  444    HE   ARG  68           HE       ARG  68  -2.815 -30.723  56.955
  445   1HH1  ARG  68          2HH2      ARG  68  -4.939 -29.037  54.675
  446   2HH1  ARG  68          1HH2      ARG  68  -3.634 -28.453  53.698
  447   1HH2  ARG  68          1HH       ARG  68  -1.380 -29.004  54.299
  448    H    GLY  69           H        GLY  69  -5.231 -25.589  58.841
  449   1HA   GLY  69          1HA       GLY  69  -3.765 -24.947  56.354
  450   2HA   GLY  69          2HA       GLY  69  -4.280 -23.713  57.486
  451    H    ALA  70           H        ALA  70  -3.465 -23.871  59.789
  452    HA   ALA  70           HA       ALA  70  -0.759 -25.016  59.761
  453   1HB   ALA  70          1HB       ALA  70  -0.339 -23.259  61.538
  454   2HB   ALA  70          2HB       ALA  70  -0.705 -22.612  59.920
  455   3HB   ALA  70          3HB       ALA  70  -1.958 -22.610  61.184
  456    H    TYR  71           H        TYR  71   0.014 -26.010  61.760
  457    HA   TYR  71           HA       TYR  71  -1.827 -27.771  62.869
  458   1HB   TYR  71          1HB       TYR  71   0.793 -27.752  62.705
  459   2HB   TYR  71          2HB       TYR  71   0.778 -26.665  64.079
  460    HD1  TYR  71           HD1      TYR  71   1.253 -29.966  63.190
  461    HD2  TYR  71           HD2      TYR  71  -0.845 -27.622  66.090
  462    HE1  TYR  71           HE1      TYR  71   1.202 -31.955  64.772
  463    HE2  TYR  71           HE2      TYR  71  -0.888 -29.619  67.662
  464    HH   TYR  71           HH       TYR  71   1.000 -31.996  67.605
  465    H    SER  72           H        SER  72  -3.266 -27.645  64.530
  466    HA   SER  72           HA       SER  72  -3.644 -25.134  65.753
  467   1HB   SER  72          1HB       SER  72  -5.377 -27.012  65.158
  468   2HB   SER  72          2HB       SER  72  -4.914 -27.724  66.692
  469    HG   SER  72           HG       SER  72  -5.440 -24.986  66.891
  470    H    SER  73           H        SER  73  -2.707 -24.366  67.616
  471    HA   SER  73           HA       SER  73  -2.235 -26.012  69.812
  472   1HB   SER  73          1HB       SER  73  -0.295 -26.576  68.110
  473   2HB   SER  73          2HB       SER  73   0.368 -25.033  68.612
  474    HG   SER  73           HG       SER  73  -0.144 -26.066  70.911
  475    H    HIS  74           H        HIS  74  -2.106 -24.692  71.644
  476    HA   HIS  74           HA       HIS  74  -2.414 -21.906  71.204
  477   1HB   HIS  74          1HB       HIS  74  -2.227 -23.620  73.688
  478   2HB   HIS  74          2HB       HIS  74  -2.413 -21.879  73.756
  479    HD1  HIS  74           HD1      HIS  74  -4.540 -21.303  71.674
  480    HD2  HIS  74           HD2      HIS  74  -4.702 -24.627  74.228
  481    HE1  HIS  74           HE1      HIS  74  -6.992 -22.002  71.783
  482    H    ASP  75           H        ASP  75  -0.448 -21.276  70.129
  483    HA   ASP  75           HA       ASP  75   1.655 -20.716  69.955
  484   1HB   ASP  75          1HB       ASP  75   2.578 -19.435  71.947
  485   2HB   ASP  75          2HB       ASP  75   0.997 -18.907  71.406
  486    HD2  ASP  75           HD2      ASP  75  -0.121 -18.874  74.423
  Start of MODEL   13
    1    H    MET   1           H        MET   1 -65.634 -14.005 -13.225
    2    HA   MET   1           HA       MET   1 -66.942 -11.790 -11.852
    3   1HB   MET   1          1HB       MET   1 -66.796 -14.775 -11.450
    4   2HB   MET   1          2HB       MET   1 -66.821 -13.809  -9.988
    5   1HG   MET   1          1HG       MET   1 -68.936 -12.781 -10.589
    6   2HG   MET   1          2HG       MET   1 -68.854 -13.401 -12.225
    7   1HE   MET   1          1HE       MET   1 -68.605 -14.266  -8.608
    8   2HE   MET   1          2HE       MET   1 -70.384 -14.307  -8.632
    9   3HE   MET   1          3HE       MET   1 -69.463 -15.811  -8.392
   10    H    GLU   2           H        GLU   2 -66.052 -11.166  -9.693
   11    HA   GLU   2           HA       GLU   2 -63.184 -11.183  -9.852
   12   1HB   GLU   2          1HB       GLU   2 -65.115  -9.316  -9.018
   13   2HB   GLU   2          2HB       GLU   2 -64.352  -9.822  -7.523
   14   1HG   GLU   2          1HG       GLU   2 -62.868  -8.147  -8.138
   15   2HG   GLU   2          2HG       GLU   2 -62.100  -9.501  -8.942
   16    HE2  GLU   2           HE2      GLU   2 -61.375  -8.571 -10.667
   17    H    VAL   3           H        VAL   3 -62.850 -13.475  -9.345
   18    HA   VAL   3           HA       VAL   3 -63.684 -14.338  -6.710
   19    HB   VAL   3           HB       VAL   3 -63.734 -15.706  -8.872
   20   1HG1  VAL   3          1HG1      VAL   3 -60.765 -15.763  -8.267
   21   2HG1  VAL   3          2HG1      VAL   3 -61.583 -16.999  -9.253
   22   3HG1  VAL   3          3HG1      VAL   3 -61.572 -15.300  -9.784
   23   1HG2  VAL   3          1HG2      VAL   3 -62.237 -17.284  -6.843
   24   2HG2  VAL   3          2HG2      VAL   3 -63.690 -16.429  -6.273
   25   3HG2  VAL   3          3HG2      VAL   3 -63.812 -17.596  -7.612
   26    H    ALA   4           H        ALA   4 -61.687 -15.805  -5.679
   27    HA   ALA   4           HA       ALA   4 -59.795 -13.773  -4.925
   28   1HB   ALA   4          1HB       ALA   4 -59.046 -15.570  -3.331
   29   2HB   ALA   4          2HB       ALA   4 -60.777 -15.175  -3.208
   30   3HB   ALA   4          3HB       ALA   4 -60.260 -16.652  -4.056
   31    H    MET   5           H        MET   5 -58.656 -13.449  -6.944
   32    HA   MET   5           HA       MET   5 -57.570 -15.432  -8.459
   33   1HB   MET   5          1HB       MET   5 -57.140 -12.531  -7.973
   34   2HB   MET   5          2HB       MET   5 -55.688 -13.334  -8.536
   35   1HG   MET   5          1HG       MET   5 -57.696 -14.389 -10.200
   36   2HG   MET   5          2HG       MET   5 -58.170 -12.713 -10.008
   37   1HE   MET   5          1HE       MET   5 -57.917 -13.483 -12.440
   38   2HE   MET   5          2HE       MET   5 -57.088 -12.024 -13.035
   39   3HE   MET   5          3HE       MET   5 -56.380 -13.631 -13.327
   40    H    VAL   6           H        VAL   6 -55.498 -16.471  -8.569
   41    HA   VAL   6           HA       VAL   6 -54.375 -16.998  -6.000
   42    HB   VAL   6           HB       VAL   6 -54.725 -18.535  -8.062
   43   1HG1  VAL   6          1HG1      VAL   6 -51.890 -17.952  -8.759
   44   2HG1  VAL   6          2HG1      VAL   6 -53.230 -18.531  -9.778
   45   3HG1  VAL   6          3HG1      VAL   6 -53.116 -16.806  -9.352
   46   1HG2  VAL   6          1HG2      VAL   6 -52.926 -18.571  -5.835
   47   2HG2  VAL   6          2HG2      VAL   6 -53.700 -19.940  -6.669
   48   3HG2  VAL   6          3HG2      VAL   6 -52.120 -19.338  -7.224
   49    H    SER   7           H        SER   7 -51.628 -17.246  -6.510
   50    HA   SER   7           HA       SER   7 -49.847 -16.029  -6.146
   51   1HB   SER   7          1HB       SER   7 -49.099 -14.681  -8.058
   52   2HB   SER   7          2HB       SER   7 -49.889 -16.139  -8.624
   53    HG   SER   7           HG       SER   7 -50.611 -14.273  -9.810
   54    H    ALA   8           H        ALA   8 -50.590 -15.003  -4.153
   55    HA   ALA   8           HA       ALA   8 -51.974 -12.518  -4.263
   56   1HB   ALA   8          1HB       ALA   8 -51.782 -14.414  -2.403
   57   2HB   ALA   8          2HB       ALA   8 -50.406 -13.422  -1.865
   58   3HB   ALA   8          3HB       ALA   8 -52.034 -12.709  -1.958
   59    H    GLU   9           H        GLU   9 -50.487 -11.480  -5.882
   60    HA   GLU   9           HA       GLU   9 -47.839 -10.955  -5.160
   61   1HB   GLU   9          1HB       GLU   9 -48.921 -10.866  -7.494
   62   2HB   GLU   9          2HB       GLU   9 -49.552  -9.293  -7.048
   63   1HG   GLU   9          1HG       GLU   9 -47.477  -8.892  -8.211
   64   2HG   GLU   9          2HG       GLU   9 -47.167  -8.565  -6.517
   65    HE2  GLU   9           HE2      GLU   9 -45.633 -10.792  -5.509
   66    H    SER  10           H        SER  10 -46.883  -8.824  -4.593
   67    HA   SER  10           HA       SER  10 -48.622  -7.495  -2.710
   68   1HB   SER  10          1HB       SER  10 -46.484  -6.435  -1.911
   69   2HB   SER  10          2HB       SER  10 -46.472  -8.186  -1.831
   70    HG   SER  10           HG       SER  10 -45.071  -6.442  -3.618
   71    H    SER  11           H        SER  11 -49.824  -5.840  -3.594
   72    HA   SER  11           HA       SER  11 -48.465  -3.646  -4.695
   73   1HB   SER  11          1HB       SER  11 -49.968  -5.492  -6.568
   74   2HB   SER  11          2HB       SER  11 -49.917  -3.772  -6.898
   75    HG   SER  11           HG       SER  11 -48.074  -4.306  -7.883
   76    H    GLY  12           H        GLY  12 -50.162  -1.900  -5.401
   77   1HA   GLY  12          1HA       GLY  12 -52.206  -0.897  -5.186
   78   2HA   GLY  12          2HA       GLY  12 -52.855  -2.337  -4.427
   79    H    CYS  13           H        CYS  13 -52.901   0.633  -3.659
   80    HA   CYS  13           HA       CYS  13 -52.904   1.808  -1.806
   81   1HB   CYS  13          1HB       CYS  13 -53.631  -0.620  -0.905
   82   2HB   CYS  13          2HB       CYS  13 -52.142  -0.442   0.002
   83    HG   CYS  13           HG       CYS  13 -54.367   0.304   1.349
   84    H    ASN  14           H        ASN  14 -50.998   2.955  -2.566
   85    HA   ASN  14           HA       ASN  14 -48.465   1.913  -1.681
   86   1HB   ASN  14          1HB       ASN  14 -49.411   3.759  -3.749
   87   2HB   ASN  14          2HB       ASN  14 -48.150   4.526  -2.806
   88   1HD2  ASN  14          1HD2      ASN  14 -48.475   3.167  -5.567
   89   2HD2  ASN  14          2HD2      ASN  14 -47.059   2.184  -5.731
   90    H    SER  15           H        SER  15 -50.652   2.958   0.189
   91    HA   SER  15           HA       SER  15 -48.951   4.846   1.568
   92   1HB   SER  15          1HB       SER  15 -51.832   5.340   0.753
   93   2HB   SER  15          2HB       SER  15 -51.162   6.124   2.170
   94    HG   SER  15           HG       SER  15 -49.391   6.896   0.707
   95    H    HIS  16           H        HIS  16 -48.590   2.762   2.777
   96    HA   HIS  16           HA       HIS  16 -50.107   2.699   5.101
   97   1HB   HIS  16          1HB       HIS  16 -51.856   1.700   3.729
   98   2HB   HIS  16          2HB       HIS  16 -50.748   0.474   3.147
   99    HD1  HIS  16           HD1      HIS  16 -51.821  -1.600   4.130
  100    HD2  HIS  16           HD2      HIS  16 -51.172   1.404   6.985
  101    HE1  HIS  16           HE1      HIS  16 -52.347  -2.643   6.399
  102    H    MET  17           H        MET  17 -47.555   3.035   5.075
  103    HA   MET  17           HA       MET  17 -46.196   0.499   4.976
  104   1HB   MET  17          1HB       MET  17 -45.406   3.421   5.304
  105   2HB   MET  17          2HB       MET  17 -44.250   2.177   5.738
  106   1HG   MET  17          1HG       MET  17 -45.638   1.999   3.053
  107   2HG   MET  17          2HG       MET  17 -44.331   3.149   3.252
  108   1HE   MET  17          1HE       MET  17 -43.578   1.881   1.287
  109   2HE   MET  17          2HE       MET  17 -42.368   0.582   1.418
  110   3HE   MET  17          3HE       MET  17 -44.093   0.177   1.252
  111    HA   PRO  18           HA       PRO  18 -46.847   0.122   9.315
  112   1HB   PRO  18          1HB       PRO  18 -46.042  -2.479   9.543
  113   2HB   PRO  18          2HB       PRO  18 -47.680  -2.016   9.124
  114   1HG   PRO  18          1HG       PRO  18 -45.553  -3.094   7.376
  115   2HG   PRO  18          2HG       PRO  18 -47.281  -3.027   7.089
  116   1HD   PRO  18          1HD       PRO  18 -45.285  -1.310   5.950
  117   2HD   PRO  18          2HD       PRO  18 -47.021  -1.172   5.756
  118    H    TYR  19           H        TYR  19 -45.567  -0.557  11.303
  119    HA   TYR  19           HA       TYR  19 -43.366   0.936  11.544
  120   1HB   TYR  19          1HB       TYR  19 -42.775  -0.753  13.358
  121   2HB   TYR  19          2HB       TYR  19 -44.486  -0.375  13.354
  122    HD1  TYR  19           HD1      TYR  19 -41.974  -2.964  12.794
  123    HD2  TYR  19           HD2      TYR  19 -46.134  -2.017  12.477
  124    HE1  TYR  19           HE1      TYR  19 -42.527  -5.435  12.571
  125    HE2  TYR  19           HE2      TYR  19 -46.673  -4.492  12.255
  126    HH   TYR  19           HH       TYR  19 -45.425  -6.538  11.443
  127    H    GLY  20           H        GLY  20 -41.447   1.082  10.504
  128   1HA   GLY  20          1HA       GLY  20 -39.928  -1.321   9.955
  129   2HA   GLY  20          2HA       GLY  20 -40.494  -0.474   8.529
  130    H    TYR  21           H        TYR  21 -39.367   1.304   7.787
  131    HA   TYR  21           HA       TYR  21 -36.842   1.850   8.531
  132   1HB   TYR  21          1HB       TYR  21 -39.116   3.115   7.111
  133   2HB   TYR  21          2HB       TYR  21 -38.084   4.342   7.819
  134    HD1  TYR  21           HD1      TYR  21 -37.676   1.144   5.881
  135    HD2  TYR  21           HD2      TYR  21 -36.414   5.190   6.461
  136    HE1  TYR  21           HE1      TYR  21 -36.068   0.930   3.924
  137    HE2  TYR  21           HE2      TYR  21 -34.810   4.963   4.501
  138    HH   TYR  21           HH       TYR  21 -34.114   3.709   2.885
  139    H    ALA  22           H        ALA  22 -39.822   2.979  10.123
  140    HA   ALA  22           HA       ALA  22 -38.622   5.058  11.597
  141   1HB   ALA  22          1HB       ALA  22 -40.793   5.403  12.051
  142   2HB   ALA  22          2HB       ALA  22 -41.195   3.876  11.229
  143   3HB   ALA  22          3HB       ALA  22 -40.858   3.885  12.977
  144    H    ALA  23           H        ALA  23 -39.294   1.567  12.280
  145    HA   ALA  23           HA       ALA  23 -38.113   1.746  14.881
  146   1HB   ALA  23          1HB       ALA  23 -38.472  -0.722  14.850
  147   2HB   ALA  23          2HB       ALA  23 -39.938   0.186  14.412
  148   3HB   ALA  23          3HB       ALA  23 -38.970  -0.606  13.146
  149    H    GLN  24           H        GLN  24 -36.855   1.853  11.762
  150    HA   GLN  24           HA       GLN  24 -34.576   0.203  12.359
  151   1HB   GLN  24          1HB       GLN  24 -35.335   1.864   9.919
  152   2HB   GLN  24          2HB       GLN  24 -33.850   0.941  10.032
  153   1HG   GLN  24          1HG       GLN  24 -36.429  -0.490  10.653
  154   2HG   GLN  24          2HG       GLN  24 -36.104  -0.100   8.976
  155   1HE2  GLN  24          1HE2      GLN  24 -35.574  -2.244  11.493
  156   2HE2  GLN  24          2HE2      GLN  24 -34.294  -3.200  10.823
  157    H    ALA  25           H        ALA  25 -35.574   3.237  13.267
  158    HA   ALA  25           HA       ALA  25 -33.392   4.874  12.681
  159   1HB   ALA  25          1HB       ALA  25 -34.333   6.338  14.319
  160   2HB   ALA  25          2HB       ALA  25 -35.708   5.491  13.570
  161   3HB   ALA  25          3HB       ALA  25 -35.121   4.991  15.175
  162    H    ARG  26           H        ARG  26 -33.751   2.131  14.808
  163    HA   ARG  26           HA       ARG  26 -31.799   2.917  16.662
  164   1HB   ARG  26          1HB       ARG  26 -33.649   0.813  16.403
  165   2HB   ARG  26          2HB       ARG  26 -32.103  -0.001  16.279
  166   1HG   ARG  26          1HG       ARG  26 -32.010   0.071  18.548
  167   2HG   ARG  26          2HG       ARG  26 -31.691   1.787  18.394
  168   1HD   ARG  26          1HD       ARG  26 -34.450   1.729  18.125
  169   2HD   ARG  26          2HD       ARG  26 -34.188   0.396  19.232
  170    HE   ARG  26           HE       ARG  26 -33.539   1.921  20.889
  171   1HH1  ARG  26          2HH2      ARG  26 -33.456   3.545  17.740
  172   2HH1  ARG  26          1HH2      ARG  26 -33.172   5.113  18.417
  173   1HH2  ARG  26          1HH       ARG  26 -33.004   5.352  20.796
  174    H    ALA  27           H        ALA  27 -31.798   1.314  13.487
  175    HA   ALA  27           HA       ALA  27 -29.198   0.208  13.694
  176   1HB   ALA  27          1HB       ALA  27 -29.914   0.737  10.975
  177   2HB   ALA  27          2HB       ALA  27 -29.981  -0.810  11.853
  178   3HB   ALA  27          3HB       ALA  27 -31.396   0.271  11.845
  179    H    ARG  28           H        ARG  28 -30.555   3.383  12.847
  180    HA   ARG  28           HA       ARG  28 -28.379   4.347  11.460
  181   1HB   ARG  28          1HB       ARG  28 -30.846   5.321  12.074
  182   2HB   ARG  28          2HB       ARG  28 -29.912   6.222  13.251
  183   1HG   ARG  28          1HG       ARG  28 -28.459   7.130  11.478
  184   2HG   ARG  28          2HG       ARG  28 -29.242   6.128  10.273
  185   1HD   ARG  28          1HD       ARG  28 -31.433   7.415  11.334
  186   2HD   ARG  28          2HD       ARG  28 -30.208   8.646  11.565
  187    HE   ARG  28           HE       ARG  28 -30.190   7.442   8.884
  188   1HH1  ARG  28          2HH2      ARG  28 -31.515  10.033  10.905
  189   2HH1  ARG  28          1HH2      ARG  28 -31.909  11.050   9.559
  190   1HH2  ARG  28          1HH       ARG  28 -31.428  10.295   7.336
  191    H    GLU  29           H        GLU  29 -29.019   3.917  14.930
  192    HA   GLU  29           HA       GLU  29 -26.872   5.624  15.704
  193   1HB   GLU  29          1HB       GLU  29 -29.145   4.492  16.959
  194   2HB   GLU  29          2HB       GLU  29 -27.774   3.765  17.773
  195   1HG   GLU  29          1HG       GLU  29 -26.877   5.898  18.418
  196   2HG   GLU  29          2HG       GLU  29 -27.881   6.763  17.271
  197    HE2  GLU  29           HE2      GLU  29 -30.644   5.883  18.263
  198    H    ARG  30           H        ARG  30 -27.342   2.255  14.825
  199    HA   ARG  30           HA       ARG  30 -24.899   1.477  16.114
  200   1HB   ARG  30          1HB       ARG  30 -27.202   0.103  14.797
  201   2HB   ARG  30          2HB       ARG  30 -25.657  -0.687  14.558
  202   1HG   ARG  30          1HG       ARG  30 -26.245   0.228  17.352
  203   2HG   ARG  30          2HG       ARG  30 -27.227  -1.095  16.755
  204   1HD   ARG  30          1HD       ARG  30 -25.492  -2.440  17.391
  205   2HD   ARG  30          2HD       ARG  30 -24.698  -1.885  15.932
  206    HE   ARG  30           HE       ARG  30 -24.051   0.105  17.706
  207   1HH1  ARG  30          2HH2      ARG  30 -23.831  -3.424  17.931
  208   2HH1  ARG  30          1HH2      ARG  30 -22.474  -3.395  19.008
  209   1HH2  ARG  30          1HH       ARG  30 -21.567  -1.286  19.696
  210    H    GLU  31           H        GLU  31 -26.166   2.426  12.944
  211    HA   GLU  31           HA       GLU  31 -24.134   1.287  11.406
  212   1HB   GLU  31          1HB       GLU  31 -26.486   2.859  10.986
  213   2HB   GLU  31          2HB       GLU  31 -25.172   3.711  10.200
  214   1HG   GLU  31          1HG       GLU  31 -24.635   1.847   8.800
  215   2HG   GLU  31          2HG       GLU  31 -25.514   0.717   9.812
  216    HE2  GLU  31           HE2      GLU  31 -28.579   1.472   8.840
  217    H    ARG  32           H        ARG  32 -24.227   4.015  13.561
  218    HA   ARG  32           HA       ARG  32 -22.439   5.694  12.335
  219   1HB   ARG  32          1HB       ARG  32 -23.870   5.957  14.534
  220   2HB   ARG  32          2HB       ARG  32 -22.484   5.260  15.348
  221   1HG   ARG  32          1HG       ARG  32 -21.068   7.080  14.138
  222   2HG   ARG  32          2HG       ARG  32 -22.594   7.848  13.748
  223   1HD   ARG  32          1HD       ARG  32 -22.575   8.822  15.800
  224   2HD   ARG  32          2HD       ARG  32 -22.773   7.235  16.518
  225    HE   ARG  32           HE       ARG  32 -20.479   7.194  17.052
  226   1HH1  ARG  32          2HH2      ARG  32 -21.130   9.878  14.832
  227   2HH1  ARG  32          1HH2      ARG  32 -19.560  10.583  15.027
  228   1HH2  ARG  32          1HH       ARG  32 -17.976   9.535  16.489
  229    H    LEU  33           H        LEU  33 -21.992   2.645  14.099
  230    HA   LEU  33           HA       LEU  33 -19.131   3.061  14.318
  231   1HB   LEU  33          1HB       LEU  33 -21.058   1.655  15.776
  232   2HB   LEU  33          2HB       LEU  33 -20.106   0.414  14.986
  233    HG   LEU  33           HG       LEU  33 -18.858   2.651  16.596
  234   1HD1  LEU  33          1HD1      LEU  33 -18.829   0.096  17.942
  235   2HD1  LEU  33          2HD1      LEU  33 -19.394   1.683  18.519
  236   3HD1  LEU  33          3HD1      LEU  33 -20.500   0.618  17.618
  237   1HD2  LEU  33          1HD2      LEU  33 -17.034   1.835  15.582
  238   2HD2  LEU  33          2HD2      LEU  33 -17.190   0.490  16.738
  239   3HD2  LEU  33          3HD2      LEU  33 -17.852   0.331  15.093
  240    H    ALA  34           H        ALA  34 -21.422   1.961  12.014
  241    HA   ALA  34           HA       ALA  34 -19.695  -0.021  10.838
  242   1HB   ALA  34          1HB       ALA  34 -21.998   1.098   9.321
  243   2HB   ALA  34          2HB       ALA  34 -21.550  -0.595   9.640
  244   3HB   ALA  34          3HB       ALA  34 -22.392   0.353  10.889
  245    H    HIS  35           H        HIS  35 -19.360   3.213  11.143
  246    HA   HIS  35           HA       HIS  35 -18.770   3.757   8.361
  247   1HB   HIS  35          1HB       HIS  35 -19.795   5.297  10.375
  248   2HB   HIS  35          2HB       HIS  35 -18.109   5.773  10.419
  249    HD1  HIS  35           HD1      HIS  35 -21.078   6.949   9.026
  250    HD2  HIS  35           HD2      HIS  35 -17.295   6.188   7.382
  251    HE1  HIS  35           HE1      HIS  35 -20.937   8.332   6.887
  252    H    SER  36           H        SER  36 -17.255   2.395  11.102
  253    HA   SER  36           HA       SER  36 -14.656   3.413  10.406
  254   1HB   SER  36          1HB       SER  36 -15.791   2.635  12.795
  255   2HB   SER  36          2HB       SER  36 -14.878   1.198  12.383
  256    HG   SER  36           HG       SER  36 -13.566   2.649  13.607
  257    H    ARG  37           H        ARG  37 -16.771   0.743   9.681
  258    HA   ARG  37           HA       ARG  37 -14.591  -0.991   8.996
  259   1HB   ARG  37          1HB       ARG  37 -17.161  -1.470   9.875
  260   2HB   ARG  37          2HB       ARG  37 -17.378  -1.688   8.150
  261   1HG   ARG  37          1HG       ARG  37 -16.731  -3.845   8.736
  262   2HG   ARG  37          2HG       ARG  37 -15.162  -3.161   8.359
  263   1HD   ARG  37          1HD       ARG  37 -14.827  -2.621  10.792
  264   2HD   ARG  37          2HD       ARG  37 -16.383  -3.339  11.158
  265    HE   ARG  37           HE       ARG  37 -15.445  -5.476  10.905
  266   1HH1  ARG  37          2HH2      ARG  37 -13.232  -3.070   9.538
  267   2HH1  ARG  37          1HH2      ARG  37 -11.943  -4.203   9.309
  268   1HH2  ARG  37          1HH       ARG  37 -12.267  -6.492   9.941
  269    H    ALA  38           H        ALA  38 -15.511   1.729   7.619
  270    HA   ALA  38           HA       ALA  38 -16.079   0.766   4.944
  271   1HB   ALA  38          1HB       ALA  38 -16.395   3.124   4.434
  272   2HB   ALA  38          2HB       ALA  38 -17.246   2.743   5.950
  273   3HB   ALA  38          3HB       ALA  38 -15.684   3.595   5.997
  274    H    ALA  39           H        ALA  39 -13.618   2.929   6.532
  275    HA   ALA  39           HA       ALA  39 -11.831   2.420   4.302
  276   1HB   ALA  39          1HB       ALA  39 -12.158   4.719   5.158
  277   2HB   ALA  39          2HB       ALA  39 -11.570   4.204   6.757
  278   3HB   ALA  39          3HB       ALA  39 -10.472   4.184   5.356
  279    H    ALA  40           H        ALA  40  -9.341   2.342   5.300
  280    HA   ALA  40           HA       ALA  40  -9.109  -0.270   6.257
  281   1HB   ALA  40          1HB       ALA  40  -7.189   0.342   5.189
  282   2HB   ALA  40          2HB       ALA  40  -7.344   2.050   5.667
  283   3HB   ALA  40          3HB       ALA  40  -6.691   0.858   6.818
  284    H    ALA  41           H        ALA  41  -8.558   2.916   7.923
  285    HA   ALA  41           HA       ALA  41  -8.598   3.477  10.062
  286   1HB   ALA  41          1HB       ALA  41 -10.945   2.740   9.879
  287   2HB   ALA  41          2HB       ALA  41 -10.463   1.080  10.305
  288   3HB   ALA  41          3HB       ALA  41 -10.292   2.391  11.498
  289    H    ALA  42           H        ALA  42  -6.245   2.518   9.617
  290    HA   ALA  42           HA       ALA  42  -5.811   0.430  11.643
  291   1HB   ALA  42          1HB       ALA  42  -4.845   0.786   8.874
  292   2HB   ALA  42          2HB       ALA  42  -3.556   0.437  10.053
  293   3HB   ALA  42          3HB       ALA  42  -4.928  -0.683   9.877
  294    H    ALA  43           H        ALA  43  -3.970   3.047   9.906
  295    HA   ALA  43           HA       ALA  43  -2.124   3.521  11.853
  296   1HB   ALA  43          1HB       ALA  43  -2.274   5.951  10.844
  297   2HB   ALA  43          2HB       ALA  43  -1.760   4.593   9.814
  298   3HB   ALA  43          3HB       ALA  43  -3.430   5.201   9.717
  299    H    VAL  44           H        VAL  44  -5.567   4.203  11.868
  300    HA   VAL  44           HA       VAL  44  -5.259   6.043  14.108
  301    HB   VAL  44           HB       VAL  44  -7.231   5.520  12.016
  302   1HG1  VAL  44          1HG1      VAL  44  -9.196   6.172  13.404
  303   2HG1  VAL  44          2HG1      VAL  44  -8.549   4.564  13.808
  304   3HG1  VAL  44          3HG1      VAL  44  -8.198   5.955  14.861
  305   1HG2  VAL  44          1HG2      VAL  44  -5.892   7.634  12.447
  306   2HG2  VAL  44          2HG2      VAL  44  -7.642   7.856  12.207
  307   3HG2  VAL  44          3HG2      VAL  44  -6.954   7.918  13.847
  308    H    ALA  45           H        ALA  45  -6.215   2.729  13.255
  309    HA   ALA  45           HA       ALA  45  -7.733   1.968  15.358
  310   1HB   ALA  45          1HB       ALA  45  -6.892   0.621  13.357
  311   2HB   ALA  45          2HB       ALA  45  -5.403   0.337  14.291
  312   3HB   ALA  45          3HB       ALA  45  -6.965  -0.252  14.907
  313    H    ALA  46           H        ALA  46  -4.098   2.010  15.276
  314    HA   ALA  46           HA       ALA  46  -3.784   1.261  17.943
  315   1HB   ALA  46          1HB       ALA  46  -1.514   1.714  17.577
  316   2HB   ALA  46          2HB       ALA  46  -2.114   1.390  15.933
  317   3HB   ALA  46          3HB       ALA  46  -1.859   3.067  16.473
  318    H    ALA  47           H        ALA  47  -3.653   4.551  16.396
  319    HA   ALA  47           HA       ALA  47  -3.409   5.929  18.813
  320   1HB   ALA  47          1HB       ALA  47  -4.720   7.608  16.974
  321   2HB   ALA  47          2HB       ALA  47  -2.964   7.462  17.227
  322   3HB   ALA  47          3HB       ALA  47  -3.767   6.484  15.975
  323    H    THR  48           H        THR  48  -5.448   7.865  18.833
  324    HA   THR  48           HA       THR  48  -7.497   8.258  19.603
  325    HB   THR  48           HB       THR  48  -8.244   5.555  18.370
  326    HG1  THR  48           HG1      THR  48  -7.987   8.310  17.388
  327   1HG2  THR  48          1HG2      THR  48  -9.845   8.150  18.617
  328   2HG2  THR  48          2HG2      THR  48 -10.437   6.569  18.052
  329   3HG2  THR  48          3HG2      THR  48 -10.011   6.800  19.765
  330    H    ALA  49           H        ALA  49  -7.413   4.655  19.976
  331    HA   ALA  49           HA       ALA  49  -8.569   4.526  22.410
  332   1HB   ALA  49          1HB       ALA  49  -8.049   2.347  22.163
  333   2HB   ALA  49          2HB       ALA  49  -7.186   2.812  20.678
  334   3HB   ALA  49          3HB       ALA  49  -6.303   2.688  22.218
  335    H    ALA  50           H        ALA  50  -7.585   4.073  24.609
  336    HA   ALA  50           HA       ALA  50  -5.687   6.177  25.170
  337   1HB   ALA  50          1HB       ALA  50  -6.623   6.155  27.242
  338   2HB   ALA  50          2HB       ALA  50  -7.906   5.206  26.455
  339   3HB   ALA  50          3HB       ALA  50  -6.603   4.378  27.342
  340    H    VAL  51           H        VAL  51  -4.380   4.416  23.560
  341    HA   VAL  51           HA       VAL  51  -2.660   3.007  25.476
  342    HB   VAL  51           HB       VAL  51  -4.244   1.562  24.070
  343   1HG1  VAL  51          1HG1      VAL  51  -4.087   1.471  21.826
  344   2HG1  VAL  51          2HG1      VAL  51  -3.288   3.054  21.972
  345   3HG1  VAL  51          3HG1      VAL  51  -2.310   1.572  21.848
  346   1HG2  VAL  51          1HG2      VAL  51  -1.255   1.193  24.261
  347   2HG2  VAL  51          2HG2      VAL  51  -2.547   0.437  25.224
  348   3HG2  VAL  51          3HG2      VAL  51  -2.294  -0.055  23.532
  349    H    GLU  52           H        GLU  52  -2.070   5.583  25.000
  350    HA   GLU  52           HA       GLU  52   0.153   5.324  23.150
  351   1HB   GLU  52          1HB       GLU  52  -1.942   6.655  22.245
  352   2HB   GLU  52          2HB       GLU  52  -1.381   7.930  23.309
  353   1HG   GLU  52          1HG       GLU  52   0.294   8.493  21.881
  354   2HG   GLU  52          2HG       GLU  52   0.872   6.840  21.808
  355    HE2  GLU  52           HE2      GLU  52  -1.067   9.080  19.796
  356    H    GLY  53           H        GLY  53   1.705   7.361  23.505
  357   1HA   GLY  53          1HA       GLY  53   1.645   8.303  26.271
  358   2HA   GLY  53          2HA       GLY  53   2.988   7.279  25.806
  359    H    THR  54           H        THR  54   1.151  10.171  24.584
  360    HA   THR  54           HA       THR  54   3.352  11.100  23.040
  361    HB   THR  54           HB       THR  54   0.714  12.319  23.997
  362    HG1  THR  54           HG1      THR  54   0.914  10.452  22.410
  363   1HG2  THR  54          1HG2      THR  54   1.089  13.954  22.112
  364   2HG2  THR  54          2HG2      THR  54   2.256  14.180  23.437
  365   3HG2  THR  54          3HG2      THR  54   2.751  13.340  21.948
  366    H    GLY  55           H        GLY  55   4.489  13.168  23.353
  367   1HA   GLY  55          1HA       GLY  55   5.124  14.906  24.872
  368   2HA   GLY  55          2HA       GLY  55   4.843  13.814  26.214
  369    H    GLY  56           H        GLY  56   6.266  11.828  26.380
  370   1HA   GLY  56          1HA       GLY  56   8.988  12.517  25.477
  371   2HA   GLY  56          2HA       GLY  56   8.572  11.574  26.895
  372    H    SER  57           H        SER  57   7.809  11.502  23.332
  373    HA   SER  57           HA       SER  57   8.351   8.639  23.475
  374   1HB   SER  57          1HB       SER  57   6.866   8.530  21.390
  375   2HB   SER  57          2HB       SER  57   6.052   8.899  22.897
  376    HG   SER  57           HG       SER  57   6.030  10.342  20.636
  377    H    GLY  58           H        GLY  58  10.534   8.559  22.879
  378   1HA   GLY  58          1HA       GLY  58  11.399   8.482  20.359
  379   2HA   GLY  58          2HA       GLY  58  11.483  10.204  20.677
  380    H    GLY  59           H        GLY  59  13.256  11.027  21.746
  381   1HA   GLY  59          1HA       GLY  59  14.722  10.553  23.729
  382   2HA   GLY  59          2HA       GLY  59  15.103   9.043  22.926
  383    H    GLY  60           H        GLY  60  16.831   8.996  21.538
  384   1HA   GLY  60          1HA       GLY  60  18.368   9.721  20.041
  385   2HA   GLY  60          2HA       GLY  60  17.521  11.249  19.907
  386    HA   PRO  61           HA       PRO  61  20.687  11.452  23.466
  387   1HB   PRO  61          1HB       PRO  61  22.802   9.726  23.325
  388   2HB   PRO  61          2HB       PRO  61  21.400   9.444  24.339
  389   1HG   PRO  61          1HG       PRO  61  22.125   8.156  21.778
  390   2HG   PRO  61          2HG       PRO  61  20.991   7.612  22.999
  391   1HD   PRO  61          1HD       PRO  61  20.351   8.839  20.487
  392   2HD   PRO  61          2HD       PRO  61  19.225   8.401  21.756
  393    H    HIS  62           H        HIS  62  22.677  12.665  23.666
  394    HA   HIS  62           HA       HIS  62  23.359  13.640  21.022
  395   1HB   HIS  62          1HB       HIS  62  23.992  15.611  22.026
  396   2HB   HIS  62          2HB       HIS  62  22.697  15.078  23.078
  397    HD1  HIS  62           HD1      HIS  62  25.692  16.715  23.483
  398    HD2  HIS  62           HD2      HIS  62  24.223  13.173  25.183
  399    HE1  HIS  62           HE1      HIS  62  27.010  16.356  25.638
  400    H    HIS  63           H        HIS  63  25.684  14.048  20.479
  401    HA   HIS  63           HA       HIS  63  27.165  11.835  20.421
  402   1HB   HIS  63          1HB       HIS  63  27.886  13.587  19.085
  403   2HB   HIS  63          2HB       HIS  63  27.888  14.744  20.401
  404    HD1  HIS  63           HD1      HIS  63  29.846  11.593  19.405
  405    HD2  HIS  63           HD2      HIS  63  30.388  15.260  21.370
  406    HE1  HIS  63           HE1      HIS  63  32.329  11.739  19.974
  407    H    HIS  64           H        HIS  64  27.876  10.463  21.968
  408    HA   HIS  64           HA       HIS  64  28.432  11.595  24.592
  409   1HB   HIS  64          1HB       HIS  64  28.565   9.010  25.093
  410   2HB   HIS  64          2HB       HIS  64  27.029   9.847  24.981
  411    HD1  HIS  64           HD1      HIS  64  25.920   9.731  22.405
  412    HD2  HIS  64           HD2      HIS  64  28.709   6.795  23.500
  413    HE1  HIS  64           HE1      HIS  64  25.582   7.786  20.788
  414    H    HIS  65           H        HIS  65  29.854   9.093  22.360
  415    HA   HIS  65           HA       HIS  65  32.268  10.101  21.963
  416   1HB   HIS  65          1HB       HIS  65  33.638   8.925  23.846
  417   2HB   HIS  65          2HB       HIS  65  32.965  10.522  24.106
  418    HD1  HIS  65           HD1      HIS  65  30.669   7.545  24.291
  419    HD2  HIS  65           HD2      HIS  65  32.798  10.050  26.896
  420    HE1  HIS  65           HE1      HIS  65  29.779   7.062  26.633
  421    H    GLN  66           H        GLN  66  33.669   8.581  20.929
  422    HA   GLN  66           HA       GLN  66  32.311   6.085  20.428
  423   1HB   GLN  66          1HB       GLN  66  33.282   7.713  18.627
  424   2HB   GLN  66          2HB       GLN  66  34.843   7.041  19.053
  425   1HG   GLN  66          1HG       GLN  66  34.385   4.994  18.091
  426   2HG   GLN  66          2HG       GLN  66  32.705   5.014  18.589
  427   1HE2  GLN  66          1HE2      GLN  66  31.383   4.982  16.953
  428   2HE2  GLN  66          2HE2      GLN  66  31.553   5.806  15.439
  429    H    THR  67           H        THR  67  34.073   4.183  19.918
  430    HA   THR  67           HA       THR  67  35.097   3.455  22.419
  431    HB   THR  67           HB       THR  67  36.054   2.318  19.766
  432    HG1  THR  67           HG1      THR  67  33.455   2.161  21.127
  433   1HG2  THR  67          1HG2      THR  67  35.436   0.169  21.006
  434   2HG2  THR  67          2HG2      THR  67  36.773   1.077  21.751
  435   3HG2  THR  67          3HG2      THR  67  35.139   1.166  22.451
  436    H    ARG  68           H        ARG  68  37.483   2.711  22.690
  437    HA   ARG  68           HA       ARG  68  38.968   5.035  22.774
  438   1HB   ARG  68          1HB       ARG  68  40.834   3.556  23.505
  439   2HB   ARG  68          2HB       ARG  68  39.337   3.114  24.301
  440   1HG   ARG  68          1HG       ARG  68  39.004   1.374  22.418
  441   2HG   ARG  68          2HG       ARG  68  40.657   1.707  21.941
  442   1HD   ARG  68          1HD       ARG  68  39.882   0.869  24.774
  443   2HD   ARG  68          2HD       ARG  68  40.356  -0.277  23.535
  444    HE   ARG  68           HE       ARG  68  42.388   1.667  23.566
  445   1HH1  ARG  68          2HH2      ARG  68  41.016  -0.640  25.879
  446   2HH1  ARG  68          1HH2      ARG  68  42.493  -0.819  26.766
  447   1HH2  ARG  68          1HH       ARG  68  44.432   0.409  26.077
  448    H    GLY  69           H        GLY  69  40.907   5.674  21.584
  449   1HA   GLY  69          1HA       GLY  69  42.208   4.365  19.592
  450   2HA   GLY  69          2HA       GLY  69  40.785   4.998  18.788
  451    H    ALA  70           H        ALA  70  43.980   5.679  19.709
  452    HA   ALA  70           HA       ALA  70  43.512   8.536  19.231
  453   1HB   ALA  70          1HB       ALA  70  45.772   7.760  21.012
  454   2HB   ALA  70          2HB       ALA  70  44.683   9.166  21.090
  455   3HB   ALA  70          3HB       ALA  70  44.137   7.584  21.695
  456    H    TYR  71           H        TYR  71  45.416   9.638  18.270
  457    HA   TYR  71           HA       TYR  71  47.446   7.876  17.178
  458   1HB   TYR  71          1HB       TYR  71  45.196   8.152  15.726
  459   2HB   TYR  71          2HB       TYR  71  45.810   9.761  15.403
  460    HD1  TYR  71           HD1      TYR  71  47.436  10.126  13.724
  461    HD2  TYR  71           HD2      TYR  71  46.652   6.143  15.074
  462    HE1  TYR  71           HE1      TYR  71  48.854   9.197  11.829
  463    HE2  TYR  71           HE2      TYR  71  48.072   5.227  13.175
  464    HH   TYR  71           HH       TYR  71  49.861   5.951  11.758
  465    H    SER  72           H        SER  72  49.224   8.944  17.938
  466    HA   SER  72           HA       SER  72  49.714  11.522  16.887
  467   1HB   SER  72          1HB       SER  72  50.150  12.568  19.177
  468   2HB   SER  72          2HB       SER  72  48.465  12.363  18.744
  469    HG   SER  72           HG       SER  72  48.897  11.656  20.929
  470    H    SER  73           H        SER  73  51.962  11.872  16.745
  471    HA   SER  73           HA       SER  73  53.617   9.746  16.912
  472   1HB   SER  73          1HB       SER  73  55.486  11.525  16.979
  473   2HB   SER  73          2HB       SER  73  54.350  11.612  15.648
  474    HG   SER  73           HG       SER  73  54.521  13.705  16.442
  475    H    HIS  74           H        HIS  74  53.963   8.503  18.731
  476    HA   HIS  74           HA       HIS  74  55.336   9.658  20.912
  477   1HB   HIS  74          1HB       HIS  74  52.822  10.237  21.267
  478   2HB   HIS  74          2HB       HIS  74  52.645   8.543  21.680
  479    HD1  HIS  74           HD1      HIS  74  52.174   8.911  24.174
  480    HD2  HIS  74           HD2      HIS  74  55.787  10.612  22.891
  481    HE1  HIS  74           HE1      HIS  74  53.419   9.620  26.285
  482    H    ASP  75           H        ASP  75  56.799   8.015  20.074
  483    HA   ASP  75           HA       ASP  75  56.122   5.386  19.765
  484   1HB   ASP  75          1HB       ASP  75  58.488   4.938  19.814
  485   2HB   ASP  75          2HB       ASP  75  58.299   6.538  19.124
  486    HD2  ASP  75           HD2      ASP  75  59.640   8.219  21.759
  Start of MODEL   14
    1    H    MET   1           H        MET   1 -30.600 -22.624 -26.431
    2    HA   MET   1           HA       MET   1 -31.498 -19.945 -26.511
    3   1HB   MET   1          1HB       MET   1 -32.368 -22.418 -25.448
    4   2HB   MET   1          2HB       MET   1 -32.015 -21.468 -24.018
    5   1HG   MET   1          1HG       MET   1 -33.570 -19.738 -24.646
    6   2HG   MET   1          2HG       MET   1 -33.684 -20.323 -26.294
    7   1HE   MET   1          1HE       MET   1 -37.218 -21.263 -25.370
    8   2HE   MET   1          2HE       MET   1 -36.190 -19.834 -25.634
    9   3HE   MET   1          3HE       MET   1 -36.146 -21.188 -26.789
   10    H    GLU   2           H        GLU   2 -29.586 -18.644 -26.196
   11    HA   GLU   2           HA       GLU   2 -29.040 -18.233 -23.441
   12   1HB   GLU   2          1HB       GLU   2 -27.388 -20.092 -24.610
   13   2HB   GLU   2          2HB       GLU   2 -26.493 -18.622 -24.939
   14   1HG   GLU   2          1HG       GLU   2 -25.934 -18.320 -22.740
   15   2HG   GLU   2          2HG       GLU   2 -27.544 -18.718 -22.176
   16    HE2  GLU   2           HE2      GLU   2 -24.542 -19.720 -22.061
   17    H    VAL   3           H        VAL   3 -29.392 -16.050 -23.417
   18    HA   VAL   3           HA       VAL   3 -28.041 -14.491 -25.510
   19    HB   VAL   3           HB       VAL   3 -30.703 -13.899 -24.204
   20   1HG1  VAL   3          1HG1      VAL   3 -29.516 -11.877 -24.853
   21   2HG1  VAL   3          2HG1      VAL   3 -29.221 -12.538 -26.479
   22   3HG1  VAL   3          3HG1      VAL   3 -30.881 -12.158 -25.960
   23   1HG2  VAL   3          1HG2      VAL   3 -31.814 -14.692 -26.093
   24   2HG2  VAL   3          2HG2      VAL   3 -30.349 -14.643 -27.103
   25   3HG2  VAL   3          3HG2      VAL   3 -30.530 -15.903 -25.859
   26    H    ALA   4           H        ALA   4 -27.458 -12.252 -24.804
   27    HA   ALA   4           HA       ALA   4 -25.884 -12.195 -22.627
   28   1HB   ALA   4          1HB       ALA   4 -27.210  -9.620 -22.993
   29   2HB   ALA   4          2HB       ALA   4 -25.535 -10.096 -23.362
   30   3HB   ALA   4          3HB       ALA   4 -26.825 -10.383 -24.554
   31    H    MET   5           H        MET   5 -26.217 -12.521 -20.490
   32    HA   MET   5           HA       MET   5 -28.896 -12.315 -19.502
   33   1HB   MET   5          1HB       MET   5 -26.207 -13.275 -18.443
   34   2HB   MET   5          2HB       MET   5 -27.521 -13.018 -17.313
   35   1HG   MET   5          1HG       MET   5 -28.876 -14.472 -19.159
   36   2HG   MET   5          2HG       MET   5 -27.266 -15.077 -19.495
   37   1HE   MET   5          1HE       MET   5 -29.170 -17.356 -18.438
   38   2HE   MET   5          2HE       MET   5 -29.795 -17.100 -16.791
   39   3HE   MET   5          3HE       MET   5 -30.197 -15.946 -18.085
   40    H    VAL   6           H        VAL   6 -29.734 -10.457 -18.666
   41    HA   VAL   6           HA       VAL   6 -27.825  -8.466 -17.679
   42    HB   VAL   6           HB       VAL   6 -29.526  -8.072 -19.599
   43   1HG1  VAL   6          1HG1      VAL   6 -31.424  -9.011 -18.127
   44   2HG1  VAL   6          2HG1      VAL   6 -31.388  -7.431 -17.308
   45   3HG1  VAL   6          3HG1      VAL   6 -31.742  -7.522 -19.050
   46   1HG2  VAL   6          1HG2      VAL   6 -29.937  -5.842 -17.762
   47   2HG2  VAL   6          2HG2      VAL   6 -28.252  -6.417 -17.754
   48   3HG2  VAL   6          3HG2      VAL   6 -29.014  -5.916 -19.282
   49    H    SER   7           H        SER   7 -29.553  -6.945 -16.078
   50    HA   SER   7           HA       SER   7 -30.640  -8.823 -14.173
   51   1HB   SER   7          1HB       SER   7 -28.148  -7.292 -13.797
   52   2HB   SER   7          2HB       SER   7 -29.314  -6.987 -12.525
   53    HG   SER   7           HG       SER   7 -27.782  -9.241 -12.996
   54    H    ALA   8           H        ALA   8 -32.494  -8.001 -13.178
   55    HA   ALA   8           HA       ALA   8 -33.380  -5.421 -14.114
   56   1HB   ALA   8          1HB       ALA   8 -35.431  -6.321 -13.830
   57   2HB   ALA   8          2HB       ALA   8 -34.587  -7.861 -13.537
   58   3HB   ALA   8          3HB       ALA   8 -35.064  -6.832 -12.165
   59    H    GLU   9           H        GLU   9 -32.500  -3.672 -13.089
   60    HA   GLU   9           HA       GLU   9 -33.087  -3.371 -10.341
   61   1HB   GLU   9          1HB       GLU   9 -30.826  -4.720 -10.526
   62   2HB   GLU   9          2HB       GLU   9 -30.132  -3.174 -10.971
   63   1HG   GLU   9          1HG       GLU   9 -31.296  -2.233  -8.836
   64   2HG   GLU   9          2HG       GLU   9 -31.540  -3.905  -8.373
   65    HE2  GLU   9           HE2      GLU   9 -28.298  -4.256  -7.300
   66    H    SER  10           H        SER  10 -32.716  -1.125  -9.612
   67    HA   SER  10           HA       SER  10 -32.736   1.027  -9.889
   68   1HB   SER  10          1HB       SER  10 -30.544   0.143 -11.631
   69   2HB   SER  10          2HB       SER  10 -31.253   1.639 -12.208
   70    HG   SER  10           HG       SER  10 -29.440   1.643 -10.465
   71    H    SER  11           H        SER  11 -33.411   2.887 -11.481
   72    HA   SER  11           HA       SER  11 -34.854   3.709 -12.877
   73   1HB   SER  11          1HB       SER  11 -34.107   1.200 -14.399
   74   2HB   SER  11          2HB       SER  11 -35.360   2.255 -15.023
   75    HG   SER  11           HG       SER  11 -33.439   3.941 -14.418
   76    H    GLY  12           H        GLY  12 -36.711   3.760 -11.562
   77   1HA   GLY  12          1HA       GLY  12 -39.062   2.888 -12.103
   78   2HA   GLY  12          2HA       GLY  12 -38.413   1.356 -11.552
   79    H    CYS  13           H        CYS  13 -38.093   0.959  -9.332
   80    HA   CYS  13           HA       CYS  13 -37.952   2.953  -7.408
   81   1HB   CYS  13          1HB       CYS  13 -40.488   2.997  -8.309
   82   2HB   CYS  13          2HB       CYS  13 -40.653   1.719  -7.121
   83    HG   CYS  13           HG       CYS  13 -39.032   4.534  -6.525
   84    H    ASN  14           H        ASN  14 -36.243   1.155  -7.286
   85    HA   ASN  14           HA       ASN  14 -37.319  -1.257  -6.095
   86   1HB   ASN  14          1HB       ASN  14 -34.995  -0.600  -7.751
   87   2HB   ASN  14          2HB       ASN  14 -34.466  -1.402  -6.286
   88   1HD2  ASN  14          1HD2      ASN  14 -34.569  -3.521  -6.171
   89   2HD2  ASN  14          2HD2      ASN  14 -35.440  -4.578  -7.232
   90    H    SER  15           H        SER  15 -37.111   1.502  -4.784
   91    HA   SER  15           HA       SER  15 -35.694   0.584  -2.449
   92   1HB   SER  15          1HB       SER  15 -34.635   2.603  -4.223
   93   2HB   SER  15          2HB       SER  15 -35.078   3.379  -2.715
   94    HG   SER  15           HG       SER  15 -33.552   0.931  -2.748
   95    H    HIS  16           H        HIS  16 -37.855   0.374  -1.562
   96    HA   HIS  16           HA       HIS  16 -38.798   2.790  -0.414
   97   1HB   HIS  16          1HB       HIS  16 -39.804   2.967  -2.666
   98   2HB   HIS  16          2HB       HIS  16 -40.589   1.416  -2.438
   99    HD1  HIS  16           HD1      HIS  16 -42.991   1.699  -1.861
  100    HD2  HIS  16           HD2      HIS  16 -40.624   4.755  -0.231
  101    HE1  HIS  16           HE1      HIS  16 -44.583   3.233  -0.588
  102    H    MET  17           H        MET  17 -37.788   0.904   1.050
  103    HA   MET  17           HA       MET  17 -38.987  -1.403   1.582
  104   1HB   MET  17          1HB       MET  17 -38.331  -0.910   4.040
  105   2HB   MET  17          2HB       MET  17 -37.051  -0.703   2.861
  106   1HG   MET  17          1HG       MET  17 -37.524   1.758   2.782
  107   2HG   MET  17          2HG       MET  17 -38.800   1.550   3.964
  108   1HE   MET  17          1HE       MET  17 -35.675   3.406   4.598
  109   2HE   MET  17          2HE       MET  17 -34.468   2.104   4.468
  110   3HE   MET  17          3HE       MET  17 -35.605   2.400   3.131
  111    HA   PRO  18           HA       PRO  18 -42.970  -0.639   3.123
  112   1HB   PRO  18          1HB       PRO  18 -43.409  -2.832   4.693
  113   2HB   PRO  18          2HB       PRO  18 -43.557  -2.858   2.947
  114   1HG   PRO  18          1HG       PRO  18 -41.397  -3.955   4.640
  115   2HG   PRO  18          2HG       PRO  18 -41.781  -4.329   2.971
  116   1HD   PRO  18          1HD       PRO  18 -39.640  -2.666   3.908
  117   2HD   PRO  18          2HD       PRO  18 -40.096  -2.947   2.239
  118    H    TYR  19           H        TYR  19 -44.229  -1.259   5.520
  119    HA   TYR  19           HA       TYR  19 -43.379   0.948   7.041
  120   1HB   TYR  19          1HB       TYR  19 -44.983  -1.512   7.943
  121   2HB   TYR  19          2HB       TYR  19 -45.192   0.135   8.505
  122    HD1  TYR  19           HD1      TYR  19 -46.264  -2.342   6.144
  123    HD2  TYR  19           HD2      TYR  19 -46.072   1.879   6.820
  124    HE1  TYR  19           HE1      TYR  19 -48.086  -1.974   4.410
  125    HE2  TYR  19           HE2      TYR  19 -47.895   2.232   5.083
  126    HH   TYR  19           HH       TYR  19 -48.621   0.479   2.855
  127    H    GLY  20           H        GLY  20 -43.128   0.552   9.597
  128   1HA   GLY  20          1HA       GLY  20 -41.989  -0.425  11.313
  129   2HA   GLY  20          2HA       GLY  20 -41.511  -1.746  10.266
  130    H    TYR  21           H        TYR  21 -40.834   0.950   8.443
  131    HA   TYR  21           HA       TYR  21 -38.033   0.723   8.954
  132   1HB   TYR  21          1HB       TYR  21 -37.959   2.177   6.989
  133   2HB   TYR  21          2HB       TYR  21 -39.351   1.143   6.738
  134    HD1  TYR  21           HD1      TYR  21 -38.327   4.537   7.872
  135    HD2  TYR  21           HD2      TYR  21 -41.533   2.054   6.510
  136    HE1  TYR  21           HE1      TYR  21 -39.810   6.585   7.609
  137    HE2  TYR  21           HE2      TYR  21 -43.006   4.111   6.251
  138    HH   TYR  21           HH       TYR  21 -41.889   7.114   6.063
  139    H    ALA  22           H        ALA  22 -40.535   2.438  10.489
  140    HA   ALA  22           HA       ALA  22 -39.131   4.884  10.925
  141   1HB   ALA  22          1HB       ALA  22 -41.093   4.573  12.907
  142   2HB   ALA  22          2HB       ALA  22 -41.280   5.408  11.346
  143   3HB   ALA  22          3HB       ALA  22 -41.735   3.695  11.499
  144    H    ALA  23           H        ALA  23 -39.234   1.663  12.372
  145    HA   ALA  23           HA       ALA  23 -37.933   2.606  14.790
  146   1HB   ALA  23          1HB       ALA  23 -39.015  -0.050  13.807
  147   2HB   ALA  23          2HB       ALA  23 -38.031   0.077  15.284
  148   3HB   ALA  23          3HB       ALA  23 -39.582   0.944  15.170
  149    H    GLN  24           H        GLN  24 -36.814   2.607  11.851
  150    HA   GLN  24           HA       GLN  24 -34.630   0.779  12.130
  151   1HB   GLN  24          1HB       GLN  24 -35.919   1.606   9.948
  152   2HB   GLN  24          2HB       GLN  24 -34.755   2.915  10.000
  153   1HG   GLN  24          1HG       GLN  24 -33.842   1.133   8.607
  154   2HG   GLN  24          2HG       GLN  24 -32.889   1.226  10.075
  155   1HE2  GLN  24          1HE2      GLN  24 -35.411  -0.513   8.369
  156   2HE2  GLN  24          2HE2      GLN  24 -35.295  -2.014   9.226
  157    H    ALA  25           H        ALA  25 -35.357   3.694  13.540
  158    HA   ALA  25           HA       ALA  25 -33.074   5.242  13.124
  159   1HB   ALA  25          1HB       ALA  25 -33.786   6.358  15.218
  160   2HB   ALA  25          2HB       ALA  25 -35.163   6.071  14.127
  161   3HB   ALA  25          3HB       ALA  25 -34.914   5.019  15.542
  162    H    ARG  26           H        ARG  26 -33.581   2.229  14.812
  163    HA   ARG  26           HA       ARG  26 -31.516   2.567  16.679
  164   1HB   ARG  26          1HB       ARG  26 -33.542   0.712  16.261
  165   2HB   ARG  26          2HB       ARG  26 -32.130  -0.213  15.791
  166   1HG   ARG  26          1HG       ARG  26 -31.195   0.945  18.100
  167   2HG   ARG  26          2HG       ARG  26 -32.902   0.839  18.482
  168   1HD   ARG  26          1HD       ARG  26 -32.934  -1.552  18.195
  169   2HD   ARG  26          2HD       ARG  26 -31.394  -1.557  17.359
  170    HE   ARG  26           HE       ARG  26 -30.970  -0.433  19.945
  171   1HH1  ARG  26          2HH2      ARG  26 -31.819  -3.552  18.495
  172   2HH1  ARG  26          1HH2      ARG  26 -31.132  -4.480  19.786
  173   1HH2  ARG  26          1HH       ARG  26 -30.105  -3.345  21.630
  174    H    ALA  27           H        ALA  27 -31.739   1.490  13.296
  175    HA   ALA  27           HA       ALA  27 -29.227   0.183  13.214
  176   1HB   ALA  27          1HB       ALA  27 -30.310   1.389  10.729
  177   2HB   ALA  27          2HB       ALA  27 -29.851  -0.294  11.079
  178   3HB   ALA  27          3HB       ALA  27 -31.436   0.324  11.603
  179    H    ARG  28           H        ARG  28 -30.360   3.542  12.932
  180    HA   ARG  28           HA       ARG  28 -28.159   4.556  11.621
  181   1HB   ARG  28          1HB       ARG  28 -30.540   5.568  12.645
  182   2HB   ARG  28          2HB       ARG  28 -29.361   6.319  13.702
  183   1HG   ARG  28          1HG       ARG  28 -28.141   7.245  11.773
  184   2HG   ARG  28          2HG       ARG  28 -29.177   6.381  10.654
  185   1HD   ARG  28          1HD       ARG  28 -30.577   8.169  10.648
  186   2HD   ARG  28          2HD       ARG  28 -30.963   7.827  12.323
  187    HE   ARG  28           HE       ARG  28 -29.072   9.868  11.336
  188   1HH1  ARG  28          2HH2      ARG  28 -30.271   8.068  14.142
  189   2HH1  ARG  28          1HH2      ARG  28 -29.675   9.219  15.291
  190   1HH2  ARG  28          1HH       ARG  28 -28.511  11.162  14.510
  191    H    GLU  29           H        GLU  29 -28.723   3.627  15.006
  192    HA   GLU  29           HA       GLU  29 -26.425   5.029  15.944
  193   1HB   GLU  29          1HB       GLU  29 -28.600   3.360  17.116
  194   2HB   GLU  29          2HB       GLU  29 -27.069   3.285  17.966
  195   1HG   GLU  29          1HG       GLU  29 -27.398   5.345  18.857
  196   2HG   GLU  29          2HG       GLU  29 -27.607   6.049  17.266
  197    HE2  GLU  29           HE2      GLU  29 -29.267   5.860  20.018
  198    H    ARG  30           H        ARG  30 -27.184   1.885  14.570
  199    HA   ARG  30           HA       ARG  30 -24.771   0.738  15.615
  200   1HB   ARG  30          1HB       ARG  30 -27.212  -0.238  14.196
  201   2HB   ARG  30          2HB       ARG  30 -25.741  -1.091  13.775
  202   1HG   ARG  30          1HG       ARG  30 -26.363  -2.332  15.636
  203   2HG   ARG  30          2HG       ARG  30 -25.377  -1.119  16.430
  204   1HD   ARG  30          1HD       ARG  30 -28.267  -0.411  16.030
  205   2HD   ARG  30          2HD       ARG  30 -27.939  -1.689  17.184
  206    HE   ARG  30           HE       ARG  30 -27.268   1.145  17.482
  207   1HH1  ARG  30          2HH2      ARG  30 -26.459  -2.135  18.550
  208   2HH1  ARG  30          1HH2      ARG  30 -25.759  -1.609  20.045
  209   1HH2  ARG  30          1HH       ARG  30 -25.703   0.732  20.555
  210    H    GLU  31           H        GLU  31 -26.056   2.271  12.691
  211    HA   GLU  31           HA       GLU  31 -24.029   1.269  10.988
  212   1HB   GLU  31          1HB       GLU  31 -26.200   3.361  10.761
  213   2HB   GLU  31          2HB       GLU  31 -24.949   3.290   9.536
  214   1HG   GLU  31          1HG       GLU  31 -25.565   0.643   9.648
  215   2HG   GLU  31          2HG       GLU  31 -27.104   1.295  10.174
  216    HE2  GLU  31           HE2      GLU  31 -25.831   0.260   7.497
  217    H    ARG  32           H        ARG  32 -24.392   3.973  13.226
  218    HA   ARG  32           HA       ARG  32 -22.584   5.714  12.122
  219   1HB   ARG  32          1HB       ARG  32 -24.187   5.771  14.309
  220   2HB   ARG  32          2HB       ARG  32 -22.677   5.408  15.122
  221   1HG   ARG  32          1HG       ARG  32 -21.922   7.432  13.359
  222   2HG   ARG  32          2HG       ARG  32 -23.549   7.914  13.798
  223   1HD   ARG  32          1HD       ARG  32 -22.128   7.019  16.182
  224   2HD   ARG  32          2HD       ARG  32 -21.166   8.222  15.347
  225    HE   ARG  32           HE       ARG  32 -23.830   9.194  15.388
  226   1HH1  ARG  32          2HH2      ARG  32 -21.274   8.434  17.722
  227   2HH1  ARG  32          1HH2      ARG  32 -21.818   9.598  18.884
  228   1HH2  ARG  32          1HH       ARG  32 -23.743  10.937  18.391
  229    H    LEU  33           H        LEU  33 -22.151   2.703  13.956
  230    HA   LEU  33           HA       LEU  33 -19.326   3.238  14.355
  231   1HB   LEU  33          1HB       LEU  33 -21.289   1.815  15.743
  232   2HB   LEU  33          2HB       LEU  33 -20.251   0.581  15.056
  233    HG   LEU  33           HG       LEU  33 -18.322   2.104  16.051
  234   1HD1  LEU  33          1HD1      LEU  33 -19.549   2.738  18.431
  235   2HD1  LEU  33          2HD1      LEU  33 -19.112   3.886  17.142
  236   3HD1  LEU  33          3HD1      LEU  33 -20.763   3.225  17.223
  237   1HD2  LEU  33          1HD2      LEU  33 -18.587   0.783  18.233
  238   2HD2  LEU  33          2HD2      LEU  33 -20.044   0.087  17.484
  239   3HD2  LEU  33          3HD2      LEU  33 -18.455  -0.135  16.714
  240    H    ALA  34           H        ALA  34 -21.431   1.978  11.957
  241    HA   ALA  34           HA       ALA  34 -19.566   0.024  10.958
  242   1HB   ALA  34          1HB       ALA  34 -22.009  -0.298  10.793
  243   2HB   ALA  34          2HB       ALA  34 -22.139   1.175   9.803
  244   3HB   ALA  34          3HB       ALA  34 -21.259  -0.241   9.180
  245    H    HIS  35           H        HIS  35 -19.364   3.276  11.167
  246    HA   HIS  35           HA       HIS  35 -18.629   3.749   8.407
  247   1HB   HIS  35          1HB       HIS  35 -19.937   5.452   9.507
  248   2HB   HIS  35          2HB       HIS  35 -18.799   5.548  10.836
  249    HD1  HIS  35           HD1      HIS  35 -19.493   6.901   7.467
  250    HD2  HIS  35           HD2      HIS  35 -16.235   6.745  10.105
  251    HE1  HIS  35           HE1      HIS  35 -17.817   8.638   6.637
  252    H    SER  36           H        SER  36 -17.233   2.538  11.280
  253    HA   SER  36           HA       SER  36 -14.634   3.626  10.699
  254   1HB   SER  36          1HB       SER  36 -15.912   2.814  13.040
  255   2HB   SER  36          2HB       SER  36 -14.813   1.484  12.732
  256    HG   SER  36           HG       SER  36 -13.104   3.197  12.458
  257    H    ARG  37           H        ARG  37 -16.609   0.863   9.943
  258    HA   ARG  37           HA       ARG  37 -14.348  -0.832   9.475
  259   1HB   ARG  37          1HB       ARG  37 -16.962  -1.348  10.165
  260   2HB   ARG  37          2HB       ARG  37 -17.049  -1.608   8.434
  261   1HG   ARG  37          1HG       ARG  37 -15.011  -3.141   8.651
  262   2HG   ARG  37          2HG       ARG  37 -15.155  -2.989  10.391
  263   1HD   ARG  37          1HD       ARG  37 -17.768  -3.636   9.610
  264   2HD   ARG  37          2HD       ARG  37 -16.789  -4.582   8.506
  265    HE   ARG  37           HE       ARG  37 -16.925  -4.888  11.440
  266   1HH1  ARG  37          2HH2      ARG  37 -15.211  -5.745   8.459
  267   2HH1  ARG  37          1HH2      ARG  37 -14.464  -7.150   9.146
  268   1HH2  ARG  37          1HH       ARG  37 -14.908  -7.716  11.432
  269    H    ALA  38           H        ALA  38 -15.208   1.825   7.943
  270    HA   ALA  38           HA       ALA  38 -15.900   1.094   5.338
  271   1HB   ALA  38          1HB       ALA  38 -14.478   3.433   5.072
  272   2HB   ALA  38          2HB       ALA  38 -16.186   3.335   5.562
  273   3HB   ALA  38          3HB       ALA  38 -14.912   3.472   6.798
  274    H    ALA  39           H        ALA  39 -12.649   2.098   6.639
  275    HA   ALA  39           HA       ALA  39 -11.419   0.824   4.340
  276   1HB   ALA  39          1HB       ALA  39  -9.335   1.817   5.618
  277   2HB   ALA  39          2HB       ALA  39 -10.444   2.901   4.745
  278   3HB   ALA  39          3HB       ALA  39 -10.571   2.734   6.512
  279    H    ALA  40           H        ALA  40 -12.464  -1.279   5.346
  280    HA   ALA  40           HA       ALA  40 -11.296  -2.352   7.666
  281   1HB   ALA  40          1HB       ALA  40 -12.675  -3.623   5.268
  282   2HB   ALA  40          2HB       ALA  40 -12.264  -4.490   6.767
  283   3HB   ALA  40          3HB       ALA  40 -13.426  -3.143   6.809
  284    H    ALA  41           H        ALA  41 -10.760  -3.218   4.169
  285    HA   ALA  41           HA       ALA  41  -8.713  -4.915   4.391
  286   1HB   ALA  41          1HB       ALA  41  -9.284  -2.684   2.432
  287   2HB   ALA  41          2HB       ALA  41  -7.861  -3.734   2.223
  288   3HB   ALA  41          3HB       ALA  41  -9.495  -4.440   2.228
  289    H    ALA  42           H        ALA  42  -7.227  -4.721   6.058
  290    HA   ALA  42           HA       ALA  42  -5.726  -2.206   6.168
  291   1HB   ALA  42          1HB       ALA  42  -4.960  -3.695   8.351
  292   2HB   ALA  42          2HB       ALA  42  -6.277  -2.497   8.350
  293   3HB   ALA  42          3HB       ALA  42  -6.645  -4.224   8.126
  294    H    ALA  43           H        ALA  43  -4.941  -5.667   6.925
  295    HA   ALA  43           HA       ALA  43  -2.279  -5.464   6.241
  296   1HB   ALA  43          1HB       ALA  43  -3.126  -7.300   7.558
  297   2HB   ALA  43          2HB       ALA  43  -4.205  -7.818   6.240
  298   3HB   ALA  43          3HB       ALA  43  -2.442  -7.982   6.063
  299    H    VAL  44           H        VAL  44  -5.115  -5.490   4.220
  300    HA   VAL  44           HA       VAL  44  -3.622  -6.394   1.900
  301    HB   VAL  44           HB       VAL  44  -6.419  -6.122   2.711
  302   1HG1  VAL  44          1HG1      VAL  44  -7.329  -5.677   0.489
  303   2HG1  VAL  44          2HG1      VAL  44  -6.347  -4.301   1.045
  304   3HG1  VAL  44          3HG1      VAL  44  -5.688  -5.437  -0.157
  305   1HG2  VAL  44          1HG2      VAL  44  -4.964  -8.200   2.065
  306   2HG2  VAL  44          2HG2      VAL  44  -6.674  -8.131   1.577
  307   3HG2  VAL  44          3HG2      VAL  44  -5.396  -7.752   0.397
  308    H    ALA  45           H        ALA  45  -4.798  -3.446   3.487
  309    HA   ALA  45           HA       ALA  45  -4.906  -1.631   1.510
  310   1HB   ALA  45          1HB       ALA  45  -4.123   0.002   3.190
  311   2HB   ALA  45          2HB       ALA  45  -5.250  -1.171   3.911
  312   3HB   ALA  45          3HB       ALA  45  -3.500  -1.328   4.195
  313    H    ALA  46           H        ALA  46  -1.858  -2.708   3.174
  314    HA   ALA  46           HA       ALA  46  -0.152  -1.206   1.557
  315   1HB   ALA  46          1HB       ALA  46   1.456  -2.150   2.859
  316   2HB   ALA  46          2HB       ALA  46   0.074  -2.753   3.804
  317   3HB   ALA  46          3HB       ALA  46   0.847  -3.801   2.591
  318    H    ALA  47           H        ALA  47  -1.168  -4.689   1.362
  319    HA   ALA  47           HA       ALA  47   0.266  -5.287  -0.934
  320   1HB   ALA  47          1HB       ALA  47  -2.299  -6.382   0.270
  321   2HB   ALA  47          2HB       ALA  47  -1.512  -7.111  -1.150
  322   3HB   ALA  47          3HB       ALA  47  -0.651  -7.041   0.407
  323    H    THR  48           H        THR  48  -1.289  -6.147  -2.967
  324    HA   THR  48           HA       THR  48  -2.018  -5.256  -4.909
  325    HB   THR  48           HB       THR  48  -4.452  -4.621  -4.667
  326    HG1  THR  48           HG1      THR  48  -5.059  -4.736  -2.248
  327   1HG2  THR  48          1HG2      THR  48  -3.367  -7.091  -4.074
  328   2HG2  THR  48          2HG2      THR  48  -4.184  -6.704  -2.540
  329   3HG2  THR  48          3HG2      THR  48  -5.115  -6.752  -4.057
  330    H    ALA  49           H        ALA  49  -0.059  -3.645  -4.447
  331    HA   ALA  49           HA       ALA  49  -0.466  -1.052  -3.716
  332   1HB   ALA  49          1HB       ALA  49   1.695  -0.990  -4.322
  333   2HB   ALA  49          2HB       ALA  49   1.514  -2.610  -5.036
  334   3HB   ALA  49          3HB       ALA  49   1.250  -1.163  -6.037
  335    H    ALA  50           H        ALA  50  -1.540   0.704  -4.524
  336    HA   ALA  50           HA       ALA  50  -3.159   0.256  -6.873
  337   1HB   ALA  50          1HB       ALA  50  -4.073   2.522  -6.203
  338   2HB   ALA  50          2HB       ALA  50  -4.223   1.259  -4.958
  339   3HB   ALA  50          3HB       ALA  50  -2.947   2.494  -4.825
  340    H    VAL  51           H        VAL  51  -0.579   0.105  -7.719
  341    HA   VAL  51           HA       VAL  51  -0.328   2.601  -9.208
  342    HB   VAL  51           HB       VAL  51   1.938   1.231  -7.745
  343   1HG1  VAL  51          1HG1      VAL  51   2.081   2.625 -10.123
  344   2HG1  VAL  51          2HG1      VAL  51   2.427   3.881  -8.911
  345   3HG1  VAL  51          3HG1      VAL  51   3.415   2.402  -8.966
  346   1HG2  VAL  51          1HG2      VAL  51   0.415   2.558  -6.284
  347   2HG2  VAL  51          2HG2      VAL  51   2.066   3.219  -6.370
  348   3HG2  VAL  51          3HG2      VAL  51   0.750   3.988  -7.290
  349    H    GLU  52           H        GLU  52  -1.610   0.623 -10.380
  350    HA   GLU  52           HA       GLU  52   0.465  -0.708 -11.941
  351   1HB   GLU  52          1HB       GLU  52  -0.957  -2.210 -10.403
  352   2HB   GLU  52          2HB       GLU  52  -2.316  -1.840 -11.446
  353   1HG   GLU  52          1HG       GLU  52   0.097  -2.648 -12.957
  354   2HG   GLU  52          2HG       GLU  52  -0.456  -3.889 -11.851
  355    HE2  GLU  52           HE2      GLU  52  -2.024  -3.281 -15.251
  356    H    GLY  53           H        GLY  53   0.100  -0.857 -14.236
  357   1HA   GLY  53          1HA       GLY  53  -2.118  -0.303 -15.681
  358   2HA   GLY  53          2HA       GLY  53  -1.524   1.294 -15.270
  359    H    THR  54           H        THR  54  -0.566  -1.855 -16.753
  360    HA   THR  54           HA       THR  54   1.642  -0.488 -18.111
  361    HB   THR  54           HB       THR  54   2.030  -2.631 -16.808
  362    HG1  THR  54           HG1      THR  54   3.257  -3.449 -18.622
  363   1HG2  THR  54          1HG2      THR  54   0.988  -4.314 -18.992
  364   2HG2  THR  54          2HG2      THR  54   0.840  -4.543 -17.233
  365   3HG2  THR  54          3HG2      THR  54  -0.323  -3.508 -18.097
  366    H    GLY  55           H        GLY  55   1.948  -0.685 -20.405
  367   1HA   GLY  55          1HA       GLY  55  -0.165  -1.732 -22.038
  368   2HA   GLY  55          2HA       GLY  55  -0.206   0.017 -21.933
  369    H    GLY  56           H        GLY  56   0.246  -0.197 -24.339
  370   1HA   GLY  56          1HA       GLY  56   2.416   0.773 -25.308
  371   2HA   GLY  56          2HA       GLY  56   3.075  -0.799 -24.901
  372    H    SER  57           H        SER  57   3.089   0.057 -27.562
  373    HA   SER  57           HA       SER  57   1.318  -1.922 -28.685
  374   1HB   SER  57          1HB       SER  57   0.726   0.842 -28.866
  375   2HB   SER  57          2HB       SER  57   1.402   0.426 -30.428
  376    HG   SER  57           HG       SER  57  -0.158  -1.347 -30.549
  377    H    GLY  58           H        GLY  58   2.233  -2.959 -30.516
  378   1HA   GLY  58          1HA       GLY  58   4.625  -1.800 -31.723
  379   2HA   GLY  58          2HA       GLY  58   4.832  -3.304 -30.847
  380    H    GLY  59           H        GLY  59   5.005  -2.604 -33.819
  381   1HA   GLY  59          1HA       GLY  59   4.246  -4.925 -34.970
  382   2HA   GLY  59          2HA       GLY  59   2.770  -3.982 -35.026
  383    H    GLY  60           H        GLY  60   4.117  -4.803 -37.386
  384   1HA   GLY  60          1HA       GLY  60   4.053  -3.078 -39.220
  385   2HA   GLY  60          2HA       GLY  60   5.351  -2.293 -38.343
  386    HA   PRO  61           HA       PRO  61   7.254  -5.295 -41.187
  387   1HB   PRO  61          1HB       PRO  61   8.811  -3.553 -42.605
  388   2HB   PRO  61          2HB       PRO  61   7.226  -4.075 -43.140
  389   1HG   PRO  61          1HG       PRO  61   8.026  -1.479 -41.974
  390   2HG   PRO  61          2HG       PRO  61   6.586  -1.873 -42.891
  391   1HD   PRO  61          1HD       PRO  61   6.768  -1.516 -40.051
  392   2HD   PRO  61          2HD       PRO  61   5.355  -2.023 -40.954
  393    H    HIS  62           H        HIS  62   9.558  -5.962 -41.498
  394    HA   HIS  62           HA       HIS  62  11.106  -4.860 -39.271
  395   1HB   HIS  62          1HB       HIS  62   9.989  -7.170 -38.902
  396   2HB   HIS  62          2HB       HIS  62  11.188  -7.778 -40.027
  397    HD1  HIS  62           HD1      HIS  62  10.761  -6.576 -36.518
  398    HD2  HIS  62           HD2      HIS  62  13.898  -7.674 -39.076
  399    HE1  HIS  62           HE1      HIS  62  12.815  -6.888 -35.037
  400    H    HIS  63           H        HIS  63  11.360  -7.062 -42.160
  401    HA   HIS  63           HA       HIS  63  13.967  -6.879 -42.672
  402   1HB   HIS  63          1HB       HIS  63  11.697  -7.688 -44.054
  403   2HB   HIS  63          2HB       HIS  63  12.403  -6.487 -45.117
  404    HD1  HIS  63           HD1      HIS  63  14.423  -8.870 -42.932
  405    HD2  HIS  63           HD2      HIS  63  13.514  -8.214 -46.974
  406    HE1  HIS  63           HE1      HIS  63  15.930 -10.438 -44.267
  407    H    HIS  64           H        HIS  64  11.586  -4.577 -44.186
  408    HA   HIS  64           HA       HIS  64  11.947  -2.593 -45.111
  409   1HB   HIS  64          1HB       HIS  64  12.259  -2.502 -42.309
  410   2HB   HIS  64          2HB       HIS  64  13.486  -1.430 -42.953
  411    HD1  HIS  64           HD1      HIS  64  12.176   0.645 -42.022
  412    HD2  HIS  64           HD2      HIS  64  10.092  -1.591 -44.895
  413    HE1  HIS  64           HE1      HIS  64  10.197   2.082 -42.748
  414    H    HIS  65           H        HIS  65  13.396  -3.538 -46.780
  415    HA   HIS  65           HA       HIS  65  15.489  -2.044 -47.405
  416   1HB   HIS  65          1HB       HIS  65  16.951  -2.369 -45.706
  417   2HB   HIS  65          2HB       HIS  65  16.285  -3.931 -45.271
  418    HD1  HIS  65           HD1      HIS  65  18.534  -2.394 -47.961
  419    HD2  HIS  65           HD2      HIS  65  17.788  -6.077 -46.097
  420    HE1  HIS  65           HE1      HIS  65  20.317  -4.004 -48.820
  421    H    GLN  66           H        GLN  66  16.939  -3.079 -49.120
  422    HA   GLN  66           HA       GLN  66  17.105  -4.214 -50.964
  423   1HB   GLN  66          1HB       GLN  66  17.704  -6.093 -49.530
  424   2HB   GLN  66          2HB       GLN  66  16.020  -6.473 -49.231
  425   1HG   GLN  66          1HG       GLN  66  15.670  -7.119 -51.559
  426   2HG   GLN  66          2HG       GLN  66  17.245  -6.509 -52.025
  427   1HE2  GLN  66          1HE2      GLN  66  18.258  -8.276 -52.694
  428   2HE2  GLN  66          2HE2      GLN  66  18.563  -9.699 -51.754
  429    H    THR  67           H        THR  67  15.889  -5.266 -52.822
  430    HA   THR  67           HA       THR  67  13.038  -5.427 -52.612
  431    HB   THR  67           HB       THR  67  14.375  -3.059 -54.019
  432    HG1  THR  67           HG1      THR  67  12.719  -2.059 -52.498
  433   1HG2  THR  67          1HG2      THR  67  12.532  -3.818 -55.460
  434   2HG2  THR  67          2HG2      THR  67  11.479  -4.057 -54.044
  435   3HG2  THR  67          3HG2      THR  67  11.965  -2.413 -54.525
  436    H    ARG  68           H        ARG  68  12.080  -5.745 -54.926
  437    HA   ARG  68           HA       ARG  68  13.443  -7.916 -55.968
  438   1HB   ARG  68          1HB       ARG  68  11.712  -7.692 -57.863
  439   2HB   ARG  68          2HB       ARG  68  11.054  -7.827 -56.244
  440   1HG   ARG  68          1HG       ARG  68  11.593  -5.024 -56.878
  441   2HG   ARG  68          2HG       ARG  68  10.591  -5.741 -58.124
  442   1HD   ARG  68          1HD       ARG  68   8.949  -6.496 -56.451
  443   2HD   ARG  68          2HD       ARG  68   9.986  -5.975 -55.138
  444    HE   ARG  68           HE       ARG  68   9.460  -3.768 -56.930
  445   1HH1  ARG  68          2HH2      ARG  68   7.947  -5.689 -54.367
  446   2HH1  ARG  68          1HH2      ARG  68   6.870  -4.422 -53.882
  447   1HH2  ARG  68          1HH       ARG  68   6.942  -2.318 -55.028
  448    H    GLY  69           H        GLY  69  14.850  -8.143 -57.744
  449   1HA   GLY  69          1HA       GLY  69  15.195  -5.980 -59.630
  450   2HA   GLY  69          2HA       GLY  69  16.541  -6.194 -58.528
  451    H    ALA  70           H        ALA  70  17.555  -8.406 -58.377
  452    HA   ALA  70           HA       ALA  70  18.511 -10.162 -59.323
  453   1HB   ALA  70          1HB       ALA  70  16.940 -11.713 -59.729
  454   2HB   ALA  70          2HB       ALA  70  15.715 -10.425 -59.825
  455   3HB   ALA  70          3HB       ALA  70  16.567 -10.954 -61.295
  456    H    TYR  71           H        TYR  71  19.900  -8.306 -60.211
  457    HA   TYR  71           HA       TYR  71  19.723  -8.331 -63.150
  458   1HB   TYR  71          1HB       TYR  71  20.305  -6.273 -60.993
  459   2HB   TYR  71          2HB       TYR  71  21.230  -6.123 -62.474
  460    HD1  TYR  71           HD1      TYR  71  18.276  -5.150 -60.839
  461    HD2  TYR  71           HD2      TYR  71  19.760  -6.212 -64.708
  462    HE1  TYR  71           HE1      TYR  71  16.342  -3.912 -61.928
  463    HE2  TYR  71           HE2      TYR  71  17.821  -4.970 -65.785
  464    HH   TYR  71           HH       TYR  71  15.448  -3.246 -63.779
  465    H    SER  72           H        SER  72  21.803  -8.237 -64.303
  466    HA   SER  72           HA       SER  72  23.979  -9.233 -62.638
  467   1HB   SER  72          1HB       SER  72  23.012 -10.254 -65.334
  468   2HB   SER  72          2HB       SER  72  24.632 -10.586 -64.756
  469    HG   SER  72           HG       SER  72  23.145 -12.298 -64.201
  470    H    SER  73           H        SER  73  23.219  -8.055 -66.005
  471    HA   SER  73           HA       SER  73  24.814  -5.794 -65.723
  472   1HB   SER  73          1HB       SER  73  26.235  -8.220 -66.472
  473   2HB   SER  73          2HB       SER  73  26.293  -7.074 -67.797
  474    HG   SER  73           HG       SER  73  26.800  -5.534 -65.761
  475    H    HIS  74           H        HIS  74  24.666  -4.426 -67.645
  476    HA   HIS  74           HA       HIS  74  23.428  -3.583 -69.271
  477   1HB   HIS  74          1HB       HIS  74  25.155  -5.384 -70.282
  478   2HB   HIS  74          2HB       HIS  74  23.661  -6.082 -70.875
  479    HD1  HIS  74           HD1      HIS  74  25.027  -2.485 -70.728
  480    HD2  HIS  74           HD2      HIS  74  23.178  -5.155 -73.383
  481    HE1  HIS  74           HE1      HIS  74  24.754  -1.228 -72.931
  482    H    ASP  75           H        ASP  75  21.559  -3.881 -67.629
  483    HA   ASP  75           HA       ASP  75  19.468  -4.306 -67.253
  484   1HB   ASP  75          1HB       ASP  75  19.632  -3.963 -70.028
  485   2HB   ASP  75          2HB       ASP  75  18.745  -5.467 -69.880
  486    HD2  ASP  75           HD2      ASP  75  16.173  -4.805 -68.795
  Start of MODEL   15
    1    H    MET   1           H        MET   1 -34.114 -30.331  13.516
    2    HA   MET   1           HA       MET   1 -32.811 -29.812  11.007
    3   1HB   MET   1          1HB       MET   1 -34.720 -31.977  11.389
    4   2HB   MET   1          2HB       MET   1 -35.475 -30.759  10.380
    5   1HG   MET   1          1HG       MET   1 -34.356 -31.800   8.669
    6   2HG   MET   1          2HG       MET   1 -32.981 -30.865   9.222
    7   1HE   MET   1          1HE       MET   1 -33.021 -33.881   7.684
    8   2HE   MET   1          2HE       MET   1 -31.680 -32.731   7.901
    9   3HE   MET   1          3HE       MET   1 -31.502 -34.417   8.441
   10    H    GLU   2           H        GLU   2 -32.994 -27.585  11.221
   11    HA   GLU   2           HA       GLU   2 -34.872 -26.185  12.482
   12   1HB   GLU   2          1HB       GLU   2 -32.778 -25.365  11.239
   13   2HB   GLU   2          2HB       GLU   2 -33.755 -25.318   9.785
   14   1HG   GLU   2          1HG       GLU   2 -34.771 -23.380  10.412
   15   2HG   GLU   2          2HG       GLU   2 -35.142 -24.002  12.008
   16    HE2  GLU   2           HE2      GLU   2 -32.645 -22.058  10.361
   17    H    VAL   3           H        VAL   3 -36.835 -25.001  11.840
   18    HA   VAL   3           HA       VAL   3 -38.487 -26.641  10.140
   19    HB   VAL   3           HB       VAL   3 -39.080 -25.628  12.414
   20   1HG1  VAL   3          1HG1      VAL   3 -39.490 -23.172  10.673
   21   2HG1  VAL   3          2HG1      VAL   3 -40.064 -23.362  12.347
   22   3HG1  VAL   3          3HG1      VAL   3 -38.318 -23.345  12.002
   23   1HG2  VAL   3          1HG2      VAL   3 -41.221 -24.861  10.496
   24   2HG2  VAL   3          2HG2      VAL   3 -40.607 -26.528  10.385
   25   3HG2  VAL   3          3HG2      VAL   3 -41.279 -25.927  11.920
   26    H    ALA   4           H        ALA   4 -40.200 -25.038   8.838
   27    HA   ALA   4           HA       ALA   4 -38.491 -23.867   6.825
   28   1HB   ALA   4          1HB       ALA   4 -41.513 -23.933   6.789
   29   2HB   ALA   4          2HB       ALA   4 -40.371 -24.023   5.427
   30   3HB   ALA   4          3HB       ALA   4 -40.571 -25.417   6.515
   31    H    MET   5           H        MET   5 -38.563 -21.671   6.143
   32    HA   MET   5           HA       MET   5 -39.709 -19.932   8.184
   33   1HB   MET   5          1HB       MET   5 -37.091 -20.113   7.400
   34   2HB   MET   5          2HB       MET   5 -37.644 -18.948   6.213
   35   1HG   MET   5          1HG       MET   5 -38.342 -17.383   7.924
   36   2HG   MET   5          2HG       MET   5 -38.204 -18.589   9.188
   37   1HE   MET   5          1HE       MET   5 -34.994 -15.866   7.584
   38   2HE   MET   5          2HE       MET   5 -36.224 -16.537   6.486
   39   3HE   MET   5          3HE       MET   5 -36.722 -15.579   7.900
   40    H    VAL   6           H        VAL   6 -41.812 -19.721   7.255
   41    HA   VAL   6           HA       VAL   6 -41.804 -18.184   4.756
   42    HB   VAL   6           HB       VAL   6 -43.925 -20.194   5.492
   43   1HG1  VAL   6          1HG1      VAL   6 -44.368 -20.082   3.026
   44   2HG1  VAL   6          2HG1      VAL   6 -44.650 -18.551   3.890
   45   3HG1  VAL   6          3HG1      VAL   6 -43.172 -18.768   2.921
   46   1HG2  VAL   6          1HG2      VAL   6 -41.351 -20.627   3.964
   47   2HG2  VAL   6          2HG2      VAL   6 -42.027 -21.580   5.307
   48   3HG2  VAL   6          3HG2      VAL   6 -42.790 -21.641   3.700
   49    H    SER   7           H        SER   7 -43.856 -16.855   4.521
   50    HA   SER   7           HA       SER   7 -44.621 -15.955   7.185
   51   1HB   SER   7          1HB       SER   7 -44.938 -13.744   6.254
   52   2HB   SER   7          2HB       SER   7 -43.365 -14.319   5.735
   53    HG   SER   7           HG       SER   7 -44.350 -13.467   3.902
   54    H    ALA   8           H        ALA   8 -46.693 -16.477   7.771
   55    HA   ALA   8           HA       ALA   8 -48.526 -17.370   5.733
   56   1HB   ALA   8          1HB       ALA   8 -49.500 -17.092   8.503
   57   2HB   ALA   8          2HB       ALA   8 -49.469 -18.519   7.440
   58   3HB   ALA   8          3HB       ALA   8 -48.016 -18.063   8.361
   59    H    GLU   9           H        GLU   9 -48.903 -15.428   4.517
   60    HA   GLU   9           HA       GLU   9 -49.727 -13.083   5.832
   61   1HB   GLU   9          1HB       GLU   9 -48.661 -13.355   3.484
   62   2HB   GLU   9          2HB       GLU   9 -50.266 -13.777   2.921
   63   1HG   GLU   9          1HG       GLU   9 -51.125 -11.629   3.296
   64   2HG   GLU   9          2HG       GLU   9 -49.988 -11.277   4.582
   65    HE2  GLU   9           HE2      GLU   9 -47.653  -9.910   2.597
   66    H    SER  10           H        SER  10 -51.894 -12.047   5.640
   67    HA   SER  10           HA       SER  10 -54.007 -13.997   5.227
   68   1HB   SER  10          1HB       SER  10 -55.187 -13.162   7.249
   69   2HB   SER  10          2HB       SER  10 -53.648 -13.898   7.652
   70    HG   SER  10           HG       SER  10 -52.884 -12.009   8.355
   71    H    SER  11           H        SER  11 -56.252 -12.748   5.203
   72    HA   SER  11           HA       SER  11 -55.773 -10.374   3.599
   73   1HB   SER  11          1HB       SER  11 -57.894 -10.801   2.545
   74   2HB   SER  11          2HB       SER  11 -57.049 -12.334   2.619
   75    HG   SER  11           HG       SER  11 -58.294 -12.793   4.611
   76    H    GLY  12           H        GLY  12 -56.759  -8.375   4.121
   77   1HA   GLY  12          1HA       GLY  12 -58.868  -7.744   5.618
   78   2HA   GLY  12          2HA       GLY  12 -57.706  -8.154   6.864
   79    H    CYS  13           H        CYS  13 -55.369  -7.136   6.419
   80    HA   CYS  13           HA       CYS  13 -54.165  -5.303   6.399
   81   1HB   CYS  13          1HB       CYS  13 -55.028  -5.523   3.866
   82   2HB   CYS  13          2HB       CYS  13 -55.751  -3.972   4.246
   83    HG   CYS  13           HG       CYS  13 -52.883  -4.665   3.384
   84    H    ASN  14           H        ASN  14 -55.511  -5.088   8.549
   85    HA   ASN  14           HA       ASN  14 -57.383  -2.905   8.424
   86   1HB   ASN  14          1HB       ASN  14 -56.840  -5.152  10.223
   87   2HB   ASN  14          2HB       ASN  14 -56.882  -3.660  11.140
   88   1HD2  ASN  14          1HD2      ASN  14 -58.708  -6.105  10.564
   89   2HD2  ASN  14          2HD2      ASN  14 -60.282  -5.416  10.342
   90    H    SER  15           H        SER  15 -54.375  -2.637   7.921
   91    HA   SER  15           HA       SER  15 -53.978  -0.277   9.285
   92   1HB   SER  15          1HB       SER  15 -53.626  -2.092  11.157
   93   2HB   SER  15          2HB       SER  15 -52.095  -2.395  10.361
   94    HG   SER  15           HG       SER  15 -51.314  -0.678  11.353
   95    H    HIS  16           H        HIS  16 -53.376   0.372   7.159
   96    HA   HIS  16           HA       HIS  16 -50.956  -0.918   6.133
   97   1HB   HIS  16          1HB       HIS  16 -51.679   0.181   3.950
   98   2HB   HIS  16          2HB       HIS  16 -52.615  -1.188   4.515
   99    HD1  HIS  16           HD1      HIS  16 -52.809   2.636   4.883
  100    HD2  HIS  16           HD2      HIS  16 -55.291  -0.709   4.379
  101    HE1  HIS  16           HE1      HIS  16 -55.190   3.534   4.696
  102    H    MET  17           H        MET  17 -50.212   0.606   8.123
  103    HA   MET  17           HA       MET  17 -50.052   3.348   7.438
  104   1HB   MET  17          1HB       MET  17 -49.603   1.665   9.723
  105   2HB   MET  17          2HB       MET  17 -48.073   2.462   9.412
  106   1HG   MET  17          1HG       MET  17 -48.886   4.547   9.976
  107   2HG   MET  17          2HG       MET  17 -50.448   4.257   9.236
  108   1HE   MET  17          1HE       MET  17 -51.883   5.010  10.485
  109   2HE   MET  17          2HE       MET  17 -52.745   3.712  11.345
  110   3HE   MET  17          3HE       MET  17 -51.984   5.035  12.262
  111    HA   PRO  18           HA       PRO  18 -46.326   3.277   5.213
  112   1HB   PRO  18          1HB       PRO  18 -45.374   5.804   5.631
  113   2HB   PRO  18          2HB       PRO  18 -46.634   5.434   4.470
  114   1HG   PRO  18          1HG       PRO  18 -46.877   6.716   7.122
  115   2HG   PRO  18          2HG       PRO  18 -48.018   6.721   5.792
  116   1HD   PRO  18          1HD       PRO  18 -48.182   5.153   8.188
  117   2HD   PRO  18          2HD       PRO  18 -49.259   5.073   6.807
  118    H    TYR  19           H        TYR  19 -45.523   1.552   6.646
  119    HA   TYR  19           HA       TYR  19 -43.658   2.543   8.635
  120   1HB   TYR  19          1HB       TYR  19 -44.985   0.602   9.244
  121   2HB   TYR  19          2HB       TYR  19 -44.836  -0.099   7.645
  122    HD1  TYR  19           HD1      TYR  19 -42.765  -1.286   6.978
  123    HD2  TYR  19           HD2      TYR  19 -43.285   0.250  10.937
  124    HE1  TYR  19           HE1      TYR  19 -40.846  -2.736   7.801
  125    HE2  TYR  19           HE2      TYR  19 -41.364  -1.205  11.746
  126    HH   TYR  19           HH       TYR  19 -40.324  -3.739  10.376
  127    H    GLY  20           H        GLY  20 -41.425   2.451   8.497
  128   1HA   GLY  20          1HA       GLY  20 -40.158   0.978   6.350
  129   2HA   GLY  20          2HA       GLY  20 -40.091   2.721   6.178
  130    H    TYR  21           H        TYR  21 -38.546   3.878   7.299
  131    HA   TYR  21           HA       TYR  21 -36.702   2.336   8.895
  132   1HB   TYR  21          1HB       TYR  21 -36.990   5.221   7.868
  133   2HB   TYR  21          2HB       TYR  21 -35.644   4.757   8.890
  134    HD1  TYR  21           HD1      TYR  21 -33.879   3.259   8.051
  135    HD2  TYR  21           HD2      TYR  21 -37.119   4.492   5.545
  136    HE1  TYR  21           HE1      TYR  21 -32.593   2.490   5.998
  137    HE2  TYR  21           HE2      TYR  21 -35.822   3.719   3.500
  138    HH   TYR  21           HH       TYR  21 -33.617   3.300   2.822
  139    H    ALA  22           H        ALA  22 -39.167   2.351  10.204
  140    HA   ALA  22           HA       ALA  22 -39.118   4.523  12.115
  141   1HB   ALA  22          1HB       ALA  22 -41.290   3.967  12.450
  142   2HB   ALA  22          2HB       ALA  22 -41.108   2.987  10.976
  143   3HB   ALA  22          3HB       ALA  22 -40.922   2.230  12.576
  144    H    ALA  23           H        ALA  23 -39.171   0.890  12.359
  145    HA   ALA  23           HA       ALA  23 -37.983   1.047  14.966
  146   1HB   ALA  23          1HB       ALA  23 -39.745  -0.622  14.168
  147   2HB   ALA  23          2HB       ALA  23 -38.446  -1.411  13.242
  148   3HB   ALA  23          3HB       ALA  23 -38.343  -1.316  15.016
  149    H    GLN  24           H        GLN  24 -36.801   1.390  11.834
  150    HA   GLN  24           HA       GLN  24 -34.386  -0.096  12.327
  151   1HB   GLN  24          1HB       GLN  24 -35.821   0.643  10.018
  152   2HB   GLN  24          2HB       GLN  24 -34.378   1.635   9.955
  153   1HG   GLN  24          1HG       GLN  24 -33.940  -0.495   8.823
  154   2HG   GLN  24          2HG       GLN  24 -32.961  -0.403  10.274
  155   1HE2  GLN  24          1HE2      GLN  24 -33.313  -1.753  11.970
  156   2HE2  GLN  24          2HE2      GLN  24 -34.399  -3.102  11.942
  157    H    ALA  25           H        ALA  25 -35.608   2.817  13.353
  158    HA   ALA  25           HA       ALA  25 -33.580   4.646  12.781
  159   1HB   ALA  25          1HB       ALA  25 -34.598   5.970  14.495
  160   2HB   ALA  25          2HB       ALA  25 -35.915   5.049  13.731
  161   3HB   ALA  25          3HB       ALA  25 -35.266   4.534  15.307
  162    H    ARG  26           H        ARG  26 -33.666   1.815  14.820
  163    HA   ARG  26           HA       ARG  26 -31.744   2.700  16.661
  164   1HB   ARG  26          1HB       ARG  26 -33.452   0.646  16.704
  165   2HB   ARG  26          2HB       ARG  26 -32.128  -0.226  15.957
  166   1HG   ARG  26          1HG       ARG  26 -30.893  -0.263  17.888
  167   2HG   ARG  26          2HG       ARG  26 -31.275   1.401  18.282
  168   1HD   ARG  26          1HD       ARG  26 -33.092   0.821  19.581
  169   2HD   ARG  26          2HD       ARG  26 -33.588  -0.467  18.501
  170    HE   ARG  26           HE       ARG  26 -31.677  -0.689  20.743
  171   1HH1  ARG  26          2HH2      ARG  26 -33.056  -2.238  17.870
  172   2HH1  ARG  26          1HH2      ARG  26 -32.581  -3.833  18.350
  173   1HH2  ARG  26          1HH       ARG  26 -31.403  -4.136  20.415
  174    H    ALA  27           H        ALA  27 -31.683   1.205  13.435
  175    HA   ALA  27           HA       ALA  27 -28.997   0.312  13.552
  176   1HB   ALA  27          1HB       ALA  27 -30.727   1.005  11.145
  177   2HB   ALA  27          2HB       ALA  27 -29.288  -0.043  11.160
  178   3HB   ALA  27          3HB       ALA  27 -30.768  -0.552  12.007
  179    H    ARG  28           H        ARG  28 -30.628   3.389  12.841
  180    HA   ARG  28           HA       ARG  28 -28.570   4.574  11.444
  181   1HB   ARG  28          1HB       ARG  28 -31.078   5.332  12.059
  182   2HB   ARG  28          2HB       ARG  28 -30.269   6.201  13.347
  183   1HG   ARG  28          1HG       ARG  28 -29.487   7.783  11.913
  184   2HG   ARG  28          2HG       ARG  28 -28.842   6.574  10.820
  185   1HD   ARG  28          1HD       ARG  28 -31.510   6.275  10.289
  186   2HD   ARG  28          2HD       ARG  28 -31.500   7.962  10.762
  187    HE   ARG  28           HE       ARG  28 -29.377   7.256   8.858
  188   1HH1  ARG  28          2HH2      ARG  28 -32.724   8.365   9.206
  189   2HH1  ARG  28          1HH2      ARG  28 -32.783   9.076   7.627
  190   1HH2  ARG  28          1HH       ARG  28 -30.850   8.962   6.215
  191    H    GLU  29           H        GLU  29 -29.096   3.981  14.910
  192    HA   GLU  29           HA       GLU  29 -27.078   5.834  15.699
  193   1HB   GLU  29          1HB       GLU  29 -29.236   4.567  16.959
  194   2HB   GLU  29          2HB       GLU  29 -27.841   3.791  17.682
  195   1HG   GLU  29          1HG       GLU  29 -27.202   6.570  17.557
  196   2HG   GLU  29          2HG       GLU  29 -28.863   6.488  18.112
  197    HE2  GLU  29           HE2      GLU  29 -28.145   4.220  20.600
  198    H    ARG  30           H        ARG  30 -27.291   2.467  14.716
  199    HA   ARG  30           HA       ARG  30 -24.765   1.852  15.930
  200   1HB   ARG  30          1HB       ARG  30 -26.976   0.337  14.613
  201   2HB   ARG  30          2HB       ARG  30 -25.377  -0.316  14.317
  202   1HG   ARG  30          1HG       ARG  30 -25.202   0.157  17.015
  203   2HG   ARG  30          2HG       ARG  30 -26.920  -0.157  16.874
  204   1HD   ARG  30          1HD       ARG  30 -26.597  -2.368  16.097
  205   2HD   ARG  30          2HD       ARG  30 -24.983  -2.036  15.502
  206    HE   ARG  30           HE       ARG  30 -24.110  -2.351  17.678
  207   1HH1  ARG  30          2HH2      ARG  30 -27.652  -2.320  17.779
  208   2HH1  ARG  30          1HH2      ARG  30 -27.734  -2.908  19.406
  209   1HH2  ARG  30          1HH       ARG  30 -25.704  -3.375  20.590
  210    H    GLU  31           H        GLU  31 -26.174   2.795  12.820
  211    HA   GLU  31           HA       GLU  31 -24.250   1.846  11.114
  212   1HB   GLU  31          1HB       GLU  31 -26.252   4.074  11.070
  213   2HB   GLU  31          2HB       GLU  31 -24.981   4.148   9.866
  214   1HG   GLU  31          1HG       GLU  31 -25.541   1.888   9.059
  215   2HG   GLU  31          2HG       GLU  31 -26.711   1.678  10.346
  216    HE2  GLU  31           HE2      GLU  31 -26.246   3.130   7.278
  217    H    ARG  32           H        ARG  32 -24.171   4.520  13.421
  218    HA   ARG  32           HA       ARG  32 -22.195   6.035  12.275
  219   1HB   ARG  32          1HB       ARG  32 -23.555   5.848  14.820
  220   2HB   ARG  32          2HB       ARG  32 -21.841   6.013  15.146
  221   1HG   ARG  32          1HG       ARG  32 -22.297   7.866  13.078
  222   2HG   ARG  32          2HG       ARG  32 -23.737   7.996  14.068
  223   1HD   ARG  32          1HD       ARG  32 -22.040   8.075  16.096
  224   2HD   ARG  32          2HD       ARG  32 -20.848   8.470  14.874
  225    HE   ARG  32           HE       ARG  32 -23.057  10.178  15.784
  226   1HH1  ARG  32          2HH2      ARG  32 -20.706   9.598  13.198
  227   2HH1  ARG  32          1HH2      ARG  32 -20.771  11.224  12.605
  228   1HH2  ARG  32          1HH       ARG  32 -22.212  12.809  13.680
  229    H    LEU  33           H        LEU  33 -22.087   2.958  14.049
  230    HA   LEU  33           HA       LEU  33 -19.202   3.111  14.330
  231   1HB   LEU  33          1HB       LEU  33 -21.275   1.933  15.786
  232   2HB   LEU  33          2HB       LEU  33 -20.438   0.587  15.039
  233    HG   LEU  33           HG       LEU  33 -18.846   2.694  16.469
  234   1HD1  LEU  33          1HD1      LEU  33 -19.680   2.263  18.476
  235   2HD1  LEU  33          2HD1      LEU  33 -20.936   1.251  17.721
  236   3HD1  LEU  33          3HD1      LEU  33 -19.403   0.519  18.251
  237   1HD2  LEU  33          1HD2      LEU  33 -18.113   0.479  15.071
  238   2HD2  LEU  33          2HD2      LEU  33 -17.151   1.222  16.371
  239   3HD2  LEU  33          3HD2      LEU  33 -18.198  -0.173  16.725
  240    H    ALA  34           H        ALA  34 -21.553   2.179  12.012
  241    HA   ALA  34           HA       ALA  34 -20.006   0.015  10.910
  242   1HB   ALA  34          1HB       ALA  34 -21.846  -0.330   9.541
  243   2HB   ALA  34          2HB       ALA  34 -22.621   0.469  10.930
  244   3HB   ALA  34          3HB       ALA  34 -22.247   1.403   9.461
  245    H    HIS  35           H        HIS  35 -19.369   3.209  11.147
  246    HA   HIS  35           HA       HIS  35 -18.691   3.628   8.364
  247   1HB   HIS  35          1HB       HIS  35 -19.034   5.307  10.774
  248   2HB   HIS  35          2HB       HIS  35 -17.736   5.807   9.708
  249    HD1  HIS  35           HD1      HIS  35 -21.408   4.750   9.256
  250    HD2  HIS  35           HD2      HIS  35 -18.626   7.534   7.804
  251    HE1  HIS  35           HE1      HIS  35 -22.664   6.209   7.581
  252    H    SER  36           H        SER  36 -17.351   2.196  11.160
  253    HA   SER  36           HA       SER  36 -14.657   2.946  10.483
  254   1HB   SER  36          1HB       SER  36 -15.812   2.454  12.878
  255   2HB   SER  36          2HB       SER  36 -15.257   0.829  12.530
  256    HG   SER  36           HG       SER  36 -13.095   1.894  12.068
  257    H    ARG  37           H        ARG  37 -17.006   0.470   9.787
  258    HA   ARG  37           HA       ARG  37 -14.989  -1.476   9.173
  259   1HB   ARG  37          1HB       ARG  37 -17.604  -1.691  10.031
  260   2HB   ARG  37          2HB       ARG  37 -17.817  -1.940   8.309
  261   1HG   ARG  37          1HG       ARG  37 -15.503  -3.440   9.343
  262   2HG   ARG  37          2HG       ARG  37 -16.977  -3.865  10.191
  263   1HD   ARG  37          1HD       ARG  37 -17.754  -5.037   8.402
  264   2HD   ARG  37          2HD       ARG  37 -17.524  -3.668   7.332
  265    HE   ARG  37           HE       ARG  37 -14.946  -4.608   7.704
  266   1HH1  ARG  37          2HH2      ARG  37 -17.969  -6.131   6.658
  267   2HH1  ARG  37          1HH2      ARG  37 -17.177  -7.311   5.668
  268   1HH2  ARG  37          1HH       ARG  37 -14.784  -7.312   5.530
  269    H    ALA  38           H        ALA  38 -15.641   1.282   7.720
  270    HA   ALA  38           HA       ALA  38 -16.539   0.585   5.140
  271   1HB   ALA  38          1HB       ALA  38 -16.609   2.865   6.181
  272   2HB   ALA  38          2HB       ALA  38 -14.837   2.947   6.031
  273   3HB   ALA  38          3HB       ALA  38 -15.850   2.849   4.571
  274    H    ALA  39           H        ALA  39 -13.231   1.304   6.472
  275    HA   ALA  39           HA       ALA  39 -11.770   0.881   4.223
  276   1HB   ALA  39          1HB       ALA  39 -10.736   1.676   6.229
  277   2HB   ALA  39          2HB       ALA  39 -11.218   0.224   7.137
  278   3HB   ALA  39          3HB       ALA  39  -9.975   0.108   5.869
  279    H    ALA  40           H        ALA  40 -12.025  -0.741   2.760
  280    HA   ALA  40           HA       ALA  40 -12.717  -3.386   3.722
  281   1HB   ALA  40          1HB       ALA  40 -13.841  -2.288   1.755
  282   2HB   ALA  40          2HB       ALA  40 -12.290  -2.371   0.885
  283   3HB   ALA  40          3HB       ALA  40 -13.114  -3.869   1.381
  284    H    ALA  41           H        ALA  41 -10.426  -3.126   4.896
  285    HA   ALA  41           HA       ALA  41  -8.040  -3.179   3.705
  286   1HB   ALA  41          1HB       ALA  41  -7.814  -5.262   5.524
  287   2HB   ALA  41          2HB       ALA  41  -7.704  -3.529   5.913
  288   3HB   ALA  41          3HB       ALA  41  -9.252  -4.386   6.101
  289    H    ALA  42           H        ALA  42 -10.340  -5.971   3.894
  290    HA   ALA  42           HA       ALA  42  -8.743  -7.858   2.683
  291   1HB   ALA  42          1HB       ALA  42 -11.707  -7.369   2.910
  292   2HB   ALA  42          2HB       ALA  42 -11.116  -8.698   1.884
  293   3HB   ALA  42          3HB       ALA  42 -10.715  -8.666   3.618
  294    H    ALA  43           H        ALA  43 -11.131  -5.590   1.143
  295    HA   ALA  43           HA       ALA  43 -10.800  -6.333  -1.452
  296   1HB   ALA  43          1HB       ALA  43 -11.748  -4.235  -1.992
  297   2HB   ALA  43          2HB       ALA  43 -12.334  -4.565  -0.345
  298   3HB   ALA  43          3HB       ALA  43 -10.985  -3.432  -0.599
  299    H    VAL  44           H        VAL  44  -8.493  -4.780   0.698
  300    HA   VAL  44           HA       VAL  44  -6.802  -4.054  -1.567
  301    HB   VAL  44           HB       VAL  44  -7.197  -3.145   1.181
  302   1HG1  VAL  44          1HG1      VAL  44  -4.394  -3.693   0.183
  303   2HG1  VAL  44          2HG1      VAL  44  -4.747  -2.433   1.389
  304   3HG1  VAL  44          3HG1      VAL  44  -5.127  -4.135   1.744
  305   1HG2  VAL  44          1HG2      VAL  44  -7.619  -1.592  -0.530
  306   2HG2  VAL  44          2HG2      VAL  44  -6.042  -1.094   0.128
  307   3HG2  VAL  44          3HG2      VAL  44  -6.121  -2.002  -1.401
  308    H    ALA  45           H        ALA  45  -7.177  -6.363   1.108
  309    HA   ALA  45           HA       ALA  45  -4.719  -7.357   1.488
  310   1HB   ALA  45          1HB       ALA  45  -5.834  -9.540   1.860
  311   2HB   ALA  45          2HB       ALA  45  -6.769  -8.195   2.558
  312   3HB   ALA  45          3HB       ALA  45  -7.283  -8.934   1.022
  313    H    ALA  46           H        ALA  46  -6.928  -8.379  -1.218
  314    HA   ALA  46           HA       ALA  46  -4.943  -9.943  -2.465
  315   1HB   ALA  46          1HB       ALA  46  -7.725  -9.219  -2.822
  316   2HB   ALA  46          2HB       ALA  46  -6.865  -9.110  -4.377
  317   3HB   ALA  46          3HB       ALA  46  -6.841 -10.630  -3.451
  318    H    ALA  47           H        ALA  47  -6.150  -6.567  -2.943
  319    HA   ALA  47           HA       ALA  47  -4.591  -6.016  -5.192
  320   1HB   ALA  47          1HB       ALA  47  -6.552  -4.750  -3.741
  321   2HB   ALA  47          2HB       ALA  47  -5.117  -3.785  -3.317
  322   3HB   ALA  47          3HB       ALA  47  -5.586  -3.982  -5.023
  323    H    THR  48           H        THR  48  -3.101  -3.708  -4.573
  324    HA   THR  48           HA       THR  48  -0.896  -3.358  -4.224
  325    HB   THR  48           HB       THR  48  -2.088  -2.432  -2.239
  326    HG1  THR  48           HG1      THR  48  -0.102  -2.810  -0.794
  327   1HG2  THR  48          1HG2      THR  48  -3.009  -4.614  -1.342
  328   2HG2  THR  48          2HG2      THR  48  -1.348  -5.102  -0.930
  329   3HG2  THR  48          3HG2      THR  48  -2.092  -3.704  -0.118
  330    H    ALA  49           H        ALA  49  -1.066  -5.844  -5.337
  331    HA   ALA  49           HA       ALA  49  -0.229  -8.033  -4.040
  332   1HB   ALA  49          1HB       ALA  49   0.189  -8.799  -6.135
  333   2HB   ALA  49          2HB       ALA  49  -0.426  -7.213  -6.659
  334   3HB   ALA  49          3HB       ALA  49   1.326  -7.477  -6.494
  335    H    ALA  50           H        ALA  50   1.732  -8.936  -3.277
  336    HA   ALA  50           HA       ALA  50   3.626  -6.938  -2.402
  337   1HB   ALA  50          1HB       ALA  50   3.418  -9.937  -1.907
  338   2HB   ALA  50          2HB       ALA  50   4.541  -8.827  -1.086
  339   3HB   ALA  50          3HB       ALA  50   2.785  -8.653  -0.849
  340    H    VAL  51           H        VAL  51   3.736  -6.916  -5.120
  341    HA   VAL  51           HA       VAL  51   6.352  -8.095  -5.578
  342    HB   VAL  51           HB       VAL  51   3.892  -8.627  -7.244
  343   1HG1  VAL  51          1HG1      VAL  51   6.729  -8.436  -8.060
  344   2HG1  VAL  51          2HG1      VAL  51   5.893  -9.922  -8.570
  345   3HG1  VAL  51          3HG1      VAL  51   5.241  -8.331  -9.032
  346   1HG2  VAL  51          1HG2      VAL  51   5.162 -10.999  -7.008
  347   2HG2  VAL  51          2HG2      VAL  51   5.677 -10.229  -5.488
  348   3HG2  VAL  51          3HG2      VAL  51   3.944 -10.418  -5.847
  349    H    GLU  52           H        GLU  52   6.267  -5.558  -4.962
  350    HA   GLU  52           HA       GLU  52   6.037  -4.163  -7.515
  351   1HB   GLU  52          1HB       GLU  52   4.530  -3.454  -5.532
  352   2HB   GLU  52          2HB       GLU  52   5.989  -2.845  -4.775
  353   1HG   GLU  52          1HG       GLU  52   6.396  -1.297  -6.616
  354   2HG   GLU  52          2HG       GLU  52   5.134  -2.028  -7.587
  355    HE2  GLU  52           HE2      GLU  52   3.242   0.472  -6.690
  356    H    GLY  53           H        GLY  53   7.646  -2.296  -7.774
  357   1HA   GLY  53          1HA       GLY  53   9.868  -1.805  -6.318
  358   2HA   GLY  53          2HA       GLY  53  10.287  -3.287  -7.154
  359    H    THR  54           H        THR  54   9.143   0.097  -7.640
  360    HA   THR  54           HA       THR  54  10.139  -0.058 -10.404
  361    HB   THR  54           HB       THR  54   7.771   0.536 -10.267
  362    HG1  THR  54           HG1      THR  54   9.396   2.973 -10.375
  363   1HG2  THR  54          1HG2      THR  54   7.614   1.342  -7.930
  364   2HG2  THR  54          2HG2      THR  54   8.716   2.690  -8.303
  365   3HG2  THR  54          3HG2      THR  54   7.095   2.637  -9.037
  366    H    GLY  55           H        GLY  55  12.251  -0.042  -8.868
  367   1HA   GLY  55          1HA       GLY  55  13.085   2.795  -8.827
  368   2HA   GLY  55          2HA       GLY  55  13.494   1.684  -7.535
  369    H    GLY  56           H        GLY  56  14.901  -0.188  -8.001
  370   1HA   GLY  56          1HA       GLY  56  16.057  -0.757 -10.452
  371   2HA   GLY  56          2HA       GLY  56  17.043   0.501  -9.734
  372    H    SER  57           H        SER  57  18.730  -0.205  -8.510
  373    HA   SER  57           HA       SER  57  18.398  -2.093  -6.505
  374   1HB   SER  57          1HB       SER  57  19.545  -4.024  -7.339
  375   2HB   SER  57          2HB       SER  57  18.336  -3.623  -8.543
  376    HG   SER  57           HG       SER  57  19.903  -3.411  -9.973
  377    H    GLY  58           H        GLY  58  20.711  -2.752  -5.606
  378   1HA   GLY  58          1HA       GLY  58  22.192  -0.380  -5.250
  379   2HA   GLY  58          2HA       GLY  58  22.639  -1.993  -4.731
  380    H    GLY  59           H        GLY  59  24.881  -1.357  -5.322
  381   1HA   GLY  59          1HA       GLY  59  25.335  -1.704  -8.224
  382   2HA   GLY  59          2HA       GLY  59  26.200  -0.507  -7.281
  383    H    GLY  60           H        GLY  60  27.992  -1.994  -8.355
  384   1HA   GLY  60          1HA       GLY  60  28.576  -4.216  -6.489
  385   2HA   GLY  60          2HA       GLY  60  29.046  -4.178  -8.177
  386    HA   PRO  61           HA       PRO  61  32.265  -2.178  -5.474
  387   1HB   PRO  61          1HB       PRO  61  33.990  -4.242  -4.996
  388   2HB   PRO  61          2HB       PRO  61  32.780  -3.718  -3.842
  389   1HG   PRO  61          1HG       PRO  61  32.776  -6.115  -5.573
  390   2HG   PRO  61          2HG       PRO  61  31.819  -5.794  -4.140
  391   1HD   PRO  61          1HD       PRO  61  30.931  -5.656  -6.864
  392   2HD   PRO  61          2HD       PRO  61  30.009  -5.224  -5.438
  393    H    HIS  62           H        HIS  62  32.409  -1.109  -7.550
  394    HA   HIS  62           HA       HIS  62  33.968  -2.381  -9.536
  395   1HB   HIS  62          1HB       HIS  62  32.284  -0.150  -9.355
  396   2HB   HIS  62          2HB       HIS  62  33.859   0.522  -9.725
  397    HD1  HIS  62           HD1      HIS  62  31.208   0.170 -11.643
  398    HD2  HIS  62           HD2      HIS  62  34.825  -1.948 -11.807
  399    HE1  HIS  62           HE1      HIS  62  31.403  -0.729 -14.023
  400    H    HIS  63           H        HIS  63  36.036  -1.269 -10.418
  401    HA   HIS  63           HA       HIS  63  38.077  -1.605  -8.726
  402   1HB   HIS  63          1HB       HIS  63  38.192   0.602 -10.772
  403   2HB   HIS  63          2HB       HIS  63  39.450  -0.519 -10.293
  404    HD1  HIS  63           HD1      HIS  63  38.867  -3.171 -10.963
  405    HD2  HIS  63           HD2      HIS  63  36.897  -0.125 -13.069
  406    HE1  HIS  63           HE1      HIS  63  37.997  -4.236 -13.112
  407    H    HIS  64           H        HIS  64  39.225  -0.453  -7.164
  408    HA   HIS  64           HA       HIS  64  37.778   1.782  -6.060
  409   1HB   HIS  64          1HB       HIS  64  38.492   0.039  -4.554
  410   2HB   HIS  64          2HB       HIS  64  40.153   0.172  -5.097
  411    HD1  HIS  64           HD1      HIS  64  37.623   2.731  -3.730
  412    HD2  HIS  64           HD2      HIS  64  41.590   1.478  -3.196
  413    HE1  HIS  64           HE1      HIS  64  38.601   4.215  -1.899
  414    H    HIS  65           H        HIS  65  41.235   1.087  -6.966
  415    HA   HIS  65           HA       HIS  65  42.817   2.377  -7.767
  416   1HB   HIS  65          1HB       HIS  65  40.459   3.984  -8.770
  417   2HB   HIS  65          2HB       HIS  65  42.118   4.405  -9.147
  418    HD1  HIS  65           HD1      HIS  65  43.468   1.933 -10.019
  419    HD2  HIS  65           HD2      HIS  65  39.414   2.600 -10.862
  420    HE1  HIS  65           HE1      HIS  65  42.896   0.439 -12.007
  421    H    GLN  66           H        GLN  66  43.755   2.862  -5.747
  422    HA   GLN  66           HA       GLN  66  42.737   4.786  -4.037
  423   1HB   GLN  66          1HB       GLN  66  44.535   2.915  -3.667
  424   2HB   GLN  66          2HB       GLN  66  45.688   4.112  -4.221
  425   1HG   GLN  66          1HG       GLN  66  45.567   5.306  -2.275
  426   2HG   GLN  66          2HG       GLN  66  43.818   5.211  -2.218
  427   1HE2  GLN  66          1HE2      GLN  66  44.484   4.993   0.110
  428   2HE2  GLN  66          2HE2      GLN  66  44.695   3.395   0.744
  429    H    THR  67           H        THR  67  44.401   6.734  -3.348
  430    HA   THR  67           HA       THR  67  44.218   8.582  -5.479
  431    HB   THR  67           HB       THR  67  45.726   9.863  -3.651
  432    HG1  THR  67           HG1      THR  67  45.266   8.680  -1.584
  433   1HG2  THR  67          1HG2      THR  67  42.828   9.012  -3.544
  434   2HG2  THR  67          2HG2      THR  67  43.529   9.762  -2.090
  435   3HG2  THR  67          3HG2      THR  67  43.516  10.652  -3.631
  436    H    ARG  68           H        ARG  68  45.716   9.459  -6.866
  437    HA   ARG  68           HA       ARG  68  47.621   7.858  -7.851
  438   1HB   ARG  68          1HB       ARG  68  46.707  10.462  -8.340
  439   2HB   ARG  68          2HB       ARG  68  48.401  10.719  -7.973
  440   1HG   ARG  68          1HG       ARG  68  48.383  10.333 -10.317
  441   2HG   ARG  68          2HG       ARG  68  48.900   8.798  -9.647
  442   1HD   ARG  68          1HD       ARG  68  45.954   9.015  -9.846
  443   2HD   ARG  68          2HD       ARG  68  46.748   9.177 -11.400
  444    HE   ARG  68           HE       ARG  68  47.749   6.940  -9.774
  445   1HH1  ARG  68          2HH2      ARG  68  45.386   7.943 -12.216
  446   2HH1  ARG  68          1HH2      ARG  68  45.135   6.337 -12.812
  447   1HH2  ARG  68          1HH       ARG  68  46.340   4.516 -11.825
  448    H    GLY  69           H        GLY  69  50.109   8.273  -7.909
  449   1HA   GLY  69          1HA       GLY  69  51.113   8.088  -5.244
  450   2HA   GLY  69          2HA       GLY  69  52.029   8.054  -6.738
  451    H    ALA  70           H        ALA  70  53.208   9.849  -7.347
  452    HA   ALA  70           HA       ALA  70  52.453  12.475  -6.686
  453   1HB   ALA  70          1HB       ALA  70  54.699  11.276  -5.013
  454   2HB   ALA  70          2HB       ALA  70  54.207  12.986  -5.035
  455   3HB   ALA  70          3HB       ALA  70  53.093  11.748  -4.407
  456    H    TYR  71           H        TYR  71  52.864  11.903  -9.108
  457    HA   TYR  71           HA       TYR  71  55.228  11.312 -10.230
  458   1HB   TYR  71          1HB       TYR  71  54.294  12.508 -12.120
  459   2HB   TYR  71          2HB       TYR  71  52.885  12.095 -11.164
  460    HD1  TYR  71           HD1      TYR  71  54.689  14.738 -12.728
  461    HD2  TYR  71           HD2      TYR  71  52.042  13.898  -9.474
  462    HE1  TYR  71           HE1      TYR  71  54.038  17.193 -12.615
  463    HE2  TYR  71           HE2      TYR  71  51.399  16.355  -9.372
  464    HH   TYR  71           HH       TYR  71  53.131  18.723 -10.633
  465    H    SER  72           H        SER  72  57.045  12.535 -11.096
  466    HA   SER  72           HA       SER  72  58.701  13.928 -10.948
  467   1HB   SER  72          1HB       SER  72  56.770  16.008  -9.838
  468   2HB   SER  72          2HB       SER  72  58.288  16.315 -10.659
  469    HG   SER  72           HG       SER  72  55.980  16.298 -11.827
  470    H    SER  73           H        SER  73  60.216  15.042  -9.383
  471    HA   SER  73           HA       SER  73  59.495  15.112  -6.662
  472   1HB   SER  73          1HB       SER  73  59.925  12.587  -7.243
  473   2HB   SER  73          2HB       SER  73  61.617  13.041  -7.297
  474    HG   SER  73           HG       SER  73  61.021  14.084  -5.059
  475    H    HIS  74           H        HIS  74  60.374  17.209  -6.638
  476    HA   HIS  74           HA       HIS  74  62.837  17.802  -7.870
  477   1HB   HIS  74          1HB       HIS  74  62.543  19.981  -7.029
  478   2HB   HIS  74          2HB       HIS  74  60.935  19.391  -7.402
  479    HD1  HIS  74           HD1      HIS  74  62.759  21.076  -4.797
  480    HD2  HIS  74           HD2      HIS  74  59.617  18.297  -4.888
  481    HE1  HIS  74           HE1      HIS  74  61.614  21.215  -2.521
  482    H    ASP  75           H        ASP  75  64.861  17.323  -7.191
  483    HA   ASP  75           HA       ASP  75  65.136  16.339  -4.506
  484   1HB   ASP  75          1HB       ASP  75  66.244  15.021  -6.178
  485   2HB   ASP  75          2HB       ASP  75  66.925  16.434  -6.960
  486    HD2  ASP  75           HD2      ASP  75  69.247  15.006  -6.339
  Start of MODEL   16
    1    H    MET   1           H        MET   1 -13.837  27.831   7.699
    2    HA   MET   1           HA       MET   1 -15.653  29.304   9.449
    3   1HB   MET   1          1HB       MET   1 -13.718  30.559   8.184
    4   2HB   MET   1          2HB       MET   1 -14.635  30.248   6.723
    5   1HG   MET   1          1HG       MET   1 -16.605  31.439   7.690
    6   2HG   MET   1          2HG       MET   1 -15.719  31.721   9.175
    7   1HE   MET   1          1HE       MET   1 -15.748  31.896   5.502
    8   2HE   MET   1          2HE       MET   1 -16.381  33.557   5.601
    9   3HE   MET   1          3HE       MET   1 -14.723  33.269   5.020
   10    H    GLU   2           H        GLU   2 -17.755  28.710   9.166
   11    HA   GLU   2           HA       GLU   2 -18.529  27.015   7.127
   12   1HB   GLU   2          1HB       GLU   2 -19.617  27.864   9.501
   13   2HB   GLU   2          2HB       GLU   2 -20.645  28.714   8.365
   14   1HG   GLU   2          1HG       GLU   2 -21.556  26.759   7.494
   15   2HG   GLU   2          2HG       GLU   2 -20.091  25.830   7.747
   16    HE2  GLU   2           HE2      GLU   2 -23.111  25.976  10.130
   17    H    VAL   3           H        VAL   3 -19.438  27.327   5.090
   18    HA   VAL   3           HA       VAL   3 -19.435  30.099   4.164
   19    HB   VAL   3           HB       VAL   3 -19.652  27.640   2.450
   20   1HG1  VAL   3          1HG1      VAL   3 -18.932  28.995   0.707
   21   2HG1  VAL   3          2HG1      VAL   3 -19.927  30.119   1.664
   22   3HG1  VAL   3          3HG1      VAL   3 -18.152  30.166   1.797
   23   1HG2  VAL   3          1HG2      VAL   3 -17.195  28.730   3.821
   24   2HG2  VAL   3          2HG2      VAL   3 -17.750  27.045   3.676
   25   3HG2  VAL   3          3HG2      VAL   3 -17.082  27.887   2.257
   26    H    ALA   4           H        ALA   4 -21.234  30.942   2.944
   27    HA   ALA   4           HA       ALA   4 -23.681  30.571   4.027
   28   1HB   ALA   4          1HB       ALA   4 -22.575  32.135   2.055
   29   2HB   ALA   4          2HB       ALA   4 -23.719  31.140   1.122
   30   3HB   ALA   4          3HB       ALA   4 -24.302  32.121   2.488
   31    H    MET   5           H        MET   5 -25.671  29.510   3.267
   32    HA   MET   5           HA       MET   5 -25.009  27.013   1.909
   33   1HB   MET   5          1HB       MET   5 -25.914  27.197   4.433
   34   2HB   MET   5          2HB       MET   5 -27.469  27.408   3.653
   35   1HG   MET   5          1HG       MET   5 -27.498  25.232   2.787
   36   2HG   MET   5          2HG       MET   5 -25.751  25.124   2.697
   37   1HE   MET   5          1HE       MET   5 -27.001  22.318   4.637
   38   2HE   MET   5          2HE       MET   5 -28.427  23.215   5.212
   39   3HE   MET   5          3HE       MET   5 -27.945  23.312   3.501
   40    H    VAL   6           H        VAL   6 -26.498  26.179   0.321
   41    HA   VAL   6           HA       VAL   6 -27.907  28.266  -1.055
   42    HB   VAL   6           HB       VAL   6 -26.472  26.311  -1.979
   43   1HG1  VAL   6          1HG1      VAL   6 -28.354  24.757  -0.727
   44   2HG1  VAL   6          2HG1      VAL   6 -28.953  24.776  -2.403
   45   3HG1  VAL   6          3HG1      VAL   6 -27.299  24.217  -2.056
   46   1HG2  VAL   6          1HG2      VAL   6 -28.898  26.382  -3.626
   47   2HG2  VAL   6          2HG2      VAL   6 -28.377  27.992  -3.072
   48   3HG2  VAL   6          3HG2      VAL   6 -27.252  26.956  -3.983
   49    H    SER   7           H        SER   7 -30.114  26.919  -2.140
   50    HA   SER   7           HA       SER   7 -32.188  26.397  -1.765
   51   1HB   SER   7          1HB       SER   7 -30.828  25.055   0.498
   52   2HB   SER   7          2HB       SER   7 -32.515  25.408   0.815
   53    HG   SER   7           HG       SER   7 -32.942  24.381  -1.358
   54    H    ALA   8           H        ALA   8 -33.376  28.283  -1.697
   55    HA   ALA   8           HA       ALA   8 -33.023  30.148   0.443
   56   1HB   ALA   8          1HB       ALA   8 -33.689  30.388  -2.159
   57   2HB   ALA   8          2HB       ALA   8 -35.323  30.341  -1.456
   58   3HB   ALA   8          3HB       ALA   8 -34.164  31.587  -0.933
   59    H    GLU   9           H        GLU   9 -33.624  29.134   2.393
   60    HA   GLU   9           HA       GLU   9 -34.946  28.400   3.952
   61   1HB   GLU   9          1HB       GLU   9 -36.192  30.401   3.870
   62   2HB   GLU   9          2HB       GLU   9 -36.881  30.034   2.302
   63   1HG   GLU   9          1HG       GLU   9 -38.229  28.190   3.318
   64   2HG   GLU   9          2HG       GLU   9 -37.532  28.540   4.887
   65    HE2  GLU   9           HE2      GLU   9 -38.542  30.345   6.005
   66    H    SER  10           H        SER  10 -36.717  26.805   4.541
   67    HA   SER  10           HA       SER  10 -37.952  25.378   2.456
   68   1HB   SER  10          1HB       SER  10 -35.571  24.535   2.275
   69   2HB   SER  10          2HB       SER  10 -35.699  23.927   3.914
   70    HG   SER  10           HG       SER  10 -36.287  22.546   1.817
   71    H    SER  11           H        SER  11 -39.583  23.959   3.305
   72    HA   SER  11           HA       SER  11 -39.605  22.994   5.872
   73   1HB   SER  11          1HB       SER  11 -39.859  25.636   6.176
   74   2HB   SER  11          2HB       SER  11 -41.531  25.315   5.762
   75    HG   SER  11           HG       SER  11 -40.396  23.588   7.699
   76    H    GLY  12           H        GLY  12 -40.863  21.211   5.489
   77   1HA   GLY  12          1HA       GLY  12 -43.557  21.467   4.583
   78   2HA   GLY  12          2HA       GLY  12 -42.516  20.839   3.322
   79    H    CYS  13           H        CYS  13 -40.768  19.129   4.388
   80    HA   CYS  13           HA       CYS  13 -40.441  17.185   5.369
   81   1HB   CYS  13          1HB       CYS  13 -41.599  18.433   7.392
   82   2HB   CYS  13          2HB       CYS  13 -42.921  17.332   7.059
   83    HG   CYS  13           HG       CYS  13 -41.580  15.129   7.190
   84    H    ASN  14           H        ASN  14 -41.208  16.808   2.967
   85    HA   ASN  14           HA       ASN  14 -43.780  15.491   2.909
   86   1HB   ASN  14          1HB       ASN  14 -42.093  16.915   0.985
   87   2HB   ASN  14          2HB       ASN  14 -42.496  15.330   0.356
   88   1HD2  ASN  14          1HD2      ASN  14 -43.880  18.213   1.878
   89   2HD2  ASN  14          2HD2      ASN  14 -45.428  18.162   1.102
   90    H    SER  15           H        SER  15 -41.252  14.426   4.271
   91    HA   SER  15           HA       SER  15 -40.952  12.028   2.635
   92   1HB   SER  15          1HB       SER  15 -38.715  11.785   3.894
   93   2HB   SER  15          2HB       SER  15 -38.803  13.035   2.669
   94    HG   SER  15           HG       SER  15 -37.896  14.044   4.438
   95    H    HIS  16           H        HIS  16 -43.026  11.441   3.863
   96    HA   HIS  16           HA       HIS  16 -42.278  10.371   6.486
   97   1HB   HIS  16          1HB       HIS  16 -44.463  12.152   5.744
   98   2HB   HIS  16          2HB       HIS  16 -45.057  10.684   6.494
   99    HD1  HIS  16           HD1      HIS  16 -43.498  13.925   7.270
  100    HD2  HIS  16           HD2      HIS  16 -43.922  10.209   9.169
  101    HE1  HIS  16           HE1      HIS  16 -42.981  14.320   9.737
  102    H    MET  17           H        MET  17 -41.586   8.655   4.720
  103    HA   MET  17           HA       MET  17 -43.402   7.263   3.271
  104   1HB   MET  17          1HB       MET  17 -40.712   6.861   4.400
  105   2HB   MET  17          2HB       MET  17 -41.585   5.342   4.357
  106   1HG   MET  17          1HG       MET  17 -41.903   5.452   1.983
  107   2HG   MET  17          2HG       MET  17 -41.539   7.165   1.922
  108   1HE   MET  17          1HE       MET  17 -39.318   7.057   0.083
  109   2HE   MET  17          2HE       MET  17 -38.693   5.395  -0.048
  110   3HE   MET  17          3HE       MET  17 -40.448   5.691  -0.077
  111    HA   PRO  18           HA       PRO  18 -45.782   4.956   6.070
  112   1HB   PRO  18          1HB       PRO  18 -46.366   2.693   4.654
  113   2HB   PRO  18          2HB       PRO  18 -47.195   4.217   4.409
  114   1HG   PRO  18          1HG       PRO  18 -45.143   2.930   2.714
  115   2HG   PRO  18          2HG       PRO  18 -46.272   4.203   2.295
  116   1HD   PRO  18          1HD       PRO  18 -43.477   4.506   2.862
  117   2HD   PRO  18          2HD       PRO  18 -44.629   5.790   2.557
  118    H    TYR  19           H        TYR  19 -46.160   2.555   6.979
  119    HA   TYR  19           HA       TYR  19 -44.184   2.033   8.685
  120   1HB   TYR  19          1HB       TYR  19 -46.526   0.898   8.090
  121   2HB   TYR  19          2HB       TYR  19 -45.584  -0.171   7.071
  122    HD1  TYR  19           HD1      TYR  19 -43.540  -1.365   8.272
  123    HD2  TYR  19           HD2      TYR  19 -46.920   0.292  10.305
  124    HE1  TYR  19           HE1      TYR  19 -43.072  -2.854  10.280
  125    HE2  TYR  19           HE2      TYR  19 -46.440  -1.202  12.305
  126    HH   TYR  19           HH       TYR  19 -45.312  -3.379  12.694
  127    H    GLY  20           H        GLY  20 -42.011   1.963   8.317
  128   1HA   GLY  20          1HA       GLY  20 -40.988  -0.170   6.647
  129   2HA   GLY  20          2HA       GLY  20 -40.642   1.446   6.061
  130    H    TYR  21           H        TYR  21 -38.936   2.590   6.933
  131    HA   TYR  21           HA       TYR  21 -37.368   1.221   8.932
  132   1HB   TYR  21          1HB       TYR  21 -37.084   3.932   7.492
  133   2HB   TYR  21          2HB       TYR  21 -35.787   3.093   8.319
  134    HD1  TYR  21           HD1      TYR  21 -37.920   3.127   5.312
  135    HD2  TYR  21           HD2      TYR  21 -34.647   1.208   7.290
  136    HE1  TYR  21           HE1      TYR  21 -37.296   1.946   3.149
  137    HE2  TYR  21           HE2      TYR  21 -34.034   0.033   5.120
  138    HH   TYR  21           HH       TYR  21 -35.886  -0.492   2.772
  139    H    ALA  22           H        ALA  22 -39.803   1.937  10.092
  140    HA   ALA  22           HA       ALA  22 -39.615   4.501  11.322
  141   1HB   ALA  22          1HB       ALA  22 -41.338   2.675  12.736
  142   2HB   ALA  22          2HB       ALA  22 -41.782   4.041  11.684
  143   3HB   ALA  22          3HB       ALA  22 -41.538   2.422  10.986
  144    H    ALA  23           H        ALA  23 -39.226   1.078  12.488
  145    HA   ALA  23           HA       ALA  23 -37.996   2.099  14.911
  146   1HB   ALA  23          1HB       ALA  23 -38.361  -0.809  14.168
  147   2HB   ALA  23          2HB       ALA  23 -38.356  -0.054  15.780
  148   3HB   ALA  23          3HB       ALA  23 -39.747   0.176  14.693
  149    H    GLN  24           H        GLN  24 -36.853   2.145  11.983
  150    HA   GLN  24           HA       GLN  24 -34.562   0.450  12.332
  151   1HB   GLN  24          1HB       GLN  24 -35.724   2.105  10.115
  152   2HB   GLN  24          2HB       GLN  24 -33.993   1.837  10.073
  153   1HG   GLN  24          1HG       GLN  24 -35.907  -0.483  10.514
  154   2HG   GLN  24          2HG       GLN  24 -35.567   0.097   8.896
  155   1HE2  GLN  24          1HE2      GLN  24 -34.380  -1.551  11.688
  156   2HE2  GLN  24          2HE2      GLN  24 -32.867  -2.103  11.048
  157    H    ALA  25           H        ALA  25 -35.496   3.379  13.588
  158    HA   ALA  25           HA       ALA  25 -33.323   5.057  13.096
  159   1HB   ALA  25          1HB       ALA  25 -34.456   5.320  15.774
  160   2HB   ALA  25          2HB       ALA  25 -34.557   6.429  14.386
  161   3HB   ALA  25          3HB       ALA  25 -35.727   5.097  14.547
  162    H    ARG  26           H        ARG  26 -33.625   2.105  14.933
  163    HA   ARG  26           HA       ARG  26 -31.596   2.680  16.781
  164   1HB   ARG  26          1HB       ARG  26 -33.468   0.611  16.349
  165   2HB   ARG  26          2HB       ARG  26 -31.920  -0.179  16.124
  166   1HG   ARG  26          1HG       ARG  26 -31.755  -0.309  18.383
  167   2HG   ARG  26          2HG       ARG  26 -31.511   1.426  18.398
  168   1HD   ARG  26          1HD       ARG  26 -34.325   0.283  18.308
  169   2HD   ARG  26          2HD       ARG  26 -33.469   0.398  19.833
  170    HE   ARG  26           HE       ARG  26 -33.346   2.901  18.358
  171   1HH1  ARG  26          2HH2      ARG  26 -35.434   0.960  20.462
  172   2HH1  ARG  26          1HH2      ARG  26 -36.331   2.324  21.040
  173   1HH2  ARG  26          1HH       ARG  26 -35.781   4.515  20.238
  174    H    ALA  27           H        ALA  27 -31.732   1.423  13.457
  175    HA   ALA  27           HA       ALA  27 -29.136   0.289  13.443
  176   1HB   ALA  27          1HB       ALA  27 -30.710   1.332  11.065
  177   2HB   ALA  27          2HB       ALA  27 -29.528   0.002  11.107
  178   3HB   ALA  27          3HB       ALA  27 -31.115  -0.193  11.889
  179    H    ARG  28           H        ARG  28 -30.496   3.542  12.991
  180    HA   ARG  28           HA       ARG  28 -28.366   4.638  11.629
  181   1HB   ARG  28          1HB       ARG  28 -30.788   5.564  12.379
  182   2HB   ARG  28          2HB       ARG  28 -29.860   6.279  13.682
  183   1HG   ARG  28          1HG       ARG  28 -29.172   7.933  12.296
  184   2HG   ARG  28          2HG       ARG  28 -28.382   6.753  11.269
  185   1HD   ARG  28          1HD       ARG  28 -29.886   7.331   9.659
  186   2HD   ARG  28          2HD       ARG  28 -31.079   6.443  10.586
  187    HE   ARG  28           HE       ARG  28 -31.971   8.478  11.393
  188   1HH1  ARG  28          2HH2      ARG  28 -28.942   9.086   9.660
  189   2HH1  ARG  28          1HH2      ARG  28 -29.168  10.803   9.614
  190   1HH2  ARG  28          1HH       ARG  28 -31.131  11.755  10.604
  191    H    GLU  29           H        GLU  29 -28.876   3.845  15.057
  192    HA   GLU  29           HA       GLU  29 -26.685   5.449  15.922
  193   1HB   GLU  29          1HB       GLU  29 -28.787   3.770  17.162
  194   2HB   GLU  29          2HB       GLU  29 -27.251   3.696  18.002
  195   1HG   GLU  29          1HG       GLU  29 -27.200   6.241  18.000
  196   2HG   GLU  29          2HG       GLU  29 -28.813   6.228  17.315
  197    HE2  GLU  29           HE2      GLU  29 -30.557   5.410  19.744
  198    H    ARG  30           H        ARG  30 -27.220   2.194  14.710
  199    HA   ARG  30           HA       ARG  30 -24.736   1.272  15.813
  200   1HB   ARG  30          1HB       ARG  30 -27.100   0.058  14.449
  201   2HB   ARG  30          2HB       ARG  30 -25.573  -0.711  14.067
  202   1HG   ARG  30          1HG       ARG  30 -25.332  -0.421  16.803
  203   2HG   ARG  30          2HG       ARG  30 -27.064  -0.637  16.649
  204   1HD   ARG  30          1HD       ARG  30 -26.674  -2.727  15.307
  205   2HD   ARG  30          2HD       ARG  30 -24.944  -2.514  15.490
  206    HE   ARG  30           HE       ARG  30 -26.417  -2.538  18.035
  207   1HH1  ARG  30          2HH2      ARG  30 -24.729  -4.511  15.624
  208   2HH1  ARG  30          1HH2      ARG  30 -24.418  -5.812  16.725
  209   1HH2  ARG  30          1HH       ARG  30 -25.178  -5.638  18.991
  210    H    GLU  31           H        GLU  31 -26.115   2.559  12.814
  211    HA   GLU  31           HA       GLU  31 -24.165   1.578  11.078
  212   1HB   GLU  31          1HB       GLU  31 -26.236   3.760  10.996
  213   2HB   GLU  31          2HB       GLU  31 -24.991   3.772   9.763
  214   1HG   GLU  31          1HG       GLU  31 -25.569   1.240   9.430
  215   2HG   GLU  31          2HG       GLU  31 -27.018   1.583  10.353
  216    HE2  GLU  31           HE2      GLU  31 -26.123   2.564   6.748
  217    H    ARG  32           H        ARG  32 -24.247   4.241  13.391
  218    HA   ARG  32           HA       ARG  32 -22.352   5.871  12.263
  219   1HB   ARG  32          1HB       ARG  32 -23.648   5.524  14.863
  220   2HB   ARG  32          2HB       ARG  32 -21.963   5.947  15.092
  221   1HG   ARG  32          1HG       ARG  32 -22.212   8.055  14.165
  222   2HG   ARG  32          2HG       ARG  32 -23.407   7.523  12.998
  223   1HD   ARG  32          1HD       ARG  32 -24.882   7.169  15.243
  224   2HD   ARG  32          2HD       ARG  32 -23.797   8.403  15.853
  225    HE   ARG  32           HE       ARG  32 -24.740   9.223  13.277
  226   1HH1  ARG  32          2HH2      ARG  32 -25.940   8.785  16.582
  227   2HH1  ARG  32          1HH2      ARG  32 -27.179   9.985  16.424
  228   1HH2  ARG  32          1HH       ARG  32 -27.417  11.160  14.349
  229    H    LEU  33           H        LEU  33 -22.083   2.791  14.011
  230    HA   LEU  33           HA       LEU  33 -19.214   3.104  14.318
  231   1HB   LEU  33          1HB       LEU  33 -21.229   1.796  15.745
  232   2HB   LEU  33          2HB       LEU  33 -20.311   0.507  14.993
  233    HG   LEU  33           HG       LEU  33 -18.688   2.609  16.306
  234   1HD1  LEU  33          1HD1      LEU  33 -20.376   2.596  17.960
  235   2HD1  LEU  33          2HD1      LEU  33 -20.563   0.828  17.870
  236   3HD1  LEU  33          3HD1      LEU  33 -19.084   1.533  18.566
  237   1HD2  LEU  33          1HD2      LEU  33 -17.707   0.348  17.254
  238   2HD2  LEU  33          2HD2      LEU  33 -18.619  -0.352  15.894
  239   3HD2  LEU  33          3HD2      LEU  33 -17.371   0.881  15.589
  240    H    ALA  34           H        ALA  34 -21.491   2.065  11.972
  241    HA   ALA  34           HA       ALA  34 -19.815   0.003  10.861
  242   1HB   ALA  34          1HB       ALA  34 -22.044   1.199   9.288
  243   2HB   ALA  34          2HB       ALA  34 -21.658  -0.508   9.611
  244   3HB   ALA  34          3HB       ALA  34 -22.492   0.464  10.846
  245    H    HIS  35           H        HIS  35 -19.361   3.225  11.135
  246    HA   HIS  35           HA       HIS  35 -18.684   3.708   8.362
  247   1HB   HIS  35          1HB       HIS  35 -19.827   5.360  10.013
  248   2HB   HIS  35          2HB       HIS  35 -18.215   5.607  10.654
  249    HD1  HIS  35           HD1      HIS  35 -17.916   8.008   9.818
  250    HD2  HIS  35           HD2      HIS  35 -18.857   5.291   6.763
  251    HE1  HIS  35           HE1      HIS  35 -17.582   9.260   7.620
  252    H    SER  36           H        SER  36 -17.289   2.325  11.156
  253    HA   SER  36           HA       SER  36 -14.636   3.232  10.510
  254   1HB   SER  36          1HB       SER  36 -15.909   1.670  12.745
  255   2HB   SER  36          2HB       SER  36 -14.200   1.415  12.454
  256    HG   SER  36           HG       SER  36 -14.949   4.122  12.461
  257    H    ARG  37           H        ARG  37 -16.837   0.637   9.767
  258    HA   ARG  37           HA       ARG  37 -14.709  -1.187   9.153
  259   1HB   ARG  37          1HB       ARG  37 -17.314  -1.557   9.984
  260   2HB   ARG  37          2HB       ARG  37 -17.500  -1.796   8.258
  261   1HG   ARG  37          1HG       ARG  37 -15.479  -3.412   8.409
  262   2HG   ARG  37          2HG       ARG  37 -15.661  -3.322  10.150
  263   1HD   ARG  37          1HD       ARG  37 -18.051  -4.002   8.400
  264   2HD   ARG  37          2HD       ARG  37 -16.894  -5.245   8.834
  265    HE   ARG  37           HE       ARG  37 -17.848  -3.670  11.123
  266   1HH1  ARG  37          2HH2      ARG  37 -18.437  -6.524   9.108
  267   2HH1  ARG  37          1HH2      ARG  37 -19.375  -7.337  10.316
  268   1HH2  ARG  37          1HH       ARG  37 -19.743  -6.270  12.430
  269    H    ALA  38           H        ALA  38 -15.500   1.545   7.722
  270    HA   ALA  38           HA       ALA  38 -16.120   0.614   5.062
  271   1HB   ALA  38          1HB       ALA  38 -16.746   2.866   6.408
  272   2HB   ALA  38          2HB       ALA  38 -15.255   3.421   5.610
  273   3HB   ALA  38          3HB       ALA  38 -16.613   2.813   4.633
  274    H    ALA  39           H        ALA  39 -13.407   2.454   6.645
  275    HA   ALA  39           HA       ALA  39 -11.709   2.186   4.414
  276   1HB   ALA  39          1HB       ALA  39 -10.961   3.908   5.697
  277   2HB   ALA  39          2HB       ALA  39 -11.599   3.198   7.199
  278   3HB   ALA  39          3HB       ALA  39 -10.043   2.639   6.541
  279    H    ALA  40           H        ALA  40  -9.694   0.912   4.296
  280    HA   ALA  40           HA       ALA  40 -10.180  -1.766   5.298
  281   1HB   ALA  40          1HB       ALA  40  -7.759  -1.233   3.691
  282   2HB   ALA  40          2HB       ALA  40  -9.056  -2.426   3.443
  283   3HB   ALA  40          3HB       ALA  40  -9.277  -0.746   2.900
  284    H    ALA  41           H        ALA  41  -7.284   0.429   5.072
  285    HA   ALA  41           HA       ALA  41  -5.609  -0.816   6.736
  286   1HB   ALA  41          1HB       ALA  41  -5.379   1.879   7.484
  287   2HB   ALA  41          2HB       ALA  41  -4.554   1.078   6.126
  288   3HB   ALA  41          3HB       ALA  41  -6.095   1.926   5.855
  289    H    ALA  42           H        ALA  42  -6.377  -1.984   8.487
  290    HA   ALA  42           HA       ALA  42  -7.945  -0.491  10.460
  291   1HB   ALA  42          1HB       ALA  42  -7.722  -3.339   9.593
  292   2HB   ALA  42          2HB       ALA  42  -8.002  -3.052  11.327
  293   3HB   ALA  42          3HB       ALA  42  -9.147  -2.413  10.123
  294    H    ALA  43           H        ALA  43  -5.571  -3.223  10.687
  295    HA   ALA  43           HA       ALA  43  -4.615  -2.502  13.169
  296   1HB   ALA  43          1HB       ALA  43  -2.959  -3.855  11.019
  297   2HB   ALA  43          2HB       ALA  43  -2.936  -4.134  12.777
  298   3HB   ALA  43          3HB       ALA  43  -4.330  -4.671  11.809
  299    H    VAL  44           H        VAL  44  -4.125  -1.009  10.061
  300    HA   VAL  44           HA       VAL  44  -1.665   0.275  10.921
  301    HB   VAL  44           HB       VAL  44  -3.058  -0.278   8.410
  302   1HG1  VAL  44          1HG1      VAL  44  -1.927   1.789   7.323
  303   2HG1  VAL  44          2HG1      VAL  44  -3.494   2.001   8.140
  304   3HG1  VAL  44          3HG1      VAL  44  -1.991   2.489   8.959
  305   1HG2  VAL  44          1HG2      VAL  44  -0.190   0.270   9.225
  306   2HG2  VAL  44          2HG2      VAL  44  -0.942  -1.298   8.849
  307   3HG2  VAL  44          3HG2      VAL  44  -0.686  -0.101   7.557
  308    H    ALA  45           H        ALA  45  -5.153   0.844  10.589
  309    HA   ALA  45           HA       ALA  45  -5.353   3.527  10.457
  310   1HB   ALA  45          1HB       ALA  45  -7.504   3.201  11.202
  311   2HB   ALA  45          2HB       ALA  45  -7.068   1.503  10.892
  312   3HB   ALA  45          3HB       ALA  45  -6.995   2.152  12.548
  313    H    ALA  46           H        ALA  46  -5.030   1.665  13.570
  314    HA   ALA  46           HA       ALA  46  -4.611   3.991  15.098
  315   1HB   ALA  46          1HB       ALA  46  -5.000   1.211  15.500
  316   2HB   ALA  46          2HB       ALA  46  -3.448   1.613  16.274
  317   3HB   ALA  46          3HB       ALA  46  -4.927   2.488  16.738
  318    H    ALA  47           H        ALA  47  -2.325   1.387  13.986
  319    HA   ALA  47           HA       ALA  47  -0.027   2.653  14.903
  320   1HB   ALA  47          1HB       ALA  47   0.864   0.728  14.156
  321   2HB   ALA  47          2HB       ALA  47  -0.749   0.286  13.546
  322   3HB   ALA  47          3HB       ALA  47   0.412   1.110  12.477
  323    H    THR  48           H        THR  48   1.750   2.943  12.792
  324    HA   THR  48           HA       THR  48   2.481   4.432  11.313
  325    HB   THR  48           HB       THR  48  -0.458   4.359  10.450
  326    HG1  THR  48           HG1      THR  48   0.391   2.364   9.941
  327   1HG2  THR  48          1HG2      THR  48   1.366   6.232   9.572
  328   2HG2  THR  48          2HG2      THR  48   1.747   4.868   8.495
  329   3HG2  THR  48          3HG2      THR  48   0.098   5.536   8.536
  330    H    ALA  49           H        ALA  49   2.636   5.579  13.574
  331    HA   ALA  49           HA       ALA  49   0.962   7.607  14.305
  332   1HB   ALA  49          1HB       ALA  49   2.705   8.281  15.686
  333   2HB   ALA  49          2HB       ALA  49   3.204   6.615  15.305
  334   3HB   ALA  49          3HB       ALA  49   3.946   7.985  14.444
  335    H    ALA  50           H        ALA  50   0.499   9.672  13.610
  336    HA   ALA  50           HA       ALA  50   1.500  10.362  10.990
  337   1HB   ALA  50          1HB       ALA  50  -0.338  11.787  10.881
  338   2HB   ALA  50          2HB       ALA  50  -0.941  10.527  11.984
  339   3HB   ALA  50          3HB       ALA  50  -0.353  12.074  12.637
  340    H    VAL  51           H        VAL  51   3.675  10.329  12.624
  341    HA   VAL  51           HA       VAL  51   4.162  13.194  13.039
  342    HB   VAL  51           HB       VAL  51   3.820  11.767  15.141
  343   1HG1  VAL  51          1HG1      VAL  51   6.667  10.962  15.011
  344   2HG1  VAL  51          2HG1      VAL  51   5.265  10.124  15.717
  345   3HG1  VAL  51          3HG1      VAL  51   5.562  10.040  13.964
  346   1HG2  VAL  51          1HG2      VAL  51   6.276  13.474  14.664
  347   2HG2  VAL  51          2HG2      VAL  51   4.711  13.957  15.361
  348   3HG2  VAL  51          3HG2      VAL  51   5.801  12.890  16.277
  349    H    GLU  52           H        GLU  52   4.623  12.243  10.571
  350    HA   GLU  52           HA       GLU  52   6.756  10.785   9.968
  351   1HB   GLU  52          1HB       GLU  52   5.164  12.097   8.424
  352   2HB   GLU  52          2HB       GLU  52   6.241  13.465   8.623
  353   1HG   GLU  52          1HG       GLU  52   8.063  12.351   7.556
  354   2HG   GLU  52          2HG       GLU  52   7.346  10.767   7.776
  355    HE2  GLU  52           HE2      GLU  52   7.941  11.157   5.275
  356    H    GLY  53           H        GLY  53   9.041  11.052   9.741
  357   1HA   GLY  53          1HA       GLY  53  11.069  12.051  10.018
  358   2HA   GLY  53          2HA       GLY  53  10.285  13.540  10.506
  359    H    THR  54           H        THR  54  11.590  10.426  11.578
  360    HA   THR  54           HA       THR  54  11.838  11.468  14.255
  361    HB   THR  54           HB       THR  54  10.127   9.002  13.633
  362    HG1  THR  54           HG1      THR  54   9.739  11.655  14.832
  363   1HG2  THR  54          1HG2      THR  54  11.644   9.685  15.998
  364   2HG2  THR  54          2HG2      THR  54   9.923   9.982  16.342
  365   3HG2  THR  54          3HG2      THR  54  10.458   8.373  15.802
  366    H    GLY  55           H        GLY  55  13.528  10.545  15.401
  367   1HA   GLY  55          1HA       GLY  55  14.980   8.641  15.713
  368   2HA   GLY  55          2HA       GLY  55  14.978   8.397  13.977
  369    H    GLY  56           H        GLY  56  17.277   8.867  15.842
  370   1HA   GLY  56          1HA       GLY  56  19.145  10.051  14.530
  371   2HA   GLY  56          2HA       GLY  56  18.232  11.495  14.919
  372    H    SER  57           H        SER  57  20.596   9.239  16.017
  373    HA   SER  57           HA       SER  57  21.257  10.766  18.201
  374   1HB   SER  57          1HB       SER  57  19.000   9.447  18.894
  375   2HB   SER  57          2HB       SER  57  20.155   8.184  19.273
  376    HG   SER  57           HG       SER  57  19.538   9.950  20.961
  377    H    GLY  58           H        GLY  58  23.279  10.046  19.084
  378   1HA   GLY  58          1HA       GLY  58  24.229   7.390  18.306
  379   2HA   GLY  58          2HA       GLY  58  25.081   8.775  17.653
  380    H    GLY  59           H        GLY  59  26.718   7.319  19.099
  381   1HA   GLY  59          1HA       GLY  59  26.781   8.589  21.773
  382   2HA   GLY  59          2HA       GLY  59  27.272   6.934  21.473
  383    H    GLY  60           H        GLY  60  29.463   7.082  22.015
  384   1HA   GLY  60          1HA       GLY  60  31.116   8.546  20.096
  385   2HA   GLY  60          2HA       GLY  60  31.291   8.956  21.790
  386    HA   PRO  61           HA       PRO  61  33.944   5.337  20.916
  387   1HB   PRO  61          1HB       PRO  61  36.374   6.468  21.447
  388   2HB   PRO  61          2HB       PRO  61  35.712   6.335  19.830
  389   1HG   PRO  61          1HG       PRO  61  35.916   8.724  21.559
  390   2HG   PRO  61          2HG       PRO  61  35.662   8.641  19.827
  391   1HD   PRO  61          1HD       PRO  61  33.683   9.199  21.827
  392   2HD   PRO  61          2HD       PRO  61  33.409   9.002  20.107
  393    H    HIS  62           H        HIS  62  35.435   4.082  22.367
  394    HA   HIS  62           HA       HIS  62  34.413   4.532  25.043
  395   1HB   HIS  62          1HB       HIS  62  34.623   2.272  23.575
  396   2HB   HIS  62          2HB       HIS  62  36.152   2.201  24.428
  397    HD1  HIS  62           HD1      HIS  62  34.291   0.007  25.147
  398    HD2  HIS  62           HD2      HIS  62  34.114   3.742  27.050
  399    HE1  HIS  62           HE1      HIS  62  33.123  -0.384  27.382
  400    H    HIS  63           H        HIS  63  35.793   6.578  25.117
  401    HA   HIS  63           HA       HIS  63  38.446   6.745  24.950
  402   1HB   HIS  63          1HB       HIS  63  36.383   8.208  26.160
  403   2HB   HIS  63          2HB       HIS  63  37.562   7.971  27.435
  404    HD1  HIS  63           HD1      HIS  63  36.822  10.654  25.639
  405    HD2  HIS  63           HD2      HIS  63  40.301   8.312  25.535
  406    HE1  HIS  63           HE1      HIS  63  38.662  12.148  24.694
  407    H    HIS  64           H        HIS  64  40.257   6.567  26.496
  408    HA   HIS  64           HA       HIS  64  41.520   5.397  27.855
  409   1HB   HIS  64          1HB       HIS  64  40.118   6.426  29.572
  410   2HB   HIS  64          2HB       HIS  64  38.964   5.112  29.459
  411    HD1  HIS  64           HD1      HIS  64  42.668   5.595  30.332
  412    HD2  HIS  64           HD2      HIS  64  39.435   3.075  31.224
  413    HE1  HIS  64           HE1      HIS  64  43.480   4.009  32.158
  414    H    HIS  65           H        HIS  65  42.273   3.628  26.760
  415    HA   HIS  65           HA       HIS  65  41.734   1.126  27.431
  416   1HB   HIS  65          1HB       HIS  65  39.539   2.124  25.749
  417   2HB   HIS  65          2HB       HIS  65  40.254   0.639  25.154
  418    HD1  HIS  65           HD1      HIS  65  37.369   1.211  26.692
  419    HD2  HIS  65           HD2      HIS  65  40.749  -0.821  28.121
  420    HE1  HIS  65           HE1      HIS  65  36.541  -0.344  28.538
  421    H    GLN  66           H        GLN  66  43.938   0.969  26.962
  422    HA   GLN  66           HA       GLN  66  44.535   1.100  24.108
  423   1HB   GLN  66          1HB       GLN  66  45.612   2.834  25.791
  424   2HB   GLN  66          2HB       GLN  66  46.655   1.497  26.230
  425   1HG   GLN  66          1HG       GLN  66  47.855   1.664  24.301
  426   2HG   GLN  66          2HG       GLN  66  46.409   1.726  23.313
  427   1HE2  GLN  66          1HE2      GLN  66  49.065   3.393  24.390
  428   2HE2  GLN  66          2HE2      GLN  66  48.597   5.021  24.028
  429    H    THR  67           H        THR  67  46.851  -0.203  23.821
  430    HA   THR  67           HA       THR  67  46.184  -2.893  24.210
  431    HB   THR  67           HB       THR  67  48.948  -1.689  23.686
  432    HG1  THR  67           HG1      THR  67  48.028  -1.815  21.421
  433   1HG2  THR  67          1HG2      THR  67  47.518  -4.286  22.961
  434   2HG2  THR  67          2HG2      THR  67  48.888  -3.679  22.000
  435   3HG2  THR  67          3HG2      THR  67  49.118  -4.089  23.717
  436    H    ARG  68           H        ARG  68  47.913  -4.466  25.249
  437    HA   ARG  68           HA       ARG  68  48.680  -5.316  27.080
  438   1HB   ARG  68          1HB       ARG  68  50.397  -3.484  26.870
  439   2HB   ARG  68          2HB       ARG  68  49.402  -2.448  27.874
  440   1HG   ARG  68          1HG       ARG  68  49.718  -3.816  29.814
  441   2HG   ARG  68          2HG       ARG  68  50.273  -5.184  28.870
  442   1HD   ARG  68          1HD       ARG  68  52.432  -4.444  28.879
  443   2HD   ARG  68          2HD       ARG  68  51.962  -2.824  28.400
  444    HE   ARG  68           HE       ARG  68  51.173  -3.092  31.097
  445   1HH1  ARG  68          2HH2      ARG  68  54.206  -3.174  29.268
  446   2HH1  ARG  68          1HH2      ARG  68  55.164  -2.599  30.592
  447   1HH2  ARG  68          1HH       ARG  68  54.102  -2.113  32.684
  448    H    GLY  69           H        GLY  69  46.950  -6.158  28.247
  449   1HA   GLY  69          1HA       GLY  69  45.654  -4.332  30.179
  450   2HA   GLY  69          2HA       GLY  69  44.739  -5.472  29.213
  451    H    ALA  70           H        ALA  70  47.795  -5.552  31.197
  452    HA   ALA  70           HA       ALA  70  46.718  -7.319  33.095
  453   1HB   ALA  70          1HB       ALA  70  47.184  -9.381  32.298
  454   2HB   ALA  70          2HB       ALA  70  47.303  -8.604  30.701
  455   3HB   ALA  70          3HB       ALA  70  48.770  -8.870  31.673
  456    H    TYR  71           H        TYR  71  47.698  -6.080  34.669
  457    HA   TYR  71           HA       TYR  71  50.550  -5.524  34.351
  458   1HB   TYR  71          1HB       TYR  71  49.971  -4.052  36.393
  459   2HB   TYR  71          2HB       TYR  71  49.068  -3.643  34.948
  460    HD1  TYR  71           HD1      TYR  71  46.670  -4.080  34.791
  461    HD2  TYR  71           HD2      TYR  71  48.872  -5.145  38.301
  462    HE1  TYR  71           HE1      TYR  71  44.495  -4.383  36.072
  463    HE2  TYR  71           HE2      TYR  71  46.690  -5.444  39.571
  464    HH   TYR  71           HH       TYR  71  43.572  -4.984  37.929
  465    H    SER  72           H        SER  72  49.942  -8.259  34.783
  466    HA   SER  72           HA       SER  72  50.585  -8.549  37.610
  467   1HB   SER  72          1HB       SER  72  49.277 -10.429  35.610
  468   2HB   SER  72          2HB       SER  72  49.919 -11.014  37.132
  469    HG   SER  72           HG       SER  72  47.517 -10.187  36.864
  470    H    SER  73           H        SER  73  52.195 -10.325  38.139
  471    HA   SER  73           HA       SER  73  54.142 -11.261  37.937
  472   1HB   SER  73          1HB       SER  73  52.913 -11.723  35.310
  473   2HB   SER  73          2HB       SER  73  54.661 -11.676  35.199
  474    HG   SER  73           HG       SER  73  54.745 -13.606  36.107
  475    H    HIS  74           H        HIS  74  56.208 -10.389  38.047
  476    HA   HIS  74           HA       HIS  74  56.614  -7.950  36.485
  477   1HB   HIS  74          1HB       HIS  74  57.447  -8.830  39.219
  478   2HB   HIS  74          2HB       HIS  74  58.518  -7.757  38.340
  479    HD1  HIS  74           HD1      HIS  74  56.643  -7.136  40.955
  480    HD2  HIS  74           HD2      HIS  74  56.053  -5.862  37.002
  481    HE1  HIS  74           HE1      HIS  74  55.187  -5.045  41.087
  482    H    ASP  75           H        ASP  75  58.139  -7.931  34.901
  483    HA   ASP  75           HA       ASP  75  59.599  -8.722  33.492
  484   1HB   ASP  75          1HB       ASP  75  60.867  -8.353  35.955
  485   2HB   ASP  75          2HB       ASP  75  61.387  -9.965  35.505
  486    HD2  ASP  75           HD2      ASP  75  63.520  -7.415  34.905
  Start of MODEL   17
    1    H    MET   1           H        MET   1 -34.436 -30.616  -7.665
    2    HA   MET   1           HA       MET   1 -36.885 -30.816  -6.142
    3   1HB   MET   1          1HB       MET   1 -34.216 -31.694  -5.250
    4   2HB   MET   1          2HB       MET   1 -34.819 -30.415  -4.215
    5   1HG   MET   1          1HG       MET   1 -35.877 -32.154  -3.136
    6   2HG   MET   1          2HG       MET   1 -37.083 -31.930  -4.388
    7   1HE   MET   1          1HE       MET   1 -36.917 -35.760  -4.068
    8   2HE   MET   1          2HE       MET   1 -36.061 -34.948  -2.736
    9   3HE   MET   1          3HE       MET   1 -37.570 -34.255  -3.377
   10    H    GLU   2           H        GLU   2 -37.105 -28.906  -4.575
   11    HA   GLU   2           HA       GLU   2 -36.849 -26.573  -5.904
   12   1HB   GLU   2          1HB       GLU   2 -37.454 -25.482  -3.848
   13   2HB   GLU   2          2HB       GLU   2 -38.228 -27.054  -3.827
   14   1HG   GLU   2          1HG       GLU   2 -35.603 -27.374  -2.684
   15   2HG   GLU   2          2HG       GLU   2 -36.327 -25.962  -1.941
   16    HE2  GLU   2           HE2      GLU   2 -37.195 -27.966   0.260
   17    H    VAL   3           H        VAL   3 -35.554 -24.541  -5.002
   18    HA   VAL   3           HA       VAL   3 -32.774 -25.276  -5.229
   19    HB   VAL   3           HB       VAL   3 -34.141 -22.585  -5.020
   20   1HG1  VAL   3          1HG1      VAL   3 -31.314 -23.324  -5.848
   21   2HG1  VAL   3          2HG1      VAL   3 -32.035 -21.702  -5.977
   22   3HG1  VAL   3          3HG1      VAL   3 -31.796 -22.445  -4.377
   23   1HG2  VAL   3          1HG2      VAL   3 -34.730 -22.786  -7.161
   24   2HG2  VAL   3          2HG2      VAL   3 -33.053 -23.169  -7.621
   25   3HG2  VAL   3          3HG2      VAL   3 -34.163 -24.473  -7.134
   26    H    ALA   4           H        ALA   4 -31.133 -24.273  -3.722
   27    HA   ALA   4           HA       ALA   4 -31.774 -24.994  -1.072
   28   1HB   ALA   4          1HB       ALA   4 -29.475 -24.177  -0.614
   29   2HB   ALA   4          2HB       ALA   4 -29.530 -25.235  -2.044
   30   3HB   ALA   4          3HB       ALA   4 -29.412 -23.471  -2.246
   31    H    MET   5           H        MET   5 -33.574 -23.755  -0.371
   32    HA   MET   5           HA       MET   5 -32.805 -21.146   0.521
   33   1HB   MET   5          1HB       MET   5 -34.258 -21.417  -1.901
   34   2HB   MET   5          2HB       MET   5 -35.493 -21.043  -0.716
   35   1HG   MET   5          1HG       MET   5 -34.888 -18.864  -1.098
   36   2HG   MET   5          2HG       MET   5 -33.568 -19.212   0.001
   37   1HE   MET   5          1HE       MET   5 -33.615 -18.405  -4.372
   38   2HE   MET   5          2HE       MET   5 -34.867 -18.293  -3.112
   39   3HE   MET   5          3HE       MET   5 -33.533 -17.116  -3.149
   40    H    VAL   6           H        VAL   6 -32.999 -22.156   2.616
   41    HA   VAL   6           HA       VAL   6 -35.729 -22.966   3.311
   42    HB   VAL   6           HB       VAL   6 -33.625 -24.457   3.601
   43   1HG1  VAL   6          1HG1      VAL   6 -32.394 -24.185   5.657
   44   2HG1  VAL   6          2HG1      VAL   6 -32.287 -22.669   4.731
   45   3HG1  VAL   6          3HG1      VAL   6 -33.389 -22.785   6.124
   46   1HG2  VAL   6          1HG2      VAL   6 -34.958 -25.703   4.903
   47   2HG2  VAL   6          2HG2      VAL   6 -34.968 -24.485   6.201
   48   3HG2  VAL   6          3HG2      VAL   6 -36.106 -24.344   4.839
   49    H    SER   7           H        SER   7 -35.612 -22.575   6.086
   50    HA   SER   7           HA       SER   7 -34.710 -19.945   6.619
   51   1HB   SER   7          1HB       SER   7 -37.726 -20.382   6.623
   52   2HB   SER   7          2HB       SER   7 -36.881 -18.894   7.001
   53    HG   SER   7           HG       SER   7 -36.160 -18.760   4.804
   54    H    ALA   8           H        ALA   8 -33.627 -21.207   8.296
   55    HA   ALA   8           HA       ALA   8 -35.184 -22.738  10.133
   56   1HB   ALA   8          1HB       ALA   8 -33.052 -23.570  10.059
   57   2HB   ALA   8          2HB       ALA   8 -32.329 -21.982   9.706
   58   3HB   ALA   8          3HB       ALA   8 -32.803 -22.394  11.372
   59    H    GLU   9           H        GLU   9 -36.769 -20.821  10.404
   60    HA   GLU   9           HA       GLU   9 -36.154 -19.655  12.905
   61   1HB   GLU   9          1HB       GLU   9 -35.099 -18.118  11.043
   62   2HB   GLU   9          2HB       GLU   9 -36.753 -17.629  10.733
   63   1HG   GLU   9          1HG       GLU   9 -36.989 -16.578  12.809
   64   2HG   GLU   9          2HG       GLU   9 -35.839 -17.636  13.602
   65    HE2  GLU   9           HE2      GLU   9 -33.459 -15.364  13.466
   66    H    SER  10           H        SER  10 -38.090 -18.514  13.831
   67    HA   SER  10           HA       SER  10 -40.496 -19.319  12.390
   68   1HB   SER  10          1HB       SER  10 -39.686 -19.703  15.255
   69   2HB   SER  10          2HB       SER  10 -41.372 -19.329  14.954
   70    HG   SER  10           HG       SER  10 -40.242 -21.313  13.279
   71    H    SER  11           H        SER  11 -40.428 -17.099  11.461
   72    HA   SER  11           HA       SER  11 -42.104 -15.384  12.760
   73   1HB   SER  11          1HB       SER  11 -39.319 -15.086  13.616
   74   2HB   SER  11          2HB       SER  11 -39.901 -13.612  12.868
   75    HG   SER  11           HG       SER  11 -41.907 -14.136  14.367
   76    H    GLY  12           H        GLY  12 -43.071 -14.723  10.872
   77   1HA   GLY  12          1HA       GLY  12 -41.330 -14.056   8.588
   78   2HA   GLY  12          2HA       GLY  12 -43.016 -14.529   8.509
   79    H    CYS  13           H        CYS  13 -44.307 -12.852   7.909
   80    HA   CYS  13           HA       CYS  13 -44.221 -10.438   9.421
   81   1HB   CYS  13          1HB       CYS  13 -42.406 -10.268   7.521
   82   2HB   CYS  13          2HB       CYS  13 -43.788 -10.002   6.476
   83    HG   CYS  13           HG       CYS  13 -42.238  -8.046   8.295
   84    H    ASN  14           H        ASN  14 -46.315 -11.838   9.679
   85    HA   ASN  14           HA       ASN  14 -48.097 -11.290   7.444
   86   1HB   ASN  14          1HB       ASN  14 -47.727 -13.584   9.210
   87   2HB   ASN  14          2HB       ASN  14 -49.364 -12.986   9.388
   88   1HD2  ASN  14          1HD2      ASN  14 -50.437 -14.553   8.347
   89   2HD2  ASN  14          2HD2      ASN  14 -50.294 -14.919   6.660
   90    H    SER  15           H        SER  15 -47.154  -9.433   9.689
   91    HA   SER  15           HA       SER  15 -49.585  -8.245  10.227
   92   1HB   SER  15          1HB       SER  15 -49.359 -10.396  11.884
   93   2HB   SER  15          2HB       SER  15 -48.516  -9.205  12.855
   94    HG   SER  15           HG       SER  15 -50.496  -7.793  12.390
   95    H    HIS  16           H        HIS  16 -48.609  -6.273   9.760
   96    HA   HIS  16           HA       HIS  16 -46.236  -5.616  11.345
   97   1HB   HIS  16          1HB       HIS  16 -45.903  -3.849   9.541
   98   2HB   HIS  16          2HB       HIS  16 -45.605  -5.519   9.100
   99    HD1  HIS  16           HD1      HIS  16 -48.733  -3.276   9.041
  100    HD2  HIS  16           HD2      HIS  16 -46.636  -5.994   6.631
  101    HE1  HIS  16           HE1      HIS  16 -50.026  -3.431   6.846
  102    H    MET  17           H        MET  17 -48.342  -5.432  12.915
  103    HA   MET  17           HA       MET  17 -49.843  -3.082  12.580
  104   1HB   MET  17          1HB       MET  17 -49.719  -5.362  14.344
  105   2HB   MET  17          2HB       MET  17 -49.640  -3.940  15.365
  106   1HG   MET  17          1HG       MET  17 -51.697  -3.030  14.263
  107   2HG   MET  17          2HG       MET  17 -51.773  -4.445  13.232
  108   1HE   MET  17          1HE       MET  17 -52.643  -4.223  17.729
  109   2HE   MET  17          2HE       MET  17 -50.998  -3.896  17.133
  110   3HE   MET  17          3HE       MET  17 -52.355  -2.872  16.607
  111    HA   PRO  18           HA       PRO  18 -46.766  -1.369  15.761
  112   1HB   PRO  18          1HB       PRO  18 -44.510  -2.781  16.382
  113   2HB   PRO  18          2HB       PRO  18 -45.973  -2.840  17.346
  114   1HG   PRO  18          1HG       PRO  18 -44.902  -4.865  15.478
  115   2HG   PRO  18          2HG       PRO  18 -46.096  -5.063  16.744
  116   1HD   PRO  18          1HD       PRO  18 -46.596  -4.892  13.925
  117   2HD   PRO  18          2HD       PRO  18 -47.797  -4.973  15.200
  118    H    TYR  19           H        TYR  19 -44.412  -0.401  15.810
  119    HA   TYR  19           HA       TYR  19 -44.029   0.716  13.329
  120   1HB   TYR  19          1HB       TYR  19 -42.413   0.174  15.856
  121   2HB   TYR  19          2HB       TYR  19 -41.559   0.863  14.490
  122    HD1  TYR  19           HD1      TYR  19 -41.207   3.136  14.735
  123    HD2  TYR  19           HD2      TYR  19 -44.919   1.478  16.070
  124    HE1  TYR  19           HE1      TYR  19 -42.007   5.452  15.411
  125    HE2  TYR  19           HE2      TYR  19 -45.706   3.800  16.741
  126    HH   TYR  19           HH       TYR  19 -44.525   6.489  15.646
  127    H    GLY  20           H        GLY  20 -41.870   0.572  12.042
  128   1HA   GLY  20          1HA       GLY  20 -40.693  -2.071  11.926
  129   2HA   GLY  20          2HA       GLY  20 -41.727  -1.673  10.568
  130    H    TYR  21           H        TYR  21 -40.921  -0.426   8.901
  131    HA   TYR  21           HA       TYR  21 -38.210   0.041   8.700
  132   1HB   TYR  21          1HB       TYR  21 -40.811   0.843   7.401
  133   2HB   TYR  21          2HB       TYR  21 -39.464   1.899   7.025
  134    HD1  TYR  21           HD1      TYR  21 -40.650  -1.619   6.835
  135    HD2  TYR  21           HD2      TYR  21 -37.770   1.241   5.480
  136    HE1  TYR  21           HE1      TYR  21 -39.864  -3.246   5.046
  137    HE2  TYR  21           HE2      TYR  21 -36.994  -0.396   3.696
  138    HH   TYR  21           HH       TYR  21 -38.005  -3.687   3.708
  139    H    ALA  22           H        ALA  22 -40.659   1.863  10.406
  140    HA   ALA  22           HA       ALA  22 -39.186   4.337  10.302
  141   1HB   ALA  22          1HB       ALA  22 -41.315   5.007  10.622
  142   2HB   ALA  22          2HB       ALA  22 -41.828   3.379  11.125
  143   3HB   ALA  22          3HB       ALA  22 -41.119   4.496  12.316
  144    H    ALA  23           H        ALA  23 -39.069   1.366  12.056
  145    HA   ALA  23           HA       ALA  23 -37.967   2.608  14.437
  146   1HB   ALA  23          1HB       ALA  23 -38.879  -0.134  13.601
  147   2HB   ALA  23          2HB       ALA  23 -37.722   0.013  14.947
  148   3HB   ALA  23          3HB       ALA  23 -39.308   0.816  15.044
  149    H    GLN  24           H        GLN  24 -36.758   2.569  11.541
  150    HA   GLN  24           HA       GLN  24 -34.450   0.962  11.840
  151   1HB   GLN  24          1HB       GLN  24 -33.853   1.723   9.687
  152   2HB   GLN  24          2HB       GLN  24 -35.605   1.754   9.655
  153   1HG   GLN  24          1HG       GLN  24 -34.946   4.284  10.674
  154   2HG   GLN  24          2HG       GLN  24 -33.688   3.995   9.488
  155   1HE2  GLN  24          1HE2      GLN  24 -36.763   5.115   9.991
  156   2HE2  GLN  24          2HE2      GLN  24 -37.392   5.083   8.378
  157    H    ALA  25           H        ALA  25 -35.409   3.698  13.460
  158    HA   ALA  25           HA       ALA  25 -33.203   5.396  13.301
  159   1HB   ALA  25          1HB       ALA  25 -34.103   5.874  15.778
  160   2HB   ALA  25          2HB       ALA  25 -35.014   6.378  14.334
  161   3HB   ALA  25          3HB       ALA  25 -35.468   4.889  15.198
  162    H    ARG  26           H        ARG  26 -33.603   2.216  14.678
  163    HA   ARG  26           HA       ARG  26 -31.648   2.492  16.671
  164   1HB   ARG  26          1HB       ARG  26 -33.534   0.559  15.939
  165   2HB   ARG  26          2HB       ARG  26 -32.020  -0.231  15.545
  166   1HG   ARG  26          1HG       ARG  26 -31.193   0.420  17.891
  167   2HG   ARG  26          2HG       ARG  26 -32.831   0.932  18.247
  168   1HD   ARG  26          1HD       ARG  26 -32.769  -1.758  17.041
  169   2HD   ARG  26          2HD       ARG  26 -31.809  -1.681  18.505
  170    HE   ARG  26           HE       ARG  26 -34.118  -0.387  19.259
  171   1HH1  ARG  26          2HH2      ARG  26 -33.533  -3.516  17.703
  172   2HH1  ARG  26          1HH2      ARG  26 -34.951  -4.253  18.370
  173   1HH2  ARG  26          1HH       ARG  26 -36.380  -2.966  19.800
  174    H    ALA  27           H        ALA  27 -31.657   1.725  13.198
  175    HA   ALA  27           HA       ALA  27 -29.072   0.568  13.124
  176   1HB   ALA  27          1HB       ALA  27 -29.418   0.490  10.809
  177   2HB   ALA  27          2HB       ALA  27 -31.080   0.457  11.445
  178   3HB   ALA  27          3HB       ALA  27 -30.402   1.973  10.805
  179    H    ARG  28           H        ARG  28 -30.388   3.870  13.090
  180    HA   ARG  28           HA       ARG  28 -28.196   5.120  11.982
  181   1HB   ARG  28          1HB       ARG  28 -30.669   5.914  12.922
  182   2HB   ARG  28          2HB       ARG  28 -29.629   6.583  14.163
  183   1HG   ARG  28          1HG       ARG  28 -29.483   8.346  12.690
  184   2HG   ARG  28          2HG       ARG  28 -28.212   7.368  11.982
  185   1HD   ARG  28          1HD       ARG  28 -29.572   6.642  10.192
  186   2HD   ARG  28          2HD       ARG  28 -31.062   6.908  11.075
  187    HE   ARG  28           HE       ARG  28 -29.616   9.396  10.659
  188   1HH1  ARG  28          2HH2      ARG  28 -31.782   7.085   9.071
  189   2HH1  ARG  28          1HH2      ARG  28 -32.414   8.252   7.958
  190   1HH2  ARG  28          1HH       ARG  28 -31.618  10.511   8.048
  191    H    GLU  29           H        GLU  29 -28.852   3.856  15.239
  192    HA   GLU  29           HA       GLU  29 -26.684   5.290  16.410
  193   1HB   GLU  29          1HB       GLU  29 -28.970   3.870  17.339
  194   2HB   GLU  29          2HB       GLU  29 -27.584   3.011  17.982
  195   1HG   GLU  29          1HG       GLU  29 -27.365   5.973  18.165
  196   2HG   GLU  29          2HG       GLU  29 -28.689   5.298  19.094
  197    HE2  GLU  29           HE2      GLU  29 -25.760   5.518  21.049
  198    H    ARG  30           H        ARG  30 -27.195   2.249  14.726
  199    HA   ARG  30           HA       ARG  30 -24.766   1.145  15.782
  200   1HB   ARG  30          1HB       ARG  30 -27.082   0.170  14.167
  201   2HB   ARG  30          2HB       ARG  30 -25.546  -0.558  13.741
  202   1HG   ARG  30          1HG       ARG  30 -25.854  -0.407  16.654
  203   2HG   ARG  30          2HG       ARG  30 -27.207  -1.252  15.928
  204   1HD   ARG  30          1HD       ARG  30 -25.634  -2.769  14.724
  205   2HD   ARG  30          2HD       ARG  30 -24.266  -1.907  15.400
  206    HE   ARG  30           HE       ARG  30 -26.017  -3.802  16.813
  207   1HH1  ARG  30          2HH2      ARG  30 -23.612  -1.225  17.168
  208   2HH1  ARG  30          1HH2      ARG  30 -23.157  -1.700  18.770
  209   1HH2  ARG  30          1HH       ARG  30 -24.232  -3.587  19.785
  210    H    GLU  31           H        GLU  31 -26.011   2.865  12.946
  211    HA   GLU  31           HA       GLU  31 -24.123   2.115  11.092
  212   1HB   GLU  31          1HB       GLU  31 -26.298   3.832  11.166
  213   2HB   GLU  31          2HB       GLU  31 -24.968   4.957  10.970
  214   1HG   GLU  31          1HG       GLU  31 -25.079   4.462   8.749
  215   2HG   GLU  31          2HG       GLU  31 -24.283   2.957   9.165
  216    HE2  GLU  31           HE2      GLU  31 -25.408   1.188   9.000
  217    H    ARG  32           H        ARG  32 -23.889   4.195  13.922
  218    HA   ARG  32           HA       ARG  32 -21.807   5.800  13.139
  219   1HB   ARG  32          1HB       ARG  32 -23.221   5.168  15.563
  220   2HB   ARG  32          2HB       ARG  32 -21.512   5.061  15.936
  221   1HG   ARG  32          1HG       ARG  32 -22.201   7.419  14.273
  222   2HG   ARG  32          2HG       ARG  32 -23.000   7.417  15.833
  223   1HD   ARG  32          1HD       ARG  32 -21.055   7.859  16.949
  224   2HD   ARG  32          2HD       ARG  32 -20.172   6.626  16.071
  225    HE   ARG  32           HE       ARG  32 -19.527   8.233  14.447
  226   1HH1  ARG  32          2HH2      ARG  32 -21.832   9.638  16.743
  227   2HH1  ARG  32          1HH2      ARG  32 -21.538  11.267  16.232
  228   1HH2  ARG  32          1HH       ARG  32 -19.951  11.681  14.484
  229    H    LEU  33           H        LEU  33 -21.921   2.396  14.140
  230    HA   LEU  33           HA       LEU  33 -19.038   2.286  14.452
  231   1HB   LEU  33          1HB       LEU  33 -21.207   0.935  15.581
  232   2HB   LEU  33          2HB       LEU  33 -20.444  -0.247  14.537
  233    HG   LEU  33           HG       LEU  33 -18.307   0.938  15.897
  234   1HD1  LEU  33          1HD1      LEU  33 -18.821   1.374  18.047
  235   2HD1  LEU  33          2HD1      LEU  33 -20.436   1.704  17.377
  236   3HD1  LEU  33          3HD1      LEU  33 -20.086   0.124  18.117
  237   1HD2  LEU  33          1HD2      LEU  33 -18.151  -1.258  17.028
  238   2HD2  LEU  33          2HD2      LEU  33 -19.772  -1.664  16.414
  239   3HD2  LEU  33          3HD2      LEU  33 -18.430  -1.393  15.275
  240    H    ALA  34           H        ALA  34 -21.403   2.093  11.975
  241    HA   ALA  34           HA       ALA  34 -19.980   0.155  10.390
  242   1HB   ALA  34          1HB       ALA  34 -22.522   0.584  10.461
  243   2HB   ALA  34          2HB       ALA  34 -22.182   2.032   9.483
  244   3HB   ALA  34          3HB       ALA  34 -21.770   0.417   8.856
  245    H    HIS  35           H        HIS  35 -19.141   3.150  11.385
  246    HA   HIS  35           HA       HIS  35 -18.387   4.173   8.784
  247   1HB   HIS  35          1HB       HIS  35 -19.081   5.326  11.257
  248   2HB   HIS  35          2HB       HIS  35 -17.375   5.669  11.053
  249    HD1  HIS  35           HD1      HIS  35 -19.330   8.004  10.945
  250    HD2  HIS  35           HD2      HIS  35 -18.154   5.841   7.549
  251    HE1  HIS  35           HE1      HIS  35 -19.723   9.541   8.947
  252    H    SER  36           H        SER  36 -17.194   2.028  11.159
  253    HA   SER  36           HA       SER  36 -14.446   2.736  10.688
  254   1HB   SER  36          1HB       SER  36 -15.825   0.657  12.426
  255   2HB   SER  36          2HB       SER  36 -14.086   0.661  12.213
  256    HG   SER  36           HG       SER  36 -15.692   2.833  13.264
  257    H    ARG  37           H        ARG  37 -16.936   0.665   9.410
  258    HA   ARG  37           HA       ARG  37 -15.048  -1.221   8.364
  259   1HB   ARG  37          1HB       ARG  37 -17.690  -1.438   9.111
  260   2HB   ARG  37          2HB       ARG  37 -17.879  -1.228   7.382
  261   1HG   ARG  37          1HG       ARG  37 -15.722  -3.084   7.752
  262   2HG   ARG  37          2HG       ARG  37 -17.005  -3.583   8.838
  263   1HD   ARG  37          1HD       ARG  37 -18.634  -3.495   6.913
  264   2HD   ARG  37          2HD       ARG  37 -17.318  -3.063   5.840
  265    HE   ARG  37           HE       ARG  37 -17.858  -5.714   6.963
  266   1HH1  ARG  37          2HH2      ARG  37 -15.363  -3.631   5.552
  267   2HH1  ARG  37          1HH2      ARG  37 -14.371  -4.956   5.040
  268   1HH2  ARG  37          1HH       ARG  37 -15.089  -7.199   5.482
  269    H    ALA  38           H        ALA  38 -15.448   1.848   7.611
  270    HA   ALA  38           HA       ALA  38 -16.040   1.579   4.782
  271   1HB   ALA  38          1HB       ALA  38 -15.503   3.915   6.649
  272   2HB   ALA  38          2HB       ALA  38 -15.693   4.106   4.890
  273   3HB   ALA  38          3HB       ALA  38 -17.037   3.466   5.865
  274    H    ALA  39           H        ALA  39 -13.932  -0.010   5.153
  275    HA   ALA  39           HA       ALA  39 -11.419   0.891   5.411
  276   1HB   ALA  39          1HB       ALA  39 -12.731  -1.181   3.676
  277   2HB   ALA  39          2HB       ALA  39 -11.003  -0.835   3.424
  278   3HB   ALA  39          3HB       ALA  39 -11.578  -1.382   5.017
  279    H    ALA  40           H        ALA  40  -9.978   2.201   4.338
  280    HA   ALA  40           HA       ALA  40 -10.751   4.198   2.729
  281   1HB   ALA  40          1HB       ALA  40  -8.481   4.606   2.408
  282   2HB   ALA  40          2HB       ALA  40  -8.443   3.534   3.827
  283   3HB   ALA  40          3HB       ALA  40  -8.091   2.881   2.209
  284    H    ALA  41           H        ALA  41  -9.177   1.170   1.456
  285    HA   ALA  41           HA       ALA  41  -9.417   1.561  -1.173
  286   1HB   ALA  41          1HB       ALA  41 -10.143  -1.023   0.266
  287   2HB   ALA  41          2HB       ALA  41  -9.521  -0.865  -1.394
  288   3HB   ALA  41          3HB       ALA  41  -8.481  -0.448  -0.011
  289    H    ALA  42           H        ALA  42 -11.126   2.742  -2.014
  290    HA   ALA  42           HA       ALA  42 -13.808   1.674  -1.496
  291   1HB   ALA  42          1HB       ALA  42 -12.646   4.375  -2.007
  292   2HB   ALA  42          2HB       ALA  42 -14.237   4.043  -2.734
  293   3HB   ALA  42          3HB       ALA  42 -14.014   3.894  -0.974
  294    H    ALA  43           H        ALA  43 -12.275   3.489  -4.239
  295    HA   ALA  43           HA       ALA  43 -13.817   2.310  -6.196
  296   1HB   ALA  43          1HB       ALA  43 -12.488   4.366  -6.476
  297   2HB   ALA  43          2HB       ALA  43 -10.985   3.420  -6.359
  298   3HB   ALA  43          3HB       ALA  43 -12.086   3.176  -7.737
  299    H    VAL  44           H        VAL  44 -11.222   0.987  -4.289
  300    HA   VAL  44           HA       VAL  44 -10.647  -1.071  -6.257
  301    HB   VAL  44           HB       VAL  44  -9.372   0.084  -3.893
  302   1HG1  VAL  44          1HG1      VAL  44  -9.956  -2.091  -2.914
  303   2HG1  VAL  44          2HG1      VAL  44  -9.204  -2.922  -4.297
  304   3HG1  VAL  44          3HG1      VAL  44  -8.202  -1.956  -3.187
  305   1HG2  VAL  44          1HG2      VAL  44  -8.735  -0.303  -6.530
  306   2HG2  VAL  44          2HG2      VAL  44  -7.568   0.085  -5.243
  307   3HG2  VAL  44          3HG2      VAL  44  -7.813  -1.606  -5.741
  308    H    ALA  45           H        ALA  45 -12.485  -0.484  -3.277
  309    HA   ALA  45           HA       ALA  45 -12.844  -2.943  -2.244
  310   1HB   ALA  45          1HB       ALA  45 -14.839  -2.096  -1.314
  311   2HB   ALA  45          2HB       ALA  45 -13.876  -0.636  -1.645
  312   3HB   ALA  45          3HB       ALA  45 -15.194  -1.102  -2.747
  313    H    ALA  46           H        ALA  46 -14.785  -1.543  -4.984
  314    HA   ALA  46           HA       ALA  46 -16.092  -4.009  -5.481
  315   1HB   ALA  46          1HB       ALA  46 -15.762  -1.603  -7.314
  316   2HB   ALA  46          2HB       ALA  46 -17.045  -2.835  -7.368
  317   3HB   ALA  46          3HB       ALA  46 -16.960  -1.697  -6.001
  318    H    ALA  47           H        ALA  47 -13.376  -2.205  -7.070
  319    HA   ALA  47           HA       ALA  47 -12.934  -4.056  -9.096
  320   1HB   ALA  47          1HB       ALA  47 -11.580  -2.345  -9.631
  321   2HB   ALA  47          2HB       ALA  47 -11.709  -1.680  -7.985
  322   3HB   ALA  47          3HB       ALA  47 -10.456  -2.886  -8.362
  323    H    THR  48           H        THR  48 -10.540  -5.166  -9.149
  324    HA   THR  48           HA       THR  48  -9.657  -7.154  -8.538
  325    HB   THR  48           HB       THR  48  -8.553  -5.049  -7.268
  326    HG1  THR  48           HG1      THR  48  -7.374  -6.943  -7.843
  327   1HG2  THR  48          1HG2      THR  48  -8.921  -6.888  -4.914
  328   2HG2  THR  48          2HG2      THR  48  -8.596  -5.138  -4.938
  329   3HG2  THR  48          3HG2      THR  48 -10.242  -5.742  -5.248
  330    H    ALA  49           H        ALA  49 -12.555  -7.046  -8.106
  331    HA   ALA  49           HA       ALA  49 -13.401  -7.947  -5.681
  332   1HB   ALA  49          1HB       ALA  49 -14.240  -8.652  -8.513
  333   2HB   ALA  49          2HB       ALA  49 -15.141  -9.198  -7.078
  334   3HB   ALA  49          3HB       ALA  49 -14.971  -7.458  -7.413
  335    H    ALA  50           H        ALA  50 -13.110 -10.351  -8.349
  336    HA   ALA  50           HA       ALA  50 -12.305 -12.320  -6.395
  337   1HB   ALA  50          1HB       ALA  50 -13.936 -12.391  -8.576
  338   2HB   ALA  50          2HB       ALA  50 -12.420 -12.991  -9.291
  339   3HB   ALA  50          3HB       ALA  50 -13.137 -13.827  -7.893
  340    H    VAL  51           H        VAL  51 -10.344 -10.436  -6.393
  341    HA   VAL  51           HA       VAL  51  -8.144 -11.932  -7.509
  342    HB   VAL  51           HB       VAL  51  -8.757  -9.089  -8.333
  343   1HG1  VAL  51          1HG1      VAL  51  -6.196 -10.568  -8.173
  344   2HG1  VAL  51          2HG1      VAL  51  -6.507  -9.741  -9.718
  345   3HG1  VAL  51          3HG1      VAL  51  -6.516  -8.817  -8.196
  346   1HG2  VAL  51          1HG2      VAL  51  -8.600 -11.721  -9.811
  347   2HG2  VAL  51          2HG2      VAL  51  -9.924 -10.533  -9.779
  348   3HG2  VAL  51          3HG2      VAL  51  -8.416 -10.161 -10.647
  349    H    GLU  52           H        GLU  52  -8.501 -12.081  -4.964
  350    HA   GLU  52           HA       GLU  52  -7.100  -9.816  -3.780
  351   1HB   GLU  52          1HB       GLU  52  -9.476 -10.987  -2.995
  352   2HB   GLU  52          2HB       GLU  52  -8.330 -11.825  -1.968
  353   1HG   GLU  52          1HG       GLU  52  -7.356  -9.430  -1.476
  354   2HG   GLU  52          2HG       GLU  52  -8.867  -8.840  -2.139
  355    HE2  GLU  52           HE2      GLU  52  -8.019  -9.510   1.175
  356    H    GLY  53           H        GLY  53  -5.936 -10.791  -1.553
  357   1HA   GLY  53          1HA       GLY  53  -3.622 -12.006  -2.356
  358   2HA   GLY  53          2HA       GLY  53  -4.257 -12.040  -0.723
  359    H    THR  54           H        THR  54  -6.287 -13.676  -0.517
  360    HA   THR  54           HA       THR  54  -6.597 -15.895  -0.221
  361    HB   THR  54           HB       THR  54  -7.665 -16.779  -2.179
  362    HG1  THR  54           HG1      THR  54  -5.935 -14.931  -3.656
  363   1HG2  THR  54          1HG2      THR  54  -8.743 -14.887  -3.308
  364   2HG2  THR  54          2HG2      THR  54  -8.568 -14.465  -1.588
  365   3HG2  THR  54          3HG2      THR  54  -7.444 -13.787  -2.789
  366    H    GLY  55           H        GLY  55  -4.120 -15.750   0.491
  367   1HA   GLY  55          1HA       GLY  55  -2.794 -17.930  -0.999
  368   2HA   GLY  55          2HA       GLY  55  -1.917 -16.499  -0.496
  369    H    GLY  56           H        GLY  56  -4.256 -18.882   0.961
  370   1HA   GLY  56          1HA       GLY  56  -2.363 -19.230   3.190
  371   2HA   GLY  56          2HA       GLY  56  -4.029 -18.799   3.520
  372    H    SER  57           H        SER  57  -4.351 -20.822   4.664
  373    HA   SER  57           HA       SER  57  -4.715 -23.021   2.791
  374   1HB   SER  57          1HB       SER  57  -3.531 -23.166   5.597
  375   2HB   SER  57          2HB       SER  57  -4.067 -24.576   4.705
  376    HG   SER  57           HG       SER  57  -2.293 -22.823   3.346
  377    H    GLY  58           H        GLY  58  -6.425 -24.590   3.501
  378   1HA   GLY  58          1HA       GLY  58  -8.105 -23.878   5.728
  379   2HA   GLY  58          2HA       GLY  58  -8.802 -23.465   4.174
  380    H    GLY  59           H        GLY  59  -8.056 -26.025   6.427
  381   1HA   GLY  59          1HA       GLY  59  -9.816 -27.867   5.721
  382   2HA   GLY  59          2HA       GLY  59  -8.595 -28.145   4.495
  383    H    GLY  60           H        GLY  60  -9.243 -30.146   6.373
  384   1HA   GLY  60          1HA       GLY  60  -6.668 -30.691   7.473
  385   2HA   GLY  60          2HA       GLY  60  -7.812 -30.245   8.723
  386    HA   PRO  61           HA       PRO  61  -8.403 -34.664   7.403
  387   1HB   PRO  61          1HB       PRO  61  -6.947 -36.017   9.278
  388   2HB   PRO  61          2HB       PRO  61  -6.352 -35.675   7.665
  389   1HG   PRO  61          1HG       PRO  61  -5.620 -34.385  10.222
  390   2HG   PRO  61          2HG       PRO  61  -4.757 -34.367   8.697
  391   1HD   PRO  61          1HD       PRO  61  -6.345 -32.246   9.797
  392   2HD   PRO  61          2HD       PRO  61  -5.579 -32.273   8.221
  393    H    HIS  62           H        HIS  62  -9.193 -36.621   8.898
  394    HA   HIS  62           HA       HIS  62 -10.646 -35.356  11.092
  395   1HB   HIS  62          1HB       HIS  62 -11.928 -35.718   8.798
  396   2HB   HIS  62          2HB       HIS  62 -12.054 -37.367   9.376
  397    HD1  HIS  62           HD1      HIS  62 -13.753 -37.859  11.221
  398    HD2  HIS  62           HD2      HIS  62 -13.260 -33.761  10.474
  399    HE1  HIS  62           HE1      HIS  62 -15.602 -36.669  12.516
  400    H    HIS  63           H        HIS  63 -10.351 -36.459  12.964
  401    HA   HIS  63           HA       HIS  63  -8.686 -38.510  13.302
  402   1HB   HIS  63          1HB       HIS  63 -10.021 -37.070  14.996
  403   2HB   HIS  63          2HB       HIS  63 -11.215 -38.352  14.935
  404    HD1  HIS  63           HD1      HIS  63 -10.932 -39.642  17.058
  405    HD2  HIS  63           HD2      HIS  63  -7.254 -38.740  15.254
  406    HE1  HIS  63           HE1      HIS  63  -9.145 -40.802  18.462
  407    H    HIS  64           H        HIS  64  -8.793 -40.818  13.476
  408    HA   HIS  64           HA       HIS  64 -11.166 -42.219  12.940
  409   1HB   HIS  64          1HB       HIS  64 -10.134 -41.140  10.641
  410   2HB   HIS  64          2HB       HIS  64  -9.357 -42.711  10.659
  411    HD1  HIS  64           HD1      HIS  64 -10.697 -44.608   9.718
  412    HD2  HIS  64           HD2      HIS  64 -13.114 -41.391  10.901
  413    HE1  HIS  64           HE1      HIS  64 -13.073 -45.198   8.999
  414    H    HIS  65           H        HIS  65 -10.879 -44.486  13.278
  415    HA   HIS  65           HA       HIS  65  -8.693 -45.974  13.170
  416   1HB   HIS  65          1HB       HIS  65  -8.342 -43.985  15.296
  417   2HB   HIS  65          2HB       HIS  65  -8.140 -45.630  15.864
  418    HD1  HIS  65           HD1      HIS  65  -5.567 -44.748  16.177
  419    HD2  HIS  65           HD2      HIS  65  -6.911 -45.325  12.245
  420    HE1  HIS  65           HE1      HIS  65  -3.478 -44.869  14.717
  421    H    GLN  66           H        GLN  66  -9.698 -47.912  13.293
  422    HA   GLN  66           HA       GLN  66 -12.153 -48.216  14.507
  423   1HB   GLN  66          1HB       GLN  66 -11.851 -50.626  14.058
  424   2HB   GLN  66          2HB       GLN  66 -11.331 -49.667  12.687
  425   1HG   GLN  66          1HG       GLN  66  -9.050 -49.945  14.403
  426   2HG   GLN  66          2HG       GLN  66  -9.784 -51.532  14.287
  427   1HE2  GLN  66          1HE2      GLN  66 -10.043 -52.530  12.274
  428   2HE2  GLN  66          2HE2      GLN  66  -9.107 -52.084  10.887
  429    H    THR  67           H        THR  67 -12.467 -50.219  16.177
  430    HA   THR  67           HA       THR  67 -11.386 -49.296  18.619
  431    HB   THR  67           HB       THR  67 -12.518 -51.650  19.274
  432    HG1  THR  67           HG1      THR  67 -12.595 -52.334  17.020
  433   1HG2  THR  67          1HG2      THR  67 -14.676 -50.590  19.355
  434   2HG2  THR  67          2HG2      THR  67 -13.517 -49.251  19.533
  435   3HG2  THR  67          3HG2      THR  67 -14.299 -49.548  17.962
  436    H    ARG  68           H        ARG  68 -10.466 -51.092  20.223
  437    HA   ARG  68           HA       ARG  68  -8.839 -53.044  19.193
  438   1HB   ARG  68          1HB       ARG  68  -7.557 -51.128  18.199
  439   2HB   ARG  68          2HB       ARG  68  -7.344 -50.441  19.797
  440   1HG   ARG  68          1HG       ARG  68  -6.234 -52.692  20.454
  441   2HG   ARG  68          2HG       ARG  68  -6.211 -53.066  18.743
  442   1HD   ARG  68          1HD       ARG  68  -5.058 -50.700  18.486
  443   2HD   ARG  68          2HD       ARG  68  -4.744 -50.844  20.204
  444    HE   ARG  68           HE       ARG  68  -3.979 -53.214  18.635
  445   1HH1  ARG  68          2HH2      ARG  68  -2.902 -50.106  19.953
  446   2HH1  ARG  68          1HH2      ARG  68  -1.221 -50.522  19.892
  447   1HH2  ARG  68          1HH       ARG  68  -0.574 -52.677  19.067
  448    H    GLY  69           H        GLY  69  -8.404 -54.377  20.945
  449   1HA   GLY  69          1HA       GLY  69  -8.696 -53.184  23.623
  450   2HA   GLY  69          2HA       GLY  69  -8.977 -54.859  23.191
  451    H    ALA  70           H        ALA  70  -7.083 -56.222  22.557
  452    HA   ALA  70           HA       ALA  70  -5.074 -57.048  22.974
  453   1HB   ALA  70          1HB       ALA  70  -4.173 -54.141  22.845
  454   2HB   ALA  70          2HB       ALA  70  -3.146 -55.578  22.627
  455   3HB   ALA  70          3HB       ALA  70  -4.415 -55.203  21.437
  456    H    TYR  71           H        TYR  71  -5.958 -57.668  25.114
  457    HA   TYR  71           HA       TYR  71  -4.473 -56.282  27.231
  458   1HB   TYR  71          1HB       TYR  71  -6.763 -55.548  27.515
  459   2HB   TYR  71          2HB       TYR  71  -7.409 -57.063  26.916
  460    HD1  TYR  71           HD1      TYR  71  -8.339 -58.539  28.449
  461    HD2  TYR  71           HD2      TYR  71  -5.355 -55.780  29.788
  462    HE1  TYR  71           HE1      TYR  71  -8.662 -59.339  30.841
  463    HE2  TYR  71           HE2      TYR  71  -5.688 -56.589  32.175
  464    HH   TYR  71           HH       TYR  71  -7.124 -59.392  32.943
  465    H    SER  72           H        SER  72  -3.769 -57.627  28.968
  466    HA   SER  72           HA       SER  72  -3.351 -60.301  28.149
  467   1HB   SER  72          1HB       SER  72  -2.032 -60.490  30.215
  468   2HB   SER  72          2HB       SER  72  -1.637 -59.001  29.380
  469    HG   SER  72           HG       SER  72  -3.742 -58.773  31.242
  470    H    SER  73           H        SER  73  -5.125 -61.670  28.210
  471    HA   SER  73           HA       SER  73  -7.035 -61.367  30.309
  472   1HB   SER  73          1HB       SER  73  -8.105 -63.382  29.139
  473   2HB   SER  73          2HB       SER  73  -7.959 -61.921  28.183
  474    HG   SER  73           HG       SER  73  -6.442 -62.835  26.905
  475    H    HIS  74           H        HIS  74  -7.314 -62.733  32.105
  476    HA   HIS  74           HA       HIS  74  -6.838 -64.242  33.625
  477   1HB   HIS  74          1HB       HIS  74  -7.274 -66.053  32.279
  478   2HB   HIS  74          2HB       HIS  74  -5.993 -65.674  31.144
  479    HD1  HIS  74           HD1      HIS  74  -6.723 -67.618  34.236
  480    HD2  HIS  74           HD2      HIS  74  -3.364 -66.530  31.972
  481    HE1  HIS  74           HE1      HIS  74  -4.815 -69.118  35.022
  482    H    ASP  75           H        ASP  75  -5.247 -64.525  35.218
  483    HA   ASP  75           HA       ASP  75  -3.163 -62.829  35.225
  484   1HB   ASP  75          1HB       ASP  75  -3.119 -65.559  36.587
  485   2HB   ASP  75          2HB       ASP  75  -2.299 -64.107  37.126
  486    HD2  ASP  75           HD2      ASP  75  -3.826 -62.421  38.086
  Start of MODEL   18
    1    H    MET   1           H        MET   1 -35.952  41.172  -8.715
    2    HA   MET   1           HA       MET   1 -35.069  39.216 -10.556
    3   1HB   MET   1          1HB       MET   1 -33.958  41.316  -8.826
    4   2HB   MET   1          2HB       MET   1 -32.983  39.865  -8.702
    5   1HG   MET   1          1HG       MET   1 -31.974  40.544 -10.631
    6   2HG   MET   1          2HG       MET   1 -33.436  40.035 -11.452
    7   1HE   MET   1          1HE       MET   1 -35.732  42.777 -10.996
    8   2HE   MET   1          2HE       MET   1 -35.176  42.676 -12.684
    9   3HE   MET   1          3HE       MET   1 -35.355  41.194 -11.716
   10    H    GLU   2           H        GLU   2 -35.684  37.108 -10.070
   11    HA   GLU   2           HA       GLU   2 -34.803  36.172  -7.451
   12   1HB   GLU   2          1HB       GLU   2 -37.437  36.215  -8.400
   13   2HB   GLU   2          2HB       GLU   2 -36.934  34.563  -8.698
   14   1HG   GLU   2          1HG       GLU   2 -36.787  34.056  -6.458
   15   2HG   GLU   2          2HG       GLU   2 -36.114  35.619  -6.039
   16    HE2  GLU   2           HE2      GLU   2 -39.428  34.239  -6.741
   17    H    VAL   3           H        VAL   3 -33.422  34.414  -7.453
   18    HA   VAL   3           HA       VAL   3 -32.106  33.673  -9.739
   19    HB   VAL   3           HB       VAL   3 -32.522  31.971  -7.277
   20   1HG1  VAL   3          1HG1      VAL   3 -31.265  30.613  -8.614
   21   2HG1  VAL   3          2HG1      VAL   3 -30.590  31.967  -9.550
   22   3HG1  VAL   3          3HG1      VAL   3 -29.951  31.599  -7.930
   23   1HG2  VAL   3          1HG2      VAL   3 -30.154  33.363  -6.920
   24   2HG2  VAL   3          2HG2      VAL   3 -31.254  34.594  -7.586
   25   3HG2  VAL   3          3HG2      VAL   3 -31.703  33.703  -6.111
   26    H    ALA   4           H        ALA   4 -32.063  31.541 -10.876
   27    HA   ALA   4           HA       ALA   4 -34.757  30.833 -11.602
   28   1HB   ALA   4          1HB       ALA   4 -33.795  30.003 -13.522
   29   2HB   ALA   4          2HB       ALA   4 -32.508  31.132 -13.035
   30   3HB   ALA   4          3HB       ALA   4 -32.354  29.397 -12.669
   31    H    MET   5           H        MET   5 -35.300  28.418 -11.854
   32    HA   MET   5           HA       MET   5 -34.249  27.023  -9.513
   33   1HB   MET   5          1HB       MET   5 -36.550  25.955  -9.395
   34   2HB   MET   5          2HB       MET   5 -36.598  27.691  -9.161
   35   1HG   MET   5          1HG       MET   5 -37.835  28.021 -11.054
   36   2HG   MET   5          2HG       MET   5 -36.804  26.977 -12.013
   37   1HE   MET   5          1HE       MET   5 -40.850  26.016 -11.703
   38   2HE   MET   5          2HE       MET   5 -40.351  27.300 -10.575
   39   3HE   MET   5          3HE       MET   5 -39.819  27.350 -12.273
   40    H    VAL   6           H        VAL   6 -33.895  24.735  -9.695
   41    HA   VAL   6           HA       VAL   6 -33.750  23.850 -12.486
   42    HB   VAL   6           HB       VAL   6 -31.708  24.072 -10.901
   43   1HG1  VAL   6          1HG1      VAL   6 -33.207  22.432  -9.279
   44   2HG1  VAL   6          2HG1      VAL   6 -32.109  21.276 -10.071
   45   3HG1  VAL   6          3HG1      VAL   6 -31.445  22.660  -9.169
   46   1HG2  VAL   6          1HG2      VAL   6 -30.646  22.824 -12.433
   47   2HG2  VAL   6          2HG2      VAL   6 -31.570  21.362 -12.010
   48   3HG2  VAL   6          3HG2      VAL   6 -32.253  22.550 -13.147
   49    H    SER   7           H        SER   7 -33.551  21.085 -12.061
   50    HA   SER   7           HA       SER   7 -35.853  20.366 -10.494
   51   1HB   SER   7          1HB       SER   7 -36.812  19.069 -12.480
   52   2HB   SER   7          2HB       SER   7 -36.994  20.811 -12.545
   53    HG   SER   7           HG       SER   7 -35.709  19.154 -14.304
   54    H    ALA   8           H        ALA   8 -35.364  18.479  -9.424
   55    HA   ALA   8           HA       ALA   8 -33.010  17.027 -10.294
   56   1HB   ALA   8          1HB       ALA   8 -34.317  15.926  -7.966
   57   2HB   ALA   8          2HB       ALA   8 -32.747  16.757  -8.080
   58   3HB   ALA   8          3HB       ALA   8 -34.235  17.698  -7.815
   59    H    GLU   9           H        GLU   9 -33.787  16.020 -12.231
   60    HA   GLU   9           HA       GLU   9 -36.116  14.766 -12.606
   61   1HB   GLU   9          1HB       GLU   9 -35.099  13.674 -14.419
   62   2HB   GLU   9          2HB       GLU   9 -34.032  15.039 -14.158
   63   1HG   GLU   9          1HG       GLU   9 -33.586  12.216 -13.075
   64   2HG   GLU   9          2HG       GLU   9 -32.758  12.915 -14.452
   65    HE2  GLU   9           HE2      GLU   9 -31.021  15.196 -12.961
   66    H    SER  10           H        SER  10 -36.462  12.246 -12.804
   67    HA   SER  10           HA       SER  10 -35.083  10.563 -11.099
   68   1HB   SER  10          1HB       SER  10 -36.498  10.358  -9.180
   69   2HB   SER  10          2HB       SER  10 -36.192  12.073  -9.367
   70    HG   SER  10           HG       SER  10 -38.277  12.251 -10.467
   71    H    SER  11           H        SER  11 -36.161   8.378 -10.987
   72    HA   SER  11           HA       SER  11 -38.617   7.897 -12.128
   73   1HB   SER  11          1HB       SER  11 -37.774   8.609 -14.269
   74   2HB   SER  11          2HB       SER  11 -36.276   7.723 -14.061
   75    HG   SER  11           HG       SER  11 -37.523   6.450 -15.412
   76    H    GLY  12           H        GLY  12 -39.116   5.603 -12.065
   77   1HA   GLY  12          1HA       GLY  12 -38.574   3.360 -11.805
   78   2HA   GLY  12          2HA       GLY  12 -36.932   3.786 -11.366
   79    H    CYS  13           H        CYS  13 -38.836   1.993  -9.945
   80    HA   CYS  13           HA       CYS  13 -38.713   3.371  -7.381
   81   1HB   CYS  13          1HB       CYS  13 -40.926   2.494  -6.736
   82   2HB   CYS  13          2HB       CYS  13 -41.027   3.631  -8.066
   83    HG   CYS  13           HG       CYS  13 -42.611   2.050  -9.013
   84    H    ASN  14           H        ASN  14 -36.682   1.781  -8.039
   85    HA   ASN  14           HA       ASN  14 -37.388  -0.932  -7.336
   86   1HB   ASN  14          1HB       ASN  14 -35.287   0.364  -8.913
   87   2HB   ASN  14          2HB       ASN  14 -34.561  -0.681  -7.708
   88   1HD2  ASN  14          1HD2      ASN  14 -36.381  -0.461 -10.608
   89   2HD2  ASN  14          2HD2      ASN  14 -36.537  -2.149 -10.964
   90    H    SER  15           H        SER  15 -37.374   1.463  -5.429
   91    HA   SER  15           HA       SER  15 -36.287   0.225  -3.245
   92   1HB   SER  15          1HB       SER  15 -34.333   1.741  -2.753
   93   2HB   SER  15          2HB       SER  15 -34.063   0.647  -4.095
   94    HG   SER  15           HG       SER  15 -34.686   2.444  -5.543
   95    H    HIS  16           H        HIS  16 -38.018   0.941  -2.021
   96    HA   HIS  16           HA       HIS  16 -38.147   3.793  -1.549
   97   1HB   HIS  16          1HB       HIS  16 -39.730   3.704  -3.282
   98   2HB   HIS  16          2HB       HIS  16 -40.380   2.167  -2.748
   99    HD1  HIS  16           HD1      HIS  16 -42.802   2.972  -2.483
  100    HD2  HIS  16           HD2      HIS  16 -40.047   5.201  -0.239
  101    HE1  HIS  16           HE1      HIS  16 -44.179   4.448  -0.922
  102    H    MET  17           H        MET  17 -37.079   2.861   0.422
  103    HA   MET  17           HA       MET  17 -37.943   0.999   2.056
  104   1HB   MET  17          1HB       MET  17 -37.105   3.867   2.735
  105   2HB   MET  17          2HB       MET  17 -37.247   2.624   3.963
  106   1HG   MET  17          1HG       MET  17 -35.583   2.034   1.506
  107   2HG   MET  17          2HG       MET  17 -34.911   3.087   2.735
  108   1HE   MET  17          1HE       MET  17 -35.242  -1.337   2.669
  109   2HE   MET  17          2HE       MET  17 -36.877  -0.634   2.716
  110   3HE   MET  17          3HE       MET  17 -35.725  -0.127   1.456
  111    HA   PRO  18           HA       PRO  18 -42.109   2.389   2.766
  112   1HB   PRO  18          1HB       PRO  18 -43.180  -0.079   3.249
  113   2HB   PRO  18          2HB       PRO  18 -43.091   0.631   1.649
  114   1HG   PRO  18          1HG       PRO  18 -41.439  -1.526   2.815
  115   2HG   PRO  18          2HG       PRO  18 -41.658  -1.100   1.129
  116   1HD   PRO  18          1HD       PRO  18 -39.381  -0.504   2.768
  117   2HD   PRO  18          2HD       PRO  18 -39.651   0.021   1.117
  118    H    TYR  19           H        TYR  19 -43.802   1.309   4.619
  119    HA   TYR  19           HA       TYR  19 -43.007   2.498   6.923
  120   1HB   TYR  19          1HB       TYR  19 -44.614   0.605   7.893
  121   2HB   TYR  19          2HB       TYR  19 -45.273   1.717   6.709
  122    HD1  TYR  19           HD1      TYR  19 -45.958   0.964   4.530
  123    HD2  TYR  19           HD2      TYR  19 -43.969  -1.714   7.209
  124    HE1  TYR  19           HE1      TYR  19 -46.588  -1.001   3.045
  125    HE2  TYR  19           HE2      TYR  19 -44.606  -3.670   5.715
  126    HH   TYR  19           HH       TYR  19 -46.443  -3.126   2.718
  127    H    GLY  20           H        GLY  20 -42.768   1.204   9.139
  128   1HA   GLY  20          1HA       GLY  20 -41.590  -0.237  10.433
  129   2HA   GLY  20          2HA       GLY  20 -41.175  -1.179   9.015
  130    H    TYR  21           H        TYR  21 -40.434   1.960   8.151
  131    HA   TYR  21           HA       TYR  21 -37.633   1.488   8.469
  132   1HB   TYR  21          1HB       TYR  21 -37.540   3.510   7.091
  133   2HB   TYR  21          2HB       TYR  21 -38.966   2.647   6.549
  134    HD1  TYR  21           HD1      TYR  21 -37.851   5.421   8.781
  135    HD2  TYR  21           HD2      TYR  21 -41.096   3.670   6.611
  136    HE1  TYR  21           HE1      TYR  21 -39.276   7.477   9.239
  137    HE2  TYR  21           HE2      TYR  21 -42.510   5.731   7.076
  138    HH   TYR  21           HH       TYR  21 -41.956   8.221   7.560
  139    H    ALA  22           H        ALA  22 -40.099   2.853  10.455
  140    HA   ALA  22           HA       ALA  22 -38.500   4.879  11.667
  141   1HB   ALA  22          1HB       ALA  22 -41.095   4.623  11.495
  142   2HB   ALA  22          2HB       ALA  22 -40.919   3.566  12.917
  143   3HB   ALA  22          3HB       ALA  22 -40.392   5.265  12.999
  144    H    ALA  23           H        ALA  23 -39.239   1.419  12.252
  145    HA   ALA  23           HA       ALA  23 -37.989   1.383  14.810
  146   1HB   ALA  23          1HB       ALA  23 -39.485  -0.392  13.064
  147   2HB   ALA  23          2HB       ALA  23 -38.055  -1.223  13.720
  148   3HB   ALA  23          3HB       ALA  23 -39.240  -0.484  14.824
  149    H    GLN  24           H        GLN  24 -36.778   1.846  11.705
  150    HA   GLN  24           HA       GLN  24 -34.428   0.240  12.116
  151   1HB   GLN  24          1HB       GLN  24 -35.651   1.758   9.856
  152   2HB   GLN  24          2HB       GLN  24 -33.899   1.714   9.865
  153   1HG   GLN  24          1HG       GLN  24 -35.394  -0.865  10.351
  154   2HG   GLN  24          2HG       GLN  24 -35.336  -0.237   8.716
  155   1HE2  GLN  24          1HE2      GLN  24 -33.870  -2.223  10.861
  156   2HE2  GLN  24          2HE2      GLN  24 -32.260  -2.292  10.226
  157    H    ALA  25           H        ALA  25 -35.532   3.127  13.328
  158    HA   ALA  25           HA       ALA  25 -33.425   4.901  12.885
  159   1HB   ALA  25          1HB       ALA  25 -35.462   4.566  15.113
  160   2HB   ALA  25          2HB       ALA  25 -34.314   5.924  15.053
  161   3HB   ALA  25          3HB       ALA  25 -35.504   5.706  13.747
  162    H    ARG  26           H        ARG  26 -33.650   1.953  14.740
  163    HA   ARG  26           HA       ARG  26 -31.704   2.634  16.641
  164   1HB   ARG  26          1HB       ARG  26 -33.507   0.638  16.492
  165   2HB   ARG  26          2HB       ARG  26 -32.160  -0.230  15.782
  166   1HG   ARG  26          1HG       ARG  26 -31.181  -0.513  17.810
  167   2HG   ARG  26          2HG       ARG  26 -31.236   1.208  18.137
  168   1HD   ARG  26          1HD       ARG  26 -33.907  -0.025  18.342
  169   2HD   ARG  26          2HD       ARG  26 -32.757  -0.782  19.427
  170    HE   ARG  26           HE       ARG  26 -33.715   2.002  19.547
  171   1HH1  ARG  26          2HH2      ARG  26 -31.274  -0.312  20.661
  172   2HH1  ARG  26          1HH2      ARG  26 -30.845   0.622  22.055
  173   1HH2  ARG  26          1HH       ARG  26 -31.961   2.703  22.462
  174    H    ALA  27           H        ALA  27 -31.686   1.351  13.325
  175    HA   ALA  27           HA       ALA  27 -29.044   0.329  13.398
  176   1HB   ALA  27          1HB       ALA  27 -29.423  -0.180  11.165
  177   2HB   ALA  27          2HB       ALA  27 -31.095  -0.074  11.768
  178   3HB   ALA  27          3HB       ALA  27 -30.380   1.294  10.880
  179    H    ARG  28           H        ARG  28 -30.531   3.516  12.878
  180    HA   ARG  28           HA       ARG  28 -28.411   4.693  11.569
  181   1HB   ARG  28          1HB       ARG  28 -30.883   5.526  12.202
  182   2HB   ARG  28          2HB       ARG  28 -30.063   6.259  13.566
  183   1HG   ARG  28          1HG       ARG  28 -28.611   6.734  11.049
  184   2HG   ARG  28          2HG       ARG  28 -30.260   7.320  10.961
  185   1HD   ARG  28          1HD       ARG  28 -29.966   8.760  12.876
  186   2HD   ARG  28          2HD       ARG  28 -28.480   7.961  13.348
  187    HE   ARG  28           HE       ARG  28 -28.796   9.957  11.197
  188   1HH1  ARG  28          2HH2      ARG  28 -26.687   7.521  12.672
  189   2HH1  ARG  28          1HH2      ARG  28 -25.242   8.166  11.968
  190   1HH2  ARG  28          1HH       ARG  28 -25.385  10.099  10.558
  191    H    GLU  29           H        GLU  29 -28.988   3.905  14.987
  192    HA   GLU  29           HA       GLU  29 -26.896   5.611  15.903
  193   1HB   GLU  29          1HB       GLU  29 -29.082   4.145  17.062
  194   2HB   GLU  29          2HB       GLU  29 -27.613   3.609  17.853
  195   1HG   GLU  29          1HG       GLU  29 -27.152   5.710  18.755
  196   2HG   GLU  29          2HG       GLU  29 -27.915   6.570  17.432
  197    HE2  GLU  29           HE2      GLU  29 -30.848   6.684  18.248
  198    H    ARG  30           H        ARG  30 -27.252   2.326  14.706
  199    HA   ARG  30           HA       ARG  30 -24.765   1.523  15.890
  200   1HB   ARG  30          1HB       ARG  30 -27.031   0.195  14.468
  201   2HB   ARG  30          2HB       ARG  30 -25.460  -0.509  14.141
  202   1HG   ARG  30          1HG       ARG  30 -25.047  -0.712  16.608
  203   2HG   ARG  30          2HG       ARG  30 -26.630  -0.031  16.923
  204   1HD   ARG  30          1HD       ARG  30 -26.360  -2.478  15.145
  205   2HD   ARG  30          2HD       ARG  30 -26.337  -2.656  16.888
  206    HE   ARG  30           HE       ARG  30 -28.562  -1.074  16.476
  207   1HH1  ARG  30          2HH2      ARG  30 -27.514  -4.170  15.108
  208   2HH1  ARG  30          1HH2      ARG  30 -29.128  -4.738  14.838
  209   1HH2  ARG  30          1HH       ARG  30 -30.980  -3.342  15.441
  210    H    GLU  31           H        GLU  31 -26.108   2.724  12.840
  211    HA   GLU  31           HA       GLU  31 -24.164   1.801  11.115
  212   1HB   GLU  31          1HB       GLU  31 -26.251   3.911  11.116
  213   2HB   GLU  31          2HB       GLU  31 -24.911   4.240  10.036
  214   1HG   GLU  31          1HG       GLU  31 -25.204   1.809   9.175
  215   2HG   GLU  31          2HG       GLU  31 -26.724   1.791  10.048
  216    HE2  GLU  31           HE2      GLU  31 -27.361   4.923   8.472
  217    H    ARG  32           H        ARG  32 -24.116   4.348  13.549
  218    HA   ARG  32           HA       ARG  32 -22.146   5.940  12.498
  219   1HB   ARG  32          1HB       ARG  32 -23.527   6.485  14.518
  220   2HB   ARG  32          2HB       ARG  32 -22.683   5.251  15.432
  221   1HG   ARG  32          1HG       ARG  32 -20.512   6.609  14.622
  222   2HG   ARG  32          2HG       ARG  32 -21.664   7.919  14.452
  223   1HD   ARG  32          1HD       ARG  32 -22.358   6.918  16.942
  224   2HD   ARG  32          2HD       ARG  32 -20.632   6.618  16.926
  225    HE   ARG  32           HE       ARG  32 -20.303   8.907  17.186
  226   1HH1  ARG  32          2HH2      ARG  32 -23.455   8.423  15.640
  227   2HH1  ARG  32          1HH2      ARG  32 -23.848  10.110  15.630
  228   1HH2  ARG  32          1HH       ARG  32 -22.286  11.685  16.537
  229    H    LEU  33           H        LEU  33 -22.024   2.765  14.084
  230    HA   LEU  33           HA       LEU  33 -19.144   2.922  14.400
  231   1HB   LEU  33          1HB       LEU  33 -21.220   1.639  15.760
  232   2HB   LEU  33          2HB       LEU  33 -20.364   0.349  14.939
  233    HG   LEU  33           HG       LEU  33 -18.466   2.135  16.189
  234   1HD1  LEU  33          1HD1      LEU  33 -20.702   2.347  17.616
  235   2HD1  LEU  33          2HD1      LEU  33 -20.108   0.814  18.297
  236   3HD1  LEU  33          3HD1      LEU  33 -19.092   2.274  18.372
  237   1HD2  LEU  33          1HD2      LEU  33 -17.527   0.112  15.913
  238   2HD2  LEU  33          2HD2      LEU  33 -18.245  -0.231  17.505
  239   3HD2  LEU  33          3HD2      LEU  33 -19.082  -0.748  16.021
  240    H    ALA  34           H        ALA  34 -21.466   2.121  12.006
  241    HA   ALA  34           HA       ALA  34 -19.891   0.041  10.785
  242   1HB   ALA  34          1HB       ALA  34 -21.741  -0.286   9.465
  243   2HB   ALA  34          2HB       ALA  34 -22.533   0.576  10.805
  244   3HB   ALA  34          3HB       ALA  34 -22.084   1.455   9.324
  245    H    HIS  35           H        HIS  35 -19.282   3.219  11.228
  246    HA   HIS  35           HA       HIS  35 -18.581   3.816   8.483
  247   1HB   HIS  35          1HB       HIS  35 -19.027   5.332  10.963
  248   2HB   HIS  35          2HB       HIS  35 -17.648   5.894  10.040
  249    HD1  HIS  35           HD1      HIS  35 -21.156   6.464  10.340
  250    HD2  HIS  35           HD2      HIS  35 -18.501   6.232   7.101
  251    HE1  HIS  35           HE1      HIS  35 -22.302   7.644   8.390
  252    H    SER  36           H        SER  36 -17.256   2.221  11.198
  253    HA   SER  36           HA       SER  36 -14.563   3.031  10.596
  254   1HB   SER  36          1HB       SER  36 -15.613   0.993  12.610
  255   2HB   SER  36          2HB       SER  36 -13.958   1.561  12.511
  256    HG   SER  36           HG       SER  36 -15.881   3.612  12.696
  257    H    ARG  37           H        ARG  37 -16.885   0.587   9.723
  258    HA   ARG  37           HA       ARG  37 -14.847  -1.302   9.009
  259   1HB   ARG  37          1HB       ARG  37 -17.467  -1.590   9.826
  260   2HB   ARG  37          2HB       ARG  37 -17.663  -1.731   8.090
  261   1HG   ARG  37          1HG       ARG  37 -16.986  -3.889   8.252
  262   2HG   ARG  37          2HG       ARG  37 -15.386  -3.306   8.663
  263   1HD   ARG  37          1HD       ARG  37 -15.659  -3.719  10.929
  264   2HD   ARG  37          2HD       ARG  37 -17.364  -3.312  10.912
  265    HE   ARG  37           HE       ARG  37 -16.180  -5.951  10.324
  266   1HH1  ARG  37          2HH2      ARG  37 -19.085  -3.927  10.192
  267   2HH1  ARG  37          1HH2      ARG  37 -20.168  -5.273  10.067
  268   1HH2  ARG  37          1HH       ARG  37 -19.278  -7.498  10.050
  269    H    ALA  38           H        ALA  38 -15.509   1.537   7.725
  270    HA   ALA  38           HA       ALA  38 -16.098   0.721   5.004
  271   1HB   ALA  38          1HB       ALA  38 -15.683   3.362   4.816
  272   2HB   ALA  38          2HB       ALA  38 -17.213   2.691   5.430
  273   3HB   ALA  38          3HB       ALA  38 -15.976   3.273   6.570
  274    H    ALA  39           H        ALA  39 -13.850  -0.602   5.679
  275    HA   ALA  39           HA       ALA  39 -11.507   0.972   5.223
  276   1HB   ALA  39          1HB       ALA  39 -11.920  -1.293   6.554
  277   2HB   ALA  39          2HB       ALA  39 -11.576  -2.022   4.967
  278   3HB   ALA  39          3HB       ALA  39 -10.366  -0.975   5.746
  279    H    ALA  40           H        ALA  40 -12.788   1.859   3.169
  280    HA   ALA  40           HA       ALA  40 -12.519   0.067   0.905
  281   1HB   ALA  40          1HB       ALA  40 -13.437   2.966   0.999
  282   2HB   ALA  40          2HB       ALA  40 -13.720   1.780  -0.298
  283   3HB   ALA  40          3HB       ALA  40 -14.512   1.576   1.283
  284    H    ALA  41           H        ALA  41 -11.449   3.450   1.725
  285    HA   ALA  41           HA       ALA  41  -8.807   3.219   1.452
  286   1HB   ALA  41          1HB       ALA  41  -8.549   2.328  -0.635
  287   2HB   ALA  41          2HB       ALA  41 -10.135   2.910  -1.196
  288   3HB   ALA  41          3HB       ALA  41  -8.747   4.022  -1.144
  289    H    ALA  42           H        ALA  42 -10.228   4.846   2.946
  290    HA   ALA  42           HA       ALA  42 -10.697   7.357   1.597
  291   1HB   ALA  42          1HB       ALA  42 -10.756   6.994   4.583
  292   2HB   ALA  42          2HB       ALA  42 -11.821   7.962   3.535
  293   3HB   ALA  42          3HB       ALA  42 -12.000   6.192   3.593
  294    H    ALA  43           H        ALA  43  -8.657   6.221   4.391
  295    HA   ALA  43           HA       ALA  43  -7.160   8.471   4.710
  296   1HB   ALA  43          1HB       ALA  43  -7.041   6.603   6.238
  297   2HB   ALA  43          2HB       ALA  43  -6.404   5.535   4.965
  298   3HB   ALA  43          3HB       ALA  43  -5.408   6.874   5.583
  299    H    VAL  44           H        VAL  44  -7.176   6.202   2.027
  300    HA   VAL  44           HA       VAL  44  -4.637   7.259   1.051
  301    HB   VAL  44           HB       VAL  44  -6.189   4.802   0.749
  302   1HG1  VAL  44          1HG1      VAL  44  -6.686   5.627  -1.464
  303   2HG1  VAL  44          2HG1      VAL  44  -4.987   6.091  -1.723
  304   3HG1  VAL  44          3HG1      VAL  44  -5.430   4.372  -1.595
  305   1HG2  VAL  44          1HG2      VAL  44  -3.296   5.633   0.444
  306   2HG2  VAL  44          2HG2      VAL  44  -4.044   4.645   1.723
  307   3HG2  VAL  44          3HG2      VAL  44  -3.856   3.982   0.082
  308    H    ALA  45           H        ALA  45  -8.153   7.344   0.549
  309    HA   ALA  45           HA       ALA  45  -8.445   8.185  -1.980
  310   1HB   ALA  45          1HB       ALA  45 -10.273   7.904  -0.357
  311   2HB   ALA  45          2HB       ALA  45  -9.743   9.365   0.511
  312   3HB   ALA  45          3HB       ALA  45 -10.377   9.496  -1.147
  313    H    ALA  46           H        ALA  46  -7.801  10.448   0.800
  314    HA   ALA  46           HA       ALA  46  -7.397  12.691  -0.768
  315   1HB   ALA  46          1HB       ALA  46  -7.344  13.523   1.316
  316   2HB   ALA  46          2HB       ALA  46  -7.161  11.884   1.985
  317   3HB   ALA  46          3HB       ALA  46  -5.720  12.829   1.538
  318    H    ALA  47           H        ALA  47  -4.882  10.526   0.731
  319    HA   ALA  47           HA       ALA  47  -2.755  11.713  -0.647
  320   1HB   ALA  47          1HB       ALA  47  -2.186  10.501   1.274
  321   2HB   ALA  47          2HB       ALA  47  -3.216   9.119   0.830
  322   3HB   ALA  47          3HB       ALA  47  -1.685   9.401  -0.033
  323    H    THR  48           H        THR  48  -1.287   9.892  -1.996
  324    HA   THR  48           HA       THR  48  -2.362   8.087  -3.674
  325    HB   THR  48           HB       THR  48  -4.046   9.434  -4.620
  326    HG1  THR  48           HG1      THR  48  -2.952  10.255  -6.665
  327   1HG2  THR  48          1HG2      THR  48  -3.105  11.872  -5.449
  328   2HG2  THR  48          2HG2      THR  48  -3.930  11.636  -3.890
  329   3HG2  THR  48          3HG2      THR  48  -2.152  11.665  -3.960
  330    H    ALA  49           H        ALA  49  -0.759   7.184  -4.867
  331    HA   ALA  49           HA       ALA  49   1.837   7.915  -4.456
  332   1HB   ALA  49          1HB       ALA  49   0.333   6.046  -6.087
  333   2HB   ALA  49          2HB       ALA  49   1.728   6.674  -6.998
  334   3HB   ALA  49          3HB       ALA  49   1.976   5.889  -5.419
  335    H    ALA  50           H        ALA  50   3.391   8.402  -6.506
  336    HA   ALA  50           HA       ALA  50   2.594  11.052  -7.331
  337   1HB   ALA  50          1HB       ALA  50   4.918  11.248  -8.033
  338   2HB   ALA  50          2HB       ALA  50   4.861  10.517  -6.411
  339   3HB   ALA  50          3HB       ALA  50   5.161   9.496  -7.838
  340    H    VAL  51           H        VAL  51   0.798   9.355  -8.469
  341    HA   VAL  51           HA       VAL  51   0.015   8.499 -10.367
  342    HB   VAL  51           HB       VAL  51  -0.029  10.899 -10.789
  343   1HG1  VAL  51          1HG1      VAL  51   2.244  11.566 -10.640
  344   2HG1  VAL  51          2HG1      VAL  51   2.742  10.431 -11.917
  345   3HG1  VAL  51          3HG1      VAL  51   1.761  11.858 -12.328
  346   1HG2  VAL  51          1HG2      VAL  51   0.318   8.912 -12.978
  347   2HG2  VAL  51          2HG2      VAL  51  -1.074   9.943 -12.570
  348   3HG2  VAL  51          3HG2      VAL  51   0.315  10.629 -13.446
  349    H    GLU  52           H        GLU  52   1.967   6.849  -9.542
  350    HA   GLU  52           HA       GLU  52   4.050   6.618 -11.428
  351   1HB   GLU  52          1HB       GLU  52   3.817   5.754  -8.921
  352   2HB   GLU  52          2HB       GLU  52   3.157   4.321  -9.683
  353   1HG   GLU  52          1HG       GLU  52   5.352   3.677  -9.835
  354   2HG   GLU  52          2HG       GLU  52   5.366   4.700 -11.258
  355    HE2  GLU  52           HE2      GLU  52   6.141   7.405 -10.054
  356    H    GLY  53           H        GLY  53   4.377   4.798 -12.948
  357   1HA   GLY  53          1HA       GLY  53   2.293   2.996 -13.593
  358   2HA   GLY  53          2HA       GLY  53   2.224   4.386 -14.658
  359    H    THR  54           H        THR  54   4.611   5.115 -15.439
  360    HA   THR  54           HA       THR  54   6.308   4.611 -16.786
  361    HB   THR  54           HB       THR  54   6.535   2.297 -14.793
  362    HG1  THR  54           HG1      THR  54   7.834   4.898 -15.213
  363   1HG2  THR  54          1HG2      THR  54   8.817   3.492 -16.404
  364   2HG2  THR  54          2HG2      THR  54   8.762   1.939 -15.537
  365   3HG2  THR  54          3HG2      THR  54   7.881   2.133 -17.072
  366    H    GLY  55           H        GLY  55   4.478   4.324 -18.385
  367   1HA   GLY  55          1HA       GLY  55   4.040   1.547 -19.176
  368   2HA   GLY  55          2HA       GLY  55   3.240   2.975 -19.801
  369    H    GLY  56           H        GLY  56   5.675   0.633 -20.369
  370   1HA   GLY  56          1HA       GLY  56   6.469   0.542 -22.657
  371   2HA   GLY  56          2HA       GLY  56   6.764   2.268 -22.581
  372    H    SER  57           H        SER  57   8.487   3.100 -21.152
  373    HA   SER  57           HA       SER  57  10.476   3.085 -20.285
  374   1HB   SER  57          1HB       SER  57   9.252   0.752 -19.149
  375   2HB   SER  57          2HB       SER  57  10.913   0.331 -19.513
  376    HG   SER  57           HG       SER  57  10.666   1.270 -17.375
  377    H    GLY  58           H        GLY  58  12.608   2.869 -21.091
  378   1HA   GLY  58          1HA       GLY  58  13.950   0.933 -22.252
  379   2HA   GLY  58          2HA       GLY  58  12.831   1.299 -23.549
  380    H    GLY  59           H        GLY  59  13.845   2.518 -25.083
  381   1HA   GLY  59          1HA       GLY  59  14.563   4.643 -25.774
  382   2HA   GLY  59          2HA       GLY  59  15.226   4.951 -24.182
  383    H    GLY  60           H        GLY  60  17.378   4.497 -23.764
  384   1HA   GLY  60          1HA       GLY  60  19.526   4.019 -24.233
  385   2HA   GLY  60          2HA       GLY  60  18.917   2.488 -24.830
  386    HA   PRO  61           HA       PRO  61  19.471   5.517 -28.467
  387   1HB   PRO  61          1HB       PRO  61  21.189   7.609 -28.095
  388   2HB   PRO  61          2HB       PRO  61  19.449   7.765 -27.967
  389   1HG   PRO  61          1HG       PRO  61  21.466   7.690 -25.808
  390   2HG   PRO  61          2HG       PRO  61  19.810   8.260 -25.744
  391   1HD   PRO  61          1HD       PRO  61  20.808   5.769 -24.731
  392   2HD   PRO  61          2HD       PRO  61  19.135   6.289 -24.771
  393    H    HIS  62           H        HIS  62  20.433   3.337 -28.736
  394    HA   HIS  62           HA       HIS  62  23.304   3.367 -28.592
  395   1HB   HIS  62          1HB       HIS  62  21.509   1.421 -28.180
  396   2HB   HIS  62          2HB       HIS  62  21.797   1.139 -29.886
  397    HD1  HIS  62           HD1      HIS  62  23.628  -0.490 -30.327
  398    HD2  HIS  62           HD2      HIS  62  24.217   1.590 -26.733
  399    HE1  HIS  62           HE1      HIS  62  25.757  -1.441 -29.291
  400    H    HIS  63           H        HIS  63  24.032   4.904 -30.099
  401    HA   HIS  63           HA       HIS  63  23.099   5.485 -32.525
  402   1HB   HIS  63          1HB       HIS  63  25.516   5.837 -31.116
  403   2HB   HIS  63          2HB       HIS  63  25.979   5.219 -32.689
  404    HD1  HIS  63           HD1      HIS  63  26.751   8.078 -32.034
  405    HD2  HIS  63           HD2      HIS  63  23.112   7.066 -33.859
  406    HE1  HIS  63           HE1      HIS  63  25.953  10.176 -33.248
  407    H    HIS  64           H        HIS  64  25.697   2.976 -32.057
  408    HA   HIS  64           HA       HIS  64  26.146   1.126 -33.146
  409   1HB   HIS  64          1HB       HIS  64  23.996   0.302 -32.582
  410   2HB   HIS  64          2HB       HIS  64  23.202   1.292 -33.791
  411    HD1  HIS  64           HD1      HIS  64  23.610   0.572 -36.364
  412    HD2  HIS  64           HD2      HIS  64  24.815  -2.199 -33.454
  413    HE1  HIS  64           HE1      HIS  64  23.906  -1.654 -37.576
  414    H    HIS  65           H        HIS  65  26.986   0.445 -35.185
  415    HA   HIS  65           HA       HIS  65  26.303   1.145 -37.645
  416   1HB   HIS  65          1HB       HIS  65  27.875   3.191 -38.050
  417   2HB   HIS  65          2HB       HIS  65  26.231   3.429 -37.492
  418    HD1  HIS  65           HD1      HIS  65  29.589   2.824 -35.709
  419    HD2  HIS  65           HD2      HIS  65  26.202   5.291 -35.514
  420    HE1  HIS  65           HE1      HIS  65  29.971   4.408 -33.745
  421    H    GLN  66           H        GLN  66  27.972   0.639 -39.227
  422    HA   GLN  66           HA       GLN  66  30.466  -0.218 -38.000
  423   1HB   GLN  66          1HB       GLN  66  28.544  -2.044 -38.623
  424   2HB   GLN  66          2HB       GLN  66  29.352  -1.948 -40.175
  425   1HG   GLN  66          1HG       GLN  66  30.951  -3.338 -39.370
  426   2HG   GLN  66          2HG       GLN  66  31.460  -2.057 -38.287
  427   1HE2  GLN  66          1HE2      GLN  66  32.072  -3.865 -36.927
  428   2HE2  GLN  66          2HE2      GLN  66  30.912  -4.581 -35.858
  429    H    THR  67           H        THR  67  31.916  -1.087 -40.117
  430    HA   THR  67           HA       THR  67  31.506   0.520 -42.451
  431    HB   THR  67           HB       THR  67  33.675   1.240 -40.413
  432    HG1  THR  67           HG1      THR  67  32.264   2.943 -40.153
  433   1HG2  THR  67          1HG2      THR  67  34.273   3.022 -42.095
  434   2HG2  THR  67          2HG2      THR  67  34.646   1.387 -42.691
  435   3HG2  THR  67          3HG2      THR  67  33.193   2.236 -43.271
  436    H    ARG  68           H        ARG  68  33.537   0.311 -43.935
  437    HA   ARG  68           HA       ARG  68  35.332  -1.711 -43.472
  438   1HB   ARG  68          1HB       ARG  68  32.924  -2.923 -43.769
  439   2HB   ARG  68          2HB       ARG  68  33.327  -2.761 -45.467
  440   1HG   ARG  68          1HG       ARG  68  34.638  -4.600 -45.286
  441   2HG   ARG  68          2HG       ARG  68  35.712  -3.691 -44.242
  442   1HD   ARG  68          1HD       ARG  68  33.557  -4.403 -42.556
  443   2HD   ARG  68          2HD       ARG  68  33.813  -5.827 -43.545
  444    HE   ARG  68           HE       ARG  68  36.276  -4.645 -42.439
  445   1HH1  ARG  68          2HH2      ARG  68  33.699  -7.032 -41.974
  446   2HH1  ARG  68          1HH2      ARG  68  34.620  -7.994 -40.867
  447   1HH2  ARG  68          1HH       ARG  68  36.848  -7.319 -40.297
  448    H    GLY  69           H        GLY  69  36.967  -0.990 -44.800
  449   1HA   GLY  69          1HA       GLY  69  36.197   0.230 -47.378
  450   2HA   GLY  69          2HA       GLY  69  37.618   0.636 -46.436
  451    H    ALA  70           H        ALA  70  39.262  -1.182 -46.062
  452    HA   ALA  70           HA       ALA  70  39.162  -3.415 -47.828
  453   1HB   ALA  70          1HB       ALA  70  40.673  -0.927 -48.580
  454   2HB   ALA  70          2HB       ALA  70  41.397  -2.511 -48.946
  455   3HB   ALA  70          3HB       ALA  70  39.803  -2.084 -49.614
  456    H    TYR  71           H        TYR  71  39.695  -4.774 -46.145
  457    HA   TYR  71           HA       TYR  71  41.717  -4.021 -44.258
  458   1HB   TYR  71          1HB       TYR  71  39.507  -5.551 -44.153
  459   2HB   TYR  71          2HB       TYR  71  40.548  -6.798 -44.810
  460    HD1  TYR  71           HD1      TYR  71  39.309  -5.375 -41.842
  461    HD2  TYR  71           HD2      TYR  71  42.843  -7.141 -43.485
  462    HE1  TYR  71           HE1      TYR  71  40.125  -5.937 -39.501
  463    HE2  TYR  71           HE2      TYR  71  43.647  -7.697 -41.138
  464    HH   TYR  71           HH       TYR  71  42.353  -8.127 -38.849
  465    H    SER  72           H        SER  72  43.877  -4.377 -44.401
  466    HA   SER  72           HA       SER  72  45.786  -5.257 -44.967
  467   1HB   SER  72          1HB       SER  72  43.983  -7.492 -45.367
  468   2HB   SER  72          2HB       SER  72  45.206  -7.521 -46.622
  469    HG   SER  72           HG       SER  72  45.629  -7.490 -43.760
  470    H    SER  73           H        SER  73  47.178  -5.803 -47.039
  471    HA   SER  73           HA       SER  73  47.877  -5.143 -48.984
  472   1HB   SER  73          1HB       SER  73  45.320  -6.335 -49.454
  473   2HB   SER  73          2HB       SER  73  45.421  -4.947 -50.519
  474    HG   SER  73           HG       SER  73  47.356  -7.095 -50.315
  475    H    HIS  74           H        HIS  74  47.648  -3.359 -50.794
  476    HA   HIS  74           HA       HIS  74  46.741  -0.953 -49.422
  477   1HB   HIS  74          1HB       HIS  74  48.906  -1.604 -51.350
  478   2HB   HIS  74          2HB       HIS  74  48.143  -0.039 -51.550
  479    HD1  HIS  74           HD1      HIS  74  50.084   1.384 -50.690
  480    HD2  HIS  74           HD2      HIS  74  48.853  -1.558 -47.965
  481    HE1  HIS  74           HE1      HIS  74  51.290   1.889 -48.500
  482    H    ASP  75           H        ASP  75  45.321   0.545 -50.414
  483    HA   ASP  75           HA       ASP  75  43.663   1.195 -51.649
  484   1HB   ASP  75          1HB       ASP  75  44.975  -0.515 -53.814
  485   2HB   ASP  75          2HB       ASP  75  43.655   0.596 -54.118
  486    HD2  ASP  75           HD2      ASP  75  46.240   0.793 -55.279
  Start of MODEL   19
    1    H    MET   1           H        MET   1 -59.658  -7.712  25.280
    2    HA   MET   1           HA       MET   1 -58.407 -10.121  26.356
    3   1HB   MET   1          1HB       MET   1 -60.926  -9.642  24.891
    4   2HB   MET   1          2HB       MET   1 -59.927 -10.811  24.051
    5   1HG   MET   1          1HG       MET   1 -59.670 -11.746  26.616
    6   2HG   MET   1          2HG       MET   1 -61.265 -11.028  26.723
    7   1HE   MET   1          1HE       MET   1 -63.258 -13.368  26.275
    8   2HE   MET   1          2HE       MET   1 -62.021 -14.626  26.514
    9   3HE   MET   1          3HE       MET   1 -61.924 -13.099  27.423
   10    H    GLU   2           H        GLU   2 -57.065 -11.382  24.859
   11    HA   GLU   2           HA       GLU   2 -56.127  -9.723  22.648
   12   1HB   GLU   2          1HB       GLU   2 -54.466  -9.891  24.482
   13   2HB   GLU   2          2HB       GLU   2 -54.528 -11.640  24.401
   14   1HG   GLU   2          1HG       GLU   2 -53.603 -11.647  22.141
   15   2HG   GLU   2          2HG       GLU   2 -53.757  -9.906  22.012
   16    HE2  GLU   2           HE2      GLU   2 -50.691 -11.576  23.896
   17    H    VAL   3           H        VAL   3 -57.806 -10.821  21.327
   18    HA   VAL   3           HA       VAL   3 -57.604 -13.656  20.994
   19    HB   VAL   3           HB       VAL   3 -59.048 -11.646  19.266
   20   1HG1  VAL   3          1HG1      VAL   3 -58.954 -13.876  18.315
   21   2HG1  VAL   3          2HG1      VAL   3 -59.517 -14.590  19.845
   22   3HG1  VAL   3          3HG1      VAL   3 -60.605 -13.549  18.895
   23   1HG2  VAL   3          1HG2      VAL   3 -60.853 -12.806  21.111
   24   2HG2  VAL   3          2HG2      VAL   3 -59.463 -12.226  22.059
   25   3HG2  VAL   3          3HG2      VAL   3 -60.346 -11.104  20.996
   26    H    ALA   4           H        ALA   4 -57.156 -14.668  18.833
   27    HA   ALA   4           HA       ALA   4 -54.708 -13.557  17.806
   28   1HB   ALA   4          1HB       ALA   4 -55.407 -16.059  18.320
   29   2HB   ALA   4          2HB       ALA   4 -56.087 -15.983  16.676
   30   3HB   ALA   4          3HB       ALA   4 -54.352 -15.682  16.937
   31    H    MET   5           H        MET   5 -55.612 -11.551  16.906
   32    HA   MET   5           HA       MET   5 -57.422 -11.925  14.697
   33   1HB   MET   5          1HB       MET   5 -56.263  -9.575  16.241
   34   2HB   MET   5          2HB       MET   5 -56.958  -9.275  14.660
   35   1HG   MET   5          1HG       MET   5 -58.704 -10.992  16.298
   36   2HG   MET   5          2HG       MET   5 -58.366  -9.469  17.097
   37   1HE   MET   5          1HE       MET   5 -61.498  -8.026  15.788
   38   2HE   MET   5          2HE       MET   5 -60.720  -8.952  17.094
   39   3HE   MET   5          3HE       MET   5 -60.034  -7.393  16.578
   40    H    VAL   6           H        VAL   6 -56.930 -10.761  12.569
   41    HA   VAL   6           HA       VAL   6 -54.486 -11.711  11.564
   42    HB   VAL   6           HB       VAL   6 -56.780 -11.245  10.443
   43   1HG1  VAL   6          1HG1      VAL   6 -55.651  -8.725   9.389
   44   2HG1  VAL   6          2HG1      VAL   6 -57.333  -9.160   9.776
   45   3HG1  VAL   6          3HG1      VAL   6 -56.226  -8.645  11.072
   46   1HG2  VAL   6          1HG2      VAL   6 -54.926 -10.356   8.433
   47   2HG2  VAL   6          2HG2      VAL   6 -54.131 -11.558   9.477
   48   3HG2  VAL   6          3HG2      VAL   6 -55.658 -11.963   8.656
   49    H    SER   7           H        SER   7 -53.476  -9.672   9.925
   50    HA   SER   7           HA       SER   7 -52.018  -8.225  11.906
   51   1HB   SER   7          1HB       SER   7 -50.664  -7.447   9.955
   52   2HB   SER   7          2HB       SER   7 -50.804  -9.193  10.024
   53    HG   SER   7           HG       SER   7 -52.391  -7.431   8.355
   54    H    ALA   8           H        ALA   8 -51.526  -5.772  11.376
   55    HA   ALA   8           HA       ALA   8 -54.083  -4.461  11.289
   56   1HB   ALA   8          1HB       ALA   8 -52.064  -2.530  11.375
   57   2HB   ALA   8          2HB       ALA   8 -52.903  -3.242  12.774
   58   3HB   ALA   8          3HB       ALA   8 -51.357  -3.928  12.219
   59    H    GLU   9           H        GLU   9 -54.385  -5.365   8.968
   60    HA   GLU   9           HA       GLU   9 -52.973  -4.751   6.827
   61   1HB   GLU   9          1HB       GLU   9 -54.932  -5.038   5.564
   62   2HB   GLU   9          2HB       GLU   9 -55.339  -5.832   7.072
   63   1HG   GLU   9          1HG       GLU   9 -56.307  -3.520   7.813
   64   2HG   GLU   9          2HG       GLU   9 -56.201  -3.073   6.121
   65    HE2  GLU   9           HE2      GLU   9 -59.455  -4.286   6.751
   66    H    SER  10           H        SER  10 -52.950  -2.998   5.208
   67    HA   SER  10           HA       SER  10 -53.071  -0.452   6.557
   68   1HB   SER  10          1HB       SER  10 -51.946  -1.249   3.835
   69   2HB   SER  10          2HB       SER  10 -51.847   0.365   4.510
   70    HG   SER  10           HG       SER  10 -50.349  -1.921   5.112
   71    H    SER  11           H        SER  11 -54.073  -1.872   3.352
   72    HA   SER  11           HA       SER  11 -55.553  -1.164   1.891
   73   1HB   SER  11          1HB       SER  11 -57.890  -1.220   2.739
   74   2HB   SER  11          2HB       SER  11 -56.931  -2.540   3.378
   75    HG   SER  11           HG       SER  11 -57.642  -0.083   4.734
   76    H    GLY  12           H        GLY  12 -54.495   0.924   1.425
   77   1HA   GLY  12          1HA       GLY  12 -56.073   3.093   1.231
   78   2HA   GLY  12          2HA       GLY  12 -55.411   3.275   2.843
   79    H    CYS  13           H        CYS  13 -52.842   2.622   2.850
   80    HA   CYS  13           HA       CYS  13 -50.804   3.130   2.201
   81   1HB   CYS  13          1HB       CYS  13 -51.946   2.359  -0.189
   82   2HB   CYS  13          2HB       CYS  13 -51.336   3.956  -0.578
   83    HG   CYS  13           HG       CYS  13 -49.887   1.177  -0.077
   84    H    ASN  14           H        ASN  14 -51.619   4.995   3.716
   85    HA   ASN  14           HA       ASN  14 -51.966   7.469   2.285
   86   1HB   ASN  14          1HB       ASN  14 -52.619   6.431   4.945
   87   2HB   ASN  14          2HB       ASN  14 -51.753   7.946   5.099
   88   1HD2  ASN  14          1HD2      ASN  14 -53.978   8.396   6.016
   89   2HD2  ASN  14          2HD2      ASN  14 -55.157   9.080   4.946
   90    H    SER  15           H        SER  15 -49.368   5.850   2.340
   91    HA   SER  15           HA       SER  15 -47.233   6.238   2.411
   92   1HB   SER  15          1HB       SER  15 -47.983   8.575   1.615
   93   2HB   SER  15          2HB       SER  15 -47.767   9.109   3.270
   94    HG   SER  15           HG       SER  15 -45.818   8.316   1.349
   95    H    HIS  16           H        HIS  16 -47.263   4.768   4.309
   96    HA   HIS  16           HA       HIS  16 -45.804   5.769   6.431
   97   1HB   HIS  16          1HB       HIS  16 -48.536   6.399   6.705
   98   2HB   HIS  16          2HB       HIS  16 -48.265   5.043   7.781
   99    HD1  HIS  16           HD1      HIS  16 -47.410   8.661   7.293
  100    HD2  HIS  16           HD2      HIS  16 -46.486   5.552   9.953
  101    HE1  HIS  16           HE1      HIS  16 -46.289   9.753   9.308
  102    H    MET  17           H        MET  17 -44.697   3.857   5.594
  103    HA   MET  17           HA       MET  17 -45.840   1.370   5.476
  104   1HB   MET  17          1HB       MET  17 -43.141   2.579   5.531
  105   2HB   MET  17          2HB       MET  17 -43.140   0.995   6.282
  106   1HG   MET  17          1HG       MET  17 -44.490   0.225   4.157
  107   2HG   MET  17          2HG       MET  17 -43.933   1.723   3.438
  108   1HE   MET  17          1HE       MET  17 -41.874  -1.899   2.805
  109   2HE   MET  17          2HE       MET  17 -43.574  -1.545   3.196
  110   3HE   MET  17          3HE       MET  17 -42.801  -0.762   1.797
  111    HA   PRO  18           HA       PRO  18 -46.029  -0.056   9.571
  112   1HB   PRO  18          1HB       PRO  18 -45.364  -2.701   9.390
  113   2HB   PRO  18          2HB       PRO  18 -46.942  -2.077   8.950
  114   1HG   PRO  18          1HG       PRO  18 -44.740  -2.959   7.186
  115   2HG   PRO  18          2HG       PRO  18 -46.435  -2.743   6.801
  116   1HD   PRO  18          1HD       PRO  18 -44.282  -0.976   6.119
  117   2HD   PRO  18          2HD       PRO  18 -45.990  -0.705   5.836
  118    H    TYR  19           H        TYR  19 -44.897  -1.339  11.428
  119    HA   TYR  19           HA       TYR  19 -42.697   0.012  12.158
  120   1HB   TYR  19          1HB       TYR  19 -43.979  -2.646  12.628
  121   2HB   TYR  19          2HB       TYR  19 -42.271  -2.662  13.020
  122    HD1  TYR  19           HD1      TYR  19 -45.495  -0.973  13.787
  123    HD2  TYR  19           HD2      TYR  19 -41.455  -1.657  15.018
  124    HE1  TYR  19           HE1      TYR  19 -45.996   0.086  16.044
  125    HE2  TYR  19           HE2      TYR  19 -41.969  -0.596  17.270
  126    HH   TYR  19           HH       TYR  19 -45.051  -0.110  18.371
  127    H    GLY  20           H        GLY  20 -41.067   0.483  10.685
  128   1HA   GLY  20          1HA       GLY  20 -39.221  -1.677  10.126
  129   2HA   GLY  20          2HA       GLY  20 -39.994  -0.993   8.710
  130    H    TYR  21           H        TYR  21 -39.206   0.903   7.835
  131    HA   TYR  21           HA       TYR  21 -36.766   1.868   8.361
  132   1HB   TYR  21          1HB       TYR  21 -38.835   2.443   6.682
  133   2HB   TYR  21          2HB       TYR  21 -39.077   3.778   7.792
  134    HD1  TYR  21           HD1      TYR  21 -36.525   4.842   8.433
  135    HD2  TYR  21           HD2      TYR  21 -37.799   3.122   4.729
  136    HE1  TYR  21           HE1      TYR  21 -34.758   6.186   7.194
  137    HE2  TYR  21           HE2      TYR  21 -36.028   4.472   3.502
  138    HH   TYR  21           HH       TYR  21 -34.662   7.056   4.585
  139    H    ALA  22           H        ALA  22 -39.813   2.822  10.030
  140    HA   ALA  22           HA       ALA  22 -38.651   4.949  11.469
  141   1HB   ALA  22          1HB       ALA  22 -41.093   3.229  12.068
  142   2HB   ALA  22          2HB       ALA  22 -40.727   4.814  12.791
  143   3HB   ALA  22          3HB       ALA  22 -41.075   4.690  11.050
  144    H    ALA  23           H        ALA  23 -39.306   1.469  12.242
  145    HA   ALA  23           HA       ALA  23 -38.124   1.700  14.827
  146   1HB   ALA  23          1HB       ALA  23 -39.783   0.051  14.646
  147   2HB   ALA  23          2HB       ALA  23 -39.171  -0.532  13.079
  148   3HB   ALA  23          3HB       ALA  23 -38.278  -0.897  14.574
  149    H    GLN  24           H        GLN  24 -36.842   1.804  11.719
  150    HA   GLN  24           HA       GLN  24 -34.534   0.209  12.339
  151   1HB   GLN  24          1HB       GLN  24 -35.459   1.764   9.905
  152   2HB   GLN  24          2HB       GLN  24 -33.816   1.166  10.006
  153   1HG   GLN  24          1HG       GLN  24 -35.819  -0.878  10.755
  154   2HG   GLN  24          2HG       GLN  24 -36.037  -0.288   9.120
  155   1HE2  GLN  24          1HE2      GLN  24 -33.687  -1.607  11.400
  156   2HE2  GLN  24          2HE2      GLN  24 -32.641  -2.366  10.246
  157    H    ALA  25           H        ALA  25 -35.600   3.218  13.252
  158    HA   ALA  25           HA       ALA  25 -33.444   4.901  12.701
  159   1HB   ALA  25          1HB       ALA  25 -35.568   5.771  13.446
  160   2HB   ALA  25          2HB       ALA  25 -35.489   4.825  14.952
  161   3HB   ALA  25          3HB       ALA  25 -34.357   6.173  14.687
  162    H    ARG  26           H        ARG  26 -33.771   2.137  14.806
  163    HA   ARG  26           HA       ARG  26 -31.854   2.949  16.685
  164   1HB   ARG  26          1HB       ARG  26 -33.678   0.857  16.462
  165   2HB   ARG  26          2HB       ARG  26 -32.157   0.022  16.220
  166   1HG   ARG  26          1HG       ARG  26 -32.496  -0.030  18.580
  167   2HG   ARG  26          2HG       ARG  26 -31.302   1.229  18.337
  168   1HD   ARG  26          1HD       ARG  26 -33.085   2.968  18.447
  169   2HD   ARG  26          2HD       ARG  26 -34.305   1.724  18.633
  170    HE   ARG  26           HE       ARG  26 -32.476   2.691  20.696
  171   1HH1  ARG  26          2HH2      ARG  26 -34.459  -0.067  19.686
  172   2HH1  ARG  26          1HH2      ARG  26 -34.608  -0.706  21.289
  173   1HH2  ARG  26          1HH       ARG  26 -33.550   0.437  23.111
  174    H    ALA  27           H        ALA  27 -31.789   1.367  13.500
  175    HA   ALA  27           HA       ALA  27 -29.170   0.311  13.726
  176   1HB   ALA  27          1HB       ALA  27 -29.904  -0.706  11.865
  177   2HB   ALA  27          2HB       ALA  27 -31.350   0.332  11.861
  178   3HB   ALA  27          3HB       ALA  27 -29.879   0.851  11.004
  179    H    ARG  28           H        ARG  28 -30.581   3.464  12.886
  180    HA   ARG  28           HA       ARG  28 -28.410   4.480  11.527
  181   1HB   ARG  28          1HB       ARG  28 -30.929   5.399  12.325
  182   2HB   ARG  28          2HB       ARG  28 -29.850   6.433  13.241
  183   1HG   ARG  28          1HG       ARG  28 -28.769   6.236  10.585
  184   2HG   ARG  28          2HG       ARG  28 -30.486   6.540  10.416
  185   1HD   ARG  28          1HD       ARG  28 -29.039   8.182  12.475
  186   2HD   ARG  28          2HD       ARG  28 -28.665   8.529  10.798
  187    HE   ARG  28           HE       ARG  28 -31.149   9.138  12.169
  188   1HH1  ARG  28          2HH2      ARG  28 -29.825   8.297   8.992
  189   2HH1  ARG  28          1HH2      ARG  28 -31.117   9.049   8.117
  190   1HH2  ARG  28          1HH       ARG  28 -32.887  10.120   9.326
  191    H    GLU  29           H        GLU  29 -29.077   4.014  14.988
  192    HA   GLU  29           HA       GLU  29 -26.971   5.758  15.795
  193   1HB   GLU  29          1HB       GLU  29 -29.090   4.142  17.095
  194   2HB   GLU  29          2HB       GLU  29 -27.599   4.210  18.012
  195   1HG   GLU  29          1HG       GLU  29 -28.317   6.230  18.773
  196   2HG   GLU  29          2HG       GLU  29 -27.901   6.858  17.191
  197    HE2  GLU  29           HE2      GLU  29 -30.027   7.046  15.661
  198    H    ARG  30           H        ARG  30 -27.367   2.386  14.889
  199    HA   ARG  30           HA       ARG  30 -24.922   1.647  16.199
  200   1HB   ARG  30          1HB       ARG  30 -27.184   0.238  14.849
  201   2HB   ARG  30          2HB       ARG  30 -25.621  -0.521  14.621
  202   1HG   ARG  30          1HG       ARG  30 -25.295  -0.854  16.959
  203   2HG   ARG  30          2HG       ARG  30 -26.492   0.349  17.395
  204   1HD   ARG  30          1HD       ARG  30 -27.857  -1.472  17.708
  205   2HD   ARG  30          2HD       ARG  30 -28.076  -1.378  15.971
  206    HE   ARG  30           HE       ARG  30 -26.756  -3.306  15.708
  207   1HH1  ARG  30          2HH2      ARG  30 -26.376  -2.070  19.007
  208   2HH1  ARG  30          1HH2      ARG  30 -25.506  -3.462  19.561
  209   1HH2  ARG  30          1HH       ARG  30 -25.067  -5.256  18.034
  210    H    GLU  31           H        GLU  31 -26.174   2.593  13.022
  211    HA   GLU  31           HA       GLU  31 -24.190   1.487  11.446
  212   1HB   GLU  31          1HB       GLU  31 -26.159   3.744  11.162
  213   2HB   GLU  31          2HB       GLU  31 -24.867   3.643   9.982
  214   1HG   GLU  31          1HG       GLU  31 -25.952   0.985  10.395
  215   2HG   GLU  31          2HG       GLU  31 -27.278   2.090  10.095
  216    HE2  GLU  31           HE2      GLU  31 -26.564   1.377   6.818
  217    H    ARG  32           H        ARG  32 -24.089   4.066  13.763
  218    HA   ARG  32           HA       ARG  32 -22.215   5.713  12.623
  219   1HB   ARG  32          1HB       ARG  32 -23.610   5.839  14.896
  220   2HB   ARG  32          2HB       ARG  32 -22.174   5.119  15.597
  221   1HG   ARG  32          1HG       ARG  32 -21.593   7.393  13.777
  222   2HG   ARG  32          2HG       ARG  32 -22.559   7.841  15.169
  223   1HD   ARG  32          1HD       ARG  32 -20.465   6.077  16.089
  224   2HD   ARG  32          2HD       ARG  32 -19.725   7.290  15.063
  225    HE   ARG  32           HE       ARG  32 -20.985   7.740  17.664
  226   1HH1  ARG  32          2HH2      ARG  32 -20.073   9.279  14.606
  227   2HH1  ARG  32          1HH2      ARG  32 -20.024  10.874  15.280
  228   1HH2  ARG  32          1HH       ARG  32 -20.526  11.182  17.603
  229    H    LEU  33           H        LEU  33 -21.944   2.510  14.095
  230    HA   LEU  33           HA       LEU  33 -19.062   2.738  14.343
  231   1HB   LEU  33          1HB       LEU  33 -21.064   1.333  15.694
  232   2HB   LEU  33          2HB       LEU  33 -20.193   0.107  14.793
  233    HG   LEU  33           HG       LEU  33 -18.152   1.619  15.906
  234   1HD1  LEU  33          1HD1      LEU  33 -20.392   1.369  17.932
  235   2HD1  LEU  33          2HD1      LEU  33 -18.701   1.783  18.306
  236   3HD1  LEU  33          3HD1      LEU  33 -19.684   2.875  17.301
  237   1HD2  LEU  33          1HD2      LEU  33 -19.303  -1.043  16.179
  238   2HD2  LEU  33          2HD2      LEU  33 -17.601  -0.522  16.164
  239   3HD2  LEU  33          3HD2      LEU  33 -18.531  -0.481  17.681
  240    H    ALA  34           H        ALA  34 -21.422   1.976  11.973
  241    HA   ALA  34           HA       ALA  34 -19.821   0.002  10.619
  242   1HB   ALA  34          1HB       ALA  34 -21.719  -0.371   9.418
  243   2HB   ALA  34          2HB       ALA  34 -22.496   0.558  10.722
  244   3HB   ALA  34          3HB       ALA  34 -22.045   1.365   9.200
  245    H    HIS  35           H        HIS  35 -19.291   3.173  11.193
  246    HA   HIS  35           HA       HIS  35 -18.680   3.914   8.462
  247   1HB   HIS  35          1HB       HIS  35 -19.633   5.347  10.561
  248   2HB   HIS  35          2HB       HIS  35 -17.920   5.683  10.720
  249    HD1  HIS  35           HD1      HIS  35 -20.726   7.212   9.329
  250    HD2  HIS  35           HD2      HIS  35 -16.931   6.326   7.778
  251    HE1  HIS  35           HE1      HIS  35 -20.380   8.780   7.346
  252    H    SER  36           H        SER  36 -17.239   2.238  11.066
  253    HA   SER  36           HA       SER  36 -14.586   3.154  10.434
  254   1HB   SER  36          1HB       SER  36 -15.611   1.071  12.413
  255   2HB   SER  36          2HB       SER  36 -13.922   1.505  12.239
  256    HG   SER  36           HG       SER  36 -15.029   3.843  12.539
  257    H    ARG  37           H        ARG  37 -16.861   0.685   9.508
  258    HA   ARG  37           HA       ARG  37 -14.790  -1.109   8.657
  259   1HB   ARG  37          1HB       ARG  37 -17.380  -1.510   9.524
  260   2HB   ARG  37          2HB       ARG  37 -17.615  -1.580   7.789
  261   1HG   ARG  37          1HG       ARG  37 -17.023  -3.782   8.049
  262   2HG   ARG  37          2HG       ARG  37 -15.389  -3.150   7.997
  263   1HD   ARG  37          1HD       ARG  37 -16.632  -3.025  10.697
  264   2HD   ARG  37          2HD       ARG  37 -16.448  -4.654  10.080
  265    HE   ARG  37           HE       ARG  37 -14.305  -2.858  10.895
  266   1HH1  ARG  37          2HH2      ARG  37 -15.075  -5.575   8.755
  267   2HH1  ARG  37          1HH2      ARG  37 -13.437  -6.130   8.666
  268   1HH2  ARG  37          1HH       ARG  37 -11.730  -4.949   9.863
  269    H    ALA  38           H        ALA  38 -15.563   1.764   7.522
  270    HA   ALA  38           HA       ALA  38 -16.206   1.058   4.783
  271   1HB   ALA  38          1HB       ALA  38 -17.305   2.985   5.846
  272   2HB   ALA  38          2HB       ALA  38 -15.720   3.729   6.164
  273   3HB   ALA  38          3HB       ALA  38 -16.284   3.518   4.489
  274    H    ALA  39           H        ALA  39 -13.580   2.784   6.613
  275    HA   ALA  39           HA       ALA  39 -11.872   2.722   4.311
  276   1HB   ALA  39          1HB       ALA  39 -12.057   4.109   6.815
  277   2HB   ALA  39          2HB       ALA  39 -10.460   3.327   6.730
  278   3HB   ALA  39          3HB       ALA  39 -10.975   4.442   5.441
  279    H    ALA  40           H        ALA  40 -12.342   0.218   4.242
  280    HA   ALA  40           HA       ALA  40 -10.752  -1.272   6.138
  281   1HB   ALA  40          1HB       ALA  40 -12.483  -2.007   3.750
  282   2HB   ALA  40          2HB       ALA  40 -11.573  -3.204   4.703
  283   3HB   ALA  40          3HB       ALA  40 -12.850  -2.235   5.477
  284    H    ALA  41           H        ALA  41 -10.864  -1.022   2.507
  285    HA   ALA  41           HA       ALA  41  -9.234  -0.942   1.006
  286   1HB   ALA  41          1HB       ALA  41  -7.219   0.099   1.520
  287   2HB   ALA  41          2HB       ALA  41  -8.239   0.645   2.873
  288   3HB   ALA  41          3HB       ALA  41  -7.092  -0.695   3.108
  289    H    ALA  42           H        ALA  42 -10.232  -3.385   1.618
  290    HA   ALA  42           HA       ALA  42  -7.854  -5.084   1.931
  291   1HB   ALA  42          1HB       ALA  42 -10.333  -6.534   2.122
  292   2HB   ALA  42          2HB       ALA  42  -9.094  -6.275   3.374
  293   3HB   ALA  42          3HB       ALA  42 -10.422  -5.105   3.180
  294    H    ALA  43           H        ALA  43 -11.122  -5.651   0.488
  295    HA   ALA  43           HA       ALA  43 -10.253  -7.232  -1.563
  296   1HB   ALA  43          1HB       ALA  43 -12.433  -7.041  -2.378
  297   2HB   ALA  43          2HB       ALA  43 -12.638  -6.572  -0.673
  298   3HB   ALA  43          3HB       ALA  43 -12.558  -5.321  -1.937
  299    H    VAL  44           H        VAL  44  -9.899  -3.772  -1.135
  300    HA   VAL  44           HA       VAL  44  -9.340  -3.388  -3.964
  301    HB   VAL  44           HB       VAL  44 -10.125  -1.746  -1.677
  302   1HG1  VAL  44          1HG1      VAL  44  -7.893  -0.802  -3.493
  303   2HG1  VAL  44          2HG1      VAL  44  -8.974   0.319  -2.631
  304   3HG1  VAL  44          3HG1      VAL  44  -7.947  -0.809  -1.714
  305   1HG2  VAL  44          1HG2      VAL  44 -11.599  -0.962  -3.174
  306   2HG2  VAL  44          2HG2      VAL  44 -10.326  -0.590  -4.361
  307   3HG2  VAL  44          3HG2      VAL  44 -10.998  -2.235  -4.262
  308    H    ALA  45           H        ALA  45  -7.766  -3.753  -0.801
  309    HA   ALA  45           HA       ALA  45  -5.326  -2.648  -1.220
  310   1HB   ALA  45          1HB       ALA  45  -5.123  -5.308  -0.020
  311   2HB   ALA  45          2HB       ALA  45  -4.895  -3.706   0.722
  312   3HB   ALA  45          3HB       ALA  45  -6.527  -4.405   0.599
  313    H    ALA  46           H        ALA  46  -6.226  -6.082  -2.033
  314    HA   ALA  46           HA       ALA  46  -3.858  -6.637  -3.380
  315   1HB   ALA  46          1HB       ALA  46  -6.204  -7.968  -2.645
  316   2HB   ALA  46          2HB       ALA  46  -6.208  -8.036  -4.424
  317   3HB   ALA  46          3HB       ALA  46  -4.818  -8.672  -3.512
  318    H    ALA  47           H        ALA  47  -7.043  -5.377  -4.543
  319    HA   ALA  47           HA       ALA  47  -6.407  -5.384  -7.253
  320   1HB   ALA  47          1HB       ALA  47  -8.137  -3.200  -6.203
  321   2HB   ALA  47          2HB       ALA  47  -8.463  -4.412  -7.465
  322   3HB   ALA  47          3HB       ALA  47  -8.611  -4.854  -5.747
  323    H    THR  48           H        THR  48  -6.782  -2.740  -8.165
  324    HA   THR  48           HA       THR  48  -5.385  -0.705  -7.104
  325    HB   THR  48           HB       THR  48  -3.575  -2.928  -7.965
  326    HG1  THR  48           HG1      THR  48  -3.522  -0.488  -6.332
  327   1HG2  THR  48          1HG2      THR  48  -1.768  -1.334  -8.578
  328   2HG2  THR  48          2HG2      THR  48  -3.107  -1.212  -9.745
  329   3HG2  THR  48          3HG2      THR  48  -2.917   0.021  -8.476
  330    H    ALA  49           H        ALA  49  -5.292   1.055  -8.490
  331    HA   ALA  49           HA       ALA  49  -6.965   1.130 -10.601
  332   1HB   ALA  49          1HB       ALA  49  -6.289   3.286 -10.679
  333   2HB   ALA  49          2HB       ALA  49  -5.221   2.866  -9.318
  334   3HB   ALA  49          3HB       ALA  49  -4.595   2.832 -10.984
  335    H    ALA  50           H        ALA  50  -6.996  -0.412 -12.199
  336    HA   ALA  50           HA       ALA  50  -4.499  -1.285 -13.359
  337   1HB   ALA  50          1HB       ALA  50  -7.400  -1.993 -13.963
  338   2HB   ALA  50          2HB       ALA  50  -5.968  -2.825 -14.614
  339   3HB   ALA  50          3HB       ALA  50  -6.314  -2.884 -12.870
  340    H    VAL  51           H        VAL  51  -4.585   1.407 -13.737
  341    HA   VAL  51           HA       VAL  51  -5.288   1.596 -16.581
  342    HB   VAL  51           HB       VAL  51  -6.839   2.796 -14.928
  343   1HG1  VAL  51          1HG1      VAL  51  -6.078   4.416 -13.579
  344   2HG1  VAL  51          2HG1      VAL  51  -4.447   3.795 -13.930
  345   3HG1  VAL  51          3HG1      VAL  51  -5.105   5.152 -14.875
  346   1HG2  VAL  51          1HG2      VAL  51  -6.205   3.278 -17.511
  347   2HG2  VAL  51          2HG2      VAL  51  -7.412   4.218 -16.602
  348   3HG2  VAL  51          3HG2      VAL  51  -5.756   4.843 -16.791
  349    H    GLU  52           H        GLU  52  -2.845   0.641 -16.008
  350    HA   GLU  52           HA       GLU  52  -1.130   2.995 -15.985
  351   1HB   GLU  52          1HB       GLU  52  -0.788   1.191 -14.218
  352   2HB   GLU  52          2HB       GLU  52  -0.318   0.097 -15.504
  353   1HG   GLU  52          1HG       GLU  52   1.793   0.892 -15.129
  354   2HG   GLU  52          2HG       GLU  52   1.277   2.262 -16.092
  355    HE2  GLU  52           HE2      GLU  52   1.358   1.109 -12.862
  356    H    GLY  53           H        GLY  53   0.518   3.230 -17.614
  357   1HA   GLY  53          1HA       GLY  53   0.297   1.362 -19.889
  358   2HA   GLY  53          2HA       GLY  53   0.158   3.093 -20.126
  359    H    THR  54           H        THR  54   2.006   4.418 -20.110
  360    HA   THR  54           HA       THR  54   4.469   3.648 -19.015
  361    HB   THR  54           HB       THR  54   4.284   1.946 -20.904
  362    HG1  THR  54           HG1      THR  54   6.388   2.584 -20.263
  363   1HG2  THR  54          1HG2      THR  54   4.072   2.583 -23.111
  364   2HG2  THR  54          2HG2      THR  54   3.339   4.059 -22.436
  365   3HG2  THR  54          3HG2      THR  54   5.064   4.041 -22.873
  366    H    GLY  55           H        GLY  55   6.283   5.140 -19.828
  367   1HA   GLY  55          1HA       GLY  55   5.381   7.787 -19.614
  368   2HA   GLY  55          2HA       GLY  55   6.992   7.260 -20.060
  369    H    GLY  56           H        GLY  56   7.645   8.115 -21.979
  370   1HA   GLY  56          1HA       GLY  56   5.628   8.854 -23.958
  371   2HA   GLY  56          2HA       GLY  56   7.318   9.316 -23.930
  372    H    SER  57           H        SER  57   5.016   7.295 -25.401
  373    HA   SER  57           HA       SER  57   7.178   5.787 -26.612
  374   1HB   SER  57          1HB       SER  57   4.732   4.681 -25.240
  375   2HB   SER  57          2HB       SER  57   5.327   3.849 -26.663
  376    HG   SER  57           HG       SER  57   7.039   3.125 -25.573
  377    H    GLY  58           H        GLY  58   7.020   5.772 -28.847
  378   1HA   GLY  58          1HA       GLY  58   4.595   5.704 -30.271
  379   2HA   GLY  58          2HA       GLY  58   5.129   7.369 -30.153
  380    H    GLY  59           H        GLY  59   4.969   5.993 -32.641
  381   1HA   GLY  59          1HA       GLY  59   7.656   6.371 -33.582
  382   2HA   GLY  59          2HA       GLY  59   7.165   4.689 -33.593
  383    H    GLY  60           H        GLY  60   6.740   4.202 -35.721
  384   1HA   GLY  60          1HA       GLY  60   4.655   4.397 -37.143
  385   2HA   GLY  60          2HA       GLY  60   5.057   6.101 -37.233
  386    HA   PRO  61           HA       PRO  61   7.369   3.700 -40.454
  387   1HB   PRO  61          1HB       PRO  61   5.852   4.188 -42.674
  388   2HB   PRO  61          2HB       PRO  61   5.734   2.711 -41.739
  389   1HG   PRO  61          1HG       PRO  61   3.875   5.008 -41.817
  390   2HG   PRO  61          2HG       PRO  61   3.583   3.378 -41.242
  391   1HD   PRO  61          1HD       PRO  61   4.037   5.710 -39.635
  392   2HD   PRO  61          2HD       PRO  61   3.860   4.062 -39.065
  393    H    HIS  62           H        HIS  62   9.189   4.690 -41.031
  394    HA   HIS  62           HA       HIS  62   8.820   7.274 -42.304
  395   1HB   HIS  62          1HB       HIS  62   9.982   8.512 -40.804
  396   2HB   HIS  62          2HB       HIS  62   9.299   7.339 -39.696
  397    HD1  HIS  62           HD1      HIS  62  10.926   5.470 -38.756
  398    HD2  HIS  62           HD2      HIS  62  12.771   8.431 -41.085
  399    HE1  HIS  62           HE1      HIS  62  13.433   5.256 -38.330
  400    H    HIS  63           H        HIS  63  11.102   8.044 -43.164
  401    HA   HIS  63           HA       HIS  63  12.642   7.631 -44.682
  402   1HB   HIS  63          1HB       HIS  63  14.183   7.200 -43.053
  403   2HB   HIS  63          2HB       HIS  63  13.299   5.833 -42.404
  404    HD1  HIS  63           HD1      HIS  63  14.478   6.205 -46.021
  405    HD2  HIS  63           HD2      HIS  63  15.236   3.882 -42.611
  406    HE1  HIS  63           HE1      HIS  63  16.076   4.356 -46.756
  407    H    HIS  64           H        HIS  64  11.566   7.075 -46.565
  408    HA   HIS  64           HA       HIS  64  11.131   4.198 -46.926
  409   1HB   HIS  64          1HB       HIS  64   9.500   6.584 -47.685
  410   2HB   HIS  64          2HB       HIS  64   9.511   5.221 -48.787
  411    HD1  HIS  64           HD1      HIS  64   6.987   4.750 -48.243
  412    HD2  HIS  64           HD2      HIS  64   9.577   4.392 -44.964
  413    HE1  HIS  64           HE1      HIS  64   5.662   3.565 -46.412
  414    H    HIS  65           H        HIS  65  13.227   3.759 -47.734
  415    HA   HIS  65           HA       HIS  65  14.762   5.176 -49.371
  416   1HB   HIS  65          1HB       HIS  65  15.809   3.177 -50.019
  417   2HB   HIS  65          2HB       HIS  65  15.149   2.863 -48.427
  418    HD1  HIS  65           HD1      HIS  65  15.631   1.052 -51.316
  419    HD2  HIS  65           HD2      HIS  65  12.176   1.814 -49.062
  420    HE1  HIS  65           HE1      HIS  65  13.979  -0.806 -51.889
  421    H    GLN  66           H        GLN  66  14.564   6.184 -51.305
  422    HA   GLN  66           HA       GLN  66  12.237   6.136 -52.731
  423   1HB   GLN  66          1HB       GLN  66  14.370   7.728 -52.770
  424   2HB   GLN  66          2HB       GLN  66  14.855   6.720 -54.119
  425   1HG   GLN  66          1HG       GLN  66  13.384   7.754 -55.503
  426   2HG   GLN  66          2HG       GLN  66  12.049   7.411 -54.421
  427   1HE2  GLN  66          1HE2      GLN  66  11.062   9.047 -53.519
  428   2HE2  GLN  66          2HE2      GLN  66  11.673  10.654 -53.307
  429    H    THR  67           H        THR  67  12.488   5.683 -55.375
  430    HA   THR  67           HA       THR  67  12.423   2.863 -55.555
  431    HB   THR  67           HB       THR  67  12.364   3.667 -58.125
  432    HG1  THR  67           HG1      THR  67  13.182   5.823 -57.212
  433   1HG2  THR  67          1HG2      THR  67  10.370   3.655 -55.964
  434   2HG2  THR  67          2HG2      THR  67  10.025   4.935 -57.151
  435   3HG2  THR  67          3HG2      THR  67  10.158   3.241 -57.682
  436    H    ARG  68           H        ARG  68  13.977   1.397 -55.855
  437    HA   ARG  68           HA       ARG  68  16.608   2.097 -55.815
  438   1HB   ARG  68          1HB       ARG  68  17.052  -0.273 -56.439
  439   2HB   ARG  68          2HB       ARG  68  15.764  -0.168 -55.255
  440   1HG   ARG  68          1HG       ARG  68  14.651  -1.535 -56.729
  441   2HG   ARG  68          2HG       ARG  68  14.268  -0.025 -57.532
  442   1HD   ARG  68          1HD       ARG  68  16.362  -0.312 -58.948
  443   2HD   ARG  68          2HD       ARG  68  16.597  -1.885 -58.211
  444    HE   ARG  68           HE       ARG  68  14.574  -1.176 -60.212
  445   1HH1  ARG  68          2HH2      ARG  68  15.459  -3.494 -57.682
  446   2HH1  ARG  68          1HH2      ARG  68  14.468  -4.761 -58.324
  447   1HH2  ARG  68          1HH       ARG  68  13.187  -4.359 -60.310
  448    H    GLY  69           H        GLY  69  18.321   1.843 -57.512
  449   1HA   GLY  69          1HA       GLY  69  18.448   1.349 -60.015
  450   2HA   GLY  69          2HA       GLY  69  17.293   2.660 -60.153
  451    H    ALA  70           H        ALA  70  20.647   1.772 -59.476
  452    HA   ALA  70           HA       ALA  70  21.352   4.600 -59.733
  453   1HB   ALA  70          1HB       ALA  70  22.959   4.415 -57.917
  454   2HB   ALA  70          2HB       ALA  70  21.353   3.943 -57.311
  455   3HB   ALA  70          3HB       ALA  70  22.563   2.694 -57.691
  456    H    TYR  71           H        TYR  71  21.651   3.810 -62.001
  457    HA   TYR  71           HA       TYR  71  24.374   3.123 -62.410
  458   1HB   TYR  71          1HB       TYR  71  23.059   0.914 -61.837
  459   2HB   TYR  71          2HB       TYR  71  22.182   1.171 -63.332
  460    HD1  TYR  71           HD1      TYR  71  25.811   1.365 -62.360
  461    HD2  TYR  71           HD2      TYR  71  22.872  -0.274 -65.001
  462    HE1  TYR  71           HE1      TYR  71  27.636   0.149 -63.646
  463    HE2  TYR  71           HE2      TYR  71  24.706  -1.485 -66.279
  464    HH   TYR  71           HH       TYR  71  28.113  -1.090 -65.348
  465    H    SER  72           H        SER  72  25.005   3.361 -64.647
  466    HA   SER  72           HA       SER  72  23.062   3.777 -66.624
  467   1HB   SER  72          1HB       SER  72  23.534   6.208 -67.038
  468   2HB   SER  72          2HB       SER  72  22.675   5.915 -65.539
  469    HG   SER  72           HG       SER  72  25.471   5.881 -65.267
  470    H    SER  73           H        SER  73  24.045   3.684 -68.692
  471    HA   SER  73           HA       SER  73  26.692   4.398 -69.128
  472   1HB   SER  73          1HB       SER  73  27.718   2.164 -69.445
  473   2HB   SER  73          2HB       SER  73  27.246   2.419 -67.777
  474    HG   SER  73           HG       SER  73  26.615   0.307 -68.536
  475    H    HIS  74           H        HIS  74  27.094   4.450 -71.384
  476    HA   HIS  74           HA       HIS  74  25.430   2.876 -73.116
  477   1HB   HIS  74          1HB       HIS  74  24.736   5.612 -72.463
  478   2HB   HIS  74          2HB       HIS  74  25.121   5.472 -74.167
  479    HD1  HIS  74           HD1      HIS  74  23.948   2.680 -74.804
  480    HD2  HIS  74           HD2      HIS  74  21.996   5.574 -72.477
  481    HE1  HIS  74           HE1      HIS  74  21.460   2.127 -74.915
  482    H    ASP  75           H        ASP  75  27.357   1.944 -73.882
  483    HA   ASP  75           HA       ASP  75  29.577   3.504 -74.537
  484   1HB   ASP  75          1HB       ASP  75  28.684   0.699 -75.324
  485   2HB   ASP  75          2HB       ASP  75  30.208   1.367 -75.873
  486    HD2  ASP  75           HD2      ASP  75  31.929   1.179 -74.335
  Start of MODEL   20
    1    H    MET   1           H        MET   1 -53.972  20.006  37.323
    2    HA   MET   1           HA       MET   1 -52.473  17.708  38.215
    3   1HB   MET   1          1HB       MET   1 -53.840  18.188  35.912
    4   2HB   MET   1          2HB       MET   1 -52.293  18.842  35.413
    5   1HG   MET   1          1HG       MET   1 -51.612  16.723  34.955
    6   2HG   MET   1          2HG       MET   1 -51.649  16.386  36.674
    7   1HE   MET   1          1HE       MET   1 -51.933  13.951  35.692
    8   2HE   MET   1          2HE       MET   1 -52.783  14.132  37.245
    9   3HE   MET   1          3HE       MET   1 -53.558  13.257  35.902
   10    H    GLU   2           H        GLU   2 -50.120  17.507  37.450
   11    HA   GLU   2           HA       GLU   2 -48.838  20.047  38.016
   12   1HB   GLU   2          1HB       GLU   2 -48.343  17.298  38.779
   13   2HB   GLU   2          2HB       GLU   2 -46.934  17.909  37.936
   14   1HG   GLU   2          1HG       GLU   2 -46.724  18.399  40.333
   15   2HG   GLU   2          2HG       GLU   2 -46.887  19.902  39.445
   16    HE2  GLU   2           HE2      GLU   2 -48.209  18.165  41.971
   17    H    VAL   3           H        VAL   3 -49.319  20.803  35.767
   18    HA   VAL   3           HA       VAL   3 -48.868  21.065  33.608
   19    HB   VAL   3           HB       VAL   3 -46.613  21.422  35.105
   20   1HG1  VAL   3          1HG1      VAL   3 -45.961  19.053  34.203
   21   2HG1  VAL   3          2HG1      VAL   3 -45.579  19.932  32.703
   22   3HG1  VAL   3          3HG1      VAL   3 -44.749  20.358  34.219
   23   1HG2  VAL   3          1HG2      VAL   3 -45.747  22.279  32.679
   24   2HG2  VAL   3          2HG2      VAL   3 -47.485  22.084  32.349
   25   3HG2  VAL   3          3HG2      VAL   3 -46.944  23.144  33.672
   26    H    ALA   4           H        ALA   4 -47.288  19.925  31.689
   27    HA   ALA   4           HA       ALA   4 -48.514  17.324  31.468
   28   1HB   ALA   4          1HB       ALA   4 -47.351  17.478  29.171
   29   2HB   ALA   4          2HB       ALA   4 -48.630  18.666  29.516
   30   3HB   ALA   4          3HB       ALA   4 -46.919  19.140  29.637
   31    H    MET   5           H        MET   5 -47.553  15.451  32.067
   32    HA   MET   5           HA       MET   5 -45.033  15.441  33.203
   33   1HB   MET   5          1HB       MET   5 -45.335  12.903  33.045
   34   2HB   MET   5          2HB       MET   5 -46.702  13.737  33.758
   35   1HG   MET   5          1HG       MET   5 -46.886  13.524  30.805
   36   2HG   MET   5          2HG       MET   5 -46.833  11.966  31.604
   37   1HE   MET   5          1HE       MET   5 -49.083  11.271  30.896
   38   2HE   MET   5          2HE       MET   5 -48.941  10.868  32.624
   39   3HE   MET   5          3HE       MET   5 -50.458  11.552  31.991
   40    H    VAL   6           H        VAL   6 -42.987  14.629  32.492
   41    HA   VAL   6           HA       VAL   6 -42.571  14.962  29.668
   42    HB   VAL   6           HB       VAL   6 -40.549  14.107  31.730
   43   1HG1  VAL   6          1HG1      VAL   6 -39.080  15.577  30.252
   44   2HG1  VAL   6          2HG1      VAL   6 -39.650  14.050  29.537
   45   3HG1  VAL   6          3HG1      VAL   6 -40.429  15.587  29.091
   46   1HG2  VAL   6          1HG2      VAL   6 -40.919  15.975  32.897
   47   2HG2  VAL   6          2HG2      VAL   6 -40.380  16.898  31.473
   48   3HG2  VAL   6          3HG2      VAL   6 -42.111  16.553  31.709
   49    H    SER   7           H        SER   7 -41.288  13.318  28.401
   50    HA   SER   7           HA       SER   7 -41.187  11.348  27.492
   51   1HB   SER   7          1HB       SER   7 -40.081  11.062  29.989
   52   2HB   SER   7          2HB       SER   7 -41.299   9.803  30.043
   53    HG   SER   7           HG       SER   7 -39.667   9.984  27.705
   54    H    ALA   8           H        ALA   8 -43.330  11.446  26.557
   55    HA   ALA   8           HA       ALA   8 -45.596  10.562  28.017
   56   1HB   ALA   8          1HB       ALA   8 -45.709  10.441  25.070
   57   2HB   ALA   8          2HB       ALA   8 -46.709  11.367  26.215
   58   3HB   ALA   8          3HB       ALA   8 -45.124  11.997  25.706
   59    H    GLU   9           H        GLU   9 -45.287   8.496  28.885
   60    HA   GLU   9           HA       GLU   9 -45.630   6.398  27.017
   61   1HB   GLU   9          1HB       GLU   9 -43.098   6.792  27.040
   62   2HB   GLU   9          2HB       GLU   9 -43.104   6.281  28.716
   63   1HG   GLU   9          1HG       GLU   9 -44.406   4.163  27.792
   64   2HG   GLU   9          2HG       GLU   9 -43.750   4.651  26.242
   65    HE2  GLU   9           HE2      GLU   9 -42.497   3.087  29.274
   66    H    SER  10           H        SER  10 -46.354   4.423  28.063
   67    HA   SER  10           HA       SER  10 -46.465   4.487  30.934
   68   1HB   SER  10          1HB       SER  10 -48.625   5.516  29.518
   69   2HB   SER  10          2HB       SER  10 -49.108   3.848  29.757
   70    HG   SER  10           HG       SER  10 -48.581   5.880  31.706
   71    H    SER  11           H        SER  11 -47.857   2.846  27.992
   72    HA   SER  11           HA       SER  11 -46.422   0.490  28.588
   73   1HB   SER  11          1HB       SER  11 -48.563  -0.940  28.767
   74   2HB   SER  11          2HB       SER  11 -48.084  -0.041  30.193
   75    HG   SER  11           HG       SER  11 -50.240   0.426  29.994
   76    H    GLY  12           H        GLY  12 -45.689   0.633  26.427
   77   1HA   GLY  12          1HA       GLY  12 -45.748   0.284  24.208
   78   2HA   GLY  12          2HA       GLY  12 -47.293  -0.513  24.429
   79    H    CYS  13           H        CYS  13 -45.873   2.837  24.464
   80    HA   CYS  13           HA       CYS  13 -47.766   3.677  22.515
   81   1HB   CYS  13          1HB       CYS  13 -48.769   3.787  25.075
   82   2HB   CYS  13          2HB       CYS  13 -48.087   5.392  24.895
   83    HG   CYS  13           HG       CYS  13 -50.259   3.771  23.003
   84    H    ASN  14           H        ASN  14 -45.315   3.755  21.854
   85    HA   ASN  14           HA       ASN  14 -44.045   6.109  22.965
   86   1HB   ASN  14          1HB       ASN  14 -43.124   3.574  21.822
   87   2HB   ASN  14          2HB       ASN  14 -42.390   4.911  20.960
   88   1HD2  ASN  14          1HD2      ASN  14 -40.383   4.928  21.708
   89   2HD2  ASN  14          2HD2      ASN  14 -39.908   5.114  23.364
   90    H    SER  15           H        SER  15 -46.438   6.049  21.055
   91    HA   SER  15           HA       SER  15 -47.170   7.103  19.306
   92   1HB   SER  15          1HB       SER  15 -44.546   8.591  19.648
   93   2HB   SER  15          2HB       SER  15 -45.644   8.998  18.345
   94    HG   SER  15           HG       SER  15 -45.948  10.271  20.337
   95    H    HIS  16           H        HIS  16 -47.354   5.511  17.721
   96    HA   HIS  16           HA       HIS  16 -45.059   5.297  15.921
   97   1HB   HIS  16          1HB       HIS  16 -46.296   3.203  17.514
   98   2HB   HIS  16          2HB       HIS  16 -46.402   2.837  15.803
   99    HD1  HIS  16           HD1      HIS  16 -44.495   1.405  15.097
  100    HD2  HIS  16           HD2      HIS  16 -43.355   4.200  18.010
  101    HE1  HIS  16           HE1      HIS  16 -42.004   1.036  15.506
  102    H    MET  17           H        MET  17 -46.465   7.134  14.985
  103    HA   MET  17           HA       MET  17 -48.964   6.431  13.921
  104   1HB   MET  17          1HB       MET  17 -47.232   8.747  14.123
  105   2HB   MET  17          2HB       MET  17 -47.689   8.585  12.439
  106   1HG   MET  17          1HG       MET  17 -49.691   8.560  14.749
  107   2HG   MET  17          2HG       MET  17 -49.290   9.993  13.824
  108   1HE   MET  17          1HE       MET  17 -52.377   7.850  13.904
  109   2HE   MET  17          2HE       MET  17 -51.902   9.553  14.102
  110   3HE   MET  17          3HE       MET  17 -52.822   9.047  12.665
  111    HA   PRO  18           HA       PRO  18 -46.465   5.899   9.923
  112   1HB   PRO  18          1HB       PRO  18 -43.733   5.865  10.009
  113   2HB   PRO  18          2HB       PRO  18 -44.663   7.300   9.621
  114   1HG   PRO  18          1HG       PRO  18 -43.243   6.633  12.127
  115   2HG   PRO  18          2HG       PRO  18 -43.803   8.196  11.565
  116   1HD   PRO  18          1HD       PRO  18 -45.029   6.554  13.572
  117   2HD   PRO  18          2HD       PRO  18 -45.650   8.061  12.927
  118    H    TYR  19           H        TYR  19 -45.259   4.101   8.753
  119    HA   TYR  19           HA       TYR  19 -46.013   1.716   9.937
  120   1HB   TYR  19          1HB       TYR  19 -45.174   2.599   7.495
  121   2HB   TYR  19          2HB       TYR  19 -43.629   1.989   8.054
  122    HD1  TYR  19           HD1      TYR  19 -47.097   1.039   7.177
  123    HD2  TYR  19           HD2      TYR  19 -43.185  -0.376   8.179
  124    HE1  TYR  19           HE1      TYR  19 -47.748  -1.306   6.441
  125    HE2  TYR  19           HE2      TYR  19 -43.850  -2.716   7.440
  126    HH   TYR  19           HH       TYR  19 -46.709  -3.795   7.238
  127    H    GLY  20           H        GLY  20 -44.339  -0.191  10.231
  128   1HA   GLY  20          1HA       GLY  20 -42.781   0.450  12.519
  129   2HA   GLY  20          2HA       GLY  20 -42.872  -1.091  11.688
  130    H    TYR  21           H        TYR  21 -42.195   1.004   9.217
  131    HA   TYR  21           HA       TYR  21 -39.508   0.160   9.024
  132   1HB   TYR  21          1HB       TYR  21 -41.476   2.050   7.669
  133   2HB   TYR  21          2HB       TYR  21 -39.787   2.208   7.227
  134    HD1  TYR  21           HD1      TYR  21 -38.701  -0.382   6.931
  135    HD2  TYR  21           HD2      TYR  21 -42.701   0.883   6.094
  136    HE1  TYR  21           HE1      TYR  21 -38.964  -2.289   5.269
  137    HE2  TYR  21           HE2      TYR  21 -42.951  -1.028   4.436
  138    HH   TYR  21           HH       TYR  21 -41.543  -2.418   3.069
  139    H    ALA  22           H        ALA  22 -41.031   2.737  10.765
  140    HA   ALA  22           HA       ALA  22 -38.791   4.530  10.598
  141   1HB   ALA  22          1HB       ALA  22 -40.632   5.810  10.980
  142   2HB   ALA  22          2HB       ALA  22 -41.524   4.476  11.751
  143   3HB   ALA  22          3HB       ALA  22 -40.329   5.406  12.687
  144    H    ALA  23           H        ALA  23 -39.105   1.539  11.934
  145    HA   ALA  23           HA       ALA  23 -37.925   2.189  14.506
  146   1HB   ALA  23          1HB       ALA  23 -38.181  -0.630  13.586
  147   2HB   ALA  23          2HB       ALA  23 -38.633   0.113  15.139
  148   3HB   ALA  23          3HB       ALA  23 -39.702   0.283  13.725
  149    H    GLN  24           H        GLN  24 -36.676   2.560  11.647
  150    HA   GLN  24           HA       GLN  24 -34.447   0.754  11.888
  151   1HB   GLN  24          1HB       GLN  24 -35.169   2.868   9.814
  152   2HB   GLN  24          2HB       GLN  24 -33.712   1.899   9.735
  153   1HG   GLN  24          1HG       GLN  24 -36.586   0.871   9.684
  154   2HG   GLN  24          2HG       GLN  24 -35.446   0.854   8.353
  155   1HE2  GLN  24          1HE2      GLN  24 -33.170  -0.061   9.248
  156   2HE2  GLN  24          2HE2      GLN  24 -33.286  -1.645   9.942
  157    H    ALA  25           H        ALA  25 -35.353   3.587  13.364
  158    HA   ALA  25           HA       ALA  25 -33.129   5.246  13.076
  159   1HB   ALA  25          1HB       ALA  25 -34.739   4.987  15.623
  160   2HB   ALA  25          2HB       ALA  25 -34.068   6.450  14.864
  161   3HB   ALA  25          3HB       ALA  25 -35.477   5.638  14.140
  162    H    ARG  26           H        ARG  26 -33.554   2.160  14.648
  163    HA   ARG  26           HA       ARG  26 -31.570   2.528  16.596
  164   1HB   ARG  26          1HB       ARG  26 -33.505   0.635  16.141
  165   2HB   ARG  26          2HB       ARG  26 -32.104  -0.232  15.544
  166   1HG   ARG  26          1HG       ARG  26 -31.691  -0.788  17.711
  167   2HG   ARG  26          2HG       ARG  26 -31.146   0.863  17.923
  168   1HD   ARG  26          1HD       ARG  26 -34.025  -0.087  18.329
  169   2HD   ARG  26          2HD       ARG  26 -32.874   0.195  19.620
  170    HE   ARG  26           HE       ARG  26 -34.345   2.224  18.140
  171   1HH1  ARG  26          2HH2      ARG  26 -31.338   1.635  19.919
  172   2HH1  ARG  26          1HH2      ARG  26 -31.103   3.304  20.320
  173   1HH2  ARG  26          1HH       ARG  26 -32.701   4.926  19.575
  174    H    ALA  27           H        ALA  27 -31.632   1.556  13.175
  175    HA   ALA  27           HA       ALA  27 -29.063   0.362  13.140
  176   1HB   ALA  27          1HB       ALA  27 -31.084   0.167  11.494
  177   2HB   ALA  27          2HB       ALA  27 -30.419   1.648  10.764
  178   3HB   ALA  27          3HB       ALA  27 -29.432   0.168  10.830
  179    H    ARG  28           H        ARG  28 -30.335   3.675  12.925
  180    HA   ARG  28           HA       ARG  28 -28.140   4.827  11.722
  181   1HB   ARG  28          1HB       ARG  28 -30.597   5.699  12.693
  182   2HB   ARG  28          2HB       ARG  28 -29.488   6.467  13.813
  183   1HG   ARG  28          1HG       ARG  28 -29.813   7.999  11.965
  184   2HG   ARG  28          2HG       ARG  28 -28.185   7.364  11.831
  185   1HD   ARG  28          1HD       ARG  28 -28.728   5.975   9.988
  186   2HD   ARG  28          2HD       ARG  28 -30.436   5.947  10.379
  187    HE   ARG  28           HE       ARG  28 -30.708   7.878   9.101
  188   1HH1  ARG  28          2HH2      ARG  28 -27.313   7.681  10.096
  189   2HH1  ARG  28          1HH2      ARG  28 -26.835   9.069   9.178
  190   1HH2  ARG  28          1HH       ARG  28 -28.476  10.246   7.888
  191    H    GLU  29           H        GLU  29 -28.773   3.763  15.055
  192    HA   GLU  29           HA       GLU  29 -26.573   5.234  16.114
  193   1HB   GLU  29          1HB       GLU  29 -28.611   3.292  17.192
  194   2HB   GLU  29          2HB       GLU  29 -27.149   3.553  18.121
  195   1HG   GLU  29          1HG       GLU  29 -27.580   5.927  18.321
  196   2HG   GLU  29          2HG       GLU  29 -28.840   5.875  17.105
  197    HE2  GLU  29           HE2      GLU  29 -28.063   4.346  20.110
  198    H    ARG  30           H        ARG  30 -27.145   2.106  14.618
  199    HA   ARG  30           HA       ARG  30 -24.718   1.032  15.710
  200   1HB   ARG  30          1HB       ARG  30 -27.067  -0.004  14.182
  201   2HB   ARG  30          2HB       ARG  30 -25.546  -0.776  13.781
  202   1HG   ARG  30          1HG       ARG  30 -25.794  -2.056  15.637
  203   2HG   ARG  30          2HG       ARG  30 -25.497  -0.620  16.596
  204   1HD   ARG  30          1HD       ARG  30 -28.287  -1.117  15.523
  205   2HD   ARG  30          2HD       ARG  30 -27.742  -2.016  16.925
  206    HE   ARG  30           HE       ARG  30 -28.415   0.815  16.839
  207   1HH1  ARG  30          2HH2      ARG  30 -26.409  -1.574  18.519
  208   2HH1  ARG  30          1HH2      ARG  30 -26.295  -0.639  19.972
  209   1HH2  ARG  30          1HH       ARG  30 -27.393   1.488  20.089
  210    H    GLU  31           H        GLU  31 -25.974   2.599  12.791
  211    HA   GLU  31           HA       GLU  31 -24.001   1.716  11.033
  212   1HB   GLU  31          1HB       GLU  31 -26.298   3.382  10.944
  213   2HB   GLU  31          2HB       GLU  31 -24.975   4.391  10.396
  214   1HG   GLU  31          1HG       GLU  31 -24.439   2.937   8.588
  215   2HG   GLU  31          2HG       GLU  31 -25.274   1.575   9.308
  216    HE2  GLU  31           HE2      GLU  31 -27.244   3.648   6.737
  217    H    ARG  32           H        ARG  32 -24.061   4.145  13.583
  218    HA   ARG  32           HA       ARG  32 -22.103   5.826  12.655
  219   1HB   ARG  32          1HB       ARG  32 -23.617   6.070  14.732
  220   2HB   ARG  32          2HB       ARG  32 -22.495   5.022  15.577
  221   1HG   ARG  32          1HG       ARG  32 -21.090   7.186  14.159
  222   2HG   ARG  32          2HG       ARG  32 -22.279   7.818  15.281
  223   1HD   ARG  32          1HD       ARG  32 -21.298   6.504  17.131
  224   2HD   ARG  32          2HD       ARG  32 -20.178   5.728  16.029
  225    HE   ARG  32           HE       ARG  32 -19.962   8.627  15.905
  226   1HH1  ARG  32          2HH2      ARG  32 -18.963   5.789  17.777
  227   2HH1  ARG  32          1HH2      ARG  32 -17.548   6.556  18.417
  228   1HH2  ARG  32          1HH       ARG  32 -17.058   8.819  17.800
  229    H    LEU  33           H        LEU  33 -21.949   2.580  14.083
  230    HA   LEU  33           HA       LEU  33 -19.080   2.781  14.479
  231   1HB   LEU  33          1HB       LEU  33 -21.160   1.387  15.720
  232   2HB   LEU  33          2HB       LEU  33 -20.257   0.159  14.856
  233    HG   LEU  33           HG       LEU  33 -18.229   1.564  16.048
  234   1HD1  LEU  33          1HD1      LEU  33 -20.262   2.769  17.254
  235   2HD1  LEU  33          2HD1      LEU  33 -20.164   1.337  18.308
  236   3HD1  LEU  33          3HD1      LEU  33 -18.746   2.394  18.107
  237   1HD2  LEU  33          1HD2      LEU  33 -19.716  -0.942  16.671
  238   2HD2  LEU  33          2HD2      LEU  33 -18.013  -0.694  16.218
  239   3HD2  LEU  33          3HD2      LEU  33 -18.553  -0.344  17.877
  240    H    ALA  34           H        ALA  34 -21.326   2.055  11.990
  241    HA   ALA  34           HA       ALA  34 -19.677   0.074  10.706
  242   1HB   ALA  34          1HB       ALA  34 -22.077   1.619   9.650
  243   2HB   ALA  34          2HB       ALA  34 -21.410   0.097   9.012
  244   3HB   ALA  34          3HB       ALA  34 -22.192   0.125  10.611
  245    H    HIS  35           H        HIS  35 -19.149   3.236  11.324
  246    HA   HIS  35           HA       HIS  35 -18.395   3.987   8.632
  247   1HB   HIS  35          1HB       HIS  35 -19.498   5.451  10.554
  248   2HB   HIS  35          2HB       HIS  35 -17.829   5.678  11.037
  249    HD1  HIS  35           HD1      HIS  35 -16.616   7.552   9.905
  250    HD2  HIS  35           HD2      HIS  35 -19.905   6.215   7.671
  251    HE1  HIS  35           HE1      HIS  35 -16.806   9.122   7.903
  252    H    SER  36           H        SER  36 -17.101   2.283  11.294
  253    HA   SER  36           HA       SER  36 -14.412   3.179  10.802
  254   1HB   SER  36          1HB       SER  36 -15.319   2.654  13.122
  255   2HB   SER  36          2HB       SER  36 -15.387   0.965  12.658
  256    HG   SER  36           HG       SER  36 -12.966   1.437  12.037
  257    H    ARG  37           H        ARG  37 -16.659   0.735   9.749
  258    HA   ARG  37           HA       ARG  37 -14.563  -1.072   8.991
  259   1HB   ARG  37          1HB       ARG  37 -17.195  -1.455   9.726
  260   2HB   ARG  37          2HB       ARG  37 -17.346  -1.512   7.981
  261   1HG   ARG  37          1HG       ARG  37 -16.392  -3.573   7.880
  262   2HG   ARG  37          2HG       ARG  37 -15.014  -3.054   8.831
  263   1HD   ARG  37          1HD       ARG  37 -17.016  -3.171  10.760
  264   2HD   ARG  37          2HD       ARG  37 -17.472  -4.487   9.696
  265    HE   ARG  37           HE       ARG  37 -14.776  -4.915   9.997
  266   1HH1  ARG  37          2HH2      ARG  37 -17.367  -4.358  12.349
  267   2HH1  ARG  37          1HH2      ARG  37 -16.601  -5.282  13.598
  268   1HH2  ARG  37          1HH       ARG  37 -14.484  -6.317  13.162
  269    H    ALA  38           H        ALA  38 -15.255   1.814   7.836
  270    HA   ALA  38           HA       ALA  38 -15.802   1.154   5.073
  271   1HB   ALA  38          1HB       ALA  38 -15.338   3.744   6.597
  272   2HB   ALA  38          2HB       ALA  38 -15.618   3.673   4.840
  273   3HB   ALA  38          3HB       ALA  38 -16.878   3.113   5.966
  274    H    ALA  39           H        ALA  39 -13.134   2.565   7.082
  275    HA   ALA  39           HA       ALA  39 -11.326   2.977   5.045
  276   1HB   ALA  39          1HB       ALA  39 -10.553   1.993   7.803
  277   2HB   ALA  39          2HB       ALA  39  -9.729   3.188   6.772
  278   3HB   ALA  39          3HB       ALA  39 -11.271   3.603   7.560
  279    H    ALA  40           H        ALA  40 -12.585  -0.001   6.377
  280    HA   ALA  40           HA       ALA  40 -10.531  -1.762   6.058
  281   1HB   ALA  40          1HB       ALA  40 -12.652  -3.231   5.200
  282   2HB   ALA  40          2HB       ALA  40 -12.380  -2.802   6.906
  283   3HB   ALA  40          3HB       ALA  40 -13.505  -1.842   5.915
  284    H    ALA  41           H        ALA  41 -13.116  -1.737   3.549
  285    HA   ALA  41           HA       ALA  41 -11.879  -0.791   1.385
  286   1HB   ALA  41          1HB       ALA  41 -10.574  -3.304   2.275
  287   2HB   ALA  41          2HB       ALA  41 -11.005  -3.245   0.549
  288   3HB   ALA  41          3HB       ALA  41  -9.950  -1.992   1.246
  289    H    ALA  42           H        ALA  42 -14.325  -0.617   1.538
  290    HA   ALA  42           HA       ALA  42 -15.534  -2.983   0.274
  291   1HB   ALA  42          1HB       ALA  42 -16.199  -1.749   2.710
  292   2HB   ALA  42          2HB       ALA  42 -17.419  -1.162   1.554
  293   3HB   ALA  42          3HB       ALA  42 -17.190  -2.911   1.796
  294    H    ALA  43           H        ALA  43 -16.394   0.515   0.757
  295    HA   ALA  43           HA       ALA  43 -17.694   0.832  -1.628
  296   1HB   ALA  43          1HB       ALA  43 -17.013   3.294  -1.294
  297   2HB   ALA  43          2HB       ALA  43 -17.888   2.509   0.042
  298   3HB   ALA  43          3HB       ALA  43 -16.125   2.730   0.142
  299    H    VAL  44           H        VAL  44 -14.274   0.417  -1.007
  300    HA   VAL  44           HA       VAL  44 -13.558   1.524  -3.596
  301    HB   VAL  44           HB       VAL  44 -12.235   0.904  -1.065
  302   1HG1  VAL  44          1HG1      VAL  44 -10.771   0.265  -3.649
  303   2HG1  VAL  44          2HG1      VAL  44 -10.037   0.368  -2.030
  304   3HG1  VAL  44          3HG1      VAL  44 -11.232  -0.902  -2.386
  305   1HG2  VAL  44          1HG2      VAL  44 -10.599   2.610  -2.416
  306   2HG2  VAL  44          2HG2      VAL  44 -12.147   2.909  -3.241
  307   3HG2  VAL  44          3HG2      VAL  44 -12.024   3.117  -1.478
  308    H    ALA  45           H        ALA  45 -14.123  -1.558  -1.923
  309    HA   ALA  45           HA       ALA  45 -12.779  -3.322  -3.498
  310   1HB   ALA  45          1HB       ALA  45 -13.919  -4.741  -2.181
  311   2HB   ALA  45          2HB       ALA  45 -14.856  -3.357  -1.570
  312   3HB   ALA  45          3HB       ALA  45 -15.456  -4.293  -2.960
  313    H    ALA  46           H        ALA  46 -15.720  -1.434  -4.241
  314    HA   ALA  46           HA       ALA  46 -16.105  -2.876  -6.722
  315   1HB   ALA  46          1HB       ALA  46 -18.205  -2.292  -6.140
  316   2HB   ALA  46          2HB       ALA  46 -17.628  -1.080  -4.971
  317   3HB   ALA  46          3HB       ALA  46 -17.786  -0.652  -6.691
  318    H    ALA  47           H        ALA  47 -14.604   0.077  -5.462
  319    HA   ALA  47           HA       ALA  47 -14.310   1.162  -8.140
  320   1HB   ALA  47          1HB       ALA  47 -12.865   2.736  -6.344
  321   2HB   ALA  47          2HB       ALA  47 -14.535   3.025  -6.888
  322   3HB   ALA  47          3HB       ALA  47 -14.233   2.136  -5.376
  323    H    THR  48           H        THR  48 -13.040  -1.456  -7.022
  324    HA   THR  48           HA       THR  48 -11.004  -2.419  -6.868
  325    HB   THR  48           HB       THR  48 -11.010  -0.852  -9.492
  326    HG1  THR  48           HG1      THR  48 -11.542  -3.134 -10.128
  327   1HG2  THR  48          1HG2      THR  48  -9.152  -3.093  -8.538
  328   2HG2  THR  48          2HG2      THR  48  -9.361  -2.635 -10.245
  329   3HG2  THR  48          3HG2      THR  48  -8.661  -1.474  -9.091
  330    H    ALA  49           H        ALA  49 -10.075  -1.591  -4.990
  331    HA   ALA  49           HA       ALA  49  -8.987   0.840  -4.577
  332   1HB   ALA  49          1HB       ALA  49  -7.307  -1.389  -3.600
  333   2HB   ALA  49          2HB       ALA  49  -8.189  -0.137  -2.692
  334   3HB   ALA  49          3HB       ALA  49  -9.046  -1.585  -3.273
  335    H    ALA  50           H        ALA  50  -7.809   1.994  -6.048
  336    HA   ALA  50           HA       ALA  50  -5.851   0.624  -7.670
  337   1HB   ALA  50          1HB       ALA  50  -5.560   3.032  -8.543
  338   2HB   ALA  50          2HB       ALA  50  -7.139   2.257  -8.812
  339   3HB   ALA  50          3HB       ALA  50  -6.944   3.448  -7.504
  340    H    VAL  51           H        VAL  51  -5.103   0.191  -5.091
  341    HA   VAL  51           HA       VAL  51  -3.573   0.578  -3.523
  342    HB   VAL  51           HB       VAL  51  -2.242  -0.214  -5.405
  343   1HG1  VAL  51          1HG1      VAL  51  -2.042   2.728  -6.092
  344   2HG1  VAL  51          2HG1      VAL  51  -0.892   1.514  -6.702
  345   3HG1  VAL  51          3HG1      VAL  51  -2.620   1.389  -7.113
  346   1HG2  VAL  51          1HG2      VAL  51  -0.317   0.035  -4.261
  347   2HG2  VAL  51          2HG2      VAL  51  -0.375   1.812  -4.353
  348   3HG2  VAL  51          3HG2      VAL  51  -1.312   0.954  -3.106
  349    H    GLU  52           H        GLU  52  -5.395   2.540  -3.303
  350    HA   GLU  52           HA       GLU  52  -3.999   5.057  -3.470
  351   1HB   GLU  52          1HB       GLU  52  -6.555   4.502  -4.025
  352   2HB   GLU  52          2HB       GLU  52  -6.767   4.772  -2.306
  353   1HG   GLU  52          1HG       GLU  52  -5.138   6.919  -3.088
  354   2HG   GLU  52          2HG       GLU  52  -6.214   6.721  -4.457
  355    HE2  GLU  52           HE2      GLU  52  -7.635   8.615  -1.432
  356    H    GLY  53           H        GLY  53  -3.780   6.495  -1.583
  357   1HA   GLY  53          1HA       GLY  53  -4.433   6.044   1.000
  358   2HA   GLY  53          2HA       GLY  53  -3.033   5.014   0.780
  359    H    THR  54           H        THR  54  -4.223   8.335   0.974
  360    HA   THR  54           HA       THR  54  -1.454   9.233   1.259
  361    HB   THR  54           HB       THR  54  -2.000  11.202  -0.217
  362    HG1  THR  54           HG1      THR  54  -4.092  11.244  -1.079
  363   1HG2  THR  54          1HG2      THR  54  -0.951   9.233  -1.339
  364   2HG2  THR  54          2HG2      THR  54  -2.556   8.488  -1.528
  365   3HG2  THR  54          3HG2      THR  54  -2.162   9.987  -2.403
  366    H    GLY  55           H        GLY  55  -1.461  11.600   2.115
  367   1HA   GLY  55          1HA       GLY  55  -3.798  12.194   3.750
  368   2HA   GLY  55          2HA       GLY  55  -2.339  11.752   4.614
  369    H    GLY  56           H        GLY  56  -2.753  14.092   5.420
  370   1HA   GLY  56          1HA       GLY  56  -0.800  15.788   4.316
  371   2HA   GLY  56          2HA       GLY  56  -2.374  16.304   3.744
  372    H    SER  57           H        SER  57  -1.121  18.133   5.267
  373    HA   SER  57           HA       SER  57  -2.845  18.294   7.501
  374   1HB   SER  57          1HB       SER  57   0.128  17.834   7.937
  375   2HB   SER  57          2HB       SER  57  -0.854  18.662   9.129
  376    HG   SER  57           HG       SER  57  -2.316  16.599   8.759
  377    H    GLY  58           H        GLY  58  -2.238  20.445   8.797
  378   1HA   GLY  58          1HA       GLY  58  -0.828  22.373   7.107
  379   2HA   GLY  58          2HA       GLY  58  -2.537  22.643   7.388
  380    H    GLY  59           H        GLY  59  -1.306  24.690   8.342
  381   1HA   GLY  59          1HA       GLY  59  -1.773  24.864  11.025
  382   2HA   GLY  59          2HA       GLY  59  -0.105  24.337  10.924
  383    H    GLY  60           H        GLY  60   0.445  26.456  11.907
  384   1HA   GLY  60          1HA       GLY  60   1.784  28.252  10.820
  385   2HA   GLY  60          2HA       GLY  60   0.328  28.659   9.935
  386    HA   PRO  61           HA       PRO  61  -0.146  29.889  14.517
  387   1HB   PRO  61          1HB       PRO  61   2.164  30.369  15.896
  388   2HB   PRO  61          2HB       PRO  61   1.270  28.867  16.018
  389   1HG   PRO  61          1HG       PRO  61   3.796  29.408  14.582
  390   2HG   PRO  61          2HG       PRO  61   3.119  27.867  15.071
  391   1HD   PRO  61          1HD       PRO  61   3.115  28.984  12.429
  392   2HD   PRO  61          2HD       PRO  61   2.338  27.499  12.940
  393    H    HIS  62           H        HIS  62   0.118  32.009  15.758
  394    HA   HIS  62           HA       HIS  62   1.418  33.966  14.060
  395   1HB   HIS  62          1HB       HIS  62  -0.528  35.361  13.846
  396   2HB   HIS  62          2HB       HIS  62  -0.876  33.778  13.181
  397    HD1  HIS  62           HD1      HIS  62  -2.467  32.188  14.639
  398    HD2  HIS  62           HD2      HIS  62  -2.166  36.161  15.952
  399    HE1  HIS  62           HE1      HIS  62  -4.407  32.556  16.255
  400    H    HIS  63           H        HIS  63   1.462  36.168  15.186
  401    HA   HIS  63           HA       HIS  63   2.645  36.025  17.578
  402   1HB   HIS  63          1HB       HIS  63   0.831  38.346  16.956
  403   2HB   HIS  63          2HB       HIS  63   2.390  38.353  17.754
  404    HD1  HIS  63           HD1      HIS  63   4.448  37.443  16.019
  405    HD2  HIS  63           HD2      HIS  63   0.993  39.142  14.355
  406    HE1  HIS  63           HE1      HIS  63   5.074  38.165  13.653
  407    H    HIS  64           H        HIS  64   1.959  36.641  19.810
  408    HA   HIS  64           HA       HIS  64  -0.808  35.803  20.289
  409   1HB   HIS  64          1HB       HIS  64   1.748  34.847  21.463
  410   2HB   HIS  64          2HB       HIS  64   0.433  35.101  22.593
  411    HD1  HIS  64           HD1      HIS  64   1.241  32.263  22.359
  412    HD2  HIS  64           HD2      HIS  64  -1.503  33.978  19.690
  413    HE1  HIS  64           HE1      HIS  64  -0.092  30.329  21.364
  414    H    HIS  65           H        HIS  65  -0.817  38.339  19.895
  415    HA   HIS  65           HA       HIS  65  -0.828  40.408  20.696
  416   1HB   HIS  65          1HB       HIS  65  -2.076  40.589  22.892
  417   2HB   HIS  65          2HB       HIS  65  -2.874  39.706  21.605
  418    HD1  HIS  65           HD1      HIS  65  -1.030  39.123  24.878
  419    HD2  HIS  65           HD2      HIS  65  -3.467  37.047  22.169
  420    HE1  HIS  65           HE1      HIS  65  -1.621  36.909  26.000
  421    H    GLN  66           H        GLN  66   1.377  40.989  20.758
  422    HA   GLN  66           HA       GLN  66   2.900  40.276  23.061
  423   1HB   GLN  66          1HB       GLN  66   4.727  41.490  21.949
  424   2HB   GLN  66          2HB       GLN  66   3.939  40.412  20.814
  425   1HG   GLN  66          1HG       GLN  66   2.861  43.214  20.988
  426   2HG   GLN  66          2HG       GLN  66   4.440  43.022  20.253
  427   1HE2  GLN  66          1HE2      GLN  66   4.492  42.657  18.177
  428   2HE2  GLN  66          2HE2      GLN  66   3.244  41.962  17.198
  429    H    THR  67           H        THR  67   4.244  42.189  24.136
  430    HA   THR  67           HA       THR  67   2.871  44.696  24.302
  431    HB   THR  67           HB       THR  67   2.693  42.656  26.579
  432    HG1  THR  67           HG1      THR  67   0.386  43.244  26.145
  433   1HG2  THR  67          1HG2      THR  67   3.130  44.867  27.582
  434   2HG2  THR  67          2HG2      THR  67   1.969  45.631  26.470
  435   3HG2  THR  67          3HG2      THR  67   1.392  44.509  27.726
  436    H    ARG  68           H        ARG  68   3.917  46.063  26.149
  437    HA   ARG  68           HA       ARG  68   6.393  45.281  27.096
  438   1HB   ARG  68          1HB       ARG  68   6.726  45.661  24.462
  439   2HB   ARG  68          2HB       ARG  68   6.766  47.353  24.916
  440   1HG   ARG  68          1HG       ARG  68   8.817  47.170  25.934
  441   2HG   ARG  68          2HG       ARG  68   8.438  45.619  26.655
  442   1HD   ARG  68          1HD       ARG  68   8.640  45.408  23.728
  443   2HD   ARG  68          2HD       ARG  68  10.106  46.075  24.418
  444    HE   ARG  68           HE       ARG  68   9.620  43.964  26.097
  445   1HH1  ARG  68          2HH2      ARG  68   9.718  44.190  22.562
  446   2HH1  ARG  68          1HH2      ARG  68  10.236  42.551  22.348
  447   1HH2  ARG  68          1HH       ARG  68  10.573  41.165  24.274
  448    H    GLY  69           H        GLY  69   5.645  46.316  29.004
  449   1HA   GLY  69          1HA       GLY  69   4.349  48.736  29.207
  450   2HA   GLY  69          2HA       GLY  69   5.370  48.023  30.440
  451    H    ALA  70           H        ALA  70   7.440  48.847  30.837
  452    HA   ALA  70           HA       ALA  70   9.116  50.289  30.794
  453   1HB   ALA  70          1HB       ALA  70   9.762  49.351  28.690
  454   2HB   ALA  70          2HB       ALA  70   8.472  50.222  27.826
  455   3HB   ALA  70          3HB       ALA  70   9.857  51.118  28.494
  456    H    TYR  71           H        TYR  71   9.294  52.411  31.437
  457    HA   TYR  71           HA       TYR  71   7.507  54.369  30.250
  458   1HB   TYR  71          1HB       TYR  71   6.968  52.932  32.669
  459   2HB   TYR  71          2HB       TYR  71   7.621  54.463  33.218
  460    HD1  TYR  71           HD1      TYR  71   4.882  52.889  31.280
  461    HD2  TYR  71           HD2      TYR  71   6.349  56.494  33.057
  462    HE1  TYR  71           HE1      TYR  71   2.611  53.984  30.952
  463    HE2  TYR  71           HE2      TYR  71   4.073  57.577  32.723
  464    HH   TYR  71           HH       TYR  71   1.496  56.310  32.480
  465    H    SER  72           H        SER  72   8.635  56.217  29.903
  466    HA   SER  72           HA       SER  72  11.236  56.410  31.039
  467   1HB   SER  72          1HB       SER  72  11.433  58.438  29.628
  468   2HB   SER  72          2HB       SER  72  10.837  57.073  28.705
  469    HG   SER  72           HG       SER  72   8.759  57.932  28.691
  470    H    SER  73           H        SER  73  12.013  58.319  32.278
  471    HA   SER  73           HA       SER  73  10.084  59.034  34.238
  472   1HB   SER  73          1HB       SER  73  12.660  58.545  34.497
  473   2HB   SER  73          2HB       SER  73  12.864  60.223  34.034
  474    HG   SER  73           HG       SER  73  11.246  59.282  36.248
  475    H    HIS  74           H        HIS  74  10.099  61.496  34.994
  476    HA   HIS  74           HA       HIS  74  10.251  63.260  32.690
  477   1HB   HIS  74          1HB       HIS  74   7.998  64.210  33.313
  478   2HB   HIS  74          2HB       HIS  74   7.986  62.638  32.537
  479    HD1  HIS  74           HD1      HIS  74   7.775  64.108  36.068
  480    HD2  HIS  74           HD2      HIS  74   6.581  60.719  33.904
  481    HE1  HIS  74           HE1      HIS  74   6.299  62.741  37.638
  482    H    ASP  75           H        ASP  75  10.758  65.413  33.230
  483    HA   ASP  75           HA       ASP  75  11.017  65.903  36.086
  484   1HB   ASP  75          1HB       ASP  75  13.205  65.331  34.660
  485   2HB   ASP  75          2HB       ASP  75  13.050  66.993  34.127
  486    HD2  ASP  75           HD2      ASP  75  14.105  68.348  37.085
  Start of MODEL   21
    1    H    MET   1           H        MET   1 -40.630   8.458  33.156
    2    HA   MET   1           HA       MET   1 -41.449   8.281  30.532
    3   1HB   MET   1          1HB       MET   1 -39.084   9.377  30.287
    4   2HB   MET   1          2HB       MET   1 -38.433   7.840  30.821
    5   1HG   MET   1          1HG       MET   1 -40.296   7.146  28.805
    6   2HG   MET   1          2HG       MET   1 -39.507   8.584  28.188
    7   1HE   MET   1          1HE       MET   1 -39.442   4.933  28.431
    8   2HE   MET   1          2HE       MET   1 -39.263   5.690  26.831
    9   3HE   MET   1          3HE       MET   1 -37.974   4.641  27.468
   10    H    GLU   2           H        GLU   2 -42.644   6.510  31.292
   11    HA   GLU   2           HA       GLU   2 -41.245   4.075  31.375
   12   1HB   GLU   2          1HB       GLU   2 -40.853   4.980  33.728
   13   2HB   GLU   2          2HB       GLU   2 -42.582   4.877  33.994
   14   1HG   GLU   2          1HG       GLU   2 -42.599   2.526  33.937
   15   2HG   GLU   2          2HG       GLU   2 -41.160   2.430  32.942
   16    HE2  GLU   2           HE2      GLU   2 -38.921   3.164  35.177
   17    H    VAL   3           H        VAL   3 -42.682   3.373  29.775
   18    HA   VAL   3           HA       VAL   3 -45.437   3.016  30.704
   19    HB   VAL   3           HB       VAL   3 -44.597   3.970  27.959
   20   1HG1  VAL   3          1HG1      VAL   3 -47.191   4.332  27.856
   21   2HG1  VAL   3          2HG1      VAL   3 -46.505   2.720  27.543
   22   3HG1  VAL   3          3HG1      VAL   3 -47.224   3.088  29.129
   23   1HG2  VAL   3          1HG2      VAL   3 -45.083   5.428  30.379
   24   2HG2  VAL   3          2HG2      VAL   3 -44.706   6.049  28.754
   25   3HG2  VAL   3          3HG2      VAL   3 -46.399   5.772  29.230
   26    H    ALA   4           H        ALA   4 -46.573   1.261  29.417
   27    HA   ALA   4           HA       ALA   4 -44.683  -0.908  29.056
   28   1HB   ALA   4          1HB       ALA   4 -47.632  -0.600  29.526
   29   2HB   ALA   4          2HB       ALA   4 -47.056  -2.084  28.731
   30   3HB   ALA   4          3HB       ALA   4 -46.451  -1.648  30.347
   31    H    MET   5           H        MET   5 -45.293  -2.495  27.161
   32    HA   MET   5           HA       MET   5 -46.054  -0.940  24.830
   33   1HB   MET   5          1HB       MET   5 -44.116  -1.873  23.573
   34   2HB   MET   5          2HB       MET   5 -43.545  -0.986  24.973
   35   1HG   MET   5          1HG       MET   5 -42.404  -2.856  25.584
   36   2HG   MET   5          2HG       MET   5 -43.947  -3.596  25.960
   37   1HE   MET   5          1HE       MET   5 -41.263  -5.733  23.716
   38   2HE   MET   5          2HE       MET   5 -40.800  -4.028  23.501
   39   3HE   MET   5          3HE       MET   5 -41.190  -4.646  25.124
   40    H    VAL   6           H        VAL   6 -46.294  -2.517  22.833
   41    HA   VAL   6           HA       VAL   6 -47.228  -5.130  23.768
   42    HB   VAL   6           HB       VAL   6 -48.761  -3.344  21.875
   43   1HG1  VAL   6          1HG1      VAL   6 -49.338  -6.021  23.169
   44   2HG1  VAL   6          2HG1      VAL   6 -50.605  -5.004  22.442
   45   3HG1  VAL   6          3HG1      VAL   6 -49.272  -5.621  21.436
   46   1HG2  VAL   6          1HG2      VAL   6 -49.187  -2.170  23.783
   47   2HG2  VAL   6          2HG2      VAL   6 -50.383  -3.468  24.011
   48   3HG2  VAL   6          3HG2      VAL   6 -48.814  -3.546  24.849
   49    H    SER   7           H        SER   7 -47.586  -6.644  21.829
   50    HA   SER   7           HA       SER   7 -46.241  -5.910  19.445
   51   1HB   SER   7          1HB       SER   7 -44.898  -7.730  21.461
   52   2HB   SER   7          2HB       SER   7 -44.605  -7.954  19.748
   53    HG   SER   7           HG       SER   7 -44.365  -5.317  20.828
   54    H    ALA   8           H        ALA   8 -46.374  -7.708  17.803
   55    HA   ALA   8           HA       ALA   8 -48.748  -9.294  18.332
   56   1HB   ALA   8          1HB       ALA   8 -48.191  -9.806  15.764
   57   2HB   ALA   8          2HB       ALA   8 -48.984  -8.294  16.267
   58   3HB   ALA   8          3HB       ALA   8 -47.235  -8.314  15.935
   59    H    GLU   9           H        GLU   9 -47.573 -10.666  19.948
   60    HA   GLU   9           HA       GLU   9 -45.374 -12.083  19.605
   61   1HB   GLU   9          1HB       GLU   9 -46.194 -13.578  21.221
   62   2HB   GLU   9          2HB       GLU   9 -47.194 -12.162  21.478
   63   1HG   GLU   9          1HG       GLU   9 -48.720 -13.418  19.606
   64   2HG   GLU   9          2HG       GLU   9 -47.931 -14.822  20.296
   65    HE2  GLU   9           HE2      GLU   9 -50.906 -13.041  21.915
   66    H    SER  10           H        SER  10 -44.925 -14.373  18.904
   67    HA   SER  10           HA       SER  10 -44.682 -15.678  17.155
   68   1HB   SER  10          1HB       SER  10 -47.681 -15.944  17.637
   69   2HB   SER  10          2HB       SER  10 -46.759 -17.051  16.640
   70    HG   SER  10           HG       SER  10 -47.042 -17.774  18.882
   71    H    SER  11           H        SER  11 -44.041 -14.270  15.447
   72    HA   SER  11           HA       SER  11 -45.613 -14.278  13.215
   73   1HB   SER  11          1HB       SER  11 -47.139 -12.683  14.067
   74   2HB   SER  11          2HB       SER  11 -45.887 -11.770  14.886
   75    HG   SER  11           HG       SER  11 -45.536 -11.918  12.104
   76    H    GLY  12           H        GLY  12 -44.021 -14.306  11.674
   77   1HA   GLY  12          1HA       GLY  12 -41.378 -13.483  12.219
   78   2HA   GLY  12          2HA       GLY  12 -42.038 -13.965  10.669
   79    H    CYS  13           H        CYS  13 -41.402 -12.387   9.236
   80    HA   CYS  13           HA       CYS  13 -42.032  -9.635  10.025
   81   1HB   CYS  13          1HB       CYS  13 -39.524 -10.429   9.646
   82   2HB   CYS  13          2HB       CYS  13 -39.935 -10.202   7.958
   83    HG   CYS  13           HG       CYS  13 -39.017  -7.968   8.300
   84    H    ASN  14           H        ASN  14 -44.187 -10.811   9.099
   85    HA   ASN  14           HA       ASN  14 -44.131 -10.524   6.204
   86   1HB   ASN  14          1HB       ASN  14 -45.402 -12.421   8.024
   87   2HB   ASN  14          2HB       ASN  14 -46.641 -11.607   7.088
   88   1HD2  ASN  14          1HD2      ASN  14 -47.222 -12.819   5.463
   89   2HD2  ASN  14          2HD2      ASN  14 -46.190 -13.689   4.377
   90    H    SER  15           H        SER  15 -44.307  -8.363   8.365
   91    HA   SER  15           HA       SER  15 -46.159  -6.749   7.176
   92   1HB   SER  15          1HB       SER  15 -47.501  -8.605   8.786
   93   2HB   SER  15          2HB       SER  15 -47.387  -7.196   9.822
   94    HG   SER  15           HG       SER  15 -49.257  -6.876   8.655
   95    H    HIS  16           H        HIS  16 -44.802  -4.999   7.460
   96    HA   HIS  16           HA       HIS  16 -43.847  -4.531  10.188
   97   1HB   HIS  16          1HB       HIS  16 -42.124  -3.077   9.002
   98   2HB   HIS  16          2HB       HIS  16 -41.958  -4.814   8.847
   99    HD1  HIS  16           HD1      HIS  16 -41.086  -5.259   6.551
  100    HD2  HIS  16           HD2      HIS  16 -44.072  -2.313   6.557
  101    HE1  HIS  16           HE1      HIS  16 -41.486  -4.641   4.108
  102    H    MET  17           H        MET  17 -46.353  -3.809  10.141
  103    HA   MET  17           HA       MET  17 -46.773  -1.278   8.940
  104   1HB   MET  17          1HB       MET  17 -48.311  -3.358  10.209
  105   2HB   MET  17          2HB       MET  17 -48.625  -1.893  11.118
  106   1HG   MET  17          1HG       MET  17 -48.787  -0.940   8.527
  107   2HG   MET  17          2HG       MET  17 -49.374  -2.577   8.313
  108   1HE   MET  17          1HE       MET  17 -51.215   0.999  10.134
  109   2HE   MET  17          2HE       MET  17 -50.232   0.278  11.431
  110   3HE   MET  17          3HE       MET  17 -49.487   0.668   9.862
  111    HA   PRO  18           HA       PRO  18 -46.271   0.123  13.445
  112   1HB   PRO  18          1HB       PRO  18 -45.323  -1.621  15.324
  113   2HB   PRO  18          2HB       PRO  18 -47.030  -1.312  15.078
  114   1HG   PRO  18          1HG       PRO  18 -45.440  -3.671  14.276
  115   2HG   PRO  18          2HG       PRO  18 -47.179  -3.519  14.427
  116   1HD   PRO  18          1HD       PRO  18 -45.662  -3.528  11.993
  117   2HD   PRO  18          2HD       PRO  18 -47.387  -3.260  12.152
  118    H    TYR  19           H        TYR  19 -44.364   0.526  15.146
  119    HA   TYR  19           HA       TYR  19 -42.311   1.575  13.824
  120   1HB   TYR  19          1HB       TYR  19 -42.159  -0.150  16.375
  121   2HB   TYR  19          2HB       TYR  19 -41.051   1.150  15.981
  122    HD1  TYR  19           HD1      TYR  19 -42.498   3.448  15.325
  123    HD2  TYR  19           HD2      TYR  19 -43.651   0.368  18.062
  124    HE1  TYR  19           HE1      TYR  19 -43.999   5.092  16.553
  125    HE2  TYR  19           HE2      TYR  19 -45.148   2.022  19.281
  126    HH   TYR  19           HH       TYR  19 -45.115   4.613  19.558
  127    H    GLY  20           H        GLY  20 -41.004   0.809  12.240
  128   1HA   GLY  20          1HA       GLY  20 -39.458  -1.588  12.739
  129   2HA   GLY  20          2HA       GLY  20 -40.606  -1.721  11.422
  130    H    TYR  21           H        TYR  21 -40.075  -0.900   9.415
  131    HA   TYR  21           HA       TYR  21 -37.515  -0.249   8.768
  132   1HB   TYR  21          1HB       TYR  21 -39.773  -0.738   7.424
  133   2HB   TYR  21          2HB       TYR  21 -40.008   0.998   7.486
  134    HD1  TYR  21           HD1      TYR  21 -38.216   2.506   6.447
  135    HD2  TYR  21           HD2      TYR  21 -38.371  -1.718   5.788
  136    HE1  TYR  21           HE1      TYR  21 -36.766   2.769   4.375
  137    HE2  TYR  21           HE2      TYR  21 -36.921  -1.441   3.718
  138    HH   TYR  21           HH       TYR  21 -35.283   1.474   3.043
  139    H    ALA  22           H        ALA  22 -40.194   1.977   9.717
  140    HA   ALA  22           HA       ALA  22 -38.611   4.305   9.250
  141   1HB   ALA  22          1HB       ALA  22 -41.263   3.764  10.633
  142   2HB   ALA  22          2HB       ALA  22 -40.560   5.392  10.473
  143   3HB   ALA  22          3HB       ALA  22 -40.994   4.463   9.018
  144    H    ALA  23           H        ALA  23 -39.050   1.975  11.852
  145    HA   ALA  23           HA       ALA  23 -37.912   3.790  13.812
  146   1HB   ALA  23          1HB       ALA  23 -38.775   0.877  14.024
  147   2HB   ALA  23          2HB       ALA  23 -38.366   1.960  15.376
  148   3HB   ALA  23          3HB       ALA  23 -39.808   2.281  14.383
  149    H    GLN  24           H        GLN  24 -36.541   2.587  11.253
  150    HA   GLN  24           HA       GLN  24 -34.561   0.887  12.349
  151   1HB   GLN  24          1HB       GLN  24 -34.947   2.270   9.677
  152   2HB   GLN  24          2HB       GLN  24 -33.457   1.418  10.031
  153   1HG   GLN  24          1HG       GLN  24 -36.123   0.047  10.496
  154   2HG   GLN  24          2HG       GLN  24 -35.456   0.128   8.877
  155   1HE2  GLN  24          1HE2      GLN  24 -35.268  -1.279  12.002
  156   2HE2  GLN  24          2HE2      GLN  24 -33.983  -2.406  11.719
  157    H    ALA  25           H        ALA  25 -35.149   4.121  12.818
  158    HA   ALA  25           HA       ALA  25 -32.681   5.337  12.354
  159   1HB   ALA  25          1HB       ALA  25 -35.184   5.872  13.836
  160   2HB   ALA  25          2HB       ALA  25 -33.745   6.668  14.517
  161   3HB   ALA  25          3HB       ALA  25 -34.202   6.954  12.820
  162    H    ARG  26           H        ARG  26 -33.708   2.945  14.678
  163    HA   ARG  26           HA       ARG  26 -31.869   3.645  16.677
  164   1HB   ARG  26          1HB       ARG  26 -34.023   2.041  16.668
  165   2HB   ARG  26          2HB       ARG  26 -32.840   0.801  16.299
  166   1HG   ARG  26          1HG       ARG  26 -31.771   0.994  18.371
  167   2HG   ARG  26          2HG       ARG  26 -32.203   2.681  18.564
  168   1HD   ARG  26          1HD       ARG  26 -34.706   1.545  18.582
  169   2HD   ARG  26          2HD       ARG  26 -33.770   0.229  19.262
  170    HE   ARG  26           HE       ARG  26 -33.177   2.846  20.459
  171   1HH1  ARG  26          2HH2      ARG  26 -35.217  -0.044  20.643
  172   2HH1  ARG  26          1HH2      ARG  26 -35.614   0.191  22.313
  173   1HH2  ARG  26          1HH       ARG  26 -34.711   2.079  23.479
  174    H    ALA  27           H        ALA  27 -31.779   1.699  13.702
  175    HA   ALA  27           HA       ALA  27 -29.430   0.251  14.342
  176   1HB   ALA  27          1HB       ALA  27 -29.829   0.634  11.502
  177   2HB   ALA  27          2HB       ALA  27 -30.063  -0.834  12.481
  178   3HB   ALA  27          3HB       ALA  27 -31.393   0.333  12.295
  179    H    ARG  28           H        ARG  28 -30.158   3.471  13.023
  180    HA   ARG  28           HA       ARG  28 -27.716   3.933  11.832
  181   1HB   ARG  28          1HB       ARG  28 -30.027   5.323  11.976
  182   2HB   ARG  28          2HB       ARG  28 -29.164   6.184  13.235
  183   1HG   ARG  28          1HG       ARG  28 -27.223   6.428  11.531
  184   2HG   ARG  28          2HG       ARG  28 -28.355   5.873  10.314
  185   1HD   ARG  28          1HD       ARG  28 -28.904   8.257  12.144
  186   2HD   ARG  28          2HD       ARG  28 -28.183   8.413  10.555
  187    HE   ARG  28           HE       ARG  28 -30.986   7.698  11.153
  188   1HH1  ARG  28          2HH2      ARG  28 -28.449   7.887   8.686
  189   2HH1  ARG  28          1HH2      ARG  28 -29.564   7.875   7.361
  190   1HH2  ARG  28          1HH       ARG  28 -31.916   7.755   7.807
  191    H    GLU  29           H        GLU  29 -28.793   4.012  15.220
  192    HA   GLU  29           HA       GLU  29 -26.496   5.460  16.087
  193   1HB   GLU  29          1HB       GLU  29 -29.033   4.944  17.134
  194   2HB   GLU  29          2HB       GLU  29 -27.991   3.961  18.144
  195   1HG   GLU  29          1HG       GLU  29 -26.558   5.936  18.628
  196   2HG   GLU  29          2HG       GLU  29 -27.540   6.928  17.568
  197    HE2  GLU  29           HE2      GLU  29 -27.572   7.273  20.753
  198    H    ARG  30           H        ARG  30 -27.404   2.119  15.492
  199    HA   ARG  30           HA       ARG  30 -25.274   1.143  17.149
  200   1HB   ARG  30          1HB       ARG  30 -27.610  -0.018  15.694
  201   2HB   ARG  30          2HB       ARG  30 -26.195  -1.051  15.731
  202   1HG   ARG  30          1HG       ARG  30 -26.662   0.165  18.358
  203   2HG   ARG  30          2HG       ARG  30 -28.091  -0.686  17.805
  204   1HD   ARG  30          1HD       ARG  30 -26.066  -2.479  17.137
  205   2HD   ARG  30          2HD       ARG  30 -25.448  -1.772  18.617
  206    HE   ARG  30           HE       ARG  30 -27.192  -2.789  19.825
  207   1HH1  ARG  30          2HH2      ARG  30 -27.892  -2.990  16.358
  208   2HH1  ARG  30          1HH2      ARG  30 -29.230  -4.069  16.564
  209   1HH2  ARG  30          1HH       ARG  30 -29.839  -4.776  18.772
  210    H    GLU  31           H        GLU  31 -26.016   1.893  13.767
  211    HA   GLU  31           HA       GLU  31 -23.773   0.392  12.805
  212   1HB   GLU  31          1HB       GLU  31 -26.108   1.786  11.649
  213   2HB   GLU  31          2HB       GLU  31 -24.646   2.014  10.710
  214   1HG   GLU  31          1HG       GLU  31 -24.706  -0.123   9.940
  215   2HG   GLU  31          2HG       GLU  31 -24.853  -0.771  11.562
  216    HE2  GLU  31           HE2      GLU  31 -27.486  -1.195   9.079
  217    H    ARG  32           H        ARG  32 -23.818   2.998  14.669
  218    HA   ARG  32           HA       ARG  32 -22.606   5.007  13.246
  219   1HB   ARG  32          1HB       ARG  32 -23.259   4.438  15.973
  220   2HB   ARG  32          2HB       ARG  32 -21.559   4.861  15.970
  221   1HG   ARG  32          1HG       ARG  32 -23.569   6.566  14.459
  222   2HG   ARG  32          2HG       ARG  32 -23.345   6.779  16.183
  223   1HD   ARG  32          1HD       ARG  32 -21.732   8.274  15.458
  224   2HD   ARG  32          2HD       ARG  32 -20.739   6.830  15.468
  225    HE   ARG  32           HE       ARG  32 -21.920   6.832  12.938
  226   1HH1  ARG  32          2HH2      ARG  32 -19.894   9.098  14.759
  227   2HH1  ARG  32          1HH2      ARG  32 -19.167   9.780  13.342
  228   1HH2  ARG  32          1HH       ARG  32 -19.810   8.962  11.183
  229    H    LEU  33           H        LEU  33 -21.361   1.960  14.560
  230    HA   LEU  33           HA       LEU  33 -18.608   2.806  14.218
  231   1HB   LEU  33          1HB       LEU  33 -19.945   1.029  15.909
  232   2HB   LEU  33          2HB       LEU  33 -19.032   0.003  14.822
  233    HG   LEU  33           HG       LEU  33 -17.775   0.476  16.850
  234   1HD1  LEU  33          1HD1      LEU  33 -16.633   0.195  14.620
  235   2HD1  LEU  33          2HD1      LEU  33 -16.470   1.967  14.565
  236   3HD1  LEU  33          3HD1      LEU  33 -15.688   1.041  15.869
  237   1HD2  LEU  33          1HD2      LEU  33 -18.923   2.902  16.903
  238   2HD2  LEU  33          2HD2      LEU  33 -17.419   2.512  17.772
  239   3HD2  LEU  33          3HD2      LEU  33 -17.348   3.342  16.198
  240    H    ALA  34           H        ALA  34 -21.179   1.508  12.356
  241    HA   ALA  34           HA       ALA  34 -19.500  -0.101  10.657
  242   1HB   ALA  34          1HB       ALA  34 -22.128  -0.189  11.313
  243   2HB   ALA  34          2HB       ALA  34 -22.228   0.749   9.803
  244   3HB   ALA  34          3HB       ALA  34 -21.478  -0.866   9.801
  245    H    HIS  35           H        HIS  35 -19.558   3.120  11.191
  246    HA   HIS  35           HA       HIS  35 -19.686   3.923   8.413
  247   1HB   HIS  35          1HB       HIS  35 -20.682   5.211  10.405
  248   2HB   HIS  35          2HB       HIS  35 -19.035   5.675  10.785
  249    HD1  HIS  35           HD1      HIS  35 -17.720   6.947   8.702
  250    HD2  HIS  35           HD2      HIS  35 -21.911   6.843   8.577
  251    HE1  HIS  35           HE1      HIS  35 -18.432   8.775   7.070
  252    H    SER  36           H        SER  36 -17.422   2.646  10.629
  253    HA   SER  36           HA       SER  36 -15.212   4.099   9.499
  254   1HB   SER  36          1HB       SER  36 -15.633   2.230  11.800
  255   2HB   SER  36          2HB       SER  36 -14.041   2.202  11.068
  256    HG   SER  36           HG       SER  36 -14.790   3.893  12.886
  257    H    ARG  37           H        ARG  37 -17.044   1.182   8.987
  258    HA   ARG  37           HA       ARG  37 -14.852  -0.140   7.690
  259   1HB   ARG  37          1HB       ARG  37 -17.064  -1.073   9.051
  260   2HB   ARG  37          2HB       ARG  37 -17.628  -1.222   7.399
  261   1HG   ARG  37          1HG       ARG  37 -15.856  -2.708   6.795
  262   2HG   ARG  37          2HG       ARG  37 -14.881  -2.257   8.179
  263   1HD   ARG  37          1HD       ARG  37 -17.554  -3.384   8.873
  264   2HD   ARG  37          2HD       ARG  37 -16.484  -4.508   8.060
  265    HE   ARG  37           HE       ARG  37 -16.119  -3.370  10.743
  266   1HH1  ARG  37          2HH2      ARG  37 -14.516  -4.978   8.023
  267   2HH1  ARG  37          1HH2      ARG  37 -13.209  -5.580   8.987
  268   1HH2  ARG  37          1HH       ARG  37 -13.159  -5.089  11.332
  269    H    ALA  38           H        ALA  38 -16.436   2.478   6.808
  270    HA   ALA  38           HA       ALA  38 -17.764   1.809   4.420
  271   1HB   ALA  38          1HB       ALA  38 -18.293   3.890   5.398
  272   2HB   ALA  38          2HB       ALA  38 -16.582   4.330   5.609
  273   3HB   ALA  38          3HB       ALA  38 -17.305   4.327   3.983
  274    H    ALA  39           H        ALA  39 -14.506   3.342   4.968
  275    HA   ALA  39           HA       ALA  39 -13.774   2.611   2.260
  276   1HB   ALA  39          1HB       ALA  39 -13.311   4.867   3.390
  277   2HB   ALA  39          2HB       ALA  39 -12.083   4.012   4.355
  278   3HB   ALA  39          3HB       ALA  39 -11.931   4.085   2.583
  279    H    ALA  40           H        ALA  40 -13.665   0.317   2.345
  280    HA   ALA  40           HA       ALA  40 -12.301  -1.056   4.381
  281   1HB   ALA  40          1HB       ALA  40 -13.284  -1.684   1.597
  282   2HB   ALA  40          2HB       ALA  40 -12.283  -2.863   2.477
  283   3HB   ALA  40          3HB       ALA  40 -13.837  -2.329   3.161
  284    H    ALA  41           H        ALA  41 -11.329  -0.481   0.918
  285    HA   ALA  41           HA       ALA  41  -8.823  -1.396   0.957
  286   1HB   ALA  41          1HB       ALA  41  -9.602   1.289  -0.241
  287   2HB   ALA  41          2HB       ALA  41  -8.357   0.160  -0.827
  288   3HB   ALA  41          3HB       ALA  41 -10.078  -0.279  -0.935
  289    H    ALA  42           H        ALA  42  -7.585  -1.291   2.822
  290    HA   ALA  42           HA       ALA  42  -7.132   1.370   3.950
  291   1HB   ALA  42          1HB       ALA  42  -7.891  -0.494   5.433
  292   2HB   ALA  42          2HB       ALA  42  -6.408  -1.388   5.020
  293   3HB   ALA  42          3HB       ALA  42  -6.301   0.157   5.898
  294    H    ALA  43           H        ALA  43  -5.084  -1.605   3.568
  295    HA   ALA  43           HA       ALA  43  -2.697  -0.237   3.409
  296   1HB   ALA  43          1HB       ALA  43  -2.211  -2.430   3.673
  297   2HB   ALA  43          2HB       ALA  43  -3.728  -2.947   2.900
  298   3HB   ALA  43          3HB       ALA  43  -2.315  -2.534   1.899
  299    H    VAL  44           H        VAL  44  -5.297  -0.478   1.105
  300    HA   VAL  44           HA       VAL  44  -3.555   0.168  -1.128
  301    HB   VAL  44           HB       VAL  44  -6.242  -0.909  -0.714
  302   1HG1  VAL  44          1HG1      VAL  44  -7.225  -0.005  -2.771
  303   2HG1  VAL  44          2HG1      VAL  44  -6.897   1.291  -1.596
  304   3HG1  VAL  44          3HG1      VAL  44  -5.814   1.058  -2.989
  305   1HG2  VAL  44          1HG2      VAL  44  -4.913  -1.126  -3.347
  306   2HG2  VAL  44          2HG2      VAL  44  -3.955  -1.710  -1.965
  307   3HG2  VAL  44          3HG2      VAL  44  -5.569  -2.391  -2.280
  308    H    ALA  45           H        ALA  45  -5.795   1.651   1.192
  309    HA   ALA  45           HA       ALA  45  -6.532   3.937  -0.067
  310   1HB   ALA  45          1HB       ALA  45  -5.585   4.347   2.700
  311   2HB   ALA  45          2HB       ALA  45  -7.217   4.521   2.012
  312   3HB   ALA  45          3HB       ALA  45  -6.622   2.915   2.495
  313    H    ALA  46           H        ALA  46  -3.525   3.567   1.954
  314    HA   ALA  46           HA       ALA  46  -2.467   6.035   1.143
  315   1HB   ALA  46          1HB       ALA  46  -0.790   5.497   2.599
  316   2HB   ALA  46          2HB       ALA  46  -1.931   4.226   3.097
  317   3HB   ALA  46          3HB       ALA  46  -0.618   3.846   1.957
  318    H    ALA  47           H        ALA  47  -2.015   2.643  -0.020
  319    HA   ALA  47           HA       ALA  47  -0.060   3.351  -1.939
  320   1HB   ALA  47          1HB       ALA  47  -1.808   0.946  -2.294
  321   2HB   ALA  47          2HB       ALA  47  -0.037   1.095  -2.392
  322   3HB   ALA  47          3HB       ALA  47  -0.839   1.043  -0.804
  323    H    THR  48           H        THR  48  -1.216   1.927  -4.240
  324    HA   THR  48           HA       THR  48  -3.612   3.267  -5.005
  325    HB   THR  48           HB       THR  48  -2.229   4.465  -6.946
  326    HG1  THR  48           HG1      THR  48  -0.413   4.284  -4.648
  327   1HG2  THR  48          1HG2      THR  48  -1.677   5.794  -4.308
  328   2HG2  THR  48          2HG2      THR  48  -2.418   6.469  -5.778
  329   3HG2  THR  48          3HG2      THR  48  -3.385   5.458  -4.677
  330    H    ALA  49           H        ALA  49  -3.632   3.059  -7.677
  331    HA   ALA  49           HA       ALA  49  -4.014   0.404  -8.142
  332   1HB   ALA  49          1HB       ALA  49  -4.635   1.145 -10.194
  333   2HB   ALA  49          2HB       ALA  49  -4.323   2.765  -9.528
  334   3HB   ALA  49          3HB       ALA  49  -3.070   1.940 -10.485
  335    H    ALA  50           H        ALA  50  -2.509  -1.150  -7.657
  336    HA   ALA  50           HA       ALA  50   0.265  -0.671  -8.301
  337   1HB   ALA  50          1HB       ALA  50  -0.199  -3.349  -7.448
  338   2HB   ALA  50          2HB       ALA  50   0.488  -2.003  -6.508
  339   3HB   ALA  50          3HB       ALA  50  -1.266  -2.303  -6.482
  340    H    VAL  51           H        VAL  51  -1.083  -0.459 -10.653
  341    HA   VAL  51           HA       VAL  51  -0.123  -2.801 -12.050
  342    HB   VAL  51           HB       VAL  51  -3.013  -1.930 -12.050
  343   1HG1  VAL  51          1HG1      VAL  51  -3.061  -2.379 -14.244
  344   2HG1  VAL  51          2HG1      VAL  51  -1.415  -3.055 -14.223
  345   3HG1  VAL  51          3HG1      VAL  51  -2.804  -4.083 -13.798
  346   1HG2  VAL  51          1HG2      VAL  51  -1.519  -4.401 -11.217
  347   2HG2  VAL  51          2HG2      VAL  51  -2.815  -3.517 -10.377
  348   3HG2  VAL  51          3HG2      VAL  51  -3.200  -4.535 -11.785
  349    H    GLU  52           H        GLU  52   1.294  -0.615 -12.152
  350    HA   GLU  52           HA       GLU  52   0.480   1.510 -13.618
  351   1HB   GLU  52          1HB       GLU  52   2.813   0.772 -12.458
  352   2HB   GLU  52          2HB       GLU  52   3.252   0.479 -14.129
  353   1HG   GLU  52          1HG       GLU  52   2.433   2.833 -14.678
  354   2HG   GLU  52          2HG       GLU  52   2.212   3.101 -12.961
  355    HE2  GLU  52           HE2      GLU  52   5.465   3.806 -14.703
  356    H    GLY  53           H        GLY  53   0.996   2.132 -15.920
  357   1HA   GLY  53          1HA       GLY  53  -0.226   0.599 -17.786
  358   2HA   GLY  53          2HA       GLY  53   1.040   1.756 -18.146
  359    H    THR  54           H        THR  54   3.394   0.807 -17.420
  360    HA   THR  54           HA       THR  54   3.520  -1.876 -18.631
  361    HB   THR  54           HB       THR  54   4.510  -0.082 -20.030
  362    HG1  THR  54           HG1      THR  54   6.465  -1.260 -20.197
  363   1HG2  THR  54          1HG2      THR  54   5.334   1.702 -18.783
  364   2HG2  THR  54          2HG2      THR  54   5.766   0.663 -17.403
  365   3HG2  THR  54          3HG2      THR  54   6.825   0.730 -18.833
  366    H    GLY  55           H        GLY  55   4.729  -3.492 -17.678
  367   1HA   GLY  55          1HA       GLY  55   6.279  -2.877 -15.298
  368   2HA   GLY  55          2HA       GLY  55   4.817  -3.805 -15.028
  369    H    GLY  56           H        GLY  56   7.828  -3.724 -17.038
  370   1HA   GLY  56          1HA       GLY  56   9.015  -5.381 -18.003
  371   2HA   GLY  56          2HA       GLY  56   8.746  -6.221 -16.489
  372    H    SER  57           H        SER  57   7.644  -5.805 -19.850
  373    HA   SER  57           HA       SER  57   6.922  -8.428 -20.116
  374   1HB   SER  57          1HB       SER  57   4.391  -8.168 -20.306
  375   2HB   SER  57          2HB       SER  57   5.031  -8.148 -18.675
  376    HG   SER  57           HG       SER  57   5.100  -5.610 -19.344
  377    H    GLY  58           H        GLY  58   6.584  -8.875 -22.335
  378   1HA   GLY  58          1HA       GLY  58   5.441  -7.649 -24.331
  379   2HA   GLY  58          2HA       GLY  58   6.769  -6.532 -24.091
  380    H    GLY  59           H        GLY  59   6.285  -8.182 -26.464
  381   1HA   GLY  59          1HA       GLY  59   8.865  -9.094 -26.980
  382   2HA   GLY  59          2HA       GLY  59   7.923 -10.484 -26.481
  383    H    GLY  60           H        GLY  60   7.713  -7.596 -28.677
  384   1HA   GLY  60          1HA       GLY  60   6.886  -9.320 -30.858
  385   2HA   GLY  60          2HA       GLY  60   5.663  -8.200 -30.293
  386    HA   PRO  61           HA       PRO  61   9.310  -5.795 -32.201
  387   1HB   PRO  61          1HB       PRO  61  10.848  -7.138 -34.017
  388   2HB   PRO  61          2HB       PRO  61  11.323  -6.903 -32.347
  389   1HG   PRO  61          1HG       PRO  61  10.312  -9.351 -33.660
  390   2HG   PRO  61          2HG       PRO  61  11.178  -9.196 -32.144
  391   1HD   PRO  61          1HD       PRO  61   8.365  -9.648 -32.475
  392   2HD   PRO  61          2HD       PRO  61   9.213  -9.377 -30.965
  393    H    HIS  62           H        HIS  62   9.630  -4.686 -34.325
  394    HA   HIS  62           HA       HIS  62   7.181  -5.171 -35.805
  395   1HB   HIS  62          1HB       HIS  62   7.868  -2.965 -36.906
  396   2HB   HIS  62          2HB       HIS  62   7.349  -2.924 -35.233
  397    HD1  HIS  62           HD1      HIS  62   8.678  -0.907 -34.445
  398    HD2  HIS  62           HD2      HIS  62  11.062  -3.806 -36.318
  399    HE1  HIS  62           HE1      HIS  62  11.098  -0.190 -34.074
  400    H    HIS  63           H        HIS  63   8.275  -7.293 -36.533
  401    HA   HIS  63           HA       HIS  63  10.470  -7.533 -38.023
  402   1HB   HIS  63          1HB       HIS  63   8.250  -9.070 -37.512
  403   2HB   HIS  63          2HB       HIS  63   8.140  -8.860 -39.249
  404    HD1  HIS  63           HD1      HIS  63   8.711 -11.655 -38.175
  405    HD2  HIS  63           HD2      HIS  63  11.732  -8.917 -39.164
  406    HE1  HIS  63           HE1      HIS  63  10.808 -13.037 -38.627
  407    H    HIS  64           H        HIS  64  10.927  -7.539 -40.373
  408    HA   HIS  64           HA       HIS  64   9.512  -5.316 -41.637
  409   1HB   HIS  64          1HB       HIS  64  12.300  -6.423 -42.051
  410   2HB   HIS  64          2HB       HIS  64  11.577  -5.204 -43.081
  411    HD1  HIS  64           HD1      HIS  64  10.611  -3.007 -41.534
  412    HD2  HIS  64           HD2      HIS  64  13.783  -5.318 -40.053
  413    HE1  HIS  64           HE1      HIS  64  11.790  -1.567 -39.788
  414    H    HIS  65           H        HIS  65  11.223  -8.391 -42.574
  415    HA   HIS  65           HA       HIS  65  10.744  -9.930 -44.061
  416   1HB   HIS  65          1HB       HIS  65   8.584  -9.927 -42.676
  417   2HB   HIS  65          2HB       HIS  65   7.854  -9.048 -44.005
  418    HD1  HIS  65           HD1      HIS  65   8.275 -10.383 -46.482
  419    HD2  HIS  65           HD2      HIS  65   8.288 -12.622 -42.934
  420    HE1  HIS  65           HE1      HIS  65   7.839 -12.803 -47.162
  421    H    GLN  66           H        GLN  66  11.572  -9.683 -46.069
  422    HA   GLN  66           HA       GLN  66  10.055  -8.276 -48.005
  423   1HB   GLN  66          1HB       GLN  66  11.520  -6.517 -46.706
  424   2HB   GLN  66          2HB       GLN  66  12.860  -7.201 -47.605
  425   1HG   GLN  66          1HG       GLN  66  12.220  -6.188 -49.545
  426   2HG   GLN  66          2HG       GLN  66  10.549  -6.677 -49.349
  427   1HE2  GLN  66          1HE2      GLN  66   9.694  -4.739 -49.952
  428   2HE2  GLN  66          2HE2      GLN  66   9.779  -3.295 -48.998
  429    H    THR  67           H        THR  67  11.556  -8.189 -50.177
  430    HA   THR  67           HA       THR  67  12.103 -10.851 -50.799
  431    HB   THR  67           HB       THR  67  13.251  -8.421 -52.238
  432    HG1  THR  67           HG1      THR  67  10.540  -9.497 -51.940
  433   1HG2  THR  67          1HG2      THR  67  13.502  -9.973 -53.897
  434   2HG2  THR  67          2HG2      THR  67  12.733 -11.223 -52.888
  435   3HG2  THR  67          3HG2      THR  67  11.732 -10.164 -53.910
  436    H    ARG  68           H        ARG  68  14.247 -11.667 -51.698
  437    HA   ARG  68           HA       ARG  68  15.968 -12.050 -49.719
  438   1HB   ARG  68          1HB       ARG  68  15.859 -12.843 -52.316
  439   2HB   ARG  68          2HB       ARG  68  17.198 -11.721 -52.453
  440   1HG   ARG  68          1HG       ARG  68  18.155 -12.970 -50.334
  441   2HG   ARG  68          2HG       ARG  68  17.011 -14.230 -50.754
  442   1HD   ARG  68          1HD       ARG  68  18.748 -13.158 -52.971
  443   2HD   ARG  68          2HD       ARG  68  19.521 -14.168 -51.765
  444    HE   ARG  68           HE       ARG  68  17.006 -15.264 -52.836
  445   1HH1  ARG  68          2HH2      ARG  68  20.532 -15.155 -53.169
  446   2HH1  ARG  68          1HH2      ARG  68  20.618 -16.641 -54.056
  447   1HH2  ARG  68          1HH       ARG  68  18.599 -17.840 -54.537
  448    H    GLY  69           H        GLY  69  17.798 -11.027 -48.803
  449   1HA   GLY  69          1HA       GLY  69  18.019  -8.356 -48.613
  450   2HA   GLY  69          2HA       GLY  69  19.385  -9.445 -48.472
  451    H    ALA  70           H        ALA  70  20.117 -10.326 -50.848
  452    HA   ALA  70           HA       ALA  70  19.928  -8.209 -52.818
  453   1HB   ALA  70          1HB       ALA  70  22.162  -8.475 -50.998
  454   2HB   ALA  70          2HB       ALA  70  22.694  -8.821 -52.660
  455   3HB   ALA  70          3HB       ALA  70  21.899  -7.274 -52.285
  456    H    TYR  71           H        TYR  71  20.606  -8.935 -54.950
  457    HA   TYR  71           HA       TYR  71  20.529 -11.859 -55.126
  458   1HB   TYR  71          1HB       TYR  71  19.000  -9.898 -56.282
  459   2HB   TYR  71          2HB       TYR  71  20.320  -9.888 -57.435
  460    HD1  TYR  71           HD1      TYR  71  17.365 -11.647 -56.277
  461    HD2  TYR  71           HD2      TYR  71  20.846 -11.974 -58.744
  462    HE1  TYR  71           HE1      TYR  71  16.325 -13.621 -57.495
  463    HE2  TYR  71           HE2      TYR  71  19.794 -13.947 -59.953
  464    HH   TYR  71           HH       TYR  71  18.149 -15.623 -59.569
  465    H    SER  72           H        SER  72  22.241 -13.018 -55.902
  466    HA   SER  72           HA       SER  72  24.372 -11.442 -57.120
  467   1HB   SER  72          1HB       SER  72  24.529 -13.673 -55.067
  468   2HB   SER  72          2HB       SER  72  25.897 -13.306 -56.099
  469    HG   SER  72           HG       SER  72  24.635 -11.143 -54.721
  470    H    SER  73           H        SER  73  23.181 -14.853 -56.629
  471    HA   SER  73           HA       SER  73  23.263 -16.603 -57.938
  472   1HB   SER  73          1HB       SER  73  21.286 -15.473 -58.846
  473   2HB   SER  73          2HB       SER  73  22.276 -14.513 -59.927
  474    HG   SER  73           HG       SER  73  21.836 -17.370 -60.011
  475    H    HIS  74           H        HIS  74  25.584 -16.955 -57.911
  476    HA   HIS  74           HA       HIS  74  27.171 -15.706 -59.938
  477   1HB   HIS  74          1HB       HIS  74  27.804 -16.473 -57.508
  478   2HB   HIS  74          2HB       HIS  74  28.073 -18.032 -58.263
  479    HD1  HIS  74           HD1      HIS  74  29.615 -14.710 -57.769
  480    HD2  HIS  74           HD2      HIS  74  30.156 -18.000 -60.314
  481    HE1  HIS  74           HE1      HIS  74  31.918 -14.422 -58.829
  482    H    ASP  75           H        ASP  75  27.899 -16.591 -61.871
  483    HA   ASP  75           HA       ASP  75  27.874 -19.270 -62.453
  484   1HB   ASP  75          1HB       ASP  75  25.950 -19.266 -64.145
  485   2HB   ASP  75          2HB       ASP  75  25.481 -19.319 -62.458
  486    HD2  ASP  75           HD2      ASP  75  24.035 -17.886 -61.895
  Start of MODEL   22
    1    H    MET   1           H        MET   1 -52.404  22.448  -1.697
    2    HA   MET   1           HA       MET   1 -52.778  25.147  -2.179
    3   1HB   MET   1          1HB       MET   1 -54.408  23.005  -1.837
    4   2HB   MET   1          2HB       MET   1 -54.526  23.645  -0.210
    5   1HG   MET   1          1HG       MET   1 -54.952  25.959  -1.512
    6   2HG   MET   1          2HG       MET   1 -55.441  24.885  -2.808
    7   1HE   MET   1          1HE       MET   1 -56.424  26.910  -0.166
    8   2HE   MET   1          2HE       MET   1 -57.846  26.216   0.649
    9   3HE   MET   1          3HE       MET   1 -56.209  25.705   1.127
   10    H    GLU   2           H        GLU   2 -53.159  26.949  -0.740
   11    HA   GLU   2           HA       GLU   2 -51.341  27.279   1.214
   12   1HB   GLU   2          1HB       GLU   2 -52.786  29.047   0.114
   13   2HB   GLU   2          2HB       GLU   2 -54.100  28.576   1.174
   14   1HG   GLU   2          1HG       GLU   2 -52.639  29.082   3.166
   15   2HG   GLU   2          2HG       GLU   2 -51.372  29.614   2.079
   16    HE2  GLU   2           HE2      GLU   2 -54.036  31.403   3.684
   17    H    VAL   3           H        VAL   3 -51.170  26.905   3.437
   18    HA   VAL   3           HA       VAL   3 -53.278  25.196   4.537
   19    HB   VAL   3           HB       VAL   3 -51.226  24.084   4.561
   20   1HG1  VAL   3          1HG1      VAL   3 -49.178  25.232   5.688
   21   2HG1  VAL   3          2HG1      VAL   3 -49.596  25.656   4.011
   22   3HG1  VAL   3          3HG1      VAL   3 -50.049  26.745   5.344
   23   1HG2  VAL   3          1HG2      VAL   3 -51.475  25.371   7.301
   24   2HG2  VAL   3          2HG2      VAL   3 -52.431  23.989   6.714
   25   3HG2  VAL   3          3HG2      VAL   3 -50.671  23.828   6.926
   26    H    ALA   4           H        ALA   4 -53.654  25.486   6.973
   27    HA   ALA   4           HA       ALA   4 -54.658  27.999   7.452
   28   1HB   ALA   4          1HB       ALA   4 -55.223  27.149   9.546
   29   2HB   ALA   4          2HB       ALA   4 -54.977  25.651   8.615
   30   3HB   ALA   4          3HB       ALA   4 -53.700  26.242   9.706
   31    H    MET   5           H        MET   5 -53.973  29.735   8.884
   32    HA   MET   5           HA       MET   5 -51.332  30.459   8.438
   33   1HB   MET   5          1HB       MET   5 -51.900  32.385   9.908
   34   2HB   MET   5          2HB       MET   5 -53.247  32.041   8.841
   35   1HG   MET   5          1HG       MET   5 -53.734  30.399  11.084
   36   2HG   MET   5          2HG       MET   5 -53.112  31.883  11.780
   37   1HE   MET   5          1HE       MET   5 -56.209  31.415  12.564
   38   2HE   MET   5          2HE       MET   5 -54.934  32.596  12.948
   39   3HE   MET   5          3HE       MET   5 -56.511  33.155  12.341
   40    H    VAL   6           H        VAL   6 -49.490  30.567   9.813
   41    HA   VAL   6           HA       VAL   6 -49.770  29.070  12.325
   42    HB   VAL   6           HB       VAL   6 -47.457  28.959  10.381
   43   1HG1  VAL   6          1HG1      VAL   6 -47.995  27.715  13.069
   44   2HG1  VAL   6          2HG1      VAL   6 -46.960  26.882  11.884
   45   3HG1  VAL   6          3HG1      VAL   6 -46.523  28.508  12.462
   46   1HG2  VAL   6          1HG2      VAL   6 -48.316  27.105   9.401
   47   2HG2  VAL   6          2HG2      VAL   6 -49.073  26.528  10.905
   48   3HG2  VAL   6          3HG2      VAL   6 -49.867  27.794   9.938
   49    H    SER   7           H        SER   7 -47.800  29.544  13.816
   50    HA   SER   7           HA       SER   7 -46.952  32.296  13.411
   51   1HB   SER   7          1HB       SER   7 -47.935  31.173  16.071
   52   2HB   SER   7          2HB       SER   7 -47.377  32.809  15.783
   53    HG   SER   7           HG       SER   7 -49.516  31.818  14.168
   54    H    ALA   8           H        ALA   8 -45.434  32.574  15.790
   55    HA   ALA   8           HA       ALA   8 -43.114  31.169  15.108
   56   1HB   ALA   8          1HB       ALA   8 -42.180  32.236  17.079
   57   2HB   ALA   8          2HB       ALA   8 -43.266  33.392  16.271
   58   3HB   ALA   8          3HB       ALA   8 -43.806  32.538  17.737
   59    H    GLU   9           H        GLU   9 -42.946  30.818  18.361
   60    HA   GLU   9           HA       GLU   9 -42.787  28.115  18.325
   61   1HB   GLU   9          1HB       GLU   9 -42.829  30.232  20.331
   62   2HB   GLU   9          2HB       GLU   9 -43.630  28.801  20.948
   63   1HG   GLU   9          1HG       GLU   9 -41.153  28.142  19.487
   64   2HG   GLU   9          2HG       GLU   9 -40.856  29.228  20.830
   65    HE2  GLU   9           HE2      GLU   9 -43.301  26.366  21.442
   66    H    SER  10           H        SER  10 -44.204  26.519  19.657
   67    HA   SER  10           HA       SER  10 -47.007  27.198  19.247
   68   1HB   SER  10          1HB       SER  10 -45.463  24.778  18.324
   69   2HB   SER  10          2HB       SER  10 -47.134  24.556  18.804
   70    HG   SER  10           HG       SER  10 -47.502  26.521  17.287
   71    H    SER  11           H        SER  11 -44.768  24.722  20.712
   72    HA   SER  11           HA       SER  11 -44.694  23.810  22.679
   73   1HB   SER  11          1HB       SER  11 -45.329  26.454  23.245
   74   2HB   SER  11          2HB       SER  11 -46.583  25.589  24.111
   75    HG   SER  11           HG       SER  11 -45.145  24.868  25.539
   76    H    GLY  12           H        GLY  12 -45.892  21.967  21.809
   77   1HA   GLY  12          1HA       GLY  12 -48.387  21.519  23.219
   78   2HA   GLY  12          2HA       GLY  12 -48.523  21.578  21.473
   79    H    CYS  13           H        CYS  13 -48.923  19.408  21.011
   80    HA   CYS  13           HA       CYS  13 -46.919  17.521  22.003
   81   1HB   CYS  13          1HB       CYS  13 -48.587  15.759  21.558
   82   2HB   CYS  13          2HB       CYS  13 -49.163  16.939  22.718
   83    HG   CYS  13           HG       CYS  13 -50.996  16.033  20.891
   84    H    ASN  14           H        ASN  14 -45.713  18.841  20.121
   85    HA   ASN  14           HA       ASN  14 -46.492  17.834  17.535
   86   1HB   ASN  14          1HB       ASN  14 -45.015  20.146  18.561
   87   2HB   ASN  14          2HB       ASN  14 -44.050  19.317  17.355
   88   1HD2  ASN  14          1HD2      ASN  14 -44.841  19.036  15.251
   89   2HD2  ASN  14          2HD2      ASN  14 -46.089  20.037  14.587
   90    H    SER  15           H        SER  15 -45.320  16.137  19.798
   91    HA   SER  15           HA       SER  15 -43.238  14.960  18.201
   92   1HB   SER  15          1HB       SER  15 -42.656  16.543  20.544
   93   2HB   SER  15          2HB       SER  15 -42.294  14.869  20.917
   94    HG   SER  15           HG       SER  15 -40.436  15.783  19.986
   95    H    HIS  16           H        HIS  16 -44.840  13.272  17.908
   96    HA   HIS  16           HA       HIS  16 -44.697  11.250  19.827
   97   1HB   HIS  16          1HB       HIS  16 -46.641  13.159  20.464
   98   2HB   HIS  16          2HB       HIS  16 -47.545  11.855  19.719
   99    HD1  HIS  16           HD1      HIS  16 -45.158  12.495  22.618
  100    HD2  HIS  16           HD2      HIS  16 -47.895   9.603  21.299
  101    HE1  HIS  16           HE1      HIS  16 -45.422  10.833  24.536
  102    H    MET  17           H        MET  17 -43.897  10.846  17.447
  103    HA   MET  17           HA       MET  17 -46.078  10.247  15.675
  104   1HB   MET  17          1HB       MET  17 -44.228   9.705  14.078
  105   2HB   MET  17          2HB       MET  17 -43.962  11.270  14.821
  106   1HG   MET  17          1HG       MET  17 -41.906  10.520  15.443
  107   2HG   MET  17          2HG       MET  17 -42.713   9.482  16.601
  108   1HE   MET  17          1HE       MET  17 -41.422   6.214  15.576
  109   2HE   MET  17          2HE       MET  17 -40.907   7.603  16.563
  110   3HE   MET  17          3HE       MET  17 -42.602   7.060  16.606
  111    HA   PRO  18           HA       PRO  18 -46.172   5.998  16.548
  112   1HB   PRO  18          1HB       PRO  18 -47.072   4.945  14.192
  113   2HB   PRO  18          2HB       PRO  18 -48.126   5.710  15.364
  114   1HG   PRO  18          1HG       PRO  18 -47.158   6.763  12.777
  115   2HG   PRO  18          2HG       PRO  18 -48.515   7.305  13.745
  116   1HD   PRO  18          1HD       PRO  18 -45.950   8.570  13.524
  117   2HD   PRO  18          2HD       PRO  18 -47.266   9.046  14.579
  118    H    TYR  19           H        TYR  19 -44.839   4.284  16.793
  119    HA   TYR  19           HA       TYR  19 -42.453   4.439  15.165
  120   1HB   TYR  19          1HB       TYR  19 -42.114   4.034  17.521
  121   2HB   TYR  19          2HB       TYR  19 -43.528   3.005  17.634
  122    HD1  TYR  19           HD1      TYR  19 -43.405   0.634  17.129
  123    HD2  TYR  19           HD2      TYR  19 -39.976   3.147  16.646
  124    HE1  TYR  19           HE1      TYR  19 -41.917  -1.420  16.942
  125    HE2  TYR  19           HE2      TYR  19 -38.500   1.085  16.460
  126    HH   TYR  19           HH       TYR  19 -38.404  -1.068  16.523
  127    H    GLY  20           H        GLY  20 -42.161   3.292  13.325
  128   1HA   GLY  20          1HA       GLY  20 -43.150   0.578  13.143
  129   2HA   GLY  20          2HA       GLY  20 -43.937   1.712  12.064
  130    H    TYR  21           H        TYR  21 -42.944   2.274  10.145
  131    HA   TYR  21           HA       TYR  21 -40.762   0.824   9.246
  132   1HB   TYR  21          1HB       TYR  21 -42.383   1.914   7.753
  133   2HB   TYR  21          2HB       TYR  21 -42.140   3.470   8.522
  134    HD1  TYR  21           HD1      TYR  21 -40.123   0.889   6.678
  135    HD2  TYR  21           HD2      TYR  21 -40.879   5.042   7.376
  136    HE1  TYR  21           HE1      TYR  21 -38.412   1.506   4.902
  137    HE2  TYR  21           HE2      TYR  21 -39.166   5.645   5.597
  138    HH   TYR  21           HH       TYR  21 -38.054   3.496   3.364
  139    H    ALA  22           H        ALA  22 -40.880   3.611  11.330
  140    HA   ALA  22           HA       ALA  22 -38.189   4.440  10.621
  141   1HB   ALA  22          1HB       ALA  22 -38.619   6.250  12.226
  142   2HB   ALA  22          2HB       ALA  22 -39.968   6.111  11.072
  143   3HB   ALA  22          3HB       ALA  22 -40.139   5.468  12.723
  144    H    ALA  23           H        ALA  23 -39.112   1.741  11.946
  145    HA   ALA  23           HA       ALA  23 -37.939   1.880  14.551
  146   1HB   ALA  23          1HB       ALA  23 -39.781   0.341  14.023
  147   2HB   ALA  23          2HB       ALA  23 -38.776  -0.463  12.793
  148   3HB   ALA  23          3HB       ALA  23 -38.333  -0.570  14.514
  149    H    GLN  24           H        GLN  24 -36.666   2.018  11.440
  150    HA   GLN  24           HA       GLN  24 -34.420   0.320  11.985
  151   1HB   GLN  24          1HB       GLN  24 -35.519   1.791   9.643
  152   2HB   GLN  24          2HB       GLN  24 -33.770   1.700   9.690
  153   1HG   GLN  24          1HG       GLN  24 -33.785  -0.500   9.123
  154   2HG   GLN  24          2HG       GLN  24 -34.916  -0.889  10.404
  155   1HE2  GLN  24          1HE2      GLN  24 -35.403  -2.372   8.450
  156   2HE2  GLN  24          2HE2      GLN  24 -36.698  -1.869   7.415
  157    H    ALA  25           H        ALA  25 -35.359   3.318  13.058
  158    HA   ALA  25           HA       ALA  25 -33.135   4.936  12.595
  159   1HB   ALA  25          1HB       ALA  25 -34.951   4.911  15.036
  160   2HB   ALA  25          2HB       ALA  25 -34.039   6.292  14.379
  161   3HB   ALA  25          3HB       ALA  25 -35.408   5.614  13.465
  162    H    ARG  26           H        ARG  26 -33.579   2.080  14.550
  163    HA   ARG  26           HA       ARG  26 -31.631   2.709  16.467
  164   1HB   ARG  26          1HB       ARG  26 -33.536   0.697  16.113
  165   2HB   ARG  26          2HB       ARG  26 -32.036  -0.174  15.864
  166   1HG   ARG  26          1HG       ARG  26 -31.480  -0.063  18.073
  167   2HG   ARG  26          2HG       ARG  26 -31.845   1.648  18.165
  168   1HD   ARG  26          1HD       ARG  26 -33.578   0.945  19.504
  169   2HD   ARG  26          2HD       ARG  26 -34.390   0.666  17.976
  170    HE   ARG  26           HE       ARG  26 -32.762  -1.614  18.801
  171   1HH1  ARG  26          2HH2      ARG  26 -35.923  -0.062  19.195
  172   2HH1  ARG  26          1HH2      ARG  26 -36.722  -1.526  19.662
  173   1HH2  ARG  26          1HH       ARG  26 -35.464  -3.562  19.786
  174    H    ALA  27           H        ALA  27 -31.629   1.299  13.202
  175    HA   ALA  27           HA       ALA  27 -29.057   0.123  13.367
  176   1HB   ALA  27          1HB       ALA  27 -29.570   0.675  10.686
  177   2HB   ALA  27          2HB       ALA  27 -30.039  -0.804  11.558
  178   3HB   ALA  27          3HB       ALA  27 -31.195   0.540  11.399
  179    H    ARG  28           H        ARG  28 -30.335   3.373  12.697
  180    HA   ARG  28           HA       ARG  28 -28.121   4.369  11.392
  181   1HB   ARG  28          1HB       ARG  28 -30.549   5.375  11.943
  182   2HB   ARG  28          2HB       ARG  28 -29.711   6.107  13.296
  183   1HG   ARG  28          1HG       ARG  28 -28.497   7.540  11.955
  184   2HG   ARG  28          2HG       ARG  28 -28.301   6.355  10.678
  185   1HD   ARG  28          1HD       ARG  28 -30.464   6.808   9.757
  186   2HD   ARG  28          2HD       ARG  28 -31.026   7.591  11.220
  187    HE   ARG  28           HE       ARG  28 -28.803   9.093  10.332
  188   1HH1  ARG  28          2HH2      ARG  28 -32.027   8.260   9.120
  189   2HH1  ARG  28          1HH2      ARG  28 -32.187   9.710   8.187
  190   1HH2  ARG  28          1HH       ARG  28 -30.404  11.311   8.191
  191    H    GLU  29           H        GLU  29 -28.811   3.748  14.824
  192    HA   GLU  29           HA       GLU  29 -26.636   5.356  15.721
  193   1HB   GLU  29          1HB       GLU  29 -28.942   4.154  16.883
  194   2HB   GLU  29          2HB       GLU  29 -27.568   3.424  17.688
  195   1HG   GLU  29          1HG       GLU  29 -26.765   5.499  18.503
  196   2HG   GLU  29          2HG       GLU  29 -27.616   6.425  17.282
  197    HE2  GLU  29           HE2      GLU  29 -29.872   7.086  19.793
  198    H    ARG  30           H        ARG  30 -27.170   2.056  14.638
  199    HA   ARG  30           HA       ARG  30 -24.759   1.149  15.902
  200   1HB   ARG  30          1HB       ARG  30 -27.075  -0.092  14.482
  201   2HB   ARG  30          2HB       ARG  30 -25.544  -0.901  14.212
  202   1HG   ARG  30          1HG       ARG  30 -25.869  -1.944  16.204
  203   2HG   ARG  30          2HG       ARG  30 -25.509  -0.409  16.970
  204   1HD   ARG  30          1HD       ARG  30 -27.836   0.177  17.151
  205   2HD   ARG  30          2HD       ARG  30 -28.323  -1.054  16.003
  206    HE   ARG  30           HE       ARG  30 -27.794  -1.441  18.847
  207   1HH1  ARG  30          2HH2      ARG  30 -27.848  -3.072  15.702
  208   2HH1  ARG  30          1HH2      ARG  30 -28.081  -4.647  16.383
  209   1HH2  ARG  30          1HH       ARG  30 -28.227  -4.886  18.764
  210    H    GLU  31           H        GLU  31 -25.968   2.314  12.783
  211    HA   GLU  31           HA       GLU  31 -23.880   1.238  11.239
  212   1HB   GLU  31          1HB       GLU  31 -26.279   2.288  10.620
  213   2HB   GLU  31          2HB       GLU  31 -25.323   3.738  10.390
  214   1HG   GLU  31          1HG       GLU  31 -23.738   2.265   8.943
  215   2HG   GLU  31          2HG       GLU  31 -25.012   1.061   8.973
  216    HE2  GLU  31           HE2      GLU  31 -24.180   4.156   7.706
  217    H    ARG  32           H        ARG  32 -24.182   3.972  13.399
  218    HA   ARG  32           HA       ARG  32 -22.386   5.697  12.247
  219   1HB   ARG  32          1HB       ARG  32 -23.707   5.346  14.829
  220   2HB   ARG  32          2HB       ARG  32 -22.054   5.869  15.084
  221   1HG   ARG  32          1HG       ARG  32 -22.503   7.695  13.305
  222   2HG   ARG  32          2HG       ARG  32 -24.196   7.260  13.420
  223   1HD   ARG  32          1HD       ARG  32 -23.914   9.079  14.956
  224   2HD   ARG  32          2HD       ARG  32 -24.007   7.646  15.961
  225    HE   ARG  32           HE       ARG  32 -21.304   7.854  15.533
  226   1HH1  ARG  32          2HH2      ARG  32 -23.721  10.212  16.606
  227   2HH1  ARG  32          1HH2      ARG  32 -22.591  11.126  17.549
  228   1HH2  ARG  32          1HH       ARG  32 -20.299  10.430  17.635
  229    H    LEU  33           H        LEU  33 -21.938   2.686  14.071
  230    HA   LEU  33           HA       LEU  33 -19.107   3.204  14.438
  231   1HB   LEU  33          1HB       LEU  33 -21.060   1.770  15.829
  232   2HB   LEU  33          2HB       LEU  33 -20.032   0.542  15.117
  233    HG   LEU  33           HG       LEU  33 -18.298   2.499  16.221
  234   1HD1  LEU  33          1HD1      LEU  33 -19.036   3.084  18.273
  235   2HD1  LEU  33          2HD1      LEU  33 -20.631   2.892  17.507
  236   3HD1  LEU  33          3HD1      LEU  33 -19.956   1.577  18.500
  237   1HD2  LEU  33          1HD2      LEU  33 -17.584   0.649  17.659
  238   2HD2  LEU  33          2HD2      LEU  33 -19.035  -0.274  17.199
  239   3HD2  LEU  33          3HD2      LEU  33 -17.807   0.122  15.973
  240    H    ALA  34           H        ALA  34 -21.240   1.981  12.047
  241    HA   ALA  34           HA       ALA  34 -19.393   0.031  11.006
  242   1HB   ALA  34          1HB       ALA  34 -21.177   0.169   9.081
  243   2HB   ALA  34          2HB       ALA  34 -21.627  -0.556  10.643
  244   3HB   ALA  34          3HB       ALA  34 -22.111   1.115  10.265
  245    H    HIS  35           H        HIS  35 -19.177   3.280  11.251
  246    HA   HIS  35           HA       HIS  35 -18.462   3.782   8.491
  247   1HB   HIS  35          1HB       HIS  35 -19.130   5.396  10.867
  248   2HB   HIS  35          2HB       HIS  35 -17.833   6.058   9.893
  249    HD1  HIS  35           HD1      HIS  35 -18.780   5.443   7.045
  250    HD2  HIS  35           HD2      HIS  35 -21.326   6.819  10.080
  251    HE1  HIS  35           HE1      HIS  35 -20.770   6.525   5.872
  252    H    SER  36           H        SER  36 -17.047   2.531  11.337
  253    HA   SER  36           HA       SER  36 -14.449   3.617  10.749
  254   1HB   SER  36          1HB       SER  36 -15.044   3.425  13.096
  255   2HB   SER  36          2HB       SER  36 -15.489   1.740  12.910
  256    HG   SER  36           HG       SER  36 -12.862   2.920  12.864
  257    H    ARG  37           H        ARG  37 -16.439   0.863   9.986
  258    HA   ARG  37           HA       ARG  37 -14.171  -0.810   9.447
  259   1HB   ARG  37          1HB       ARG  37 -16.765  -1.357  10.218
  260   2HB   ARG  37          2HB       ARG  37 -16.885  -1.633   8.492
  261   1HG   ARG  37          1HG       ARG  37 -15.941  -3.670   8.794
  262   2HG   ARG  37          2HG       ARG  37 -14.451  -2.875   9.259
  263   1HD   ARG  37          1HD       ARG  37 -14.705  -3.718  11.351
  264   2HD   ARG  37          2HD       ARG  37 -16.117  -2.700  11.555
  265    HE   ARG  37           HE       ARG  37 -16.749  -5.110  10.053
  266   1HH1  ARG  37          2HH2      ARG  37 -16.256  -3.867  13.334
  267   2HH1  ARG  37          1HH2      ARG  37 -17.230  -5.091  14.078
  268   1HH2  ARG  37          1HH       ARG  37 -18.265  -6.762  12.706
  269    H    ALA  38           H        ALA  38 -15.119   1.842   7.962
  270    HA   ALA  38           HA       ALA  38 -15.868   1.077   5.368
  271   1HB   ALA  38          1HB       ALA  38 -14.811   3.461   4.922
  272   2HB   ALA  38          2HB       ALA  38 -16.304   3.303   5.878
  273   3HB   ALA  38          3HB       ALA  38 -14.741   3.533   6.699
  274    H    ALA  39           H        ALA  39 -12.662   2.368   6.512
  275    HA   ALA  39           HA       ALA  39 -11.405   1.177   4.205
  276   1HB   ALA  39          1HB       ALA  39  -9.381   2.207   5.708
  277   2HB   ALA  39          2HB       ALA  39 -10.362   3.171   4.579
  278   3HB   ALA  39          3HB       ALA  39 -10.751   3.167   6.316
  279    H    ALA  40           H        ALA  40 -12.317  -1.017   5.130
  280    HA   ALA  40           HA       ALA  40 -11.386  -2.221   7.375
  281   1HB   ALA  40          1HB       ALA  40 -12.036  -4.226   6.357
  282   2HB   ALA  40          2HB       ALA  40 -12.961  -3.017   5.435
  283   3HB   ALA  40          3HB       ALA  40 -11.473  -3.710   4.749
  284    H    ALA  41           H        ALA  41  -9.819  -2.580   4.108
  285    HA   ALA  41           HA       ALA  41  -7.587  -3.874   4.786
  286   1HB   ALA  41          1HB       ALA  41  -7.688  -3.415   2.538
  287   2HB   ALA  41          2HB       ALA  41  -8.251  -1.746   2.793
  288   3HB   ALA  41          3HB       ALA  41  -6.531  -2.147   3.010
  289    H    ALA  42           H        ALA  42  -6.638  -3.566   6.793
  290    HA   ALA  42           HA       ALA  42  -5.794  -0.836   7.431
  291   1HB   ALA  42          1HB       ALA  42  -5.541  -1.702   9.716
  292   2HB   ALA  42          2HB       ALA  42  -7.170  -2.060   9.095
  293   3HB   ALA  42          3HB       ALA  42  -5.937  -3.343   9.155
  294    H    ALA  43           H        ALA  43  -4.434  -4.122   8.147
  295    HA   ALA  43           HA       ALA  43  -1.805  -3.295   8.162
  296   1HB   ALA  43          1HB       ALA  43  -1.334  -5.540   8.436
  297   2HB   ALA  43          2HB       ALA  43  -3.074  -5.552   8.813
  298   3HB   ALA  43          3HB       ALA  43  -2.509  -6.050   7.200
  299    H    VAL  44           H        VAL  44  -4.016  -3.681   5.498
  300    HA   VAL  44           HA       VAL  44  -1.855  -3.972   3.578
  301    HB   VAL  44           HB       VAL  44  -4.744  -4.418   3.676
  302   1HG1  VAL  44          1HG1      VAL  44  -4.731  -2.442   2.192
  303   2HG1  VAL  44          2HG1      VAL  44  -3.563  -3.261   1.127
  304   3HG1  VAL  44          3HG1      VAL  44  -5.202  -3.927   1.329
  305   1HG2  VAL  44          1HG2      VAL  44  -2.301  -5.614   2.523
  306   2HG2  VAL  44          2HG2      VAL  44  -3.741  -6.389   3.226
  307   3HG2  VAL  44          3HG2      VAL  44  -3.770  -5.819   1.540
  308    H    ALA  45           H        ALA  45  -4.043  -1.557   4.985
  309    HA   ALA  45           HA       ALA  45  -4.003   0.395   3.073
  310   1HB   ALA  45          1HB       ALA  45  -4.786   0.110   5.743
  311   2HB   ALA  45          2HB       ALA  45  -3.613   1.449   5.776
  312   3HB   ALA  45          3HB       ALA  45  -5.038   1.541   4.715
  313    H    ALA  46           H        ALA  46  -1.590  -0.124   5.744
  314    HA   ALA  46           HA       ALA  46   0.130   1.903   4.763
  315   1HB   ALA  46          1HB       ALA  46   0.637  -0.414   6.673
  316   2HB   ALA  46          2HB       ALA  46   1.668   1.024   6.475
  317   3HB   ALA  46          3HB       ALA  46   0.022   1.192   7.130
  318    H    ALA  47           H        ALA  47   0.389  -1.728   4.824
  319    HA   ALA  47           HA       ALA  47   2.659  -1.826   3.211
  320   1HB   ALA  47          1HB       ALA  47   0.845  -4.110   2.927
  321   2HB   ALA  47          2HB       ALA  47   2.463  -4.027   3.664
  322   3HB   ALA  47          3HB       ALA  47   1.026  -3.599   4.623
  323    H    THR  48           H        THR  48   1.983  -3.619   1.104
  324    HA   THR  48           HA       THR  48   1.398  -3.597  -1.040
  325    HB   THR  48           HB       THR  48  -0.976  -2.062   0.135
  326    HG1  THR  48           HG1      THR  48  -0.295  -4.407   0.662
  327   1HG2  THR  48          1HG2      THR  48  -0.296  -2.604  -2.654
  328   2HG2  THR  48          2HG2      THR  48  -1.699  -3.586  -2.168
  329   3HG2  THR  48          3HG2      THR  48  -1.751  -1.815  -2.000
  330    H    ALA  49           H        ALA  49   3.478  -2.124  -0.859
  331    HA   ALA  49           HA       ALA  49   3.370   0.585  -1.173
  332   1HB   ALA  49          1HB       ALA  49   5.580   0.397  -1.952
  333   2HB   ALA  49          2HB       ALA  49   5.358  -1.095  -1.007
  334   3HB   ALA  49          3HB       ALA  49   5.258  -1.144  -2.784
  335    H    ALA  50           H        ALA  50   3.851   1.839  -3.282
  336    HA   ALA  50           HA       ALA  50   1.740   1.155  -5.131
  337   1HB   ALA  50          1HB       ALA  50   2.244   3.395  -6.057
  338   2HB   ALA  50          2HB       ALA  50   2.001   3.458  -4.295
  339   3HB   ALA  50          3HB       ALA  50   3.647   3.525  -4.970
  340    H    VAL  51           H        VAL  51   3.535  -0.883  -5.276
  341    HA   VAL  51           HA       VAL  51   4.689  -0.422  -7.908
  342    HB   VAL  51           HB       VAL  51   6.198  -1.418  -5.489
  343   1HG1  VAL  51          1HG1      VAL  51   6.506  -2.130  -8.303
  344   2HG1  VAL  51          2HG1      VAL  51   7.973  -1.375  -7.635
  345   3HG1  VAL  51          3HG1      VAL  51   7.282  -2.820  -6.857
  346   1HG2  VAL  51          1HG2      VAL  51   7.695   0.405  -5.881
  347   2HG2  VAL  51          2HG2      VAL  51   6.920   0.790  -7.437
  348   3HG2  VAL  51          3HG2      VAL  51   6.043   1.067  -5.913
  349    H    GLU  52           H        GLU  52   2.328  -1.617  -7.717
  350    HA   GLU  52           HA       GLU  52   2.199  -4.211  -6.918
  351   1HB   GLU  52          1HB       GLU  52   0.476  -2.468  -8.097
  352   2HB   GLU  52          2HB       GLU  52   0.798  -3.506  -9.471
  353   1HG   GLU  52          1HG       GLU  52  -0.476  -5.179  -8.612
  354   2HG   GLU  52          2HG       GLU  52   0.378  -5.131  -7.082
  355    HE2  GLU  52           HE2      GLU  52  -2.643  -4.864  -8.091
  356    H    GLY  53           H        GLY  53   1.950  -6.199  -8.462
  357   1HA   GLY  53          1HA       GLY  53   3.212  -6.355 -10.927
  358   2HA   GLY  53          2HA       GLY  53   4.453  -6.636  -9.721
  359    H    THR  54           H        THR  54   4.093  -8.384  -8.083
  360    HA   THR  54           HA       THR  54   3.782 -10.575  -7.746
  361    HB   THR  54           HB       THR  54   1.642  -9.398  -6.946
  362    HG1  THR  54           HG1      THR  54   2.023 -11.641  -6.476
  363   1HG2  THR  54          1HG2      THR  54   0.470  -8.854  -8.993
  364   2HG2  THR  54          2HG2      THR  54   0.716 -10.492  -9.645
  365   3HG2  THR  54          3HG2      THR  54  -0.410 -10.232  -8.291
  366    H    GLY  55           H        GLY  55   2.044 -12.512  -8.792
  367   1HA   GLY  55          1HA       GLY  55   1.544 -13.682 -10.710
  368   2HA   GLY  55          2HA       GLY  55   2.388 -12.492 -11.682
  369    H    GLY  56           H        GLY  56   2.521 -15.646 -10.489
  370   1HA   GLY  56          1HA       GLY  56   4.849 -16.405 -11.657
  371   2HA   GLY  56          2HA       GLY  56   5.365 -15.846 -10.079
  372    H    SER  57           H        SER  57   3.017 -18.052 -11.721
  373    HA   SER  57           HA       SER  57   3.140 -19.694  -9.312
  374   1HB   SER  57          1HB       SER  57   0.874 -18.636 -10.115
  375   2HB   SER  57          2HB       SER  57   0.916 -19.860 -11.368
  376    HG   SER  57           HG       SER  57  -0.009 -20.172  -8.913
  377    H    GLY  58           H        GLY  58   3.813 -21.839  -9.546
  378   1HA   GLY  58          1HA       GLY  58   3.662 -23.295 -11.957
  379   2HA   GLY  58          2HA       GLY  58   5.260 -22.590 -11.812
  380    H    GLY  59           H        GLY  59   6.616 -24.225 -11.170
  381   1HA   GLY  59          1HA       GLY  59   7.248 -25.165  -8.908
  382   2HA   GLY  59          2HA       GLY  59   5.692 -25.968  -8.972
  383    H    GLY  60           H        GLY  60   8.624 -26.951  -9.033
  384   1HA   GLY  60          1HA       GLY  60   8.733 -29.261 -10.040
  385   2HA   GLY  60          2HA       GLY  60   8.501 -28.450 -11.577
  386    HA   PRO  61           HA       PRO  61  12.749 -27.599 -11.742
  387   1HB   PRO  61          1HB       PRO  61  12.884 -25.265 -13.157
  388   2HB   PRO  61          2HB       PRO  61  12.620 -26.827 -13.908
  389   1HG   PRO  61          1HG       PRO  61  10.676 -24.654 -13.418
  390   2HG   PRO  61          2HG       PRO  61  10.550 -26.013 -14.518
  391   1HD   PRO  61          1HD       PRO  61   9.245 -25.735 -11.979
  392   2HD   PRO  61          2HD       PRO  61   9.213 -27.140 -13.026
  393    H    HIS  62           H        HIS  62  14.397 -26.940 -10.473
  394    HA   HIS  62           HA       HIS  62  13.729 -24.566  -8.890
  395   1HB   HIS  62          1HB       HIS  62  14.353 -27.252  -8.052
  396   2HB   HIS  62          2HB       HIS  62  15.601 -26.163  -7.480
  397    HD1  HIS  62           HD1      HIS  62  14.867 -24.247  -5.811
  398    HD2  HIS  62           HD2      HIS  62  11.846 -26.977  -6.818
  399    HE1  HIS  62           HE1      HIS  62  12.990 -23.892  -4.119
  400    H    HIS  63           H        HIS  63  14.777 -23.373 -10.701
  401    HA   HIS  63           HA       HIS  63  17.213 -23.723 -11.718
  402   1HB   HIS  63          1HB       HIS  63  15.393 -21.716 -11.730
  403   2HB   HIS  63          2HB       HIS  63  16.666 -20.953 -10.799
  404    HD1  HIS  63           HD1      HIS  63  16.242 -22.754 -14.155
  405    HD2  HIS  63           HD2      HIS  63  18.671 -19.866 -12.322
  406    HE1  HIS  63           HE1      HIS  63  17.776 -21.848 -15.981
  407    H    HIS  64           H        HIS  64  16.646 -21.796  -8.681
  408    HA   HIS  64           HA       HIS  64  19.408 -21.795  -8.076
  409   1HB   HIS  64          1HB       HIS  64  18.715 -20.728  -5.989
  410   2HB   HIS  64          2HB       HIS  64  17.961 -19.981  -7.383
  411    HD1  HIS  64           HD1      HIS  64  15.362 -20.648  -7.809
  412    HD2  HIS  64           HD2      HIS  64  16.961 -21.660  -4.066
  413    HE1  HIS  64           HE1      HIS  64  13.371 -21.106  -6.282
  414    H    HIS  65           H        HIS  65  20.611 -23.379  -7.158
  415    HA   HIS  65           HA       HIS  65  21.110 -25.344  -6.296
  416   1HB   HIS  65          1HB       HIS  65  19.864 -23.780  -4.342
  417   2HB   HIS  65          2HB       HIS  65  19.143 -25.365  -4.144
  418    HD1  HIS  65           HD1      HIS  65  21.910 -23.462  -2.961
  419    HD2  HIS  65           HD2      HIS  65  21.404 -27.465  -4.109
  420    HE1  HIS  65           HE1      HIS  65  23.835 -24.758  -1.902
  421    H    GLN  66           H        GLN  66  20.503 -26.781  -7.944
  422    HA   GLN  66           HA       GLN  66  17.781 -27.631  -8.068
  423   1HB   GLN  66          1HB       GLN  66  19.512 -27.345 -10.021
  424   2HB   GLN  66          2HB       GLN  66  20.088 -28.930  -9.546
  425   1HG   GLN  66          1HG       GLN  66  18.276 -29.983 -10.450
  426   2HG   GLN  66          2HG       GLN  66  17.149 -28.852  -9.727
  427   1HE2  GLN  66          1HE2      GLN  66  16.944 -29.925 -12.313
  428   2HE2  GLN  66          2HE2      GLN  66  17.068 -28.650 -13.479
  429    H    THR  67           H        THR  67  17.591 -30.251  -8.405
  430    HA   THR  67           HA       THR  67  17.947 -31.330  -5.847
  431    HB   THR  67           HB       THR  67  17.458 -32.708  -8.541
  432    HG1  THR  67           HG1      THR  67  15.193 -32.321  -7.679
  433   1HG2  THR  67          1HG2      THR  67  17.779 -34.413  -6.837
  434   2HG2  THR  67          2HG2      THR  67  16.879 -33.459  -5.634
  435   3HG2  THR  67          3HG2      THR  67  16.020 -34.198  -7.006
  436    H    ARG  68           H        ARG  68  19.053 -33.609  -5.584
  437    HA   ARG  68           HA       ARG  68  21.704 -33.154  -5.455
  438   1HB   ARG  68          1HB       ARG  68  21.951 -35.570  -5.043
  439   2HB   ARG  68          2HB       ARG  68  20.470 -35.007  -4.294
  440   1HG   ARG  68          1HG       ARG  68  19.487 -35.681  -6.750
  441   2HG   ARG  68          2HG       ARG  68  20.837 -36.797  -6.673
  442   1HD   ARG  68          1HD       ARG  68  19.041 -36.569  -4.253
  443   2HD   ARG  68          2HD       ARG  68  18.438 -37.439  -5.649
  444    HE   ARG  68           HE       ARG  68  21.151 -38.234  -4.874
  445   1HH1  ARG  68          2HH2      ARG  68  17.699 -38.817  -4.329
  446   2HH1  ARG  68          1HH2      ARG  68  17.938 -40.423  -3.726
  447   1HH2  ARG  68          1HH       ARG  68  20.162 -41.305  -3.587
  448    H    GLY  69           H        GLY  69  23.546 -33.623  -6.765
  449   1HA   GLY  69          1HA       GLY  69  23.898 -35.191  -8.885
  450   2HA   GLY  69          2HA       GLY  69  22.971 -33.890  -9.606
  451    H    ALA  70           H        ALA  70  25.975 -34.675  -7.793
  452    HA   ALA  70           HA       ALA  70  27.352 -32.612  -9.251
  453   1HB   ALA  70          1HB       ALA  70  27.292 -31.038  -7.651
  454   2HB   ALA  70          2HB       ALA  70  26.329 -32.107  -6.602
  455   3HB   ALA  70          3HB       ALA  70  28.107 -32.166  -6.541
  456    H    TYR  71           H        TYR  71  28.088 -34.840 -10.005
  457    HA   TYR  71           HA       TYR  71  30.136 -35.850  -8.148
  458   1HB   TYR  71          1HB       TYR  71  28.009 -37.036  -9.903
  459   2HB   TYR  71          2HB       TYR  71  29.573 -37.799 -10.111
  460    HD1  TYR  71           HD1      TYR  71  30.793 -38.490  -7.849
  461    HD2  TYR  71           HD2      TYR  71  26.584 -37.833  -8.243
  462    HE1  TYR  71           HE1      TYR  71  30.371 -39.904  -5.778
  463    HE2  TYR  71           HE2      TYR  71  26.176 -39.249  -6.172
  464    HH   TYR  71           HH       TYR  71  28.546 -40.013  -4.017
  465    H    SER  72           H        SER  72  32.158 -35.318  -8.795
  466    HA   SER  72           HA       SER  72  32.843 -35.752 -11.529
  467   1HB   SER  72          1HB       SER  72  32.789 -32.971 -10.321
  468   2HB   SER  72          2HB       SER  72  33.937 -33.364 -11.585
  469    HG   SER  72           HG       SER  72  32.174 -33.938 -12.981
  470    H    SER  73           H        SER  73  33.944 -34.029  -8.511
  471    HA   SER  73           HA       SER  73  36.546 -35.211  -8.887
  472   1HB   SER  73          1HB       SER  73  36.266 -32.778  -8.284
  473   2HB   SER  73          2HB       SER  73  35.575 -33.263  -6.749
  474    HG   SER  73           HG       SER  73  37.587 -34.335  -6.228
  475    H    HIS  74           H        HIS  74  36.678 -37.321  -8.168
  476    HA   HIS  74           HA       HIS  74  36.041 -37.780  -5.396
  477   1HB   HIS  74          1HB       HIS  74  34.218 -38.551  -7.444
  478   2HB   HIS  74          2HB       HIS  74  34.975 -40.015  -6.848
  479    HD1  HIS  74           HD1      HIS  74  32.980 -40.906  -5.525
  480    HD2  HIS  74           HD2      HIS  74  34.080 -37.007  -4.436
  481    HE1  HIS  74           HE1      HIS  74  31.648 -40.348  -3.421
  482    H    ASP  75           H        ASP  75  37.939 -38.568  -4.641
  483    HA   ASP  75           HA       ASP  75  38.976 -40.935  -5.656
  484   1HB   ASP  75          1HB       ASP  75  41.224 -40.024  -6.397
  485   2HB   ASP  75          2HB       ASP  75  39.900 -39.659  -7.487
  486    HD2  ASP  75           HD2      ASP  75  42.280 -36.994  -6.468
  Start of MODEL   23
    1    H    MET   1           H        MET   1 -21.603  23.460  17.339
    2    HA   MET   1           HA       MET   1 -23.538  25.260  18.099
    3   1HB   MET   1          1HB       MET   1 -21.033  26.535  17.676
    4   2HB   MET   1          2HB       MET   1 -21.911  26.824  16.187
    5   1HG   MET   1          1HG       MET   1 -22.928  28.546  17.282
    6   2HG   MET   1          2HG       MET   1 -23.858  27.324  18.126
    7   1HE   MET   1          1HE       MET   1 -23.473  26.810  20.849
    8   2HE   MET   1          2HE       MET   1 -23.246  28.446  21.512
    9   3HE   MET   1          3HE       MET   1 -24.346  28.188  20.137
   10    H    GLU   2           H        GLU   2 -24.728  23.655  16.904
   11    HA   GLU   2           HA       GLU   2 -25.033  24.328  14.199
   12   1HB   GLU   2          1HB       GLU   2 -22.932  22.668  14.416
   13   2HB   GLU   2          2HB       GLU   2 -24.191  21.450  14.472
   14   1HG   GLU   2          1HG       GLU   2 -24.066  21.550  12.186
   15   2HG   GLU   2          2HG       GLU   2 -25.097  22.956  12.368
   16    HE2  GLU   2           HE2      GLU   2 -23.905  24.962  12.656
   17    H    VAL   3           H        VAL   3 -27.110  24.665  15.428
   18    HA   VAL   3           HA       VAL   3 -28.612  22.146  15.475
   19    HB   VAL   3           HB       VAL   3 -27.932  23.085  17.756
   20   1HG1  VAL   3          1HG1      VAL   3 -30.007  25.146  16.947
   21   2HG1  VAL   3          2HG1      VAL   3 -29.477  24.863  18.622
   22   3HG1  VAL   3          3HG1      VAL   3 -28.312  25.435  17.404
   23   1HG2  VAL   3          1HG2      VAL   3 -29.675  21.946  18.621
   24   2HG2  VAL   3          2HG2      VAL   3 -30.881  22.961  17.794
   25   3HG2  VAL   3          3HG2      VAL   3 -30.092  21.626  16.920
   26    H    ALA   4           H        ALA   4 -31.148  22.977  15.748
   27    HA   ALA   4           HA       ALA   4 -31.544  24.461  13.306
   28   1HB   ALA   4          1HB       ALA   4 -33.882  23.782  13.603
   29   2HB   ALA   4          2HB       ALA   4 -32.805  22.384  13.836
   30   3HB   ALA   4          3HB       ALA   4 -33.524  23.199  15.246
   31    H    MET   5           H        MET   5 -30.382  26.364  14.541
   32    HA   MET   5           HA       MET   5 -30.495  28.329  15.466
   33   1HB   MET   5          1HB       MET   5 -32.779  28.048  13.818
   34   2HB   MET   5          2HB       MET   5 -33.431  28.716  15.301
   35   1HG   MET   5          1HG       MET   5 -32.812  30.591  13.896
   36   2HG   MET   5          2HG       MET   5 -31.643  30.527  15.200
   37   1HE   MET   5          1HE       MET   5 -30.416  31.204  11.194
   38   2HE   MET   5          2HE       MET   5 -32.069  31.291  11.848
   39   3HE   MET   5          3HE       MET   5 -30.746  32.170  12.652
   40    H    VAL   6           H        VAL   6 -31.782  29.787  17.208
   41    HA   VAL   6           HA       VAL   6 -32.111  29.932  19.406
   42    HB   VAL   6           HB       VAL   6 -34.360  29.390  18.259
   43   1HG1  VAL   6          1HG1      VAL   6 -35.445  27.337  19.310
   44   2HG1  VAL   6          2HG1      VAL   6 -34.263  27.034  18.015
   45   3HG1  VAL   6          3HG1      VAL   6 -33.799  26.797  19.718
   46   1HG2  VAL   6          1HG2      VAL   6 -34.848  28.770  21.059
   47   2HG2  VAL   6          2HG2      VAL   6 -33.627  30.053  20.877
   48   3HG2  VAL   6          3HG2      VAL   6 -35.233  30.241  20.133
   49    H    SER   7           H        SER   7 -32.896  28.183  21.437
   50    HA   SER   7           HA       SER   7 -30.581  27.067  22.190
   51   1HB   SER   7          1HB       SER   7 -31.824  25.889  23.886
   52   2HB   SER   7          2HB       SER   7 -32.670  27.393  23.581
   53    HG   SER   7           HG       SER   7 -33.743  25.679  21.855
   54    H    ALA   8           H        ALA   8 -29.890  24.741  22.418
   55    HA   ALA   8           HA       ALA   8 -30.402  23.354  19.920
   56   1HB   ALA   8          1HB       ALA   8 -28.237  23.574  21.887
   57   2HB   ALA   8          2HB       ALA   8 -28.565  21.887  21.423
   58   3HB   ALA   8          3HB       ALA   8 -28.175  23.094  20.174
   59    H    GLU   9           H        GLU   9 -32.702  22.907  20.579
   60    HA   GLU   9           HA       GLU   9 -33.569  21.630  22.719
   61   1HB   GLU   9          1HB       GLU   9 -35.411  20.927  21.442
   62   2HB   GLU   9          2HB       GLU   9 -34.772  22.248  20.484
   63   1HG   GLU   9          1HG       GLU   9 -33.420  20.500  19.171
   64   2HG   GLU   9          2HG       GLU   9 -34.330  19.266  20.018
   65    HE2  GLU   9           HE2      GLU   9 -36.786  19.059  18.681
   66    H    SER  10           H        SER  10 -34.047  19.309  23.242
   67    HA   SER  10           HA       SER  10 -32.593  17.315  21.884
   68   1HB   SER  10          1HB       SER  10 -30.907  18.649  23.463
   69   2HB   SER  10          2HB       SER  10 -31.641  17.681  24.726
   70    HG   SER  10           HG       SER  10 -30.877  16.260  22.403
   71    H    SER  11           H        SER  11 -33.928  15.553  22.057
   72    HA   SER  11           HA       SER  11 -35.379  14.134  22.822
   73   1HB   SER  11          1HB       SER  11 -33.722  13.939  24.726
   74   2HB   SER  11          2HB       SER  11 -34.670  15.107  25.625
   75    HG   SER  11           HG       SER  11 -35.783  12.646  24.586
   76    H    GLY  12           H        GLY  12 -37.650  14.041  23.247
   77   1HA   GLY  12          1HA       GLY  12 -39.308  15.407  24.746
   78   2HA   GLY  12          2HA       GLY  12 -38.890  16.670  23.607
   79    H    CYS  13           H        CYS  13 -40.059  13.244  23.770
   80    HA   CYS  13           HA       CYS  13 -42.020  13.873  21.773
   81   1HB   CYS  13          1HB       CYS  13 -39.748  13.101  20.635
   82   2HB   CYS  13          2HB       CYS  13 -40.314  11.504  21.082
   83    HG   CYS  13           HG       CYS  13 -40.864  12.487  18.518
   84    H    ASN  14           H        ASN  14 -42.671  13.442  24.303
   85    HA   ASN  14           HA       ASN  14 -43.050  10.579  24.611
   86   1HB   ASN  14          1HB       ASN  14 -42.525  12.794  26.446
   87   2HB   ASN  14          2HB       ASN  14 -44.014  11.996  26.911
   88   1HD2  ASN  14          1HD2      ASN  14 -40.762  12.025  27.301
   89   2HD2  ASN  14          2HD2      ASN  14 -40.464  10.402  27.828
   90    H    SER  15           H        SER  15 -44.574  12.501  22.778
   91    HA   SER  15           HA       SER  15 -47.144  12.586  24.104
   92   1HB   SER  15          1HB       SER  15 -45.864  14.000  21.813
   93   2HB   SER  15          2HB       SER  15 -47.571  13.660  21.608
   94    HG   SER  15           HG       SER  15 -47.419  15.666  22.639
   95    H    HIS  16           H        HIS  16 -46.522   9.983  23.790
   96    HA   HIS  16           HA       HIS  16 -46.975   8.074  22.785
   97   1HB   HIS  16          1HB       HIS  16 -49.242   9.045  23.445
   98   2HB   HIS  16          2HB       HIS  16 -49.466   9.443  21.753
   99    HD1  HIS  16           HD1      HIS  16 -48.115   6.731  20.653
  100    HD2  HIS  16           HD2      HIS  16 -51.172   7.031  23.510
  101    HE1  HIS  16           HE1      HIS  16 -49.352   4.500  20.613
  102    H    MET  17           H        MET  17 -45.106   8.329  21.332
  103    HA   MET  17           HA       MET  17 -45.754   9.250  18.682
  104   1HB   MET  17          1HB       MET  17 -43.573   9.841  19.799
  105   2HB   MET  17          2HB       MET  17 -43.168   8.139  19.912
  106   1HG   MET  17          1HG       MET  17 -42.029   8.735  17.950
  107   2HG   MET  17          2HG       MET  17 -43.538   8.139  17.286
  108   1HE   MET  17          1HE       MET  17 -42.493   9.366  15.293
  109   2HE   MET  17          2HE       MET  17 -44.241   9.651  15.111
  110   3HE   MET  17          3HE       MET  17 -43.090  10.984  14.851
  111    HA   PRO  18           HA       PRO  18 -46.575   5.071  17.566
  112   1HB   PRO  18          1HB       PRO  18 -47.689   5.595  15.127
  113   2HB   PRO  18          2HB       PRO  18 -48.606   5.599  16.620
  114   1HG   PRO  18          1HG       PRO  18 -47.684   7.897  15.006
  115   2HG   PRO  18          2HG       PRO  18 -48.934   7.849  16.234
  116   1HD   PRO  18          1HD       PRO  18 -46.280   8.898  16.526
  117   2HD   PRO  18          2HD       PRO  18 -47.490   8.743  17.784
  118    H    TYR  19           H        TYR  19 -44.653   4.034  17.403
  119    HA   TYR  19           HA       TYR  19 -42.965   4.824  15.181
  120   1HB   TYR  19          1HB       TYR  19 -41.486   3.073  16.334
  121   2HB   TYR  19          2HB       TYR  19 -42.000   4.348  17.421
  122    HD1  TYR  19           HD1      TYR  19 -43.262   3.862  19.372
  123    HD2  TYR  19           HD2      TYR  19 -42.720   0.843  16.390
  124    HE1  TYR  19           HE1      TYR  19 -44.228   2.119  20.951
  125    HE2  TYR  19           HE2      TYR  19 -43.688  -0.890  17.978
  126    HH   TYR  19           HH       TYR  19 -44.136  -1.280  20.156
  127    H    GLY  20           H        GLY  20 -42.365   3.473  13.441
  128   1HA   GLY  20          1HA       GLY  20 -43.478   0.808  13.247
  129   2HA   GLY  20          2HA       GLY  20 -44.217   1.982  12.176
  130    H    TYR  21           H        TYR  21 -43.205   2.512  10.258
  131    HA   TYR  21           HA       TYR  21 -41.114   0.970   9.322
  132   1HB   TYR  21          1HB       TYR  21 -42.536   3.572   8.679
  133   2HB   TYR  21          2HB       TYR  21 -41.041   3.283   7.811
  134    HD1  TYR  21           HD1      TYR  21 -44.552   2.450   8.077
  135    HD2  TYR  21           HD2      TYR  21 -40.830   1.211   6.368
  136    HE1  TYR  21           HE1      TYR  21 -45.796   0.995   6.404
  137    HE2  TYR  21           HE2      TYR  21 -42.087  -0.240   4.702
  138    HH   TYR  21           HH       TYR  21 -44.034  -0.755   3.877
  139    H    ALA  22           H        ALA  22 -41.041   3.677  11.500
  140    HA   ALA  22           HA       ALA  22 -38.304   4.356  10.798
  141   1HB   ALA  22          1HB       ALA  22 -40.504   5.772  11.786
  142   2HB   ALA  22          2HB       ALA  22 -39.432   5.600  13.196
  143   3HB   ALA  22          3HB       ALA  22 -38.824   6.354  11.703
  144    H    ALA  23           H        ALA  23 -38.871   1.627  11.697
  145    HA   ALA  23           HA       ALA  23 -37.932   1.594  14.444
  146   1HB   ALA  23          1HB       ALA  23 -38.191  -0.933  14.033
  147   2HB   ALA  23          2HB       ALA  23 -39.678   0.045  13.991
  148   3HB   ALA  23          3HB       ALA  23 -38.921  -0.488  12.471
  149    H    GLN  24           H        GLN  24 -36.602   1.927  11.362
  150    HA   GLN  24           HA       GLN  24 -34.335   0.240  11.897
  151   1HB   GLN  24          1HB       GLN  24 -35.474   1.653   9.556
  152   2HB   GLN  24          2HB       GLN  24 -33.724   1.713   9.621
  153   1HG   GLN  24          1HG       GLN  24 -33.775  -0.363   8.683
  154   2HG   GLN  24          2HG       GLN  24 -34.216  -0.941  10.278
  155   1HE2  GLN  24          1HE2      GLN  24 -35.035  -2.504   8.416
  156   2HE2  GLN  24          2HE2      GLN  24 -36.720  -2.356   8.040
  157    H    ALA  25           H        ALA  25 -35.358   3.207  12.986
  158    HA   ALA  25           HA       ALA  25 -33.175   4.886  12.566
  159   1HB   ALA  25          1HB       ALA  25 -35.399   4.668  14.590
  160   2HB   ALA  25          2HB       ALA  25 -34.095   5.854  14.838
  161   3HB   ALA  25          3HB       ALA  25 -35.099   5.929  13.370
  162    H    ARG  26           H        ARG  26 -33.550   1.990  14.477
  163    HA   ARG  26           HA       ARG  26 -31.628   2.644  16.412
  164   1HB   ARG  26          1HB       ARG  26 -33.494   0.662  16.161
  165   2HB   ARG  26          2HB       ARG  26 -32.074  -0.233  15.659
  166   1HG   ARG  26          1HG       ARG  26 -31.396   1.333  18.004
  167   2HG   ARG  26          2HG       ARG  26 -32.877   0.454  18.330
  168   1HD   ARG  26          1HD       ARG  26 -31.857  -1.663  17.989
  169   2HD   ARG  26          2HD       ARG  26 -30.551  -0.994  17.030
  170    HE   ARG  26           HE       ARG  26 -30.126   0.220  19.447
  171   1HH1  ARG  26          2HH2      ARG  26 -30.697  -3.170  18.591
  172   2HH1  ARG  26          1HH2      ARG  26 -29.779  -3.790  19.923
  173   1HH2  ARG  26          1HH       ARG  26 -28.741  -2.259  21.447
  174    H    ALA  27           H        ALA  27 -31.573   1.282  13.127
  175    HA   ALA  27           HA       ALA  27 -28.970   0.175  13.287
  176   1HB   ALA  27          1HB       ALA  27 -30.614   1.085  10.889
  177   2HB   ALA  27          2HB       ALA  27 -29.202   0.001  10.845
  178   3HB   ALA  27          3HB       ALA  27 -30.700  -0.521  11.652
  179    H    ARG  28           H        ARG  28 -30.333   3.398  12.661
  180    HA   ARG  28           HA       ARG  28 -28.143   4.474  11.380
  181   1HB   ARG  28          1HB       ARG  28 -30.635   5.381  12.086
  182   2HB   ARG  28          2HB       ARG  28 -29.669   6.237  13.271
  183   1HG   ARG  28          1HG       ARG  28 -28.185   6.606  10.944
  184   2HG   ARG  28          2HG       ARG  28 -29.827   6.624  10.333
  185   1HD   ARG  28          1HD       ARG  28 -29.844   8.188  12.736
  186   2HD   ARG  28          2HD       ARG  28 -28.425   8.683  11.835
  187    HE   ARG  28           HE       ARG  28 -30.893   8.461  10.234
  188   1HH1  ARG  28          2HH2      ARG  28 -28.785  10.602  12.110
  189   2HH1  ARG  28          1HH2      ARG  28 -29.387  12.048  11.370
  190   1HH2  ARG  28          1HH       ARG  28 -31.093  11.886   9.695
  191    H    GLU  29           H        GLU  29 -28.829   3.782  14.800
  192    HA   GLU  29           HA       GLU  29 -26.702   5.435  15.730
  193   1HB   GLU  29          1HB       GLU  29 -28.977   4.137  16.863
  194   2HB   GLU  29          2HB       GLU  29 -27.578   3.461  17.673
  195   1HG   GLU  29          1HG       GLU  29 -26.968   6.191  17.568
  196   2HG   GLU  29          2HG       GLU  29 -28.700   6.193  17.832
  197    HE2  GLU  29           HE2      GLU  29 -27.279   6.510  20.783
  198    H    ARG  30           H        ARG  30 -27.142   2.139  14.594
  199    HA   ARG  30           HA       ARG  30 -24.714   1.277  15.856
  200   1HB   ARG  30          1HB       ARG  30 -26.990  -0.003  14.407
  201   2HB   ARG  30          2HB       ARG  30 -25.438  -0.767  14.132
  202   1HG   ARG  30          1HG       ARG  30 -25.880  -0.094  16.977
  203   2HG   ARG  30          2HG       ARG  30 -27.101  -1.182  16.346
  204   1HD   ARG  30          1HD       ARG  30 -25.506  -2.858  15.780
  205   2HD   ARG  30          2HD       ARG  30 -24.168  -1.725  15.781
  206    HE   ARG  30           HE       ARG  30 -23.927  -2.082  18.073
  207   1HH1  ARG  30          2HH2      ARG  30 -27.223  -2.996  17.149
  208   2HH1  ARG  30          1HH2      ARG  30 -27.629  -3.599  18.721
  209   1HH2  ARG  30          1HH       ARG  30 -25.991  -3.521  20.468
  210    H    GLU  31           H        GLU  31 -25.940   2.457  12.749
  211    HA   GLU  31           HA       GLU  31 -23.881   1.444  11.159
  212   1HB   GLU  31          1HB       GLU  31 -26.176   2.409  10.456
  213   2HB   GLU  31          2HB       GLU  31 -25.447   3.994  10.616
  214   1HG   GLU  31          1HG       GLU  31 -24.320   3.785   8.649
  215   2HG   GLU  31          2HG       GLU  31 -23.710   2.199   9.078
  216    HE2  GLU  31           HE2      GLU  31 -26.335   0.507   7.518
  217    H    ARG  32           H        ARG  32 -24.098   4.119  13.421
  218    HA   ARG  32           HA       ARG  32 -22.219   5.800  12.340
  219   1HB   ARG  32          1HB       ARG  32 -23.802   5.978  14.481
  220   2HB   ARG  32          2HB       ARG  32 -22.401   5.369  15.338
  221   1HG   ARG  32          1HG       ARG  32 -21.258   7.342  15.131
  222   2HG   ARG  32          2HG       ARG  32 -21.726   7.550  13.455
  223   1HD   ARG  32          1HD       ARG  32 -23.975   8.359  14.164
  224   2HD   ARG  32          2HD       ARG  32 -23.553   8.102  15.845
  225    HE   ARG  32           HE       ARG  32 -22.262  10.063  15.810
  226   1HH1  ARG  32          2HH2      ARG  32 -23.024   9.116  12.482
  227   2HH1  ARG  32          1HH2      ARG  32 -22.413  10.583  11.793
  228   1HH2  ARG  32          1HH       ARG  32 -21.496  12.264  13.234
  229    H    LEU  33           H        LEU  33 -21.915   2.719  14.070
  230    HA   LEU  33           HA       LEU  33 -19.070   3.112  14.484
  231   1HB   LEU  33          1HB       LEU  33 -21.096   1.722  15.817
  232   2HB   LEU  33          2HB       LEU  33 -20.109   0.474  15.083
  233    HG   LEU  33           HG       LEU  33 -18.256   2.242  16.218
  234   1HD1  LEU  33          1HD1      LEU  33 -19.875   1.646  18.572
  235   2HD1  LEU  33          2HD1      LEU  33 -19.030   3.142  18.104
  236   3HD1  LEU  33          3HD1      LEU  33 -20.659   2.804  17.471
  237   1HD2  LEU  33          1HD2      LEU  33 -17.668   0.400  17.608
  238   2HD2  LEU  33          2HD2      LEU  33 -19.294  -0.311  17.467
  239   3HD2  LEU  33          3HD2      LEU  33 -18.217  -0.265  16.051
  240    H    ALA  34           H        ALA  34 -21.227   2.042  12.041
  241    HA   ALA  34           HA       ALA  34 -19.451   0.046  10.965
  242   1HB   ALA  34          1HB       ALA  34 -21.151  -0.167   9.245
  243   2HB   ALA  34          2HB       ALA  34 -21.958  -0.059  10.827
  244   3HB   ALA  34          3HB       ALA  34 -21.915   1.359   9.752
  245    H    HIS  35           H        HIS  35 -19.103   3.276  11.301
  246    HA   HIS  35           HA       HIS  35 -18.339   3.821   8.562
  247   1HB   HIS  35          1HB       HIS  35 -19.567   5.396  10.287
  248   2HB   HIS  35          2HB       HIS  35 -17.938   5.734  10.838
  249    HD1  HIS  35           HD1      HIS  35 -16.909   7.708   9.723
  250    HD2  HIS  35           HD2      HIS  35 -19.670   5.767   7.233
  251    HE1  HIS  35           HE1      HIS  35 -17.003   9.066   7.565
  252    H    SER  36           H        SER  36 -17.007   2.436  11.386
  253    HA   SER  36           HA       SER  36 -14.361   3.429  10.852
  254   1HB   SER  36          1HB       SER  36 -15.490   2.888  13.189
  255   2HB   SER  36          2HB       SER  36 -15.001   1.241  12.841
  256    HG   SER  36           HG       SER  36 -12.934   1.737  13.197
  257    H    ARG  37           H        ARG  37 -16.454   0.783   9.992
  258    HA   ARG  37           HA       ARG  37 -14.252  -0.969   9.431
  259   1HB   ARG  37          1HB       ARG  37 -16.874  -1.427  10.160
  260   2HB   ARG  37          2HB       ARG  37 -16.989  -1.646   8.425
  261   1HG   ARG  37          1HG       ARG  37 -15.259  -3.367   8.446
  262   2HG   ARG  37          2HG       ARG  37 -14.863  -3.031  10.119
  263   1HD   ARG  37          1HD       ARG  37 -17.731  -3.662   9.728
  264   2HD   ARG  37          2HD       ARG  37 -16.675  -4.969   9.231
  265    HE   ARG  37           HE       ARG  37 -15.632  -4.188  11.686
  266   1HH1  ARG  37          2HH2      ARG  37 -18.836  -5.224  10.583
  267   2HH1  ARG  37          1HH2      ARG  37 -19.278  -5.907  12.112
  268   1HH2  ARG  37          1HH       ARG  37 -17.722  -5.817  13.933
  269    H    ALA  38           H        ALA  38 -15.071   1.761   8.010
  270    HA   ALA  38           HA       ALA  38 -15.499   0.809   5.305
  271   1HB   ALA  38          1HB       ALA  38 -15.931   3.082   4.788
  272   2HB   ALA  38          2HB       ALA  38 -16.614   2.855   6.417
  273   3HB   ALA  38          3HB       ALA  38 -15.041   3.664   6.216
  274    H    ALA  39           H        ALA  39 -13.085   2.869   7.088
  275    HA   ALA  39           HA       ALA  39 -11.204   2.481   4.925
  276   1HB   ALA  39          1HB       ALA  39 -10.030   3.796   7.167
  277   2HB   ALA  39          2HB       ALA  39 -10.576   4.517   5.634
  278   3HB   ALA  39          3HB       ALA  39 -11.696   4.405   7.014
  279    H    ALA  40           H        ALA  40 -11.519   0.001   5.495
  280    HA   ALA  40           HA       ALA  40 -10.050  -0.845   7.813
  281   1HB   ALA  40          1HB       ALA  40 -10.892  -2.606   5.505
  282   2HB   ALA  40          2HB       ALA  40 -10.799  -2.993   7.240
  283   3HB   ALA  40          3HB       ALA  40 -12.104  -1.948   6.630
  284    H    ALA  41           H        ALA  41  -9.650  -1.297   4.222
  285    HA   ALA  41           HA       ALA  41  -7.152  -0.424   3.893
  286   1HB   ALA  41          1HB       ALA  41  -5.996  -1.643   5.464
  287   2HB   ALA  41          2HB       ALA  41  -7.148  -2.999   5.420
  288   3HB   ALA  41          3HB       ALA  41  -5.941  -2.814   4.125
  289    H    ALA  42           H        ALA  42  -9.165  -0.449   2.215
  290    HA   ALA  42           HA       ALA  42  -9.027  -2.828   0.549
  291   1HB   ALA  42          1HB       ALA  42 -11.229  -1.920   1.035
  292   2HB   ALA  42          2HB       ALA  42 -10.732  -0.308   0.469
  293   3HB   ALA  42          3HB       ALA  42 -10.868  -1.654  -0.687
  294    H    ALA  43           H        ALA  43  -8.733   0.778   0.134
  295    HA   ALA  43           HA       ALA  43  -7.740   0.791  -2.401
  296   1HB   ALA  43          1HB       ALA  43  -8.396   2.778  -1.078
  297   2HB   ALA  43          2HB       ALA  43  -6.943   2.580  -0.068
  298   3HB   ALA  43          3HB       ALA  43  -6.779   2.977  -1.796
  299    H    VAL  44           H        VAL  44  -6.226  -0.370   0.549
  300    HA   VAL  44           HA       VAL  44  -3.606  -0.377  -0.734
  301    HB   VAL  44           HB       VAL  44  -4.654  -0.336   1.992
  302   1HG1  VAL  44          1HG1      VAL  44  -2.592  -1.601   2.868
  303   2HG1  VAL  44          2HG1      VAL  44  -3.957  -2.568   2.258
  304   3HG1  VAL  44          3HG1      VAL  44  -2.511  -2.333   1.247
  305   1HG2  VAL  44          1HG2      VAL  44  -2.200   0.501   2.315
  306   2HG2  VAL  44          2HG2      VAL  44  -2.161   0.516   0.535
  307   3HG2  VAL  44          3HG2      VAL  44  -3.359   1.502   1.408
  308    H    ALA  45           H        ALA  45  -6.320  -2.456   0.235
  309    HA   ALA  45           HA       ALA  45  -5.267  -4.915   0.373
  310   1HB   ALA  45          1HB       ALA  45  -7.392  -5.714  -0.580
  311   2HB   ALA  45          2HB       ALA  45  -7.672  -4.345   0.522
  312   3HB   ALA  45          3HB       ALA  45  -7.717  -4.093  -1.240
  313    H    ALA  46           H        ALA  46  -6.180  -3.282  -2.749
  314    HA   ALA  46           HA       ALA  46  -5.147  -5.262  -4.396
  315   1HB   ALA  46          1HB       ALA  46  -6.250  -3.891  -5.795
  316   2HB   ALA  46          2HB       ALA  46  -6.232  -2.576  -4.596
  317   3HB   ALA  46          3HB       ALA  46  -4.863  -2.778  -5.715
  318    H    ALA  47           H        ALA  47  -3.644  -2.124  -3.331
  319    HA   ALA  47           HA       ALA  47  -1.180  -2.608  -4.536
  320   1HB   ALA  47          1HB       ALA  47  -2.295  -0.476  -3.428
  321   2HB   ALA  47          2HB       ALA  47  -1.430  -1.040  -1.978
  322   3HB   ALA  47          3HB       ALA  47  -0.524  -0.655  -3.462
  323    H    THR  48           H        THR  48   0.842  -2.445  -2.701
  324    HA   THR  48           HA       THR  48   2.147  -3.698  -1.409
  325    HB   THR  48           HB       THR  48  -0.585  -4.159  -0.133
  326    HG1  THR  48           HG1      THR  48   0.242  -2.459   1.108
  327   1HG2  THR  48          1HG2      THR  48   1.390  -5.983   0.299
  328   2HG2  THR  48          2HG2      THR  48   1.964  -4.688   1.377
  329   3HG2  THR  48          3HG2      THR  48   0.346  -5.391   1.614
  330    H    ALA  49           H        ALA  49   3.128  -5.738  -1.284
  331    HA   ALA  49           HA       ALA  49   2.691  -7.422  -3.387
  332   1HB   ALA  49          1HB       ALA  49   4.158  -7.479  -0.810
  333   2HB   ALA  49          2HB       ALA  49   3.814  -9.077  -1.515
  334   3HB   ALA  49          3HB       ALA  49   4.718  -7.866  -2.455
  335    H    ALA  50           H        ALA  50   2.202  -9.941  -2.999
  336    HA   ALA  50           HA       ALA  50  -0.548  -9.984  -2.118
  337   1HB   ALA  50          1HB       ALA  50   0.021 -11.012  -4.244
  338   2HB   ALA  50          2HB       ALA  50   1.262 -12.024  -3.469
  339   3HB   ALA  50          3HB       ALA  50  -0.459 -12.292  -3.104
  340    H    VAL  51           H        VAL  51   0.925  -9.414   0.096
  341    HA   VAL  51           HA       VAL  51   1.604 -10.120   2.093
  342    HB   VAL  51           HB       VAL  51  -0.812 -10.430   2.193
  343   1HG1  VAL  51          1HG1      VAL  51  -0.177 -13.211   1.178
  344   2HG1  VAL  51          2HG1      VAL  51  -1.701 -12.811   2.006
  345   3HG1  VAL  51          3HG1      VAL  51  -1.280 -12.001   0.479
  346   1HG2  VAL  51          1HG2      VAL  51   0.547 -12.706   3.666
  347   2HG2  VAL  51          2HG2      VAL  51   0.702 -10.995   4.135
  348   3HG2  VAL  51          3HG2      VAL  51  -0.893 -11.785   4.161
  349    H    GLU  52           H        GLU  52   3.454 -10.945   0.328
  350    HA   GLU  52           HA       GLU  52   3.831 -13.612  -0.034
  351   1HB   GLU  52          1HB       GLU  52   5.183 -11.597  -0.925
  352   2HB   GLU  52          2HB       GLU  52   6.094 -11.671   0.571
  353   1HG   GLU  52          1HG       GLU  52   7.377 -13.324  -0.294
  354   2HG   GLU  52          2HG       GLU  52   5.964 -14.353  -0.423
  355    HE2  GLU  52           HE2      GLU  52   4.890 -13.440  -3.295
  356    H    GLY  53           H        GLY  53   5.080 -15.254   1.090
  357   1HA   GLY  53          1HA       GLY  53   5.237 -14.755   4.001
  358   2HA   GLY  53          2HA       GLY  53   4.839 -16.291   3.259
  359    H    THR  54           H        THR  54   6.593 -17.131   1.605
  360    HA   THR  54           HA       THR  54   9.178 -16.832   2.960
  361    HB   THR  54           HB       THR  54   8.080 -19.104   2.811
  362    HG1  THR  54           HG1      THR  54  10.486 -18.600   2.678
  363   1HG2  THR  54          1HG2      THR  54   8.659 -18.780  -0.180
  364   2HG2  THR  54          2HG2      THR  54   8.050 -20.246   0.625
  365   3HG2  THR  54          3HG2      THR  54   7.024 -18.796   0.524
  366    H    GLY  55           H        GLY  55  10.887 -15.874   2.032
  367   1HA   GLY  55          1HA       GLY  55  10.588 -15.134  -0.816
  368   2HA   GLY  55          2HA       GLY  55  11.394 -14.161   0.399
  369    H    GLY  56           H        GLY  56  12.832 -14.717  -1.861
  370   1HA   GLY  56          1HA       GLY  56  15.230 -15.338  -1.511
  371   2HA   GLY  56          2HA       GLY  56  14.634 -16.926  -1.069
  372    H    SER  57           H        SER  57  15.538 -14.817  -3.671
  373    HA   SER  57           HA       SER  57  14.491 -16.779  -5.561
  374   1HB   SER  57          1HB       SER  57  14.407 -15.015  -7.238
  375   2HB   SER  57          2HB       SER  57  13.542 -14.476  -5.813
  376    HG   SER  57           HG       SER  57  14.945 -12.876  -5.539
  377    H    GLY  58           H        GLY  58  16.215 -18.195  -5.849
  378   1HA   GLY  58          1HA       GLY  58  18.592 -17.137  -7.116
  379   2HA   GLY  58          2HA       GLY  58  18.862 -17.827  -5.528
  380    H    GLY  59           H        GLY  59  20.232 -19.389  -6.834
  381   1HA   GLY  59          1HA       GLY  59  19.281 -21.900  -6.915
  382   2HA   GLY  59          2HA       GLY  59  18.798 -21.290  -8.485
  383    H    GLY  60           H        GLY  60  20.685 -23.424  -8.118
  384   1HA   GLY  60          1HA       GLY  60  22.787 -24.075  -8.628
  385   2HA   GLY  60          2HA       GLY  60  22.644 -22.884  -9.905
  386    HA   PRO  61           HA       PRO  61  25.032 -21.006  -6.233
  387   1HB   PRO  61          1HB       PRO  61  26.201 -22.749  -4.483
  388   2HB   PRO  61          2HB       PRO  61  24.675 -21.949  -4.163
  389   1HG   PRO  61          1HG       PRO  61  25.169 -24.759  -4.939
  390   2HG   PRO  61          2HG       PRO  61  23.737 -24.056  -4.213
  391   1HD   PRO  61          1HD       PRO  61  24.079 -24.797  -6.963
  392   2HD   PRO  61          2HD       PRO  61  22.692 -23.988  -6.261
  393    H    HIS  62           H        HIS  62  27.145 -20.251  -6.328
  394    HA   HIS  62           HA       HIS  62  29.040 -20.046  -7.447
  395   1HB   HIS  62          1HB       HIS  62  29.607 -21.548  -5.536
  396   2HB   HIS  62          2HB       HIS  62  29.419 -22.930  -6.597
  397    HD1  HIS  62           HD1      HIS  62  32.135 -22.209  -5.188
  398    HD2  HIS  62           HD2      HIS  62  31.109 -21.170  -9.120
  399    HE1  HIS  62           HE1      HIS  62  34.335 -21.842  -6.427
  400    H    HIS  63           H        HIS  63  27.567 -19.933  -9.452
  401    HA   HIS  63           HA       HIS  63  27.006 -21.913 -11.143
  402   1HB   HIS  63          1HB       HIS  63  26.718 -19.344 -11.337
  403   2HB   HIS  63          2HB       HIS  63  28.258 -19.370 -12.172
  404    HD1  HIS  63           HD1      HIS  63  24.669 -20.505 -12.529
  405    HD2  HIS  63           HD2      HIS  63  28.202 -20.396 -14.789
  406    HE1  HIS  63           HE1      HIS  63  24.003 -21.077 -14.925
  407    H    HIS  64           H        HIS  64  28.029 -23.252 -12.642
  408    HA   HIS  64           HA       HIS  64  30.955 -23.137 -12.535
  409   1HB   HIS  64          1HB       HIS  64  29.477 -25.156 -11.602
  410   2HB   HIS  64          2HB       HIS  64  29.512 -25.644 -13.284
  411    HD1  HIS  64           HD1      HIS  64  32.232 -24.282 -10.927
  412    HD2  HIS  64           HD2      HIS  64  31.525 -27.445 -13.590
  413    HE1  HIS  64           HE1      HIS  64  34.367 -25.679 -10.960
  414    H    HIS  65           H        HIS  65  32.003 -24.137 -14.581
  415    HA   HIS  65           HA       HIS  65  30.881 -24.535 -16.945
  416   1HB   HIS  65          1HB       HIS  65  30.501 -21.720 -16.212
  417   2HB   HIS  65          2HB       HIS  65  31.299 -21.920 -17.759
  418    HD1  HIS  65           HD1      HIS  65  28.030 -21.552 -16.442
  419    HD2  HIS  65           HD2      HIS  65  29.706 -24.044 -19.371
  420    HE1  HIS  65           HE1      HIS  65  26.091 -22.353 -17.895
  421    H    GLN  66           H        GLN  66  32.789 -25.723 -17.174
  422    HA   GLN  66           HA       GLN  66  34.924 -24.328 -18.311
  423   1HB   GLN  66          1HB       GLN  66  35.112 -24.160 -15.604
  424   2HB   GLN  66          2HB       GLN  66  35.908 -25.704 -15.837
  425   1HG   GLN  66          1HG       GLN  66  37.791 -24.561 -16.381
  426   2HG   GLN  66          2HG       GLN  66  36.996 -24.080 -17.867
  427   1HE2  GLN  66          1HE2      GLN  66  38.006 -22.108 -17.943
  428   2HE2  GLN  66          2HE2      GLN  66  37.624 -20.787 -16.891
  429    H    THR  67           H        THR  67  36.998 -26.145 -18.162
  430    HA   THR  67           HA       THR  67  36.033 -28.838 -18.292
  431    HB   THR  67           HB       THR  67  36.704 -27.288 -20.846
  432    HG1  THR  67           HG1      THR  67  34.471 -28.788 -19.682
  433   1HG2  THR  67          1HG2      THR  67  36.297 -30.276 -20.326
  434   2HG2  THR  67          2HG2      THR  67  36.123 -29.534 -21.935
  435   3HG2  THR  67          3HG2      THR  67  37.699 -29.505 -21.107
  436    H    ARG  68           H        ARG  68  37.881 -30.310 -19.182
  437    HA   ARG  68           HA       ARG  68  40.039 -29.834 -17.546
  438   1HB   ARG  68          1HB       ARG  68  39.519 -31.723 -19.866
  439   2HB   ARG  68          2HB       ARG  68  41.111 -31.681 -19.134
  440   1HG   ARG  68          1HG       ARG  68  38.858 -31.822 -17.186
  441   2HG   ARG  68          2HG       ARG  68  39.008 -33.225 -18.225
  442   1HD   ARG  68          1HD       ARG  68  40.680 -33.971 -16.880
  443   2HD   ARG  68          2HD       ARG  68  41.668 -32.636 -17.439
  444    HE   ARG  68           HE       ARG  68  40.191 -32.783 -14.889
  445   1HH1  ARG  68          2HH2      ARG  68  41.940 -30.704 -17.164
  446   2HH1  ARG  68          1HH2      ARG  68  42.262 -29.476 -15.986
  447   1HH2  ARG  68          1HH       ARG  68  41.474 -29.766 -13.742
  448    H    GLY  69           H        GLY  69  42.022 -28.793 -17.850
  449   1HA   GLY  69          1HA       GLY  69  42.496 -27.655 -20.540
  450   2HA   GLY  69          2HA       GLY  69  42.891 -26.857 -19.031
  451    H    ALA  70           H        ALA  70  44.328 -28.349 -17.471
  452    HA   ALA  70           HA       ALA  70  46.346 -29.192 -17.129
  453   1HB   ALA  70          1HB       ALA  70  45.666 -30.839 -19.600
  454   2HB   ALA  70          2HB       ALA  70  46.936 -31.222 -18.413
  455   3HB   ALA  70          3HB       ALA  70  45.225 -31.239 -17.923
  456    H    TYR  71           H        TYR  71  48.631 -29.577 -18.200
  457    HA   TYR  71           HA       TYR  71  49.069 -27.253 -19.907
  458   1HB   TYR  71          1HB       TYR  71  50.797 -29.190 -18.249
  459   2HB   TYR  71          2HB       TYR  71  51.500 -27.898 -19.201
  460    HD1  TYR  71           HD1      TYR  71  50.017 -28.790 -16.056
  461    HD2  TYR  71           HD2      TYR  71  50.824 -25.479 -18.643
  462    HE1  TYR  71           HE1      TYR  71  49.726 -27.186 -14.105
  463    HE2  TYR  71           HE2      TYR  71  50.530 -23.886 -16.683
  464    HH   TYR  71           HH       TYR  71  49.850 -25.139 -13.428
  465    H    SER  72           H        SER  72  50.970 -27.533 -21.538
  466    HA   SER  72           HA       SER  72  50.157 -29.207 -23.505
  467   1HB   SER  72          1HB       SER  72  52.463 -28.840 -24.485
  468   2HB   SER  72          2HB       SER  72  51.639 -27.372 -23.997
  469    HG   SER  72           HG       SER  72  53.151 -26.982 -22.522
  470    H    SER  73           H        SER  73  53.021 -29.681 -21.301
  471    HA   SER  73           HA       SER  73  54.018 -31.464 -20.570
  472   1HB   SER  73          1HB       SER  73  51.305 -32.168 -20.498
  473   2HB   SER  73          2HB       SER  73  52.051 -33.533 -21.305
  474    HG   SER  73           HG       SER  73  52.161 -32.802 -18.644
  475    H    HIS  74           H        HIS  74  55.754 -31.673 -22.001
  476    HA   HIS  74           HA       HIS  74  55.281 -33.499 -24.240
  477   1HB   HIS  74          1HB       HIS  74  57.003 -32.184 -25.504
  478   2HB   HIS  74          2HB       HIS  74  55.469 -31.373 -25.257
  479    HD1  HIS  74           HD1      HIS  74  59.101 -31.220 -24.283
  480    HD2  HIS  74           HD2      HIS  74  55.556 -29.093 -23.573
  481    HE1  HIS  74           HE1      HIS  74  59.794 -29.020 -23.192
  482    H    ASP  75           H        ASP  75  57.401 -34.556 -24.990
  483    HA   ASP  75           HA       ASP  75  59.564 -34.537 -23.213
  484   1HB   ASP  75          1HB       ASP  75  59.328 -36.948 -22.468
  485   2HB   ASP  75          2HB       ASP  75  58.179 -35.850 -21.730
  486    HD2  ASP  75           HD2      ASP  75  58.563 -38.570 -23.516
  Start of MODEL   24
    1    H    MET   1           H        MET   1 -22.739 -14.986  39.099
    2    HA   MET   1           HA       MET   1 -24.866 -16.877  38.447
    3   1HB   MET   1          1HB       MET   1 -25.007 -14.413  39.798
    4   2HB   MET   1          2HB       MET   1 -25.449 -13.972  38.161
    5   1HG   MET   1          1HG       MET   1 -27.462 -15.064  38.278
    6   2HG   MET   1          2HG       MET   1 -26.766 -16.465  39.066
    7   1HE   MET   1          1HE       MET   1 -29.131 -14.260  39.066
    8   2HE   MET   1          2HE       MET   1 -29.764 -14.284  40.729
    9   3HE   MET   1          3HE       MET   1 -28.785 -12.907  40.169
   10    H    GLU   2           H        GLU   2 -24.637 -17.568  36.360
   11    HA   GLU   2           HA       GLU   2 -23.056 -16.465  34.485
   12   1HB   GLU   2          1HB       GLU   2 -24.490 -18.688  34.543
   13   2HB   GLU   2          2HB       GLU   2 -25.673 -17.742  33.662
   14   1HG   GLU   2          1HG       GLU   2 -22.956 -17.389  32.573
   15   2HG   GLU   2          2HG       GLU   2 -23.448 -19.071  32.563
   16    HE2  GLU   2           HE2      GLU   2 -24.380 -16.665  29.888
   17    H    VAL   3           H        VAL   3 -23.384 -15.097  32.604
   18    HA   VAL   3           HA       VAL   3 -25.176 -12.929  33.171
   19    HB   VAL   3           HB       VAL   3 -23.530 -13.263  30.680
   20   1HG1  VAL   3          1HG1      VAL   3 -23.488 -10.924  30.615
   21   2HG1  VAL   3          2HG1      VAL   3 -25.137 -11.294  31.172
   22   3HG1  VAL   3          3HG1      VAL   3 -23.901 -10.770  32.340
   23   1HG2  VAL   3          1HG2      VAL   3 -21.712 -13.636  31.951
   24   2HG2  VAL   3          2HG2      VAL   3 -21.857 -11.921  32.404
   25   3HG2  VAL   3          3HG2      VAL   3 -22.550 -13.181  33.453
   26    H    ALA   4           H        ALA   4 -26.877 -12.172  31.766
   27    HA   ALA   4           HA       ALA   4 -28.578 -14.164  30.883
   28   1HB   ALA   4          1HB       ALA   4 -28.852 -11.546  29.543
   29   2HB   ALA   4          2HB       ALA   4 -29.991 -12.415  30.601
   30   3HB   ALA   4          3HB       ALA   4 -28.682 -11.440  31.312
   31    H    MET   5           H        MET   5 -28.532 -15.482  29.136
   32    HA   MET   5           HA       MET   5 -26.552 -14.999  27.148
   33   1HB   MET   5          1HB       MET   5 -28.625 -17.154  27.732
   34   2HB   MET   5          2HB       MET   5 -27.788 -17.165  26.192
   35   1HG   MET   5          1HG       MET   5 -25.671 -17.557  27.189
   36   2HG   MET   5          2HG       MET   5 -26.172 -16.928  28.746
   37   1HE   MET   5          1HE       MET   5 -25.069 -20.526  27.850
   38   2HE   MET   5          2HE       MET   5 -26.508 -20.943  26.890
   39   3HE   MET   5          3HE       MET   5 -25.567 -19.485  26.496
   40    H    VAL   6           H        VAL   6 -26.842 -14.344  25.005
   41    HA   VAL   6           HA       VAL   6 -29.424 -13.156  24.442
   42    HB   VAL   6           HB       VAL   6 -27.062 -12.127  24.135
   43   1HG1  VAL   6          1HG1      VAL   6 -25.830 -12.612  22.241
   44   2HG1  VAL   6          2HG1      VAL   6 -26.443 -14.226  22.674
   45   3HG1  VAL   6          3HG1      VAL   6 -27.226 -13.296  21.373
   46   1HG2  VAL   6          1HG2      VAL   6 -28.116 -10.524  22.964
   47   2HG2  VAL   6          2HG2      VAL   6 -28.520 -11.631  21.631
   48   3HG2  VAL   6          3HG2      VAL   6 -29.548 -11.575  23.084
   49    H    SER   7           H        SER   7 -29.512 -13.331  21.644
   50    HA   SER   7           HA       SER   7 -29.602 -16.204  21.195
   51   1HB   SER   7          1HB       SER   7 -31.799 -15.979  20.096
   52   2HB   SER   7          2HB       SER   7 -31.886 -15.461  21.768
   53    HG   SER   7           HG       SER   7 -32.370 -13.459  21.155
   54    H    ALA   8           H        ALA   8 -29.766 -16.727  18.775
   55    HA   ALA   8           HA       ALA   8 -27.955 -14.979  17.370
   56   1HB   ALA   8          1HB       ALA   8 -28.925 -17.128  15.745
   57   2HB   ALA   8          2HB       ALA   8 -27.331 -16.959  16.517
   58   3HB   ALA   8          3HB       ALA   8 -28.660 -17.762  17.386
   59    H    GLU   9           H        GLU   9 -29.364 -13.081  17.212
   60    HA   GLU   9           HA       GLU   9 -31.872 -13.095  16.173
   61   1HB   GLU   9          1HB       GLU   9 -30.200 -11.173  17.071
   62   2HB   GLU   9          2HB       GLU   9 -30.033 -10.866  15.354
   63   1HG   GLU   9          1HG       GLU   9 -32.418 -10.501  15.091
   64   2HG   GLU   9          2HG       GLU   9 -32.759 -11.123  16.694
   65    HE2  GLU   9           HE2      GLU   9 -32.888  -8.447  15.263
   66    H    SER  10           H        SER  10 -32.512 -12.086  13.929
   67    HA   SER  10           HA       SER  10 -31.182 -13.729  11.970
   68   1HB   SER  10          1HB       SER  10 -33.876 -12.791  12.415
   69   2HB   SER  10          2HB       SER  10 -33.360 -12.229  10.837
   70    HG   SER  10           HG       SER  10 -33.920 -14.827  11.715
   71    H    SER  11           H        SER  11 -30.573 -12.812   9.820
   72    HA   SER  11           HA       SER  11 -28.856 -10.810   9.914
   73   1HB   SER  11          1HB       SER  11 -30.680 -11.700   7.659
   74   2HB   SER  11          2HB       SER  11 -29.504 -10.428   7.399
   75    HG   SER  11           HG       SER  11 -29.119 -13.156   7.546
   76    H    GLY  12           H        GLY  12 -28.905  -8.514   9.052
   77   1HA   GLY  12          1HA       GLY  12 -31.380  -7.186   9.945
   78   2HA   GLY  12          2HA       GLY  12 -29.773  -6.487   9.921
   79    H    CYS  13           H        CYS  13 -32.014  -8.137   7.567
   80    HA   CYS  13           HA       CYS  13 -32.322  -5.888   5.973
   81   1HB   CYS  13          1HB       CYS  13 -29.795  -6.552   5.597
   82   2HB   CYS  13          2HB       CYS  13 -30.474  -7.782   4.549
   83    HG   CYS  13           HG       CYS  13 -30.822  -4.497   4.495
   84    H    ASN  14           H        ASN  14 -34.344  -7.223   6.717
   85    HA   ASN  14           HA       ASN  14 -34.724  -9.537   5.021
   86   1HB   ASN  14          1HB       ASN  14 -35.708  -8.662   7.638
   87   2HB   ASN  14          2HB       ASN  14 -37.064  -9.031   6.591
   88   1HD2  ASN  14          1HD2      ASN  14 -35.487 -10.327   8.936
   89   2HD2  ASN  14          2HD2      ASN  14 -35.342 -11.991   8.479
   90    H    SER  15           H        SER  15 -34.675  -6.614   4.112
   91    HA   SER  15           HA       SER  15 -35.732  -5.318   2.729
   92   1HB   SER  15          1HB       SER  15 -36.784  -7.941   2.136
   93   2HB   SER  15          2HB       SER  15 -38.086  -6.782   1.959
   94    HG   SER  15           HG       SER  15 -36.214  -7.287   0.176
   95    H    HIS  16           H        HIS  16 -36.463  -3.641   4.051
   96    HA   HIS  16           HA       HIS  16 -39.126  -4.032   5.211
   97   1HB   HIS  16          1HB       HIS  16 -36.714  -2.522   6.204
   98   2HB   HIS  16          2HB       HIS  16 -38.326  -2.098   6.747
   99    HD1  HIS  16           HD1      HIS  16 -35.564  -4.069   7.775
  100    HD2  HIS  16           HD2      HIS  16 -39.710  -4.701   7.716
  101    HE1  HIS  16           HE1      HIS  16 -36.026  -5.938   9.450
  102    H    MET  17           H        MET  17 -39.446  -3.477   2.695
  103    HA   MET  17           HA       MET  17 -39.030  -0.831   1.933
  104   1HB   MET  17          1HB       MET  17 -40.065  -3.256   0.828
  105   2HB   MET  17          2HB       MET  17 -41.371  -2.098   0.674
  106   1HG   MET  17          1HG       MET  17 -39.100  -0.628  -0.109
  107   2HG   MET  17          2HG       MET  17 -38.806  -2.221  -0.778
  108   1HE   MET  17          1HE       MET  17 -41.670   0.951  -2.038
  109   2HE   MET  17          2HE       MET  17 -40.427   0.931  -0.764
  110   3HE   MET  17          3HE       MET  17 -39.947   0.870  -2.477
  111    HA   PRO  18           HA       PRO  18 -43.538  -0.228   3.289
  112   1HB   PRO  18          1HB       PRO  18 -44.791  -2.159   4.763
  113   2HB   PRO  18          2HB       PRO  18 -44.960  -2.020   3.024
  114   1HG   PRO  18          1HG       PRO  18 -43.390  -3.981   4.582
  115   2HG   PRO  18          2HG       PRO  18 -43.913  -4.072   2.912
  116   1HD   PRO  18          1HD       PRO  18 -41.276  -3.449   3.853
  117   2HD   PRO  18          2HD       PRO  18 -41.828  -3.427   2.189
  118    H    TYR  19           H        TYR  19 -44.867   0.095   5.480
  119    HA   TYR  19           HA       TYR  19 -43.353   1.583   7.107
  120   1HB   TYR  19          1HB       TYR  19 -45.515  -0.434   7.974
  121   2HB   TYR  19          2HB       TYR  19 -45.159   1.080   8.782
  122    HD1  TYR  19           HD1      TYR  19 -47.114  -0.529   6.241
  123    HD2  TYR  19           HD2      TYR  19 -45.584   3.267   7.489
  124    HE1  TYR  19           HE1      TYR  19 -48.856   0.650   4.814
  125    HE2  TYR  19           HE2      TYR  19 -47.332   4.433   6.057
  126    HH   TYR  19           HH       TYR  19 -49.913   3.389   5.161
  127    H    GLY  20           H        GLY  20 -42.138   1.360   9.033
  128   1HA   GLY  20          1HA       GLY  20 -41.599  -0.326  10.822
  129   2HA   GLY  20          2HA       GLY  20 -41.152  -1.387   9.502
  130    H    TYR  21           H        TYR  21 -40.409   1.613   8.303
  131    HA   TYR  21           HA       TYR  21 -37.621   1.223   8.701
  132   1HB   TYR  21          1HB       TYR  21 -39.303   2.404   6.854
  133   2HB   TYR  21          2HB       TYR  21 -38.876   3.828   7.782
  134    HD1  TYR  21           HD1      TYR  21 -37.766   1.422   5.307
  135    HD2  TYR  21           HD2      TYR  21 -36.459   4.528   7.944
  136    HE1  TYR  21           HE1      TYR  21 -35.604   1.643   3.987
  137    HE2  TYR  21           HE2      TYR  21 -34.302   4.739   6.615
  138    HH   TYR  21           HH       TYR  21 -33.605   2.522   3.946
  139    H    ALA  22           H        ALA  22 -40.163   3.143  10.265
  140    HA   ALA  22           HA       ALA  22 -38.556   5.109  11.409
  141   1HB   ALA  22          1HB       ALA  22 -41.171   3.807  12.251
  142   2HB   ALA  22          2HB       ALA  22 -40.469   5.218  13.079
  143   3HB   ALA  22          3HB       ALA  22 -40.948   5.337  11.368
  144    H    ALA  23           H        ALA  23 -39.299   1.728  12.352
  145    HA   ALA  23           HA       ALA  23 -38.024   1.977  14.895
  146   1HB   ALA  23          1HB       ALA  23 -38.451  -0.662  13.532
  147   2HB   ALA  23          2HB       ALA  23 -38.755  -0.189  15.220
  148   3HB   ALA  23          3HB       ALA  23 -39.882   0.314  13.938
  149    H    GLN  24           H        GLN  24 -36.863   2.028  11.737
  150    HA   GLN  24           HA       GLN  24 -34.586   0.369  12.213
  151   1HB   GLN  24          1HB       GLN  24 -35.902   1.070   9.945
  152   2HB   GLN  24          2HB       GLN  24 -34.649   2.294   9.915
  153   1HG   GLN  24          1HG       GLN  24 -33.426   0.653   8.874
  154   2HG   GLN  24          2HG       GLN  24 -33.115   0.117  10.513
  155   1HE2  GLN  24          1HE2      GLN  24 -35.683  -0.109   8.051
  156   2HE2  GLN  24          2HE2      GLN  24 -36.018  -1.798   8.238
  157    H    ALA  25           H        ALA  25 -35.499   3.349  13.361
  158    HA   ALA  25           HA       ALA  25 -33.294   4.980  12.866
  159   1HB   ALA  25          1HB       ALA  25 -35.147   6.078  13.744
  160   2HB   ALA  25          2HB       ALA  25 -35.461   4.808  14.950
  161   3HB   ALA  25          3HB       ALA  25 -34.112   5.945  15.186
  162    H    ARG  26           H        ARG  26 -33.671   2.086  14.779
  163    HA   ARG  26           HA       ARG  26 -31.666   2.684  16.647
  164   1HB   ARG  26          1HB       ARG  26 -33.586   0.721  16.400
  165   2HB   ARG  26          2HB       ARG  26 -32.159  -0.184  15.936
  166   1HG   ARG  26          1HG       ARG  26 -31.104   0.968  18.108
  167   2HG   ARG  26          2HG       ARG  26 -32.783   1.150  18.576
  168   1HD   ARG  26          1HD       ARG  26 -32.876  -1.452  17.824
  169   2HD   ARG  26          2HD       ARG  26 -31.171  -1.369  18.223
  170    HE   ARG  26           HE       ARG  26 -32.891  -0.182  20.277
  171   1HH1  ARG  26          2HH2      ARG  26 -31.427  -3.196  19.123
  172   2HH1  ARG  26          1HH2      ARG  26 -31.515  -3.975  20.668
  173   1HH2  ARG  26          1HH       ARG  26 -32.448  -2.788  22.530
  174    H    ALA  27           H        ALA  27 -31.761   1.336  13.356
  175    HA   ALA  27           HA       ALA  27 -29.182   0.166  13.420
  176   1HB   ALA  27          1HB       ALA  27 -29.643  -0.402  11.231
  177   2HB   ALA  27          2HB       ALA  27 -31.299  -0.094  11.807
  178   3HB   ALA  27          3HB       ALA  27 -30.433   1.153  10.878
  179    H    ARG  28           H        ARG  28 -30.487   3.425  12.855
  180    HA   ARG  28           HA       ARG  28 -28.318   4.453  11.503
  181   1HB   ARG  28          1HB       ARG  28 -30.754   5.421  12.260
  182   2HB   ARG  28          2HB       ARG  28 -29.762   6.219  13.465
  183   1HG   ARG  28          1HG       ARG  28 -28.275   6.633  11.155
  184   2HG   ARG  28          2HG       ARG  28 -29.913   6.684  10.534
  185   1HD   ARG  28          1HD       ARG  28 -30.404   8.297  12.552
  186   2HD   ARG  28          2HD       ARG  28 -28.662   8.450  12.671
  187    HE   ARG  28           HE       ARG  28 -29.042   8.930  10.013
  188   1HH1  ARG  28          2HH2      ARG  28 -30.705  10.221  12.863
  189   2HH1  ARG  28          1HH2      ARG  28 -31.091  11.731  12.107
  190   1HH2  ARG  28          1HH       ARG  28 -30.403  12.122   9.845
  191    H    GLU  29           H        GLU  29 -28.900   3.762  14.941
  192    HA   GLU  29           HA       GLU  29 -26.701   5.358  15.803
  193   1HB   GLU  29          1HB       GLU  29 -28.971   4.150  17.011
  194   2HB   GLU  29          2HB       GLU  29 -27.584   3.373  17.749
  195   1HG   GLU  29          1HG       GLU  29 -26.635   5.832  17.971
  196   2HG   GLU  29          2HG       GLU  29 -28.299   6.321  17.721
  197    HE2  GLU  29           HE2      GLU  29 -29.378   3.972  19.740
  198    H    ARG  30           H        ARG  30 -27.261   2.079  14.669
  199    HA   ARG  30           HA       ARG  30 -24.811   1.152  15.841
  200   1HB   ARG  30          1HB       ARG  30 -27.168  -0.065  14.468
  201   2HB   ARG  30          2HB       ARG  30 -25.645  -0.865  14.134
  202   1HG   ARG  30          1HG       ARG  30 -26.296  -0.160  17.000
  203   2HG   ARG  30          2HG       ARG  30 -27.120  -1.524  16.272
  204   1HD   ARG  30          1HD       ARG  30 -25.287  -2.809  16.646
  205   2HD   ARG  30          2HD       ARG  30 -24.370  -1.800  15.545
  206    HE   ARG  30           HE       ARG  30 -23.448  -0.625  17.382
  207   1HH1  ARG  30          2HH2      ARG  30 -26.014  -2.805  18.488
  208   2HH1  ARG  30          1HH2      ARG  30 -25.608  -2.634  20.163
  209   1HH2  ARG  30          1HH       ARG  30 -23.782  -1.214  20.789
  210    H    GLU  31           H        GLU  31 -26.117   2.377  12.784
  211    HA   GLU  31           HA       GLU  31 -24.090   1.333  11.148
  212   1HB   GLU  31          1HB       GLU  31 -26.465   2.321  10.562
  213   2HB   GLU  31          2HB       GLU  31 -25.631   3.860  10.506
  214   1HG   GLU  31          1HG       GLU  31 -24.088   3.037   8.786
  215   2HG   GLU  31          2HG       GLU  31 -24.713   1.407   8.938
  216    HE2  GLU  31           HE2      GLU  31 -27.487   1.601   8.305
  217    H    ARG  32           H        ARG  32 -24.324   4.060  13.348
  218    HA   ARG  32           HA       ARG  32 -22.508   5.755  12.183
  219   1HB   ARG  32          1HB       ARG  32 -23.955   5.593  14.618
  220   2HB   ARG  32          2HB       ARG  32 -22.278   5.699  15.116
  221   1HG   ARG  32          1HG       ARG  32 -22.230   7.635  13.231
  222   2HG   ARG  32          2HG       ARG  32 -23.942   7.700  13.599
  223   1HD   ARG  32          1HD       ARG  32 -22.946   9.261  15.109
  224   2HD   ARG  32          2HD       ARG  32 -23.267   7.847  16.092
  225    HE   ARG  32           HE       ARG  32 -20.638   7.610  14.969
  226   1HH1  ARG  32          2HH2      ARG  32 -22.396   9.494  17.401
  227   2HH1  ARG  32          1HH2      ARG  32 -20.988   9.797  18.363
  228   1HH2  ARG  32          1HH       ARG  32 -18.873   8.915  17.660
  229    H    LEU  33           H        LEU  33 -22.095   2.739  14.010
  230    HA   LEU  33           HA       LEU  33 -19.250   3.207  14.337
  231   1HB   LEU  33          1HB       LEU  33 -21.211   1.821  15.767
  232   2HB   LEU  33          2HB       LEU  33 -20.216   0.569  15.051
  233    HG   LEU  33           HG       LEU  33 -18.725   2.780  16.342
  234   1HD1  LEU  33          1HD1      LEU  33 -19.265   1.185  18.530
  235   2HD1  LEU  33          2HD1      LEU  33 -19.922   2.811  18.224
  236   3HD1  LEU  33          3HD1      LEU  33 -20.858   1.369  17.759
  237   1HD2  LEU  33          1HD2      LEU  33 -17.405   1.022  15.544
  238   2HD2  LEU  33          2HD2      LEU  33 -17.516   0.727  17.296
  239   3HD2  LEU  33          3HD2      LEU  33 -18.515  -0.223  16.169
  240    H    ALA  34           H        ALA  34 -21.440   2.007  11.986
  241    HA   ALA  34           HA       ALA  34 -19.646   0.014  10.935
  242   1HB   ALA  34          1HB       ALA  34 -22.213   1.234   9.838
  243   2HB   ALA  34          2HB       ALA  34 -21.385  -0.206   9.199
  244   3HB   ALA  34          3HB       ALA  34 -22.103  -0.241  10.827
  245    H    HIS  35           H        HIS  35 -19.361   3.260  11.152
  246    HA   HIS  35           HA       HIS  35 -18.676   3.727   8.379
  247   1HB   HIS  35          1HB       HIS  35 -19.838   5.529   9.301
  248   2HB   HIS  35          2HB       HIS  35 -18.977   5.447  10.825
  249    HD1  HIS  35           HD1      HIS  35 -18.580   6.662   7.259
  250    HD2  HIS  35           HD2      HIS  35 -16.581   6.894  10.939
  251    HE1  HIS  35           HE1      HIS  35 -16.756   8.423   6.971
  252    H    SER  36           H        SER  36 -17.247   2.469  11.215
  253    HA   SER  36           HA       SER  36 -14.636   3.499  10.583
  254   1HB   SER  36          1HB       SER  36 -15.940   2.207  12.885
  255   2HB   SER  36          2HB       SER  36 -14.354   1.532  12.567
  256    HG   SER  36           HG       SER  36 -13.448   3.315  13.322
  257    H    ARG  37           H        ARG  37 -16.691   0.779   9.867
  258    HA   ARG  37           HA       ARG  37 -14.464  -0.943   9.311
  259   1HB   ARG  37          1HB       ARG  37 -17.058  -1.431  10.121
  260   2HB   ARG  37          2HB       ARG  37 -17.208  -1.717   8.399
  261   1HG   ARG  37          1HG       ARG  37 -15.068  -3.197   8.644
  262   2HG   ARG  37          2HG       ARG  37 -15.363  -3.121  10.369
  263   1HD   ARG  37          1HD       ARG  37 -17.787  -3.793   8.788
  264   2HD   ARG  37          2HD       ARG  37 -16.501  -4.973   8.627
  265    HE   ARG  37           HE       ARG  37 -16.902  -4.211  11.405
  266   1HH1  ARG  37          2HH2      ARG  37 -18.176  -6.282   8.828
  267   2HH1  ARG  37          1HH2      ARG  37 -18.875  -7.427   9.923
  268   1HH2  ARG  37          1HH       ARG  37 -18.656  -7.077  12.284
  269    H    ALA  38           H        ALA  38 -15.381   1.716   7.818
  270    HA   ALA  38           HA       ALA  38 -15.867   0.668   5.162
  271   1HB   ALA  38          1HB       ALA  38 -16.811   2.686   4.833
  272   2HB   ALA  38          2HB       ALA  38 -16.553   2.998   6.567
  273   3HB   ALA  38          3HB       ALA  38 -15.342   3.533   5.376
  274    H    ALA  39           H        ALA  39 -13.444   2.888   6.732
  275    HA   ALA  39           HA       ALA  39 -11.659   2.788   4.583
  276   1HB   ALA  39          1HB       ALA  39 -11.930   4.202   6.940
  277   2HB   ALA  39          2HB       ALA  39 -10.494   3.202   7.263
  278   3HB   ALA  39          3HB       ALA  39 -10.525   4.284   5.850
  279    H    ALA  40           H        ALA  40 -11.041   0.790   3.810
  280    HA   ALA  40           HA       ALA  40 -10.286  -1.256   5.721
  281   1HB   ALA  40          1HB       ALA  40 -10.796  -1.099   2.752
  282   2HB   ALA  40          2HB       ALA  40  -9.883  -2.472   3.422
  283   3HB   ALA  40          3HB       ALA  40 -11.546  -2.155   3.973
  284    H    ALA  41           H        ALA  41  -8.789   0.218   2.746
  285    HA   ALA  41           HA       ALA  41  -6.701   0.825   2.317
  286   1HB   ALA  41          1HB       ALA  41  -6.950   1.199   5.167
  287   2HB   ALA  41          2HB       ALA  41  -5.315   0.603   4.795
  288   3HB   ALA  41          3HB       ALA  41  -5.925   2.080   4.010
  289    H    ALA  42           H        ALA  42  -7.172  -1.558   1.431
  290    HA   ALA  42           HA       ALA  42  -5.034  -3.268   2.509
  291   1HB   ALA  42          1HB       ALA  42  -7.786  -3.870   1.416
  292   2HB   ALA  42          2HB       ALA  42  -6.495  -5.092   1.336
  293   3HB   ALA  42          3HB       ALA  42  -7.018  -4.452   2.912
  294    H    ALA  43           H        ALA  43  -6.992  -3.051  -0.545
  295    HA   ALA  43           HA       ALA  43  -5.035  -3.927  -2.233
  296   1HB   ALA  43          1HB       ALA  43  -6.419  -2.116  -3.772
  297   2HB   ALA  43          2HB       ALA  43  -6.986  -3.757  -3.380
  298   3HB   ALA  43          3HB       ALA  43  -7.544  -2.369  -2.416
  299    H    VAL  44           H        VAL  44  -5.259  -0.886  -0.500
  300    HA   VAL  44           HA       VAL  44  -3.287   0.349  -2.251
  301    HB   VAL  44           HB       VAL  44  -5.339   1.224  -0.364
  302   1HG1  VAL  44          1HG1      VAL  44  -2.550   2.364  -0.175
  303   2HG1  VAL  44          2HG1      VAL  44  -3.983   3.366   0.156
  304   3HG1  VAL  44          3HG1      VAL  44  -3.672   1.910   1.131
  305   1HG2  VAL  44          1HG2      VAL  44  -5.529   1.802  -2.671
  306   2HG2  VAL  44          2HG2      VAL  44  -5.146   3.304  -1.796
  307   3HG2  VAL  44          3HG2      VAL  44  -3.876   2.459  -2.714
  308    H    ALA  45           H        ALA  45  -3.680  -1.219   0.913
  309    HA   ALA  45           HA       ALA  45  -1.515  -0.331   2.286
  310   1HB   ALA  45          1HB       ALA  45  -3.370  -2.181   2.732
  311   2HB   ALA  45          2HB       ALA  45  -2.078  -3.283   2.201
  312   3HB   ALA  45          3HB       ALA  45  -1.817  -2.216   3.600
  313    H    ALA  46           H        ALA  46  -1.546  -3.109  -0.065
  314    HA   ALA  46           HA       ALA  46   1.250  -3.428   0.015
  315   1HB   ALA  46          1HB       ALA  46  -0.104  -4.285  -2.452
  316   2HB   ALA  46          2HB       ALA  46   0.757  -5.249  -1.229
  317   3HB   ALA  46          3HB       ALA  46  -0.948  -4.809  -0.975
  318    H    ALA  47           H        ALA  47  -0.977  -1.881  -2.407
  319    HA   ALA  47           HA       ALA  47   1.039  -0.997  -4.105
  320   1HB   ALA  47          1HB       ALA  47  -0.863   0.783  -4.610
  321   2HB   ALA  47          2HB       ALA  47  -1.089  -0.933  -5.027
  322   3HB   ALA  47          3HB       ALA  47  -1.827  -0.272  -3.548
  323    H    THR  48           H        THR  48   0.906   1.713  -4.456
  324    HA   THR  48           HA       THR  48   2.034   3.520  -3.768
  325    HB   THR  48           HB       THR  48   0.441   3.216  -1.186
  326    HG1  THR  48           HG1      THR  48  -1.277   3.023  -2.565
  327   1HG2  THR  48          1HG2      THR  48  -0.084   5.665  -1.839
  328   2HG2  THR  48          2HG2      THR  48   1.589   5.347  -1.318
  329   3HG2  THR  48          3HG2      THR  48   1.212   5.513  -3.050
  330    H    ALA  49           H        ALA  49   4.152   2.703  -3.713
  331    HA   ALA  49           HA       ALA  49   5.281   1.204  -1.738
  332   1HB   ALA  49          1HB       ALA  49   6.704   3.525  -3.071
  333   2HB   ALA  49          2HB       ALA  49   7.358   1.933  -2.614
  334   3HB   ALA  49          3HB       ALA  49   6.224   2.072  -3.980
  335    H    ALA  50           H        ALA  50   4.165   4.540  -1.623
  336    HA   ALA  50           HA       ALA  50   5.705   5.137   0.747
  337   1HB   ALA  50          1HB       ALA  50   4.551   6.612  -1.329
  338   2HB   ALA  50          2HB       ALA  50   3.510   6.956   0.073
  339   3HB   ALA  50          3HB       ALA  50   5.260   7.270   0.165
  340    H    VAL  51           H        VAL  51   4.374   2.829   1.295
  341    HA   VAL  51           HA       VAL  51   2.540   3.723   3.333
  342    HB   VAL  51           HB       VAL  51   1.707   1.957   1.034
  343   1HG1  VAL  51          1HG1      VAL  51  -0.449   2.166   2.822
  344   2HG1  VAL  51          2HG1      VAL  51   0.509   0.713   2.450
  345   3HG1  VAL  51          3HG1      VAL  51   0.957   1.746   3.829
  346   1HG2  VAL  51          1HG2      VAL  51  -0.319   3.579   1.215
  347   2HG2  VAL  51          2HG2      VAL  51   0.795   4.603   2.152
  348   3HG2  VAL  51          3HG2      VAL  51   1.191   4.161   0.474
  349    H    GLU  52           H        GLU  52   4.842   2.985   4.151
  350    HA   GLU  52           HA       GLU  52   4.768   0.090   4.469
  351   1HB   GLU  52          1HB       GLU  52   6.849   1.637   3.588
  352   2HB   GLU  52          2HB       GLU  52   7.200   1.607   5.305
  353   1HG   GLU  52          1HG       GLU  52   8.309  -0.328   4.606
  354   2HG   GLU  52          2HG       GLU  52   6.762  -0.998   5.085
  355    HE2  GLU  52           HE2      GLU  52   6.014  -2.259   2.194
  356    H    GLY  53           H        GLY  53   5.697  -0.666   6.696
  357   1HA   GLY  53          1HA       GLY  53   4.624   1.119   8.800
  358   2HA   GLY  53          2HA       GLY  53   4.425  -0.622   8.793
  359    H    THR  54           H        THR  54   7.198   1.686   8.274
  360    HA   THR  54           HA       THR  54   9.244   1.748   9.140
  361    HB   THR  54           HB       THR  54   7.792   0.356  11.448
  362    HG1  THR  54           HG1      THR  54   7.287   2.487  11.847
  363   1HG2  THR  54          1HG2      THR  54  10.066   0.036  12.055
  364   2HG2  THR  54          2HG2      THR  54  10.599   1.488  11.174
  365   3HG2  THR  54          3HG2      THR  54   9.726   1.653  12.717
  366    H    GLY  55           H        GLY  55   9.296   0.101   7.162
  367   1HA   GLY  55          1HA       GLY  55  10.040  -1.871   6.313
  368   2HA   GLY  55          2HA       GLY  55  11.366  -1.564   7.417
  369    H    GLY  56           H        GLY  56  11.721  -3.844   7.754
  370   1HA   GLY  56          1HA       GLY  56  10.068  -4.938   9.859
  371   2HA   GLY  56          2HA       GLY  56   9.976  -5.812   8.343
  372    H    SER  57           H        SER  57  12.414  -5.946   7.258
  373    HA   SER  57           HA       SER  57  14.496  -6.225   9.103
  374   1HB   SER  57          1HB       SER  57  12.804  -8.618   8.558
  375   2HB   SER  57          2HB       SER  57  14.529  -8.886   8.410
  376    HG   SER  57           HG       SER  57  13.621  -7.451  10.699
  377    H    GLY  58           H        GLY  58  16.490  -7.210   7.983
  378   1HA   GLY  58          1HA       GLY  58  16.708  -8.014   5.406
  379   2HA   GLY  58          2HA       GLY  58  16.559  -6.275   5.256
  380    H    GLY  59           H        GLY  59  18.916  -7.573   4.448
  381   1HA   GLY  59          1HA       GLY  59  20.959  -6.139   5.312
  382   2HA   GLY  59          2HA       GLY  59  20.846  -7.299   6.621
  383    H    GLY  60           H        GLY  60  23.141  -7.145   4.965
  384   1HA   GLY  60          1HA       GLY  60  22.928  -9.689   3.469
  385   2HA   GLY  60          2HA       GLY  60  23.845  -8.315   2.885
  386    HA   PRO  61           HA       PRO  61  26.070 -10.247   6.631
  387   1HB   PRO  61          1HB       PRO  61  25.470 -12.845   7.231
  388   2HB   PRO  61          2HB       PRO  61  24.782 -11.480   8.088
  389   1HG   PRO  61          1HG       PRO  61  23.513 -13.236   6.077
  390   2HG   PRO  61          2HG       PRO  61  22.751 -12.165   7.236
  391   1HD   PRO  61          1HD       PRO  61  23.091 -11.691   4.428
  392   2HD   PRO  61          2HD       PRO  61  22.435 -10.574   5.607
  393    H    HIS  62           H        HIS  62  27.949 -11.767   6.868
  394    HA   HIS  62           HA       HIS  62  28.417 -13.390   4.574
  395   1HB   HIS  62          1HB       HIS  62  28.874 -10.939   3.873
  396   2HB   HIS  62          2HB       HIS  62  30.296 -11.052   4.891
  397    HD1  HIS  62           HD1      HIS  62  32.332 -11.621   3.581
  398    HD2  HIS  62           HD2      HIS  62  28.893 -13.411   1.979
  399    HE1  HIS  62           HE1      HIS  62  33.097 -12.929   1.528
  400    H    HIS  63           H        HIS  63  28.381 -14.732   6.631
  401    HA   HIS  63           HA       HIS  63  30.033 -14.523   8.721
  402   1HB   HIS  63          1HB       HIS  63  29.739 -17.172   7.318
  403   2HB   HIS  63          2HB       HIS  63  29.796 -16.838   9.038
  404    HD1  HIS  63           HD1      HIS  63  27.456 -17.959   6.715
  405    HD2  HIS  63           HD2      HIS  63  27.348 -14.889   9.571
  406    HE1  HIS  63           HE1      HIS  63  24.989 -17.494   7.172
  407    H    HIS  64           H        HIS  64  32.204 -14.608   9.174
  408    HA   HIS  64           HA       HIS  64  34.062 -16.006   7.686
  409   1HB   HIS  64          1HB       HIS  64  33.253 -13.847   6.209
  410   2HB   HIS  64          2HB       HIS  64  34.628 -13.174   7.062
  411    HD1  HIS  64           HD1      HIS  64  33.722 -15.892   4.582
  412    HD2  HIS  64           HD2      HIS  64  37.137 -14.098   6.230
  413    HE1  HIS  64           HE1      HIS  64  35.703 -16.728   3.208
  414    H    HIS  65           H        HIS  65  34.601 -16.518   9.876
  415    HA   HIS  65           HA       HIS  65  34.971 -14.917  11.961
  416   1HB   HIS  65          1HB       HIS  65  36.728 -17.206  11.048
  417   2HB   HIS  65          2HB       HIS  65  36.855 -16.468  12.632
  418    HD1  HIS  65           HD1      HIS  65  36.194 -18.897  13.563
  419    HD2  HIS  65           HD2      HIS  65  33.196 -16.878  11.435
  420    HE1  HIS  65           HE1      HIS  65  34.006 -20.093  14.103
  421    H    GLN  66           H        GLN  66  35.832 -12.901  12.060
  422    HA   GLN  66           HA       GLN  66  38.550 -12.533  11.722
  423   1HB   GLN  66          1HB       GLN  66  37.533 -12.637   9.243
  424   2HB   GLN  66          2HB       GLN  66  37.126 -10.966   9.578
  425   1HG   GLN  66          1HG       GLN  66  39.276 -10.315   9.265
  426   2HG   GLN  66          2HG       GLN  66  39.846 -11.459  10.464
  427   1HE2  GLN  66          1HE2      GLN  66  40.110 -13.707   9.807
  428   2HE2  GLN  66          2HE2      GLN  66  40.633 -14.077   8.197
  429    H    THR  67           H        THR  67  38.954  -9.906  11.561
  430    HA   THR  67           HA       THR  67  36.807  -8.381  12.706
  431    HB   THR  67           HB       THR  67  39.285  -8.894  14.421
  432    HG1  THR  67           HG1      THR  67  36.553  -9.947  14.589
  433   1HG2  THR  67          1HG2      THR  67  36.474  -7.964  15.183
  434   2HG2  THR  67          2HG2      THR  67  37.928  -7.963  16.209
  435   3HG2  THR  67          3HG2      THR  67  37.801  -6.827  14.844
  436    H    ARG  68           H        ARG  68  37.437  -6.090  13.050
  437    HA   ARG  68           HA       ARG  68  38.810  -5.203  10.841
  438   1HB   ARG  68          1HB       ARG  68  38.764  -2.947  12.097
  439   2HB   ARG  68          2HB       ARG  68  37.212  -3.726  11.858
  440   1HG   ARG  68          1HG       ARG  68  36.954  -4.239  14.107
  441   2HG   ARG  68          2HG       ARG  68  38.672  -4.468  14.368
  442   1HD   ARG  68          1HD       ARG  68  39.067  -2.054  14.399
  443   2HD   ARG  68          2HD       ARG  68  37.428  -1.723  13.874
  444    HE   ARG  68           HE       ARG  68  36.628  -2.192  16.057
  445   1HH1  ARG  68          2HH2      ARG  68  40.075  -2.975  15.809
  446   2HH1  ARG  68          1HH2      ARG  68  40.286  -3.143  17.520
  447   1HH2  ARG  68          1HH       ARG  68  38.411  -2.809  18.973
  448    H    GLY  69           H        GLY  69  40.952  -4.449  10.510
  449   1HA   GLY  69          1HA       GLY  69  42.907  -3.547  11.878
  450   2HA   GLY  69          2HA       GLY  69  42.840  -5.104  12.679
  451    H    ALA  70           H        ALA  70  42.975  -3.657   9.350
  452    HA   ALA  70           HA       ALA  70  44.189  -6.073   8.334
  453   1HB   ALA  70          1HB       ALA  70  43.469  -5.299   6.333
  454   2HB   ALA  70          2HB       ALA  70  42.546  -4.110   7.283
  455   3HB   ALA  70          3HB       ALA  70  44.139  -3.675   6.619
  456    H    TYR  71           H        TYR  71  45.991  -5.785  10.037
  457    HA   TYR  71           HA       TYR  71  48.243  -4.656   8.674
  458   1HB   TYR  71          1HB       TYR  71  46.710  -3.197  10.693
  459   2HB   TYR  71          2HB       TYR  71  48.252  -3.628  11.406
  460    HD1  TYR  71           HD1      TYR  71  50.394  -2.945  10.159
  461    HD2  TYR  71           HD2      TYR  71  46.533  -1.369   9.207
  462    HE1  TYR  71           HE1      TYR  71  51.483  -0.972   8.982
  463    HE2  TYR  71           HE2      TYR  71  47.634   0.599   8.033
  464    HH   TYR  71           HH       TYR  71  51.066   0.662   7.456
  465    H    SER  72           H        SER  72  50.287  -4.923  10.176
  466    HA   SER  72           HA       SER  72  51.607  -6.305  11.203
  467   1HB   SER  72          1HB       SER  72  49.160  -6.944  12.910
  468   2HB   SER  72          2HB       SER  72  50.805  -7.383  13.326
  469    HG   SER  72           HG       SER  72  49.527  -5.032  13.775
  470    H    SER  73           H        SER  73  52.218  -7.913   9.764
  471    HA   SER  73           HA       SER  73  50.748 -10.382   9.978
  472   1HB   SER  73          1HB       SER  73  49.655  -9.587   8.036
  473   2HB   SER  73          2HB       SER  73  51.096  -8.803   7.420
  474    HG   SER  73           HG       SER  73  52.018 -10.933   7.032
  475    H    HIS  74           H        HIS  74  52.567 -11.285  11.050
  476    HA   HIS  74           HA       HIS  74  54.514 -12.278  11.233
  477   1HB   HIS  74          1HB       HIS  74  53.770 -13.271   9.031
  478   2HB   HIS  74          2HB       HIS  74  54.776 -12.086   8.222
  479    HD1  HIS  74           HD1      HIS  74  56.993 -13.011   7.577
  480    HD2  HIS  74           HD2      HIS  74  55.540 -14.753  11.105
  481    HE1  HIS  74           HE1      HIS  74  58.737 -14.729   8.297
  482    H    ASP  75           H        ASP  75  57.007 -11.991  10.758
  483    HA   ASP  75           HA       ASP  75  57.506  -9.167  10.277
  484   1HB   ASP  75          1HB       ASP  75  58.269 -10.868  12.655
  485   2HB   ASP  75          2HB       ASP  75  59.392  -9.627  12.136
  486    HD2  ASP  75           HD2      ASP  75  57.865  -7.084  13.453
  Start of MODEL   25
    1    H    MET   1           H        MET   1 -38.604  19.586  44.947
    2    HA   MET   1           HA       MET   1 -40.418  21.321  43.918
    3   1HB   MET   1          1HB       MET   1 -39.416  20.710  41.719
    4   2HB   MET   1          2HB       MET   1 -38.167  20.770  42.947
    5   1HG   MET   1          1HG       MET   1 -39.019  18.120  43.118
    6   2HG   MET   1          2HG       MET   1 -39.179  18.445  41.404
    7   1HE   MET   1          1HE       MET   1 -36.784  19.048  39.780
    8   2HE   MET   1          2HE       MET   1 -35.928  17.555  40.234
    9   3HE   MET   1          3HE       MET   1 -37.705  17.569  40.142
   10    H    GLU   2           H        GLU   2 -42.111  21.100  42.256
   11    HA   GLU   2           HA       GLU   2 -44.108  19.477  42.893
   12   1HB   GLU   2          1HB       GLU   2 -43.345  21.034  40.526
   13   2HB   GLU   2          2HB       GLU   2 -44.334  19.655  40.089
   14   1HG   GLU   2          1HG       GLU   2 -46.103  20.334  41.627
   15   2HG   GLU   2          2HG       GLU   2 -45.087  21.572  42.340
   16    HE2  GLU   2           HE2      GLU   2 -47.434  21.135  40.159
   17    H    VAL   3           H        VAL   3 -45.042  17.473  42.015
   18    HA   VAL   3           HA       VAL   3 -42.967  15.705  40.915
   19    HB   VAL   3           HB       VAL   3 -45.241  14.980  42.771
   20   1HG1  VAL   3          1HG1      VAL   3 -44.086  12.827  42.979
   21   2HG1  VAL   3          2HG1      VAL   3 -44.526  13.155  41.286
   22   3HG1  VAL   3          3HG1      VAL   3 -42.844  13.371  41.826
   23   1HG2  VAL   3          1HG2      VAL   3 -42.991  16.393  43.489
   24   2HG2  VAL   3          2HG2      VAL   3 -43.949  15.355  44.573
   25   3HG2  VAL   3          3HG2      VAL   3 -42.491  14.710  43.781
   26    H    ALA   4           H        ALA   4 -43.823  13.921  39.534
   27    HA   ALA   4           HA       ALA   4 -45.688  14.986  37.675
   28   1HB   ALA   4          1HB       ALA   4 -43.611  13.183  37.606
   29   2HB   ALA   4          2HB       ALA   4 -45.026  12.105  37.534
   30   3HB   ALA   4          3HB       ALA   4 -44.822  13.387  36.316
   31    H    MET   5           H        MET   5 -47.642  15.337  38.871
   32    HA   MET   5           HA       MET   5 -48.877  12.882  39.831
   33   1HB   MET   5          1HB       MET   5 -48.646  14.864  41.407
   34   2HB   MET   5          2HB       MET   5 -49.627  15.820  40.313
   35   1HG   MET   5          1HG       MET   5 -51.414  13.911  40.582
   36   2HG   MET   5          2HG       MET   5 -50.472  13.416  41.973
   37   1HE   MET   5          1HE       MET   5 -50.856  14.245  44.206
   38   2HE   MET   5          2HE       MET   5 -49.607  15.438  43.776
   39   3HE   MET   5          3HE       MET   5 -51.081  15.959  44.627
   40    H    VAL   6           H        VAL   6 -50.301  11.922  38.451
   41    HA   VAL   6           HA       VAL   6 -51.191  13.161  36.112
   42    HB   VAL   6           HB       VAL   6 -52.356  10.783  37.572
   43   1HG1  VAL   6          1HG1      VAL   6 -52.820  10.074  35.139
   44   2HG1  VAL   6          2HG1      VAL   6 -53.857  11.335  35.849
   45   3HG1  VAL   6          3HG1      VAL   6 -52.550  11.785  34.728
   46   1HG2  VAL   6          1HG2      VAL   6 -50.475  10.289  35.359
   47   2HG2  VAL   6          2HG2      VAL   6 -49.735  11.043  36.791
   48   3HG2  VAL   6          3HG2      VAL   6 -50.612   9.502  36.949
   49    H    SER   7           H        SER   7 -53.650  13.318  35.564
   50    HA   SER   7           HA       SER   7 -55.030  14.453  37.861
   51   1HB   SER   7          1HB       SER   7 -55.009  15.674  35.066
   52   2HB   SER   7          2HB       SER   7 -55.844  16.314  36.468
   53    HG   SER   7           HG       SER   7 -53.337  16.045  37.289
   54    H    ALA   8           H        ALA   8 -57.433  15.173  36.537
   55    HA   ALA   8           HA       ALA   8 -58.698  12.686  36.342
   56   1HB   ALA   8          1HB       ALA   8 -59.662  15.378  35.302
   57   2HB   ALA   8          2HB       ALA   8 -60.661  13.994  35.806
   58   3HB   ALA   8          3HB       ALA   8 -59.714  14.895  37.014
   59    H    GLU   9           H        GLU   9 -60.140  14.158  33.794
   60    HA   GLU   9           HA       GLU   9 -59.545  12.283  31.975
   61   1HB   GLU   9          1HB       GLU   9 -60.717  14.984  31.937
   62   2HB   GLU   9          2HB       GLU   9 -59.965  14.573  30.409
   63   1HG   GLU   9          1HG       GLU   9 -62.221  13.781  30.241
   64   2HG   GLU   9          2HG       GLU   9 -61.242  12.348  30.491
   65    HE2  GLU   9           HE2      GLU   9 -63.770  11.792  32.843
   66    H    SER  10           H        SER  10 -58.361  12.561  29.784
   67    HA   SER  10           HA       SER  10 -56.525  12.814  28.657
   68   1HB   SER  10          1HB       SER  10 -56.906  15.373  29.883
   69   2HB   SER  10          2HB       SER  10 -55.190  15.028  29.973
   70    HG   SER  10           HG       SER  10 -55.045  14.892  27.748
   71    H    SER  11           H        SER  11 -55.202  11.067  29.088
   72    HA   SER  11           HA       SER  11 -53.955  10.893  31.659
   73   1HB   SER  11          1HB       SER  11 -53.663   9.057  29.241
   74   2HB   SER  11          2HB       SER  11 -53.186   8.685  30.886
   75    HG   SER  11           HG       SER  11 -55.839   8.974  29.806
   76    H    GLY  12           H        GLY  12 -51.660  10.929  32.037
   77   1HA   GLY  12          1HA       GLY  12 -50.147  12.815  30.828
   78   2HA   GLY  12          2HA       GLY  12 -49.488  11.402  31.629
   79    H    CYS  13           H        CYS  13 -49.316   9.334  30.292
   80    HA   CYS  13           HA       CYS  13 -49.473   9.549  27.481
   81   1HB   CYS  13          1HB       CYS  13 -47.426  10.932  27.883
   82   2HB   CYS  13          2HB       CYS  13 -46.657   9.539  28.615
   83    HG   CYS  13           HG       CYS  13 -48.153   8.784  25.896
   84    H    ASN  14           H        ASN  14 -50.798   7.702  28.593
   85    HA   ASN  14           HA       ASN  14 -49.127   5.487  29.363
   86   1HB   ASN  14          1HB       ASN  14 -51.888   6.343  29.835
   87   2HB   ASN  14          2HB       ASN  14 -51.874   4.693  29.243
   88   1HD2  ASN  14          1HD2      ASN  14 -51.015   3.061  30.441
   89   2HD2  ASN  14          2HD2      ASN  14 -50.510   3.218  32.091
   90    H    SER  15           H        SER  15 -49.308   6.621  26.525
   91    HA   SER  15           HA       SER  15 -49.708   4.104  25.245
   92   1HB   SER  15          1HB       SER  15 -51.898   5.845  25.298
   93   2HB   SER  15          2HB       SER  15 -51.162   6.188  23.745
   94    HG   SER  15           HG       SER  15 -51.383   4.016  23.126
   95    H    HIS  16           H        HIS  16 -47.390   4.411  24.917
   96    HA   HIS  16           HA       HIS  16 -46.857   6.378  22.815
   97   1HB   HIS  16          1HB       HIS  16 -45.893   6.599  25.366
   98   2HB   HIS  16          2HB       HIS  16 -44.604   5.692  24.601
   99    HD1  HIS  16           HD1      HIS  16 -43.021   7.780  24.804
  100    HD2  HIS  16           HD2      HIS  16 -46.401   8.370  22.390
  101    HE1  HIS  16           HE1      HIS  16 -42.601   9.932  23.499
  102    H    MET  17           H        MET  17 -47.619   4.201  21.716
  103    HA   MET  17           HA       MET  17 -46.086   1.959  21.774
  104   1HB   MET  17          1HB       MET  17 -47.882   3.333  19.786
  105   2HB   MET  17          2HB       MET  17 -46.859   2.070  19.130
  106   1HG   MET  17          1HG       MET  17 -47.717   0.515  20.959
  107   2HG   MET  17          2HG       MET  17 -48.834   1.776  21.444
  108   1HE   MET  17          1HE       MET  17 -47.410  -0.357  18.914
  109   2HE   MET  17          2HE       MET  17 -48.852  -1.261  18.393
  110   3HE   MET  17          3HE       MET  17 -48.237   0.083  17.401
  111    HA   PRO  18           HA       PRO  18 -42.401   2.917  19.693
  112   1HB   PRO  18          1HB       PRO  18 -41.716   0.528  18.555
  113   2HB   PRO  18          2HB       PRO  18 -41.452   0.894  20.248
  114   1HG   PRO  18          1HG       PRO  18 -43.512  -0.838  19.026
  115   2HG   PRO  18          2HG       PRO  18 -42.964  -0.791  20.690
  116   1HD   PRO  18          1HD       PRO  18 -45.403   0.309  19.655
  117   2HD   PRO  18          2HD       PRO  18 -44.799   0.456  21.293
  118    H    TYR  19           H        TYR  19 -41.212   3.211  17.661
  119    HA   TYR  19           HA       TYR  19 -43.020   4.115  15.701
  120   1HB   TYR  19          1HB       TYR  19 -40.014   3.463  15.835
  121   2HB   TYR  19          2HB       TYR  19 -40.725   4.234  14.431
  122    HD1  TYR  19           HD1      TYR  19 -42.296   6.371  15.137
  123    HD2  TYR  19           HD2      TYR  19 -38.943   4.867  17.328
  124    HE1  TYR  19           HE1      TYR  19 -41.987   8.643  16.237
  125    HE2  TYR  19           HE2      TYR  19 -38.645   7.144  18.420
  126    HH   TYR  19           HH       TYR  19 -39.408   9.695  17.499
  127    H    GLY  20           H        GLY  20 -43.383   3.356  13.540
  128   1HA   GLY  20          1HA       GLY  20 -43.370   0.453  13.363
  129   2HA   GLY  20          2HA       GLY  20 -44.181   1.589  12.303
  130    H    TYR  21           H        TYR  21 -43.254   2.109  10.344
  131    HA   TYR  21           HA       TYR  21 -41.105   0.643   9.393
  132   1HB   TYR  21          1HB       TYR  21 -41.280   2.383   7.535
  133   2HB   TYR  21          2HB       TYR  21 -42.852   1.775   8.015
  134    HD1  TYR  21           HD1      TYR  21 -40.571   4.670   8.153
  135    HD2  TYR  21           HD2      TYR  21 -44.468   3.202   9.134
  136    HE1  TYR  21           HE1      TYR  21 -41.361   7.045   8.599
  137    HE2  TYR  21           HE2      TYR  21 -45.245   5.582   9.576
  138    HH   TYR  21           HH       TYR  21 -44.717   7.669   9.601
  139    H    ALA  22           H        ALA  22 -41.148   3.457  11.444
  140    HA   ALA  22           HA       ALA  22 -38.473   4.258  10.638
  141   1HB   ALA  22          1HB       ALA  22 -40.422   5.846  11.195
  142   2HB   ALA  22          2HB       ALA  22 -40.160   5.385  12.894
  143   3HB   ALA  22          3HB       ALA  22 -38.859   6.182  11.976
  144    H    ALA  23           H        ALA  23 -38.854   1.551  11.688
  145    HA   ALA  23           HA       ALA  23 -37.853   1.715  14.408
  146   1HB   ALA  23          1HB       ALA  23 -38.073  -0.766  14.297
  147   2HB   ALA  23          2HB       ALA  23 -39.589   0.072  13.885
  148   3HB   ALA  23          3HB       ALA  23 -38.577  -0.623  12.596
  149    H    GLN  24           H        GLN  24 -36.616   1.963  11.278
  150    HA   GLN  24           HA       GLN  24 -34.287   0.381  11.726
  151   1HB   GLN  24          1HB       GLN  24 -35.432   2.010   9.509
  152   2HB   GLN  24          2HB       GLN  24 -33.681   1.951   9.553
  153   1HG   GLN  24          1HG       GLN  24 -34.029   0.015   8.345
  154   2HG   GLN  24          2HG       GLN  24 -34.152  -0.680   9.949
  155   1HE2  GLN  24          1HE2      GLN  24 -35.322  -2.148   8.236
  156   2HE2  GLN  24          2HE2      GLN  24 -37.046  -1.987   8.184
  157    H    ALA  25           H        ALA  25 -35.343   3.240  13.041
  158    HA   ALA  25           HA       ALA  25 -33.181   4.975  12.718
  159   1HB   ALA  25          1HB       ALA  25 -34.894   4.747  15.209
  160   2HB   ALA  25          2HB       ALA  25 -34.187   6.207  14.475
  161   3HB   ALA  25          3HB       ALA  25 -35.544   5.377  13.677
  162    H    ARG  26           H        ARG  26 -33.522   1.956  14.434
  163    HA   ARG  26           HA       ARG  26 -31.606   2.503  16.408
  164   1HB   ARG  26          1HB       ARG  26 -33.452   0.517  16.015
  165   2HB   ARG  26          2HB       ARG  26 -32.011  -0.325  15.480
  166   1HG   ARG  26          1HG       ARG  26 -30.877   0.266  17.642
  167   2HG   ARG  26          2HG       ARG  26 -32.337   1.073  18.178
  168   1HD   ARG  26          1HD       ARG  26 -33.577  -1.150  17.831
  169   2HD   ARG  26          2HD       ARG  26 -32.016  -1.899  17.557
  170    HE   ARG  26           HE       ARG  26 -31.614  -0.598  19.946
  171   1HH1  ARG  26          2HH2      ARG  26 -34.149  -2.810  18.835
  172   2HH1  ARG  26          1HH2      ARG  26 -34.462  -3.443  20.416
  173   1HH2  ARG  26          1HH       ARG  26 -33.203  -2.619  22.281
  174    H    ALA  27           H        ALA  27 -31.541   1.360  13.041
  175    HA   ALA  27           HA       ALA  27 -28.926   0.272  13.129
  176   1HB   ALA  27          1HB       ALA  27 -30.420  -0.469  11.419
  177   2HB   ALA  27          2HB       ALA  27 -30.790   1.198  10.917
  178   3HB   ALA  27          3HB       ALA  27 -29.182   0.507  10.593
  179    H    ARG  28           H        ARG  28 -30.323   3.514  12.714
  180    HA   ARG  28           HA       ARG  28 -28.146   4.693  11.505
  181   1HB   ARG  28          1HB       ARG  28 -30.661   5.511  12.385
  182   2HB   ARG  28          2HB       ARG  28 -29.603   6.388  13.472
  183   1HG   ARG  28          1HG       ARG  28 -29.120   7.875  11.834
  184   2HG   ARG  28          2HG       ARG  28 -28.459   6.591  10.842
  185   1HD   ARG  28          1HD       ARG  28 -30.967   6.055  10.247
  186   2HD   ARG  28          2HD       ARG  28 -31.309   7.650  10.887
  187    HE   ARG  28           HE       ARG  28 -30.195   8.630   9.048
  188   1HH1  ARG  28          2HH2      ARG  28 -29.644   5.130   9.069
  189   2HH1  ARG  28          1HH2      ARG  28 -28.962   5.103   7.477
  190   1HH2  ARG  28          1HH       ARG  28 -28.767   7.151   6.248
  191    H    GLU  29           H        GLU  29 -28.822   3.774  14.872
  192    HA   GLU  29           HA       GLU  29 -26.711   5.386  15.908
  193   1HB   GLU  29          1HB       GLU  29 -28.988   4.274  16.990
  194   2HB   GLU  29          2HB       GLU  29 -27.771   3.155  17.569
  195   1HG   GLU  29          1HG       GLU  29 -26.798   4.712  18.958
  196   2HG   GLU  29          2HG       GLU  29 -26.997   6.019  17.809
  197    HE2  GLU  29           HE2      GLU  29 -29.388   6.106  20.765
  198    H    ARG  30           H        ARG  30 -27.117   2.166  14.561
  199    HA   ARG  30           HA       ARG  30 -24.678   1.250  15.764
  200   1HB   ARG  30          1HB       ARG  30 -26.943   0.042  14.236
  201   2HB   ARG  30          2HB       ARG  30 -25.382  -0.686  13.910
  202   1HG   ARG  30          1HG       ARG  30 -25.886  -1.941  15.770
  203   2HG   ARG  30          2HG       ARG  30 -25.222  -0.561  16.623
  204   1HD   ARG  30          1HD       ARG  30 -28.082  -0.209  15.936
  205   2HD   ARG  30          2HD       ARG  30 -27.799  -1.602  16.961
  206    HE   ARG  30           HE       ARG  30 -27.342   1.226  17.673
  207   1HH1  ARG  30          2HH2      ARG  30 -26.792  -2.161  18.553
  208   2HH1  ARG  30          1HH2      ARG  30 -26.458  -1.804  20.214
  209   1HH2  ARG  30          1HH       ARG  30 -26.528   0.471  20.963
  210    H    GLU  31           H        GLU  31 -25.921   2.615  12.739
  211    HA   GLU  31           HA       GLU  31 -23.907   1.723  11.051
  212   1HB   GLU  31          1HB       GLU  31 -26.199   3.421  10.905
  213   2HB   GLU  31          2HB       GLU  31 -24.854   4.357  10.284
  214   1HG   GLU  31          1HG       GLU  31 -24.435   2.860   8.519
  215   2HG   GLU  31          2HG       GLU  31 -25.139   1.496   9.363
  216    HE2  GLU  31           HE2      GLU  31 -27.116   1.036   8.841
  217    H    ARG  32           H        ARG  32 -24.014   4.231  13.524
  218    HA   ARG  32           HA       ARG  32 -22.047   5.888  12.571
  219   1HB   ARG  32          1HB       ARG  32 -23.637   5.864  14.783
  220   2HB   ARG  32          2HB       ARG  32 -22.143   5.332  15.529
  221   1HG   ARG  32          1HG       ARG  32 -21.411   7.475  15.561
  222   2HG   ARG  32          2HG       ARG  32 -21.429   7.497  13.809
  223   1HD   ARG  32          1HD       ARG  32 -22.916   9.242  14.239
  224   2HD   ARG  32          2HD       ARG  32 -24.049   7.910  14.139
  225    HE   ARG  32           HE       ARG  32 -24.468   8.117  16.435
  226   1HH1  ARG  32          2HH2      ARG  32 -21.478   9.851  15.656
  227   2HH1  ARG  32          1HH2      ARG  32 -21.332  10.558  17.231
  228   1HH2  ARG  32          1HH       ARG  32 -22.988  10.073  18.894
  229    H    LEU  33           H        LEU  33 -21.904   2.691  14.107
  230    HA   LEU  33           HA       LEU  33 -19.042   2.915  14.537
  231   1HB   LEU  33          1HB       LEU  33 -21.135   1.556  15.795
  232   2HB   LEU  33          2HB       LEU  33 -20.216   0.303  14.986
  233    HG   LEU  33           HG       LEU  33 -19.453   0.586  17.269
  234   1HD1  LEU  33          1HD1      LEU  33 -17.072   1.748  16.098
  235   2HD1  LEU  33          2HD1      LEU  33 -17.379   0.085  16.654
  236   3HD1  LEU  33          3HD1      LEU  33 -17.823   0.567  14.999
  237   1HD2  LEU  33          1HD2      LEU  33 -18.464   2.626  18.105
  238   2HD2  LEU  33          2HD2      LEU  33 -18.722   3.435  16.540
  239   3HD2  LEU  33          3HD2      LEU  33 -20.118   2.955  17.535
  240    H    ALA  34           H        ALA  34 -21.251   2.098  12.043
  241    HA   ALA  34           HA       ALA  34 -19.578   0.080  10.849
  242   1HB   ALA  34          1HB       ALA  34 -22.223   0.516  10.778
  243   2HB   ALA  34          2HB       ALA  34 -21.764   1.480   9.353
  244   3HB   ALA  34          3HB       ALA  34 -21.358  -0.252   9.425
  245    H    HIS  35           H        HIS  35 -19.067   3.264  11.368
  246    HA   HIS  35           HA       HIS  35 -18.278   3.926   8.663
  247   1HB   HIS  35          1HB       HIS  35 -18.818   5.391  11.166
  248   2HB   HIS  35          2HB       HIS  35 -17.460   6.011  10.249
  249    HD1  HIS  35           HD1      HIS  35 -20.912   6.607  10.600
  250    HD2  HIS  35           HD2      HIS  35 -18.400   6.185   7.267
  251    HE1  HIS  35           HE1      HIS  35 -22.122   7.719   8.648
  252    H    SER  36           H        SER  36 -17.017   2.317  11.399
  253    HA   SER  36           HA       SER  36 -14.324   3.205  10.916
  254   1HB   SER  36          1HB       SER  36 -15.220   2.776  13.239
  255   2HB   SER  36          2HB       SER  36 -15.358   1.076  12.840
  256    HG   SER  36           HG       SER  36 -12.874   1.649  12.166
  257    H    ARG  37           H        ARG  37 -16.548   0.722   9.909
  258    HA   ARG  37           HA       ARG  37 -14.437  -1.104   9.244
  259   1HB   ARG  37          1HB       ARG  37 -17.079  -1.471   9.951
  260   2HB   ARG  37          2HB       ARG  37 -17.204  -1.581   8.206
  261   1HG   ARG  37          1HG       ARG  37 -16.450  -3.714   8.321
  262   2HG   ARG  37          2HG       ARG  37 -14.903  -3.109   8.881
  263   1HD   ARG  37          1HD       ARG  37 -15.286  -4.120  10.878
  264   2HD   ARG  37          2HD       ARG  37 -16.596  -2.992  11.159
  265    HE   ARG  37           HE       ARG  37 -16.845  -5.777  10.223
  266   1HH1  ARG  37          2HH2      ARG  37 -18.474  -2.657  10.637
  267   2HH1  ARG  37          1HH2      ARG  37 -20.064  -3.340  10.578
  268   1HH2  ARG  37          1HH       ARG  37 -20.317  -5.705  10.287
  269    H    ALA  38           H        ALA  38 -15.115   1.741   7.985
  270    HA   ALA  38           HA       ALA  38 -15.978   1.432   5.390
  271   1HB   ALA  38          1HB       ALA  38 -14.730   3.429   7.042
  272   2HB   ALA  38          2HB       ALA  38 -13.916   3.409   5.460
  273   3HB   ALA  38          3HB       ALA  38 -15.677   3.650   5.551
  274    H    ALA  39           H        ALA  39 -12.711   0.956   6.834
  275    HA   ALA  39           HA       ALA  39 -11.214   0.719   4.568
  276   1HB   ALA  39          1HB       ALA  39  -9.631  -0.024   6.020
  277   2HB   ALA  39          2HB       ALA  39 -10.849   0.353   7.262
  278   3HB   ALA  39          3HB       ALA  39 -10.680  -1.313   6.658
  279    H    ALA  40           H        ALA  40 -11.591  -0.429   2.742
  280    HA   ALA  40           HA       ALA  40 -13.446  -2.355   2.379
  281   1HB   ALA  40          1HB       ALA  40 -10.734  -2.385   1.013
  282   2HB   ALA  40          2HB       ALA  40 -12.313  -2.847   0.335
  283   3HB   ALA  40          3HB       ALA  40 -11.960  -1.138   0.686
  284    H    ALA  41           H        ALA  41  -9.921  -3.210   2.585
  285    HA   ALA  41           HA       ALA  41 -10.118  -5.850   2.920
  286   1HB   ALA  41          1HB       ALA  41  -8.246  -3.731   3.782
  287   2HB   ALA  41          2HB       ALA  41  -8.131  -5.236   4.727
  288   3HB   ALA  41          3HB       ALA  41  -7.925  -5.277   2.960
  289    H    ALA  42           H        ALA  42 -11.852  -6.748   4.021
  290    HA   ALA  42           HA       ALA  42 -12.233  -5.891   6.791
  291   1HB   ALA  42          1HB       ALA  42 -14.425  -6.269   6.414
  292   2HB   ALA  42          2HB       ALA  42 -13.998  -6.418   4.692
  293   3HB   ALA  42          3HB       ALA  42 -14.103  -7.873   5.713
  294    H    ALA  43           H        ALA  43 -12.619  -9.070   5.088
  295    HA   ALA  43           HA       ALA  43 -11.987 -10.598   7.292
  296   1HB   ALA  43          1HB       ALA  43 -13.008 -11.777   5.582
  297   2HB   ALA  43          2HB       ALA  43 -12.033 -10.995   4.314
  298   3HB   ALA  43          3HB       ALA  43 -11.316 -12.268   5.330
  299    H    VAL  44           H        VAL  44  -9.945  -8.625   5.276
  300    HA   VAL  44           HA       VAL  44  -7.559 -10.110   6.009
  301    HB   VAL  44           HB       VAL  44  -8.364  -8.161   3.984
  302   1HG1  VAL  44          1HG1      VAL  44  -6.197  -7.063   3.746
  303   2HG1  VAL  44          2HG1      VAL  44  -6.906  -6.695   5.337
  304   3HG1  VAL  44          3HG1      VAL  44  -5.594  -7.890   5.202
  305   1HG2  VAL  44          1HG2      VAL  44  -6.394  -9.287   2.804
  306   2HG2  VAL  44          2HG2      VAL  44  -6.269 -10.329   4.241
  307   3HG2  VAL  44          3HG2      VAL  44  -7.759 -10.332   3.267
  308    H    ALA  45           H        ALA  45  -9.433  -7.222   6.876
  309    HA   ALA  45           HA       ALA  45  -7.574  -5.694   8.148
  310   1HB   ALA  45          1HB       ALA  45 -10.348  -5.806   7.918
  311   2HB   ALA  45          2HB       ALA  45 -10.070  -5.961   9.669
  312   3HB   ALA  45          3HB       ALA  45  -9.419  -4.560   8.785
  313    H    ALA  46           H        ALA  46  -9.538  -8.366   9.647
  314    HA   ALA  46           HA       ALA  46  -8.102  -8.287  12.068
  315   1HB   ALA  46          1HB       ALA  46  -9.429 -10.813  11.202
  316   2HB   ALA  46          2HB       ALA  46  -9.604  -9.887  12.713
  317   3HB   ALA  46          3HB       ALA  46 -10.452  -9.357  11.240
  318    H    ALA  47           H        ALA  47  -8.004 -10.571   9.240
  319    HA   ALA  47           HA       ALA  47  -5.902 -12.110  10.203
  320   1HB   ALA  47          1HB       ALA  47  -7.566 -12.004   7.949
  321   2HB   ALA  47          2HB       ALA  47  -5.922 -11.810   7.296
  322   3HB   ALA  47          3HB       ALA  47  -6.322 -13.229   8.294
  323    H    THR  48           H        THR  48  -3.921 -12.072   8.170
  324    HA   THR  48           HA       THR  48  -1.954 -11.134   7.728
  325    HB   THR  48           HB       THR  48  -3.685  -8.605   7.749
  326    HG1  THR  48           HG1      THR  48  -4.121 -10.516   6.278
  327   1HG2  THR  48          1HG2      THR  48  -0.900  -9.184   6.619
  328   2HG2  THR  48          2HG2      THR  48  -1.919  -7.837   6.058
  329   3HG2  THR  48          3HG2      THR  48  -1.351  -7.881   7.744
  330    H    ALA  49           H        ALA  49  -1.749 -11.983  10.120
  331    HA   ALA  49           HA       ALA  49  -1.672 -10.334  12.278
  332   1HB   ALA  49          1HB       ALA  49  -1.255 -12.575  12.727
  333   2HB   ALA  49          2HB       ALA  49  -0.094 -12.738  11.388
  334   3HB   ALA  49          3HB       ALA  49   0.382 -11.894  12.881
  335    H    ALA  50           H        ALA  50  -0.483  -8.600  12.951
  336    HA   ALA  50           HA       ALA  50   1.485  -7.581  11.099
  337   1HB   ALA  50          1HB       ALA  50   0.365  -5.748  11.814
  338   2HB   ALA  50          2HB       ALA  50  -0.239  -6.574  13.271
  339   3HB   ALA  50          3HB       ALA  50   1.393  -5.864  13.263
  340    H    VAL  51           H        VAL  51   2.462  -9.964  11.975
  341    HA   VAL  51           HA       VAL  51   4.518  -9.108  13.887
  342    HB   VAL  51           HB       VAL  51   2.696 -10.677  14.778
  343   1HG1  VAL  51          1HG1      VAL  51   3.008 -12.109  12.561
  344   2HG1  VAL  51          2HG1      VAL  51   4.253 -12.917  13.545
  345   3HG1  VAL  51          3HG1      VAL  51   2.565 -12.869  14.109
  346   1HG2  VAL  51          1HG2      VAL  51   5.352 -10.342  15.406
  347   2HG2  VAL  51          2HG2      VAL  51   4.174 -11.266  16.369
  348   3HG2  VAL  51          3HG2      VAL  51   5.232 -12.108  15.212
  349    H    GLU  52           H        GLU  52   5.004  -8.603  11.295
  350    HA   GLU  52           HA       GLU  52   5.847 -10.704   9.742
  351   1HB   GLU  52          1HB       GLU  52   5.530  -8.428   8.873
  352   2HB   GLU  52          2HB       GLU  52   6.846  -7.826   9.860
  353   1HG   GLU  52          1HG       GLU  52   8.388  -9.474   8.642
  354   2HG   GLU  52          2HG       GLU  52   7.055  -9.816   7.557
  355    HE2  GLU  52           HE2      GLU  52   7.611  -7.075   5.658
  356    H    GLY  53           H        GLY  53   7.968 -11.604   9.303
  357   1HA   GLY  53          1HA       GLY  53  10.329 -10.929  10.572
  358   2HA   GLY  53          2HA       GLY  53   9.515 -12.050  11.646
  359    H    THR  54           H        THR  54   8.304 -13.925  10.120
  360    HA   THR  54           HA       THR  54  10.220 -15.686   9.405
  361    HB   THR  54           HB       THR  54   7.422 -15.266   8.229
  362    HG1  THR  54           HG1      THR  54   8.535 -17.032  10.286
  363   1HG2  THR  54          1HG2      THR  54   7.741 -17.945   8.271
  364   2HG2  THR  54          2HG2      THR  54   8.195 -16.991   6.838
  365   3HG2  THR  54          3HG2      THR  54   9.444 -17.500   8.000
  366    H    GLY  55           H        GLY  55  11.393 -16.315   7.602
  367   1HA   GLY  55          1HA       GLY  55  11.300 -15.743   5.047
  368   2HA   GLY  55          2HA       GLY  55  11.780 -14.168   5.648
  369    H    GLY  56           H        GLY  56  13.615 -14.474   7.560
  370   1HA   GLY  56          1HA       GLY  56  15.995 -14.929   6.443
  371   2HA   GLY  56          2HA       GLY  56  15.671 -15.255   8.134
  372    H    SER  57           H        SER  57  15.222 -17.430   8.854
  373    HA   SER  57           HA       SER  57  15.371 -19.596   8.843
  374   1HB   SER  57          1HB       SER  57  14.962 -19.416   5.825
  375   2HB   SER  57          2HB       SER  57  14.886 -20.900   6.753
  376    HG   SER  57           HG       SER  57  12.762 -20.086   6.453
  377    H    GLY  58           H        GLY  58  17.323 -20.525   9.327
  378   1HA   GLY  58          1HA       GLY  58  19.727 -19.717   8.069
  379   2HA   GLY  58          2HA       GLY  58  19.519 -21.014   9.229
  380    H    GLY  59           H        GLY  59  21.272 -21.911   7.646
  381   1HA   GLY  59          1HA       GLY  59  20.111 -23.014   5.195
  382   2HA   GLY  59          2HA       GLY  59  21.802 -22.990   5.655
  383    H    GLY  60           H        GLY  60  22.661 -24.924   6.266
  384   1HA   GLY  60          1HA       GLY  60  21.077 -26.741   7.900
  385   2HA   GLY  60          2HA       GLY  60  21.514 -27.319   6.304
  386    HA   PRO  61           HA       PRO  61  25.485 -28.275   7.762
  387   1HB   PRO  61          1HB       PRO  61  27.076 -27.956   5.563
  388   2HB   PRO  61          2HB       PRO  61  26.058 -29.360   5.814
  389   1HG   PRO  61          1HG       PRO  61  25.649 -27.080   3.977
  390   2HG   PRO  61          2HG       PRO  61  24.899 -28.663   3.946
  391   1HD   PRO  61          1HD       PRO  61  23.709 -26.218   4.858
  392   2HD   PRO  61          2HD       PRO  61  23.002 -27.819   4.934
  393    H    HIS  62           H        HIS  62  27.949 -27.570   7.774
  394    HA   HIS  62           HA       HIS  62  27.975 -24.663   7.897
  395   1HB   HIS  62          1HB       HIS  62  27.578 -26.097  10.180
  396   2HB   HIS  62          2HB       HIS  62  29.329 -26.028  10.150
  397    HD1  HIS  62           HD1      HIS  62  29.595 -24.368  12.082
  398    HD2  HIS  62           HD2      HIS  62  27.139 -22.945   8.993
  399    HE1  HIS  62           HE1      HIS  62  29.189 -21.897  12.572
  400    H    HIS  63           H        HIS  63  30.112 -23.742   7.667
  401    HA   HIS  63           HA       HIS  63  31.681 -24.822   5.806
  402   1HB   HIS  63          1HB       HIS  63  31.756 -22.529   7.027
  403   2HB   HIS  63          2HB       HIS  63  32.922 -23.294   8.087
  404    HD1  HIS  63           HD1      HIS  63  35.165 -22.443   7.390
  405    HD2  HIS  63           HD2      HIS  63  32.767 -23.450   4.099
  406    HE1  HIS  63           HE1      HIS  63  36.621 -22.119   5.319
  407    H    HIS  64           H        HIS  64  33.888 -25.823   5.861
  408    HA   HIS  64           HA       HIS  64  33.819 -28.041   7.694
  409   1HB   HIS  64          1HB       HIS  64  35.412 -29.058   6.282
  410   2HB   HIS  64          2HB       HIS  64  34.266 -28.253   5.229
  411    HD1  HIS  64           HD1      HIS  64  37.835 -28.578   5.848
  412    HD2  HIS  64           HD2      HIS  64  35.318 -25.617   4.267
  413    HE1  HIS  64           HE1      HIS  64  39.339 -26.984   4.541
  414    H    HIS  65           H        HIS  65  35.935 -28.737   8.780
  415    HA   HIS  65           HA       HIS  65  38.101 -27.282   9.227
  416   1HB   HIS  65          1HB       HIS  65  37.441 -26.021  11.411
  417   2HB   HIS  65          2HB       HIS  65  37.197 -25.268   9.847
  418    HD1  HIS  65           HD1      HIS  65  35.420 -23.877  11.491
  419    HD2  HIS  65           HD2      HIS  65  34.394 -27.779  10.342
  420    HE1  HIS  65           HE1      HIS  65  32.904 -24.092  11.857
  421    H    GLN  66           H        GLN  66  39.093 -29.164   9.830
  422    HA   GLN  66           HA       GLN  66  37.877 -30.566  12.077
  423   1HB   GLN  66          1HB       GLN  66  38.311 -31.698   9.737
  424   2HB   GLN  66          2HB       GLN  66  39.982 -31.769  10.261
  425   1HG   GLN  66          1HG       GLN  66  39.564 -33.492  11.688
  426   2HG   GLN  66          2HG       GLN  66  38.192 -32.666  12.401
  427   1HE2  GLN  66          1HE2      GLN  66  38.210 -35.378  11.987
  428   2HE2  GLN  66          2HE2      GLN  66  37.054 -35.822  10.777
  429    H    THR  67           H        THR  67  39.812 -31.948  13.261
  430    HA   THR  67           HA       THR  67  41.324 -30.028  14.622
  431    HB   THR  67           HB       THR  67  41.539 -33.076  14.394
  432    HG1  THR  67           HG1      THR  67  39.552 -31.812  15.210
  433   1HG2  THR  67          1HG2      THR  67  43.608 -32.286  15.433
  434   2HG2  THR  67          2HG2      THR  67  42.717 -31.081  16.395
  435   3HG2  THR  67          3HG2      THR  67  42.525 -32.817  16.742
  436    H    ARG  68           H        ARG  68  43.815 -30.293  14.905
  437    HA   ARG  68           HA       ARG  68  44.950 -29.327  12.638
  438   1HB   ARG  68          1HB       ARG  68  45.753 -29.629  15.235
  439   2HB   ARG  68          2HB       ARG  68  46.735 -30.878  14.495
  440   1HG   ARG  68          1HG       ARG  68  48.194 -29.167  14.064
  441   2HG   ARG  68          2HG       ARG  68  47.137 -28.831  12.707
  442   1HD   ARG  68          1HD       ARG  68  46.242 -27.637  15.290
  443   2HD   ARG  68          2HD       ARG  68  47.764 -27.009  14.690
  444    HE   ARG  68           HE       ARG  68  46.650 -26.095  12.803
  445   1HH1  ARG  68          2HH2      ARG  68  44.426 -28.079  14.720
  446   2HH1  ARG  68          1HH2      ARG  68  43.011 -27.497  13.908
  447   1HH2  ARG  68          1HH       ARG  68  43.244 -25.880  12.156
  448    H    GLY  69           H        GLY  69  47.017 -30.398  11.536
  449   1HA   GLY  69          1HA       GLY  69  46.801 -33.287  11.237
  450   2HA   GLY  69          2HA       GLY  69  46.392 -32.333   9.825
  451    H    ALA  70           H        ALA  70  48.981 -33.230  12.110
  452    HA   ALA  70           HA       ALA  70  50.913 -32.123  10.187
  453   1HB   ALA  70          1HB       ALA  70  50.549 -31.510  12.934
  454   2HB   ALA  70          2HB       ALA  70  52.017 -32.512  12.833
  455   3HB   ALA  70          3HB       ALA  70  51.893 -31.015  11.877
  456    H    TYR  71           H        TYR  71  52.994 -33.365  10.095
  457    HA   TYR  71           HA       TYR  71  52.527 -36.199  10.740
  458   1HB   TYR  71          1HB       TYR  71  53.215 -34.658   8.267
  459   2HB   TYR  71          2HB       TYR  71  54.325 -35.982   8.559
  460    HD1  TYR  71           HD1      TYR  71  53.833 -37.798   7.211
  461    HD2  TYR  71           HD2      TYR  71  50.605 -35.592   8.947
  462    HE1  TYR  71           HE1      TYR  71  52.164 -39.417   6.183
  463    HE2  TYR  71           HE2      TYR  71  48.947 -37.219   7.913
  464    HH   TYR  71           HH       TYR  71  49.580 -39.123   5.467
  465    H    SER  72           H        SER  72  54.263 -37.362  11.592
  466    HA   SER  72           HA       SER  72  56.098 -37.667  12.711
  467   1HB   SER  72          1HB       SER  72  56.886 -36.604  10.200
  468   2HB   SER  72          2HB       SER  72  57.902 -35.796  11.377
  469    HG   SER  72           HG       SER  72  57.986 -38.414  10.495
  470    H    SER  73           H        SER  73  55.565 -36.772  14.743
  471    HA   SER  73           HA       SER  73  56.980 -34.380  15.368
  472   1HB   SER  73          1HB       SER  73  53.950 -34.466  15.722
  473   2HB   SER  73          2HB       SER  73  55.000 -33.208  16.342
  474    HG   SER  73           HG       SER  73  55.699 -33.102  13.907
  475    H    HIS  74           H        HIS  74  58.163 -35.504  16.936
  476    HA   HIS  74           HA       HIS  74  56.785 -36.093  19.350
  477   1HB   HIS  74          1HB       HIS  74  57.628 -38.309  17.537
  478   2HB   HIS  74          2HB       HIS  74  57.931 -38.511  19.251
  479    HD1  HIS  74           HD1      HIS  74  55.660 -38.072  20.823
  480    HD2  HIS  74           HD2      HIS  74  55.103 -39.034  16.778
  481    HE1  HIS  74           HE1      HIS  74  53.252 -38.887  20.607
  482    H    ASP  75           H        ASP  75  58.175 -35.867  21.098
  483    HA   ASP  75           HA       ASP  75  59.952 -35.159  22.132
  484   1HB   ASP  75          1HB       ASP  75  60.648 -37.494  21.877
  485   2HB   ASP  75          2HB       ASP  75  61.258 -37.186  20.263
  486    HD2  ASP  75           HD2      ASP  75  63.627 -37.447  20.655