*HEADER    GENE REGULATION                         12-OCT-99   1D5V              
*TITLE     SOLUTION STRUCTURE OF THE FORKHEAD DOMAIN OF THE ADIPOCYTE-           
*TITLE    2 TRANSCRIPTION FACTOR FREAC-11 (S12)                                  
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: S12 TRANSCRIPTION FACTOR (FKH-14);                         
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: DNA-BINDING DOMAIN;                                        
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 TISSUE: ADIPOSE TISSUE;                                              
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET-11A                                   
*KEYWDS    WINGED HELIX, DNA-RECOGNITION HELIX                                   
*EXPDTA    NMR, 25 STRUCTURES                                                    
*AUTHOR    M.J.P.VAN DONGEN, A.CEDERBERG, P.CARLSSON, S.ENERBACK,                
*AUTHOR   2 M.WIKSTROM                                                           
*REVDAT   1   11-OCT-00 1D5V    0                                                

! S12 DBD NMR restraints for X-PLOR

noe
  reset
  nrestraints=4000

! residue 1    Met , intraresidue NOEs
! residue 2    Leu , intraresidue NOEs
assi  ( resi   2 and name   HN ) ( resi   2 and name  HB2 )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi   2 and name   HN ) ( resi   2 and name   HG )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi   2 and name   HA ) ( resi   2 and name   HG )  3.00  1.20  0.30 !    0 {intra}
! residue 3    Val , intraresidue NOEs
assi  ( resi   3 and name   HN ) ( resi   3 and name  HG# )  2.50  0.70  1.00 !   11 {intra}
assi  ( resi   3 and name   HA ) ( resi   3 and name  HG# )  2.50  0.70  0.70 !    1 {intra}
! residue 4    Lys , intraresidue NOEs
assi  ( resi   4 and name   HN ) ( resi   4 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 5    Pro , intraresidue NOEs
assi  ( resi   5 and name   HA ) ( resi   5 and name  HG# )  3.00  1.20  0.30 !    0 {intra}
! residue 6    Pro , intraresidue NOEs
! residue 7    Tyr , intraresidue NOEs
! residue 8    Ser , intraresidue NOEs
! residue 9    Tyr , intraresidue NOEs
assi  ( resi   9 and name   HN ) ( resi   9 and name  HB2 )  3.00  1.20  0.60 !   10 {intra}
! residue 10   Ile , intraresidue NOEs
assi  ( resi  10 and name   HN ) ( resi  10 and name   HB )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  10 and name   HN ) ( resi  10 and name HG2# )  3.00  1.20  1.10 !   11 {intra}
assi  ( resi  10 and name   HN ) ( resi  10 and name HG1# )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  10 and name   HA ) ( resi  10 and name HG2# )  2.50  0.70  0.70 !    1 {intra}
! residue 11   Ala , intraresidue NOEs
assi  ( resi  11 and name   HN ) ( resi  11 and name  HB# )  2.50  0.70  1.00 !   11 {intra}
! residue 12   Leu , intraresidue NOEs
assi  ( resi  12 and name   HN ) ( resi  12 and name  HB2 )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  12 and name   HN ) ( resi  12 and name   HG )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  12 and name   HN ) ( resi  12 and name  HD# )  2.50  0.70  1.00 !   11 {intra}
! residue 13   Ile , intraresidue NOEs
assi  ( resi  13 and name   HN ) ( resi  13 and name HD1# )  2.50  0.70  1.00 !   11 {intra}
assi  ( resi  13 and name   HA ) ( resi  13 and name HG2# )  2.50  0.70  0.70 !    1 {intra}
assi  ( resi  13 and name   HA ) ( resi  13 and name HG1# )  3.00  1.20  0.30 !    0 {intra}
! residue 14   Thr , intraresidue NOEs
assi  ( resi  14 and name   HA ) ( resi  14 and name HG2# )  2.50  0.70  0.70 !    1 {intra}
! residue 15   Met , intraresidue NOEs
assi  ( resi  15 and name   HN ) ( resi  15 and name  HB1 )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  15 and name   HN ) ( resi  15 and name  HB2 )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  15 and name   HN ) ( resi  15 and name  HG# )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  15 and name   HA ) ( resi  15 and name  HG# )  3.00  1.20  0.30 !    0 {intra}
! residue 16   Ala , intraresidue NOEs
assi  ( resi  16 and name   HN ) ( resi  16 and name  HB# )  2.50  0.70  1.00 !   11 {intra}
! residue 17   Ile , intraresidue NOEs
assi  ( resi  17 and name   HN ) ( resi  17 and name   HB )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  17 and name   HN ) ( resi  17 and name HD1# )  3.00  1.20  1.10 !   11 {intra}
assi  ( resi  17 and name   HN ) ( resi  17 and name HG1# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  17 and name   HA ) ( resi  17 and name HG2# )  2.50  0.70  0.70 !    1 {intra}
! residue 18   Gln , intraresidue NOEs
assi  ( resi  18 and name   HN ) ( resi  18 and name  HB2 )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  18 and name   HN ) ( resi  18 and name  HG# )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  18 and name   HA ) ( resi  18 and name  HG# )  2.50  0.70  0.20 !    0 {intra}
! residue 19   Asn , intraresidue NOEs
assi  ( resi  19 and name   HN ) ( resi  19 and name  HB# )  3.00  1.20  0.60 !   10 {intra}
! residue 20   Ala , intraresidue NOEs
assi  ( resi  20 and name   HN ) ( resi  20 and name  HB# )  2.50  0.70  1.00 !   11 {intra}
! residue 21   Pro , intraresidue NOEs
! residue 22   Glu , intraresidue NOEs
! residue 23   Lys , intraresidue NOEs
! residue 24   Lys , intraresidue NOEs
assi  ( resi  24 and name   HA ) ( resi  24 and name  HG# )  2.50  0.70  0.20 !    0 {intra}
! residue 25   Ile , intraresidue NOEs
assi  ( resi  25 and name   HA ) ( resi  25 and name HG2# )  3.00  1.20  0.80 !    1 {intra}
assi  ( resi  25 and name   HA ) ( resi  25 and name HG1# )  2.50  0.70  0.20 !    0 {intra}
! residue 26   Thr , intraresidue NOEs
assi  ( resi  26 and name   HA ) ( resi  26 and name HG2# )  2.50  0.70  0.70 !    1 {intra}
! residue 27   Leu , intraresidue NOEs
assi  ( resi  27 and name   HA ) ( resi  27 and name   HG )  3.00  1.20  0.30 !    0 {intra}
! residue 28   Asn , intraresidue NOEs
assi  ( resi  28 and name   HN ) ( resi  28 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 29   Gly , intraresidue NOEs
! residue 30   Ile , intraresidue NOEs
assi  ( resi  30 and name   HN ) ( resi  30 and name   HB )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  30 and name   HN ) ( resi  30 and name HD1# )  3.00  1.20  1.10 !   11 {intra}
assi  ( resi  30 and name   HA ) ( resi  30 and name HG2# )  2.50  0.70  0.70 !    1 {intra}
assi  ( resi  30 and name   HA ) ( resi  30 and name HG1# )  3.00  1.20  0.30 !    0 {intra}
! residue 31   Tyr , intraresidue NOEs
! residue 32   Gln , intraresidue NOEs
assi  ( resi  32 and name   HN ) ( resi  32 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  32 and name   HA ) ( resi  32 and name  HG# )  3.00  1.20  0.30 !    0 {intra}
! residue 33   Phe , intraresidue NOEs
assi  ( resi  33 and name   HN ) ( resi  33 and name  HB# )  3.00  1.20  0.60 !   10 {intra}
! residue 34   Ile , intraresidue NOEs
assi  ( resi  34 and name   HN ) ( resi  34 and name   HB )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  34 and name   HA ) ( resi  34 and name HG2# )  3.00  1.20  0.80 !    1 {intra}
! residue 35   Met , intraresidue NOEs
assi  ( resi  35 and name   HN ) ( resi  35 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  35 and name   HN ) ( resi  35 and name  HG# )  3.00  1.20  0.60 !   10 {intra}
! residue 36   Asp , intraresidue NOEs
assi  ( resi  36 and name   HN ) ( resi  36 and name  HB1 )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  36 and name   HN ) ( resi  36 and name  HB2 )  2.50  0.70  0.50 !   10 {intra}
! residue 37   Arg , intraresidue NOEs
assi  ( resi  37 and name   HN ) ( resi  37 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 38   Phe , intraresidue NOEs
assi  ( resi  38 and name   HN ) ( resi  38 and name  HD# )  2.50  0.70  0.50 !   10 {intra}
! residue 39   Pro , intraresidue NOEs
! residue 40   Phe , intraresidue NOEs
assi  ( resi  40 and name   HN ) ( resi  40 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 41   Tyr , intraresidue NOEs
assi  ( resi  41 and name   HN ) ( resi  41 and name  HB# )  3.00  1.20  0.60 !   10 {intra}
! residue 42   Arg , intraresidue NOEs
assi  ( resi  42 and name   HN ) ( resi  42 and name  HB1 )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  42 and name   HN ) ( resi  42 and name  HB2 )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  42 and name   HN ) ( resi  42 and name  HG# )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  42 and name   HA ) ( resi  42 and name  HG# )  2.50  0.70  0.20 !    0 {intra}
! residue 43   Glu , intraresidue NOEs
assi  ( resi  43 and name   HN ) ( resi  43 and name  HB# )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  43 and name   HA ) ( resi  43 and name  HG# )  3.00  1.20  0.30 !    0 {intra}
! residue 44   Asn , intraresidue NOEs
assi  ( resi  44 and name   HN ) ( resi  44 and name  HB# )  3.00  1.20  0.60 !   10 {intra}
! residue 45   Lys , intraresidue NOEs
assi  ( resi  45 and name   HN ) ( resi  45 and name  HB1 )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  45 and name   HN ) ( resi  45 and name  HB2 )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  45 and name   HN ) ( resi  45 and name  HG# )  2.50  0.70  0.50 !   10 {intra}
! residue 46   Gln , intraresidue NOEs
assi  ( resi  46 and name   HN ) ( resi  46 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  46 and name   HN ) ( resi  46 and name  HG# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  46 and name   HA ) ( resi  46 and name  HG# )  2.50  0.70  0.20 !    0 {intra}
! residue 47   Gly , intraresidue NOEs
! residue 48   Trp , intraresidue NOEs
assi  ( resi  48 and name   HN ) ( resi  48 and name  HD1 )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  48 and name   HN ) ( resi  48 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 49   Gln , intraresidue NOEs
! residue 50   Asn , intraresidue NOEs
assi  ( resi  50 and name   HN ) ( resi  50 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 51   Ser , intraresidue NOEs
assi  ( resi  51 and name   HN ) ( resi  51 and name  HB# )  3.00  1.20  0.60 !   10 {intra}
! residue 52   Ile , intraresidue NOEs
assi  ( resi  52 and name   HN ) ( resi  52 and name   HB )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  52 and name   HN ) ( resi  52 and name HG1# )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  52 and name   HA ) ( resi  52 and name HG2# )  2.50  0.70  0.70 !    1 {intra}
! residue 53   Arg , intraresidue NOEs
assi  ( resi  53 and name   HN ) ( resi  53 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  53 and name   HN ) ( resi  53 and name  HG# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  53 and name   HA ) ( resi  53 and name  HG# )  3.00  1.20  0.30 !    0 {intra}
! residue 54   His , intraresidue NOEs
assi  ( resi  54 and name   HN ) ( resi  54 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 55   Asn , intraresidue NOEs
assi  ( resi  55 and name   HN ) ( resi  55 and name  HB# )  3.00  1.20  0.60 !   10 {intra}
! residue 56   Leu , intraresidue NOEs
! residue 57   Ser , intraresidue NOEs
! residue 58   Leu , intraresidue NOEs
assi  ( resi  58 and name   HN ) ( resi  58 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  58 and name   HA ) ( resi  58 and name   HG )  2.50  0.70  0.20 !    0 {intra}
! residue 59   Asn , intraresidue NOEs
! residue 60   Glu , intraresidue NOEs
assi  ( resi  60 and name   HN ) ( resi  60 and name  HB1 )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  60 and name   HN ) ( resi  60 and name  HB2 )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  60 and name   HN ) ( resi  60 and name  HG# )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  60 and name   HA ) ( resi  60 and name  HG# )  2.50  0.70  0.20 !    0 {intra}
! residue 61   Cys , intraresidue NOEs
! residue 62   Phe , intraresidue NOEs
! residue 63   Val , intraresidue NOEs
assi  ( resi  63 and name   HN ) ( resi  63 and name  HG# )  3.00  1.20  1.10 !   11 {intra}
assi  ( resi  63 and name   HA ) ( resi  63 and name  HG# )  2.50  0.70  0.70 !    1 {intra}
! residue 64   Lys , intraresidue NOEs
! residue 65   Val , intraresidue NOEs
assi  ( resi  65 and name   HN ) ( resi  65 and name  HG# )  3.00  1.20  1.10 !   11 {intra}
assi  ( resi  65 and name   HA ) ( resi  65 and name  HG# )  2.50  0.70  0.70 !    1 {intra}
! residue 66   Pro , intraresidue NOEs
! residue 67   Arg , intraresidue NOEs
assi  ( resi  67 and name   HN ) ( resi  67 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 68   Asp , intraresidue NOEs
assi  ( resi  68 and name   HN ) ( resi  68 and name  HB# )  3.00  1.20  0.60 !   10 {intra}
! residue 69   Asp , intraresidue NOEs
assi  ( resi  69 and name   HN ) ( resi  69 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 70   Lys , intraresidue NOEs
assi  ( resi  70 and name   HN ) ( resi  70 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  70 and name   HN ) ( resi  70 and name  HG# )  2.50  0.70  0.50 !   10 {intra}
! residue 71   Lys , intraresidue NOEs
assi  ( resi  71 and name   HN ) ( resi  71 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  71 and name   HN ) ( resi  71 and name  HG# )  3.00  1.20  0.60 !   10 {intra}
assi  ( resi  71 and name   HA ) ( resi  71 and name  HG# )  3.00  1.20  0.30 !    0 {intra}
! residue 72   Pro , intraresidue NOEs
! residue 73   Gly , intraresidue NOEs
! residue 74   Lys , intraresidue NOEs
assi  ( resi  74 and name   HN ) ( resi  74 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 75   Gly , intraresidue NOEs
! residue 76   Ser , intraresidue NOEs
! residue 77   Tyr , intraresidue NOEs
! residue 78   Trp , intraresidue NOEs
! residue 79   Thr , intraresidue NOEs
assi  ( resi  79 and name   HN ) ( resi  79 and name HG2# )  3.00  1.20  1.10 !   11 {intra}
assi  ( resi  79 and name   HA ) ( resi  79 and name HG2# )  3.00  1.20  0.80 !    1 {intra}
! residue 80   Leu , intraresidue NOEs
assi  ( resi  80 and name   HN ) ( resi  80 and name   HG )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  80 and name   HN ) ( resi  80 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 81   Asp , intraresidue NOEs
assi  ( resi  81 and name   HN ) ( resi  81 and name  HB# )  3.00  1.20  0.60 !   10 {intra}
! residue 82   Pro , intraresidue NOEs
! residue 83   Asp , intraresidue NOEs
assi  ( resi  83 and name   HN ) ( resi  83 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 84   Ser , intraresidue NOEs
assi  ( resi  84 and name   HN ) ( resi  84 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 85   Tyr , intraresidue NOEs
assi  ( resi  85 and name   HN ) ( resi  85 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 86   Asn , intraresidue NOEs
assi  ( resi  86 and name   HN ) ( resi  86 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 87   Met , intraresidue NOEs
assi  ( resi  87 and name   HN ) ( resi  87 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  87 and name   HN ) ( resi  87 and name  HG# )  2.50  0.70  0.50 !   10 {intra}
! residue 88   Phe , intraresidue NOEs
assi  ( resi  88 and name   HN ) ( resi  88 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 89   Glu , intraresidue NOEs
assi  ( resi  89 and name   HN ) ( resi  89 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  89 and name   HN ) ( resi  89 and name  HG# )  2.50  0.70  0.50 !   10 {intra}
! residue 90   Asn , intraresidue NOEs
assi  ( resi  90 and name   HN ) ( resi  90 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 91   Gly , intraresidue NOEs
! residue 92   Ser , intraresidue NOEs
! residue 93   Phe , intraresidue NOEs
assi  ( resi  93 and name   HN ) ( resi  93 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
! residue 94   Leu , intraresidue NOEs
assi  ( resi  94 and name   HN ) ( resi  94 and name  HB# )  2.50  0.70  0.50 !   10 {intra}
assi  ( resi  94 and name   HN ) ( resi  94 and name  HD# )  3.00  1.20  1.10 !   11 {intra}
! residue 95   Arg , intraresidue NOEs
! residue 96   Arg , intraresidue NOEs
! residue 97   Arg , intraresidue NOEs
! residue 98   Arg , intraresidue NOEs
! residue 99   Arg , intraresidue NOEs
! residue 100  Phe , intraresidue NOEs
! residue 101  Lys , intraresidue NOEs
! residue 102  Lys , intraresidue NOEs
! residue 1    Met , NOEs forward in sequence
assi  ( resi   1 and name   HA ) ( resi   2 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi   1 and name   HA ) ( resi   2 and name   HG )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   1 and name   HA ) ( resi   2 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   1 and name  HB# ) ( resi   2 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi   1 and name  HB# ) ( resi   2 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   1 and name  HG# ) ( resi   2 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   1 and name  HG# ) ( resi   2 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
! residue 2    Leu , NOEs forward in sequence
assi  ( resi   2 and name   HN ) ( resi   3 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   2 and name   HA ) ( resi   3 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi   2 and name   HA ) ( resi   3 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   2 and name   HA ) ( resi   3 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   2 and name  HB1 ) ( resi   3 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi   2 and name  HD# ) ( resi   3 and name   HN )  2.50  0.70  1.00 !   11 {  seq}
! residue 3    Val , NOEs forward in sequence
assi  ( resi   3 and name   HA ) ( resi   4 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi   3 and name   HB ) ( resi   4 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
! residue 4    Lys , NOEs forward in sequence
assi  ( resi   4 and name   HN ) ( resi   5 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   4 and name   HA ) ( resi   5 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   4 and name   HA ) ( resi   5 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   4 and name   HA ) ( resi   5 and name  HD# )  2.50  0.70  0.20 !    0 {  seq}
assi  ( resi   4 and name  HB# ) ( resi   5 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   4 and name  HG# ) ( resi   5 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
! residue 5    Pro , NOEs forward in sequence
assi  ( resi   5 and name   HA ) ( resi   6 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   5 and name   HA ) ( resi   6 and name  HD# )  2.50  0.70  0.20 !    0 {  seq}
assi  ( resi   5 and name  HB# ) ( resi   6 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
! residue 6    Pro , NOEs forward in sequence
assi  ( resi   6 and name   HA ) ( resi   7 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi   6 and name  HB# ) ( resi   7 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   6 and name  HD# ) ( resi   7 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   6 and name  HD# ) ( resi   7 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   6 and name  HD# ) ( resi   7 and name  HE# )  4.00  2.20  1.00 !    0 {  seq}
! residue 7    Tyr , NOEs forward in sequence
assi  ( resi   7 and name   HN ) ( resi   8 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   7 and name   HA ) ( resi   8 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi   7 and name  HB1 ) ( resi   8 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   7 and name  HB2 ) ( resi   8 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   7 and name  HD# ) ( resi   8 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 8    Ser , NOEs forward in sequence
assi  ( resi   8 and name  HB# ) ( resi   9 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 9    Tyr , NOEs forward in sequence
assi  ( resi   9 and name   HN ) ( resi  10 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   9 and name   HN ) ( resi  10 and name HG1# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   9 and name  HB1 ) ( resi  10 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   9 and name  HB2 ) ( resi  10 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi   9 and name  HB2 ) ( resi  10 and name HD1# )  4.00  2.20  1.00 !    0 {  seq}
! residue 10   Ile , NOEs forward in sequence
assi  ( resi  10 and name   HN ) ( resi  11 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  10 and name   HA ) ( resi  11 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  10 and name   HB ) ( resi  11 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  10 and name HG2# ) ( resi  11 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  10 and name HG2# ) ( resi  11 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  10 and name HG2# ) ( resi  11 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  10 and name HG1# ) ( resi  11 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 11   Ala , NOEs forward in sequence
assi  ( resi  11 and name   HN ) ( resi  12 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  11 and name   HA ) ( resi  12 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  11 and name  HB# ) ( resi  12 and name   HN )  2.50  0.70  1.00 !   11 {  seq}
assi  ( resi  11 and name  HB# ) ( resi  12 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
! residue 12   Leu , NOEs forward in sequence
assi  ( resi  12 and name   HN ) ( resi  13 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  12 and name  HB2 ) ( resi  13 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 13   Ile , NOEs forward in sequence
assi  ( resi  13 and name   HB ) ( resi  14 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  13 and name HG2# ) ( resi  14 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  13 and name HG2# ) ( resi  14 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  13 and name HG2# ) ( resi  14 and name   HB )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  13 and name HD1# ) ( resi  14 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 14   Thr , NOEs forward in sequence
assi  ( resi  14 and name   HN ) ( resi  15 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  14 and name HG2# ) ( resi  15 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
! residue 15   Met , NOEs forward in sequence
assi  ( resi  15 and name   HN ) ( resi  16 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  15 and name   HN ) ( resi  16 and name  HB# )  3.00  1.20  1.10 !   11 {  seq}
assi  ( resi  15 and name   HA ) ( resi  16 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  15 and name  HB1 ) ( resi  16 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  15 and name  HB1 ) ( resi  16 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  15 and name  HB2 ) ( resi  16 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  15 and name  HB2 ) ( resi  16 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  15 and name  HG# ) ( resi  16 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 16   Ala , NOEs forward in sequence
assi  ( resi  16 and name   HN ) ( resi  17 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  16 and name   HN ) ( resi  17 and name HG1# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  16 and name   HA ) ( resi  17 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  16 and name  HB# ) ( resi  17 and name   HN )  3.00  1.20  1.10 !   11 {  seq}
assi  ( resi  16 and name  HB# ) ( resi  17 and name HG1# )  4.00  2.20  1.00 !    0 {  seq}
! residue 17   Ile , NOEs forward in sequence
assi  ( resi  17 and name   HN ) ( resi  18 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  17 and name   HA ) ( resi  18 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  17 and name   HB ) ( resi  18 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  17 and name HG2# ) ( resi  18 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  17 and name HG2# ) ( resi  18 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  17 and name HG2# ) ( resi  18 and name  HG# )  3.00  1.20  0.80 !    1 {  seq}
assi  ( resi  17 and name HD1# ) ( resi  18 and name   HN )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  17 and name HG1# ) ( resi  18 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
! residue 18   Gln , NOEs forward in sequence
assi  ( resi  18 and name   HN ) ( resi  19 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  18 and name   HA ) ( resi  19 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  18 and name  HB2 ) ( resi  19 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  18 and name  HG# ) ( resi  19 and name HD2# )  4.00  2.20  1.00 !    0 {  seq}
! residue 19   Asn , NOEs forward in sequence
assi  ( resi  19 and name   HN ) ( resi  20 and name   HN )  2.50  0.70  0.80 !   20 {  seq}
assi  ( resi  19 and name   HN ) ( resi  20 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  19 and name   HA ) ( resi  20 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  19 and name  HB# ) ( resi  20 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 20   Ala , NOEs forward in sequence
assi  ( resi  20 and name   HN ) ( resi  21 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  20 and name   HA ) ( resi  21 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  20 and name   HA ) ( resi  21 and name  HD# )  2.50  0.70  0.20 !    0 {  seq}
assi  ( resi  20 and name  HB# ) ( resi  21 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  20 and name  HB# ) ( resi  21 and name  HD# )  3.00  1.20  0.80 !    1 {  seq}
! residue 21   Pro , NOEs forward in sequence
! residue 22   Glu , NOEs forward in sequence
! residue 23   Lys , NOEs forward in sequence
assi  ( resi  23 and name   HN ) ( resi  24 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  23 and name   HA ) ( resi  24 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  23 and name  HG# ) ( resi  24 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 24   Lys , NOEs forward in sequence
assi  ( resi  24 and name   HA ) ( resi  25 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  24 and name   HA ) ( resi  25 and name HG2# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  24 and name  HB# ) ( resi  25 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 25   Ile , NOEs forward in sequence
assi  ( resi  25 and name   HA ) ( resi  26 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  25 and name HG1# ) ( resi  26 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 26   Thr , NOEs forward in sequence
assi  ( resi  26 and name   HA ) ( resi  27 and name   HN )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  26 and name HG2# ) ( resi  27 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 27   Leu , NOEs forward in sequence
assi  ( resi  27 and name   HN ) ( resi  28 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  27 and name   HA ) ( resi  28 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  27 and name  HB1 ) ( resi  28 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  27 and name  HB2 ) ( resi  28 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  27 and name   HG ) ( resi  28 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  27 and name  HD# ) ( resi  28 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  27 and name  HD# ) ( resi  28 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
! residue 28   Asn , NOEs forward in sequence
assi  ( resi  28 and name  HB# ) ( resi  29 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
! residue 29   Gly , NOEs forward in sequence
assi  ( resi  29 and name  HA1 ) ( resi  30 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  29 and name  HA2 ) ( resi  30 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 30   Ile , NOEs forward in sequence
assi  ( resi  30 and name   HN ) ( resi  31 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  30 and name   HB ) ( resi  31 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  30 and name HG2# ) ( resi  31 and name   HN )  3.00  1.20  1.10 !   11 {  seq}
assi  ( resi  30 and name HG2# ) ( resi  31 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  30 and name HD1# ) ( resi  31 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 31   Tyr , NOEs forward in sequence
assi  ( resi  31 and name   HN ) ( resi  32 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  31 and name   HN ) ( resi  32 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  31 and name  HB1 ) ( resi  32 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  31 and name  HB1 ) ( resi  32 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  31 and name  HB2 ) ( resi  32 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  31 and name  HB2 ) ( resi  32 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  31 and name  HD# ) ( resi  32 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 32   Gln , NOEs forward in sequence
assi  ( resi  32 and name   HN ) ( resi  33 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  32 and name   HN ) ( resi  33 and name   HA )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  32 and name   HA ) ( resi  33 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  32 and name  HB# ) ( resi  33 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
! residue 33   Phe , NOEs forward in sequence
assi  ( resi  33 and name   HN ) ( resi  34 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  33 and name   HA ) ( resi  34 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  33 and name  HB1 ) ( resi  34 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  33 and name  HB2 ) ( resi  34 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  33 and name  HD# ) ( resi  34 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  33 and name  HD# ) ( resi  34 and name   HA )  3.00  1.20  0.30 !    0 {  seq}
assi  ( resi  33 and name  HD# ) ( resi  34 and name HG2# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  33 and name  HE# ) ( resi  34 and name   HN )  6.00  4.20  2.00 !    0 {  seq}
! residue 34   Ile , NOEs forward in sequence
assi  ( resi  34 and name   HN ) ( resi  35 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  34 and name   HB ) ( resi  35 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  34 and name HG2# ) ( resi  35 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  34 and name HG2# ) ( resi  35 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  34 and name HG2# ) ( resi  35 and name  HE# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  34 and name HG2# ) ( resi  35 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  34 and name HD1# ) ( resi  35 and name  HE# )  4.00  2.20  1.00 !    0 {  seq}
! residue 35   Met , NOEs forward in sequence
assi  ( resi  35 and name   HN ) ( resi  36 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  35 and name   HA ) ( resi  36 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  35 and name  HB# ) ( resi  36 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  35 and name  HG# ) ( resi  36 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 36   Asp , NOEs forward in sequence
assi  ( resi  36 and name   HN ) ( resi  37 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  36 and name   HN ) ( resi  37 and name   HA )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  36 and name   HN ) ( resi  37 and name  HB# )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  36 and name   HA ) ( resi  37 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  36 and name  HB1 ) ( resi  37 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  36 and name  HB2 ) ( resi  37 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
! residue 37   Arg , NOEs forward in sequence
assi  ( resi  37 and name   HN ) ( resi  38 and name   HN )  2.50  0.70  0.80 !   20 {  seq}
assi  ( resi  37 and name   HA ) ( resi  38 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  37 and name  HB# ) ( resi  38 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  37 and name  HB# ) ( resi  38 and name  HD# )  3.00  1.20  0.30 !    0 {  seq}
! residue 38   Phe , NOEs forward in sequence
assi  ( resi  38 and name   HA ) ( resi  39 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  38 and name   HA ) ( resi  39 and name  HD# )  2.50  0.70  0.20 !    0 {  seq}
assi  ( resi  38 and name  HB1 ) ( resi  39 and name  HD# )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  38 and name  HD# ) ( resi  39 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
! residue 39   Pro , NOEs forward in sequence
assi  ( resi  39 and name   HA ) ( resi  40 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  39 and name  HB# ) ( resi  40 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  39 and name  HD# ) ( resi  40 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 40   Phe , NOEs forward in sequence
assi  ( resi  40 and name   HN ) ( resi  41 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  40 and name   HA ) ( resi  41 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  40 and name  HB# ) ( resi  41 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  40 and name  HB# ) ( resi  41 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  40 and name  HD# ) ( resi  41 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  40 and name  HD# ) ( resi  41 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  40 and name  HD# ) ( resi  41 and name  HE# )  2.50  0.70  0.20 !    0 {  seq}
assi  ( resi  40 and name  HE# ) ( resi  41 and name  HE# )  4.00  2.20  1.00 !    0 {  seq}
! residue 41   Tyr , NOEs forward in sequence
assi  ( resi  41 and name   HN ) ( resi  42 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  41 and name   HN ) ( resi  42 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  41 and name   HA ) ( resi  42 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  41 and name  HB# ) ( resi  42 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 42   Arg , NOEs forward in sequence
assi  ( resi  42 and name   HN ) ( resi  43 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  42 and name   HA ) ( resi  43 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 43   Glu , NOEs forward in sequence
assi  ( resi  43 and name   HN ) ( resi  44 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  43 and name   HA ) ( resi  44 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  43 and name  HB# ) ( resi  44 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  43 and name  HG# ) ( resi  44 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 44   Asn , NOEs forward in sequence
assi  ( resi  44 and name   HN ) ( resi  45 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  44 and name   HA ) ( resi  45 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  44 and name  HB# ) ( resi  45 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 45   Lys , NOEs forward in sequence
assi  ( resi  45 and name   HN ) ( resi  46 and name   HN )  2.50  0.70  0.80 !   20 {  seq}
assi  ( resi  45 and name   HN ) ( resi  46 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  45 and name   HN ) ( resi  46 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  45 and name   HA ) ( resi  46 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  45 and name   HA ) ( resi  46 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  45 and name  HB1 ) ( resi  46 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  45 and name  HB2 ) ( resi  46 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  45 and name  HG# ) ( resi  46 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 46   Gln , NOEs forward in sequence
assi  ( resi  46 and name   HA ) ( resi  47 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  46 and name  HB# ) ( resi  47 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  46 and name  HG# ) ( resi  47 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 47   Gly , NOEs forward in sequence
assi  ( resi  47 and name   HN ) ( resi  48 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  47 and name   HN ) ( resi  48 and name  HD1 )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  47 and name  HA# ) ( resi  48 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 48   Trp , NOEs forward in sequence
assi  ( resi  48 and name   HN ) ( resi  49 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  48 and name  HE3 ) ( resi  49 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  48 and name  HE3 ) ( resi  49 and name  HG# )  6.00  4.20  2.00 !    0 {  seq}
! residue 49   Gln , NOEs forward in sequence
assi  ( resi  49 and name   HA ) ( resi  50 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  49 and name  HB# ) ( resi  50 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  49 and name  HG# ) ( resi  50 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 50   Asn , NOEs forward in sequence
assi  ( resi  50 and name   HN ) ( resi  51 and name   HN )  2.50  0.70  0.80 !   20 {  seq}
assi  ( resi  50 and name   HA ) ( resi  51 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  50 and name  HB# ) ( resi  51 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
! residue 51   Ser , NOEs forward in sequence
assi  ( resi  51 and name   HN ) ( resi  52 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  51 and name   HN ) ( resi  52 and name HD1# )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  51 and name   HA ) ( resi  52 and name   HN )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  51 and name  HB# ) ( resi  52 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 52   Ile , NOEs forward in sequence
assi  ( resi  52 and name   HB ) ( resi  53 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  52 and name HG2# ) ( resi  53 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  52 and name HG2# ) ( resi  53 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
! residue 53   Arg , NOEs forward in sequence
assi  ( resi  53 and name   HN ) ( resi  54 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  53 and name   HA ) ( resi  54 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  53 and name  HB# ) ( resi  54 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  53 and name  HG# ) ( resi  54 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 54   His , NOEs forward in sequence
assi  ( resi  54 and name   HN ) ( resi  55 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  54 and name   HA ) ( resi  55 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  54 and name  HB# ) ( resi  55 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
! residue 55   Asn , NOEs forward in sequence
assi  ( resi  55 and name   HN ) ( resi  56 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  55 and name  HB# ) ( resi  56 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 56   Leu , NOEs forward in sequence
assi  ( resi  56 and name   HN ) ( resi  57 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  56 and name  HB1 ) ( resi  57 and name   HA )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  56 and name  HB2 ) ( resi  57 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 57   Ser , NOEs forward in sequence
assi  ( resi  57 and name   HN ) ( resi  58 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  57 and name  HB# ) ( resi  58 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  57 and name  HB# ) ( resi  58 and name   HG )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  57 and name  HB# ) ( resi  58 and name  HB# )  6.00  4.20  2.00 !    0 {  seq}
! residue 58   Leu , NOEs forward in sequence
assi  ( resi  58 and name   HN ) ( resi  59 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  58 and name   HA ) ( resi  59 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  58 and name  HB# ) ( resi  59 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  58 and name  HB# ) ( resi  59 and name HD2# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  58 and name  HD# ) ( resi  59 and name   HN )  6.00  4.20  2.00 !    0 {  seq}
! residue 59   Asn , NOEs forward in sequence
assi  ( resi  59 and name   HN ) ( resi  60 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  59 and name   HA ) ( resi  60 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  59 and name   HA ) ( resi  60 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  59 and name   HA ) ( resi  60 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  59 and name  HB# ) ( resi  60 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 60   Glu , NOEs forward in sequence
assi  ( resi  60 and name   HN ) ( resi  61 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  60 and name  HB1 ) ( resi  61 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  60 and name  HB2 ) ( resi  61 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  60 and name  HG# ) ( resi  61 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 61   Cys , NOEs forward in sequence
! residue 62   Phe , NOEs forward in sequence
assi  ( resi  62 and name   HN ) ( resi  63 and name   HN )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  62 and name   HN ) ( resi  63 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  62 and name   HA ) ( resi  63 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  62 and name   HA ) ( resi  63 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  62 and name  HB# ) ( resi  63 and name   HN )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  62 and name  HD# ) ( resi  63 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 63   Val , NOEs forward in sequence
assi  ( resi  63 and name   HA ) ( resi  64 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  63 and name   HB ) ( resi  64 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  63 and name  HG# ) ( resi  64 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 64   Lys , NOEs forward in sequence
assi  ( resi  64 and name   HA ) ( resi  65 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  64 and name   HA ) ( resi  65 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  64 and name  HB# ) ( resi  65 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
! residue 65   Val , NOEs forward in sequence
assi  ( resi  65 and name   HA ) ( resi  66 and name  HD# )  2.50  0.70  0.20 !    0 {  seq}
assi  ( resi  65 and name   HB ) ( resi  66 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  65 and name HG1# ) ( resi  66 and name  HD# )  3.00  1.20  0.80 !    1 {  seq}
! residue 66   Pro , NOEs forward in sequence
assi  ( resi  66 and name   HA ) ( resi  67 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  66 and name  HB# ) ( resi  67 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 67   Arg , NOEs forward in sequence
assi  ( resi  67 and name   HN ) ( resi  68 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  67 and name   HA ) ( resi  68 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  67 and name   HA ) ( resi  68 and name   HA )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  67 and name  HB# ) ( resi  68 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  67 and name  HB# ) ( resi  68 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  67 and name  HG# ) ( resi  68 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  67 and name  HD# ) ( resi  68 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 68   Asp , NOEs forward in sequence
assi  ( resi  68 and name   HA ) ( resi  69 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  68 and name  HB# ) ( resi  69 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
! residue 69   Asp , NOEs forward in sequence
assi  ( resi  69 and name   HN ) ( resi  70 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  69 and name   HA ) ( resi  70 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  69 and name  HB# ) ( resi  70 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
! residue 70   Lys , NOEs forward in sequence
assi  ( resi  70 and name   HN ) ( resi  71 and name   HN )  2.50  0.70  0.80 !   20 {  seq}
assi  ( resi  70 and name   HA ) ( resi  71 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  70 and name  HB# ) ( resi  71 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 71   Lys , NOEs forward in sequence
assi  ( resi  71 and name   HN ) ( resi  72 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  71 and name   HA ) ( resi  72 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  71 and name   HA ) ( resi  72 and name  HD# )  2.50  0.70  0.20 !    0 {  seq}
! residue 72   Pro , NOEs forward in sequence
assi  ( resi  72 and name   HA ) ( resi  73 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  72 and name  HB# ) ( resi  73 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  72 and name  HD# ) ( resi  73 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 73   Gly , NOEs forward in sequence
assi  ( resi  73 and name   HN ) ( resi  74 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  73 and name  HA# ) ( resi  74 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  73 and name  HA# ) ( resi  74 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
! residue 74   Lys , NOEs forward in sequence
assi  ( resi  74 and name   HN ) ( resi  75 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  74 and name   HA ) ( resi  75 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  74 and name  HB# ) ( resi  75 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  74 and name  HG# ) ( resi  75 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  74 and name  HD# ) ( resi  75 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 75   Gly , NOEs forward in sequence
assi  ( resi  75 and name  HA# ) ( resi  76 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
! residue 76   Ser , NOEs forward in sequence
assi  ( resi  76 and name   HA ) ( resi  77 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  76 and name   HA ) ( resi  77 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  76 and name  HB# ) ( resi  77 and name  HB# )  6.00  4.20  2.00 !    0 {  seq}
! residue 77   Tyr , NOEs forward in sequence
assi  ( resi  77 and name  HB# ) ( resi  78 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  77 and name  HD# ) ( resi  78 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 78   Trp , NOEs forward in sequence
assi  ( resi  78 and name   HA ) ( resi  79 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  78 and name   HA ) ( resi  79 and name HG2# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  78 and name  HB1 ) ( resi  79 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  78 and name  HB2 ) ( resi  79 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 79   Thr , NOEs forward in sequence
assi  ( resi  79 and name   HA ) ( resi  80 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  79 and name   HA ) ( resi  80 and name   HA )  6.00  4.20  2.00 !    0 {  seq}
assi  ( resi  79 and name HG2# ) ( resi  80 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
! residue 80   Leu , NOEs forward in sequence
assi  ( resi  80 and name   HA ) ( resi  81 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  80 and name   HG ) ( resi  81 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  80 and name  HB# ) ( resi  81 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  80 and name  HD# ) ( resi  81 and name   HN )  3.00  1.20  1.10 !   11 {  seq}
! residue 81   Asp , NOEs forward in sequence
assi  ( resi  81 and name   HA ) ( resi  82 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  81 and name   HA ) ( resi  82 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  81 and name   HA ) ( resi  82 and name  HD# )  2.50  0.70  0.20 !    0 {  seq}
assi  ( resi  81 and name  HB# ) ( resi  82 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
! residue 82   Pro , NOEs forward in sequence
assi  ( resi  82 and name   HA ) ( resi  83 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  82 and name  HB# ) ( resi  83 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  82 and name  HB# ) ( resi  83 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
! residue 83   Asp , NOEs forward in sequence
assi  ( resi  83 and name   HN ) ( resi  84 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  83 and name   HN ) ( resi  84 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  83 and name   HA ) ( resi  84 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  83 and name  HB# ) ( resi  84 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 84   Ser , NOEs forward in sequence
! residue 85   Tyr , NOEs forward in sequence
assi  ( resi  85 and name   HN ) ( resi  86 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  85 and name  HB# ) ( resi  86 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  85 and name  HD# ) ( resi  86 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  85 and name  HD# ) ( resi  86 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
! residue 86   Asn , NOEs forward in sequence
assi  ( resi  86 and name   HN ) ( resi  87 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  86 and name   HN ) ( resi  87 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  86 and name   HN ) ( resi  87 and name  HB# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  86 and name   HN ) ( resi  87 and name  HG# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  86 and name   HA ) ( resi  87 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  86 and name  HB# ) ( resi  87 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  86 and name  HB# ) ( resi  87 and name  HE# )  4.00  2.20  1.00 !    0 {  seq}
! residue 87   Met , NOEs forward in sequence
assi  ( resi  87 and name   HA ) ( resi  88 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  87 and name   HA ) ( resi  88 and name  HD# )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  87 and name  HB# ) ( resi  88 and name   HN )  3.00  1.20  0.60 !   10 {  seq}
assi  ( resi  87 and name  HB# ) ( resi  88 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  87 and name  HG# ) ( resi  88 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 88   Phe , NOEs forward in sequence
assi  ( resi  88 and name   HN ) ( resi  89 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  88 and name  HB# ) ( resi  89 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  88 and name  HD# ) ( resi  89 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 89   Glu , NOEs forward in sequence
assi  ( resi  89 and name   HN ) ( resi  90 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  89 and name   HA ) ( resi  90 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  89 and name  HB# ) ( resi  90 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  89 and name  HG# ) ( resi  90 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 90   Asn , NOEs forward in sequence
assi  ( resi  90 and name   HN ) ( resi  91 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  90 and name   HA ) ( resi  91 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
assi  ( resi  90 and name  HB# ) ( resi  91 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
! residue 91   Gly , NOEs forward in sequence
assi  ( resi  91 and name   HN ) ( resi  92 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
assi  ( resi  91 and name  HA# ) ( resi  92 and name   HN )  2.50  0.70  0.50 !   10 {  seq}
! residue 92   Ser , NOEs forward in sequence
assi  ( resi  92 and name   HN ) ( resi  93 and name   HN )  3.00  1.20  0.90 !   20 {  seq}
! residue 93   Phe , NOEs forward in sequence
assi  ( resi  93 and name   HN ) ( resi  94 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  93 and name  HB# ) ( resi  94 and name   HN )  4.00  2.20  1.00 !    0 {  seq}
assi  ( resi  93 and name  HD# ) ( resi  94 and name   HA )  4.00  2.20  1.00 !    0 {  seq}
! residue 94   Leu , NOEs forward in sequence
! residue 95   Arg , NOEs forward in sequence
! residue 96   Arg , NOEs forward in sequence
! residue 97   Arg , NOEs forward in sequence
! residue 98   Arg , NOEs forward in sequence
! residue 99   Arg , NOEs forward in sequence
! residue 100  Phe , NOEs forward in sequence
! residue 101  Lys , NOEs forward in sequence
assi  ( resi   1 and name  HG# ) ( resi   3 and name   HA )  6.00  4.20  2.00 !    0 {short}
assi  ( resi   3 and name  HG# ) ( resi   5 and name   HA )  4.00  2.20  1.00 !    0 {short}
assi  ( resi   5 and name   HA ) ( resi   7 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi   5 and name  HB# ) ( resi   7 and name  HD# )  2.50  0.70  0.20 !    0 {short}
assi  ( resi   5 and name  HB# ) ( resi   7 and name  HE# )  2.50  0.70  0.20 !    0 {short}
assi  ( resi   7 and name   HN ) ( resi  11 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi   7 and name   HA ) ( resi  11 and name  HB# )  3.00  1.20  0.80 !    1 {short}
assi  ( resi   7 and name  HB1 ) ( resi  11 and name  HB# )  2.50  0.70  0.70 !    1 {short}
assi  ( resi   7 and name  HB2 ) ( resi  11 and name  HB# )  3.00  1.20  0.80 !    1 {short}
assi  ( resi   8 and name   HN ) ( resi  11 and name  HB# )  2.50  0.70  1.00 !   11 {short}
assi  ( resi   8 and name   HA ) ( resi  11 and name   HN )  6.00  4.20  2.00 !    0 {short}
assi  ( resi   8 and name   HN ) ( resi  12 and name  HD# )  6.00  4.20  2.00 !    0 {short}
assi  ( resi   9 and name   HN ) ( resi  12 and name  HD# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi   9 and name   HA ) ( resi  12 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi   9 and name   HA ) ( resi  12 and name  HB1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi   9 and name   HA ) ( resi  12 and name  HB2 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi   9 and name   HA ) ( resi  12 and name   HG )  4.00  2.20  1.00 !    0 {short}
assi  ( resi   9 and name   HA ) ( resi  12 and name  HD# )  3.00  1.20  0.80 !    1 {short}
assi  ( resi   9 and name  HB1 ) ( resi  13 and name HD1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi   9 and name  HB2 ) ( resi  13 and name HD1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  10 and name   HA ) ( resi  13 and name   HB )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  10 and name   HA ) ( resi  13 and name HG2# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  10 and name   HA ) ( resi  13 and name HD1# )  3.00  1.20  0.80 !    1 {short}
assi  ( resi  10 and name HG2# ) ( resi  13 and name   HB )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  10 and name HG2# ) ( resi  14 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  10 and name HG2# ) ( resi  14 and name   HB )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  11 and name   HA ) ( resi  14 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  11 and name   HA ) ( resi  14 and name   HA )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  11 and name   HA ) ( resi  14 and name   HB )  2.50  0.70  0.20 !    0 {short}
assi  ( resi  11 and name   HA ) ( resi  14 and name HG2# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  11 and name  HB# ) ( resi  14 and name   HB )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  11 and name   HA ) ( resi  15 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  12 and name   HA ) ( resi  15 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  12 and name   HA ) ( resi  15 and name  HB1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  12 and name   HA ) ( resi  15 and name  HB2 )  3.00  1.20  0.30 !    0 {short}
assi  ( resi  12 and name   HA ) ( resi  15 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  12 and name  HD# ) ( resi  15 and name  HB1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  12 and name  HD# ) ( resi  15 and name  HB2 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  12 and name  HD# ) ( resi  15 and name  HE# )  2.50  0.70  1.20 !    2 {short}
assi  ( resi  13 and name   HB ) ( resi  15 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  13 and name   HA ) ( resi  16 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  13 and name   HA ) ( resi  16 and name  HB# )  2.50  0.70  0.70 !    1 {short}
assi  ( resi  13 and name HG2# ) ( resi  16 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  13 and name HG2# ) ( resi  17 and name HG2# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  13 and name HG2# ) ( resi  17 and name HD1# )  2.50  0.70  1.20 !    2 {short}
assi  ( resi  13 and name HG2# ) ( resi  17 and name HG1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  14 and name   HA ) ( resi  17 and name   HB )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  14 and name   HA ) ( resi  17 and name HG2# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  14 and name   HA ) ( resi  17 and name HD1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  14 and name   HB ) ( resi  17 and name HD1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  14 and name HG2# ) ( resi  17 and name   HB )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  14 and name HG2# ) ( resi  17 and name HD1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  14 and name HG2# ) ( resi  18 and name  HB2 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  14 and name HG2# ) ( resi  18 and name  HG# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  14 and name HG2# ) ( resi  18 and name HE2# )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  15 and name   HA ) ( resi  18 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  15 and name   HA ) ( resi  18 and name  HG# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  16 and name   HN ) ( resi  19 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  17 and name   HA ) ( resi  20 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  17 and name   HA ) ( resi  20 and name  HB# )  3.00  1.20  0.80 !    1 {short}
assi  ( resi  17 and name HG2# ) ( resi  20 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  17 and name HG2# ) ( resi  20 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  18 and name   HA ) ( resi  20 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  18 and name   HA ) ( resi  20 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  18 and name  HB2 ) ( resi  20 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  20 and name  HB# ) ( resi  23 and name   HA )  2.50  0.70  0.70 !    1 {short}
assi  ( resi  25 and name HD1# ) ( resi  29 and name  HA2 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  25 and name HG1# ) ( resi  29 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  25 and name HG1# ) ( resi  29 and name  HA1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  25 and name HG1# ) ( resi  29 and name  HA2 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  26 and name   HB ) ( resi  28 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  26 and name HG2# ) ( resi  28 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  26 and name HG2# ) ( resi  28 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  27 and name   HA ) ( resi  30 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  27 and name   HA ) ( resi  30 and name   HB )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  27 and name   HA ) ( resi  30 and name HG2# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  27 and name   HA ) ( resi  30 and name HD1# )  2.50  0.70  0.70 !    1 {short}
assi  ( resi  27 and name   HA ) ( resi  30 and name HG1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  27 and name   HG ) ( resi  31 and name  HE# )  2.50  0.70  0.20 !    0 {short}
assi  ( resi  27 and name  HD# ) ( resi  31 and name  HE# )  2.50  0.70  0.70 !    1 {short}
assi  ( resi  28 and name   HN ) ( resi  31 and name  HD# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  28 and name   HA ) ( resi  31 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  28 and name   HA ) ( resi  31 and name  HB1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  28 and name   HA ) ( resi  31 and name  HB2 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  28 and name   HA ) ( resi  31 and name  HD# )  2.50  0.70  0.20 !    0 {short}
assi  ( resi  28 and name   HA ) ( resi  31 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  28 and name  HB# ) ( resi  31 and name  HD# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  29 and name  HA1 ) ( resi  32 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  29 and name  HA2 ) ( resi  32 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  30 and name   HA ) ( resi  33 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  30 and name   HA ) ( resi  33 and name  HB1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  30 and name   HA ) ( resi  34 and name HD1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  30 and name HG2# ) ( resi  34 and name HG2# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  30 and name HG2# ) ( resi  34 and name HG1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  31 and name   HA ) ( resi  34 and name   HB )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  31 and name   HA ) ( resi  34 and name HG2# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  31 and name   HA ) ( resi  34 and name HD1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  31 and name   HA ) ( resi  35 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  31 and name  HB2 ) ( resi  35 and name  HE# )  3.00  1.20  0.80 !    1 {short}
assi  ( resi  32 and name   HA ) ( resi  35 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  32 and name   HA ) ( resi  35 and name  HE# )  2.50  0.70  0.70 !    1 {short}
assi  ( resi  32 and name   HA ) ( resi  35 and name  HG# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  32 and name   HA ) ( resi  36 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  33 and name   HA ) ( resi  36 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  33 and name   HA ) ( resi  36 and name  HB1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  33 and name   HA ) ( resi  36 and name  HB2 )  3.00  1.20  0.30 !    0 {short}
assi  ( resi  34 and name   HA ) ( resi  37 and name  HG# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  34 and name   HA ) ( resi  38 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  34 and name HG2# ) ( resi  38 and name  HB1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  34 and name HG2# ) ( resi  38 and name  HB2 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  34 and name HG2# ) ( resi  38 and name  HD# )  3.00  1.20  0.80 !    1 {short}
assi  ( resi  34 and name HG2# ) ( resi  38 and name  HE# )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  35 and name   HA ) ( resi  38 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  36 and name   HN ) ( resi  38 and name   HN )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  38 and name  HB2 ) ( resi  40 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  38 and name  HB1 ) ( resi  41 and name  HD# )  3.00  1.20  0.30 !    0 {short}
assi  ( resi  38 and name  HB1 ) ( resi  41 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  38 and name  HB2 ) ( resi  41 and name   HN )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  38 and name  HB2 ) ( resi  41 and name  HD# )  2.50  0.70  0.20 !    0 {short}
assi  ( resi  38 and name  HB2 ) ( resi  41 and name  HE# )  2.50  0.70  0.20 !    0 {short}
assi  ( resi  38 and name  HD# ) ( resi  41 and name  HD# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  38 and name  HD# ) ( resi  41 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  39 and name   HA ) ( resi  41 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  39 and name   HA ) ( resi  42 and name  HD# )  3.00  1.20  0.30 !    0 {short}
assi  ( resi  40 and name   HA ) ( resi  42 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  40 and name   HA ) ( resi  43 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  41 and name   HA ) ( resi  44 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  41 and name  HD# ) ( resi  44 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  42 and name   HA ) ( resi  45 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  43 and name   HA ) ( resi  45 and name  HG# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  43 and name   HA ) ( resi  45 and name  HE# )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  44 and name   HA ) ( resi  46 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  44 and name  HB# ) ( resi  47 and name  HA# )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  44 and name  HB# ) ( resi  48 and name  HD1 )  3.00  1.20  0.30 !    0 {short}
assi  ( resi  44 and name  HB# ) ( resi  48 and name  HE1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  45 and name   HA ) ( resi  48 and name   HN )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  45 and name   HA ) ( resi  48 and name  HD1 )  3.00  1.20  0.30 !    0 {short}
assi  ( resi  45 and name   HA ) ( resi  48 and name  HE1 )  3.00  1.20  0.30 !    0 {short}
assi  ( resi  45 and name  HB# ) ( resi  48 and name  HD1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  45 and name  HG# ) ( resi  48 and name  HZ2 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  45 and name  HB1 ) ( resi  49 and name  HG# )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  46 and name   HN ) ( resi  48 and name   HN )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  46 and name   HN ) ( resi  48 and name  HD1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  46 and name   HA ) ( resi  48 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  46 and name   HA ) ( resi  48 and name  HD1 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  46 and name  HB# ) ( resi  48 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  46 and name  HB# ) ( resi  48 and name  HD1 )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  46 and name   HA ) ( resi  49 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  47 and name  HA# ) ( resi  50 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  48 and name   HA ) ( resi  51 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  48 and name   HA ) ( resi  51 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  48 and name  HE3 ) ( resi  52 and name   HB )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  48 and name  HE3 ) ( resi  52 and name HD1# )  3.00  1.20  0.80 !    1 {short}
assi  ( resi  48 and name  HE3 ) ( resi  52 and name HG1# )  3.00  1.20  0.30 !    0 {short}
assi  ( resi  49 and name   HA ) ( resi  52 and name   HB )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  49 and name   HA ) ( resi  52 and name HG2# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  49 and name   HA ) ( resi  52 and name HD1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  49 and name   HA ) ( resi  52 and name HG1# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  50 and name   HA ) ( resi  52 and name   HN )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  50 and name   HA ) ( resi  53 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  50 and name   HA ) ( resi  53 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  50 and name   HA ) ( resi  53 and name  HD# )  3.00  1.20  0.30 !    0 {short}
assi  ( resi  51 and name   HA ) ( resi  54 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  51 and name   HA ) ( resi  54 and name  HB# )  3.00  1.20  0.30 !    0 {short}
assi  ( resi  52 and name   HA ) ( resi  55 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  52 and name   HA ) ( resi  55 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  52 and name HD1# ) ( resi  55 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  52 and name HG2# ) ( resi  56 and name  HD# )  3.00  1.20  1.30 !    2 {short}
assi  ( resi  52 and name HG1# ) ( resi  56 and name   HG )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  53 and name   HA ) ( resi  56 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  53 and name   HA ) ( resi  56 and name   HA )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  53 and name   HA ) ( resi  56 and name  HB2 )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  53 and name   HA ) ( resi  56 and name  HD# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  54 and name  HD2 ) ( resi  58 and name  HD# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  54 and name  HE1 ) ( resi  58 and name  HD# )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  55 and name   HA ) ( resi  58 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  55 and name   HA ) ( resi  58 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  55 and name   HA ) ( resi  58 and name  HD# )  2.50  0.70  0.70 !    1 {short}
assi  ( resi  55 and name  HB# ) ( resi  58 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  55 and name   HA ) ( resi  59 and name HD2# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  58 and name  HB# ) ( resi  60 and name  HG# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  59 and name   HA ) ( resi  61 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  59 and name  HB# ) ( resi  62 and name  HD# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  59 and name  HB# ) ( resi  62 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  67 and name  HD# ) ( resi  70 and name   HN )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  67 and name  HD# ) ( resi  71 and name  HG# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  68 and name   HA ) ( resi  70 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  68 and name  HB# ) ( resi  70 and name   HN )  2.50  0.70  0.50 !   10 {short}
assi  ( resi  68 and name   HN ) ( resi  71 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  68 and name  HB# ) ( resi  71 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  68 and name  HB# ) ( resi  71 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  69 and name   HN ) ( resi  71 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  69 and name   HA ) ( resi  71 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  74 and name  HB# ) ( resi  77 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  81 and name  HB# ) ( resi  84 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  82 and name   HA ) ( resi  84 and name   HN )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  82 and name  HB# ) ( resi  84 and name   HN )  6.00  4.20  2.00 !    0 {short}
assi  ( resi  82 and name  HB# ) ( resi  84 and name   HA )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  82 and name  HD# ) ( resi  84 and name   HA )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  83 and name  HB# ) ( resi  85 and name  HD# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  84 and name   HA ) ( resi  87 and name  HB# )  3.00  1.20  0.30 !    0 {short}
assi  ( resi  84 and name  HB# ) ( resi  87 and name  HE# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  84 and name  HB# ) ( resi  87 and name  HB# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi  84 and name  HB# ) ( resi  87 and name  HG# )  4.00  2.20  1.00 !    0 {short}
assi  ( resi   2 and name  HD# ) ( resi  39 and name  HB# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi   2 and name  HD# ) ( resi  39 and name  HG# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   2 and name  HB1 ) ( resi  40 and name   HN )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   2 and name  HB1 ) ( resi  40 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   2 and name  HB1 ) ( resi  40 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   2 and name  HB2 ) ( resi  40 and name   HN )  6.00  4.20  2.00 !    0 { long}
assi  ( resi   2 and name  HB2 ) ( resi  40 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   2 and name  HB2 ) ( resi  40 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   2 and name  HD# ) ( resi  40 and name   HN )  3.00  1.20  1.10 !   11 { long}
assi  ( resi   2 and name  HD# ) ( resi  40 and name   HA )  3.00  1.20  0.80 !    1 { long}
assi  ( resi   2 and name  HD# ) ( resi  43 and name  HG# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   3 and name   HN ) ( resi  40 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   4 and name   HN ) ( resi  40 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   4 and name   HA ) ( resi  40 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   4 and name  HG# ) ( resi  40 and name  HD# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi   4 and name  HG# ) ( resi  40 and name  HE# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi   4 and name  HD# ) ( resi  40 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   4 and name   HA ) ( resi  41 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   5 and name  HB# ) ( resi  12 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   5 and name  HG# ) ( resi  12 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   5 and name  HB# ) ( resi  38 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   5 and name  HB# ) ( resi  38 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   5 and name  HG# ) ( resi  38 and name  HD# )  3.00  1.20  0.30 !    0 { long}
assi  ( resi   5 and name  HG# ) ( resi  38 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   5 and name  HD# ) ( resi  40 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   5 and name  HD# ) ( resi  40 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   5 and name  HD# ) ( resi  40 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   5 and name  HB# ) ( resi  41 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   5 and name  HG# ) ( resi  41 and name  HE# )  3.00  1.20  0.30 !    0 { long}
assi  ( resi   5 and name  HD# ) ( resi  41 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   5 and name  HD# ) ( resi  41 and name  HE# )  2.50  0.70  0.20 !    0 { long}
assi  ( resi   7 and name   HN ) ( resi  12 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   7 and name   HA ) ( resi  12 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   7 and name  HB1 ) ( resi  12 and name   HG )  2.50  0.70  0.20 !    0 { long}
assi  ( resi   7 and name  HB1 ) ( resi  12 and name  HD# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi   7 and name  HB2 ) ( resi  12 and name  HD# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi   7 and name  HD# ) ( resi  12 and name  HD# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi   7 and name  HE# ) ( resi  12 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   7 and name  HB1 ) ( resi  15 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   7 and name  HD# ) ( resi  15 and name  HE# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi   7 and name  HE# ) ( resi  15 and name  HE# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi   7 and name  HD# ) ( resi  38 and name  HD# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi   7 and name  HD# ) ( resi  38 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   7 and name  HE# ) ( resi  38 and name  HE# )  2.50  0.70  0.20 !    0 { long}
assi  ( resi   9 and name  HD# ) ( resi  41 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   9 and name  HE# ) ( resi  41 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   9 and name  HE# ) ( resi  41 and name  HE# )  3.00  1.20  0.30 !    0 { long}
assi  ( resi   9 and name  HD# ) ( resi  51 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   9 and name  HE# ) ( resi  51 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   9 and name   HA ) ( resi  52 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   9 and name  HB1 ) ( resi  52 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   9 and name  HB2 ) ( resi  52 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi   9 and name  HD# ) ( resi  52 and name HD1# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi   9 and name  HD# ) ( resi  52 and name HG1# )  3.00  1.20  0.30 !    0 { long}
assi  ( resi   9 and name  HE# ) ( resi  52 and name HD1# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi   9 and name  HE# ) ( resi  52 and name HG1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  10 and name HD1# ) ( resi  55 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  10 and name HD1# ) ( resi  55 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  10 and name HD1# ) ( resi  59 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  12 and name   HA ) ( resi  34 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  12 and name  HB1 ) ( resi  34 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  12 and name  HB2 ) ( resi  34 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  12 and name  HD# ) ( resi  34 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  12 and name  HD# ) ( resi  34 and name HG2# )  3.00  1.20  1.30 !    2 { long}
assi  ( resi  12 and name  HD# ) ( resi  34 and name HD1# )  2.50  0.70  1.20 !    2 { long}
assi  ( resi  12 and name  HD# ) ( resi  34 and name HG1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  12 and name  HD# ) ( resi  38 and name  HE# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  12 and name  HD# ) ( resi  41 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  12 and name  HB1 ) ( resi  52 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name HG2# ) ( resi  25 and name HG2# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name HG2# ) ( resi  27 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name   HA ) ( resi  30 and name HG2# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  13 and name HG2# ) ( resi  30 and name HG2# )  3.00  1.20  1.30 !    2 { long}
assi  ( resi  13 and name HG2# ) ( resi  30 and name HD1# )  2.50  0.70  1.20 !    2 { long}
assi  ( resi  13 and name HG1# ) ( resi  30 and name HG2# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name   HN ) ( resi  52 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name HG2# ) ( resi  52 and name HG2# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name HG2# ) ( resi  52 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name HD1# ) ( resi  52 and name   HN )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  13 and name HD1# ) ( resi  52 and name   HA )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  13 and name HD1# ) ( resi  52 and name HD1# )  2.50  0.70  1.20 !    2 { long}
assi  ( resi  13 and name HD1# ) ( resi  52 and name HG1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name HG1# ) ( resi  52 and name HD1# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  13 and name HD1# ) ( resi  55 and name  HB# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  13 and name HG2# ) ( resi  56 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name HG2# ) ( resi  56 and name  HD# )  2.50  0.70  1.20 !    2 { long}
assi  ( resi  13 and name HD1# ) ( resi  56 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name HD1# ) ( resi  56 and name  HD# )  3.00  1.20  1.30 !    2 { long}
assi  ( resi  13 and name HG1# ) ( resi  56 and name  HD# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  13 and name HG2# ) ( resi  62 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name HG2# ) ( resi  62 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  13 and name HG2# ) ( resi  80 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  14 and name   HA ) ( resi  62 and name  HD# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  14 and name   HA ) ( resi  80 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  14 and name   HB ) ( resi  80 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  16 and name   HA ) ( resi  25 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  16 and name  HB# ) ( resi  25 and name HG2# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  16 and name  HB# ) ( resi  30 and name   HA )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  16 and name  HB# ) ( resi  30 and name HG2# )  2.50  0.70  1.20 !    2 { long}
assi  ( resi  16 and name  HB# ) ( resi  30 and name HD1# )  3.00  1.20  1.30 !    2 { long}
assi  ( resi  16 and name  HB# ) ( resi  30 and name HG1# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  16 and name  HB# ) ( resi  33 and name  HB1 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  16 and name  HB# ) ( resi  33 and name  HB2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  16 and name  HB# ) ( resi  33 and name  HB# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  16 and name  HB# ) ( resi  33 and name  HD# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  16 and name  HB# ) ( resi  34 and name HG1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  17 and name HG2# ) ( resi  23 and name   HA )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  17 and name HG2# ) ( resi  23 and name  HD# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  17 and name HG2# ) ( resi  24 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  17 and name   HA ) ( resi  25 and name HG2# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  17 and name HG2# ) ( resi  25 and name   HN )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  17 and name HG2# ) ( resi  30 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  17 and name HD1# ) ( resi  56 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  17 and name HD1# ) ( resi  62 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  17 and name HD1# ) ( resi  62 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  17 and name HG2# ) ( resi  79 and name   HA )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  17 and name HD1# ) ( resi  79 and name   HA )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  17 and name HG2# ) ( resi  80 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  17 and name HD1# ) ( resi  80 and name   HN )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  17 and name HD1# ) ( resi  80 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  17 and name HD1# ) ( resi  80 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  17 and name HD1# ) ( resi  80 and name  HD# )  3.00  1.20  1.30 !    2 { long}
assi  ( resi  18 and name   HA ) ( resi  23 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  18 and name   HA ) ( resi  23 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  19 and name HD2# ) ( resi  33 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  20 and name  HB# ) ( resi  25 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  20 and name  HB# ) ( resi  25 and name HG2# )  2.50  0.70  1.20 !    2 { long}
assi  ( resi  20 and name  HB# ) ( resi  25 and name HD1# )  2.50  0.70  1.20 !    2 { long}
assi  ( resi  24 and name  HB# ) ( resi  65 and name  HG# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  24 and name  HG# ) ( resi  65 and name  HG# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  24 and name  HD# ) ( resi  65 and name  HG# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  24 and name   HA ) ( resi  77 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  24 and name   HA ) ( resi  77 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  24 and name  HB# ) ( resi  77 and name  HD# )  2.50  0.70  0.20 !    0 { long}
assi  ( resi  24 and name  HD# ) ( resi  77 and name  HD# )  3.00  1.20  0.30 !    0 { long}
assi  ( resi  24 and name   HA ) ( resi  79 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  24 and name   HA ) ( resi  79 and name   HB )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  24 and name  HB# ) ( resi  79 and name   HB )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  24 and name  HG# ) ( resi  79 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  24 and name  HG# ) ( resi  79 and name   HB )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  24 and name  HE# ) ( resi  79 and name HG2# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  25 and name   HN ) ( resi  77 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  25 and name   HN ) ( resi  77 and name  HD# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  25 and name   HN ) ( resi  78 and name   HN )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  25 and name HG2# ) ( resi  78 and name  HB1 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  25 and name HG2# ) ( resi  78 and name  HB2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  26 and name HG2# ) ( resi  67 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  26 and name   HA ) ( resi  77 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  26 and name HG2# ) ( resi  77 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  26 and name HG2# ) ( resi  77 and name  HD# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  26 and name HG2# ) ( resi  77 and name  HE# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  26 and name   HA ) ( resi  78 and name  HD1 )  3.00  1.20  0.30 !    0 { long}
assi  ( resi  27 and name  HD# ) ( resi  52 and name   HB )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  27 and name   HG ) ( resi  53 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  27 and name   HG ) ( resi  53 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  27 and name   HG ) ( resi  53 and name  HG# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  27 and name   HG ) ( resi  53 and name  HD# )  3.00  1.20  0.30 !    0 { long}
assi  ( resi  27 and name  HD# ) ( resi  53 and name  HB# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  27 and name  HD# ) ( resi  53 and name  HG# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  27 and name  HD# ) ( resi  53 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  27 and name   HA ) ( resi  56 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  27 and name   HG ) ( resi  56 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  27 and name  HD# ) ( resi  56 and name  HD# )  2.50  0.70  1.20 !    2 { long}
assi  ( resi  27 and name   HA ) ( resi  78 and name  HD1 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  27 and name  HB2 ) ( resi  78 and name  HD1 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  30 and name HG2# ) ( resi  56 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  30 and name HD1# ) ( resi  56 and name  HD# )  2.50  0.70  1.20 !    2 { long}
assi  ( resi  31 and name   HA ) ( resi  48 and name  HZ2 )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  31 and name   HA ) ( resi  48 and name  HH2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  31 and name  HB2 ) ( resi  48 and name  HH2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  31 and name  HE# ) ( resi  48 and name  HE3 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  31 and name  HD# ) ( resi  49 and name  HG# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  31 and name  HE# ) ( resi  49 and name   HA )  2.50  0.70  0.20 !    0 { long}
assi  ( resi  31 and name  HE# ) ( resi  49 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  31 and name  HE# ) ( resi  49 and name  HG# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  31 and name  HD# ) ( resi  52 and name HG1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  31 and name  HE# ) ( resi  52 and name   HN )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  31 and name  HE# ) ( resi  52 and name   HB )  2.50  0.70  0.20 !    0 { long}
assi  ( resi  31 and name  HE# ) ( resi  52 and name HG2# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  31 and name  HE# ) ( resi  52 and name HG1# )  3.00  1.20  0.30 !    0 { long}
assi  ( resi  31 and name  HE# ) ( resi  53 and name   HN )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  34 and name HG2# ) ( resi  41 and name   HN )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  34 and name HG2# ) ( resi  41 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  34 and name HG2# ) ( resi  41 and name  HB# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  34 and name HG2# ) ( resi  41 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  34 and name HG2# ) ( resi  41 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  34 and name HD1# ) ( resi  41 and name  HD# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  34 and name   HB ) ( resi  48 and name  HH2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  34 and name HG2# ) ( resi  48 and name  HZ2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  34 and name HG2# ) ( resi  48 and name  HH2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  34 and name HD1# ) ( resi  48 and name  HH2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  34 and name HG2# ) ( resi  52 and name HD1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  34 and name HD1# ) ( resi  52 and name HG1# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  35 and name   HA ) ( resi  42 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  35 and name   HA ) ( resi  42 and name  HG# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  35 and name  HB# ) ( resi  42 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  35 and name  HG# ) ( resi  42 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  35 and name   HA ) ( resi  48 and name  HZ2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  35 and name  HE# ) ( resi  48 and name  HZ2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  35 and name  HE# ) ( resi  48 and name  HH2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  35 and name  HG# ) ( resi  48 and name  HZ2 )  2.50  0.70  0.20 !    0 { long}
assi  ( resi  35 and name  HG# ) ( resi  48 and name  HH2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  41 and name   HA ) ( resi  48 and name  HD1 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  41 and name  HB# ) ( resi  48 and name  HD1 )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  41 and name  HD# ) ( resi  48 and name  HD1 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  41 and name  HD# ) ( resi  48 and name  HE1 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  41 and name  HE# ) ( resi  48 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  41 and name  HE# ) ( resi  48 and name  HD1 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  42 and name   HA ) ( resi  48 and name  HZ2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  56 and name   HA ) ( resi  62 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  56 and name   HA ) ( resi  62 and name  HD# )  3.00  1.20  0.30 !    0 { long}
assi  ( resi  56 and name  HB1 ) ( resi  62 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  56 and name  HD# ) ( resi  62 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  56 and name  HD# ) ( resi  62 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  56 and name  HB2 ) ( resi  78 and name  HZ2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  56 and name  HD# ) ( resi  78 and name  HB1 )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  56 and name  HD# ) ( resi  78 and name  HB2 )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  56 and name  HD# ) ( resi  78 and name  HD1 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  56 and name  HD# ) ( resi  78 and name  HE3 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  56 and name  HD# ) ( resi  78 and name  HZ2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  56 and name  HD# ) ( resi  78 and name  HZ3 )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  56 and name  HD# ) ( resi  78 and name  HH2 )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  57 and name   HA ) ( resi  64 and name  HE# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  57 and name  HB# ) ( resi  64 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  57 and name   HA ) ( resi  78 and name  HZ2 )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  57 and name   HA ) ( resi  78 and name  HZ3 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  57 and name   HA ) ( resi  78 and name  HH2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  57 and name  HB# ) ( resi  78 and name  HZ2 )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  61 and name  HB# ) ( resi  80 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  61 and name   HA ) ( resi  81 and name   HN )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  62 and name  HB# ) ( resi  78 and name  HE3 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  62 and name  HB# ) ( resi  78 and name  HH2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  62 and name   HA ) ( resi  80 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  62 and name   HA ) ( resi  80 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  62 and name  HD# ) ( resi  80 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  62 and name  HD# ) ( resi  80 and name   HG )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  62 and name  HD# ) ( resi  80 and name  HB# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  62 and name  HD# ) ( resi  80 and name  HD# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  62 and name  HE# ) ( resi  80 and name  HD# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  62 and name   HA ) ( resi  81 and name   HN )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  63 and name   HN ) ( resi  79 and name   HN )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  63 and name   HN ) ( resi  79 and name HG2# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  63 and name   HB ) ( resi  79 and name HG2# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  63 and name   HN ) ( resi  80 and name   HA )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  63 and name  HG# ) ( resi  80 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  63 and name  HG# ) ( resi  81 and name   HA )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  63 and name  HG# ) ( resi  81 and name  HB# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  63 and name  HG# ) ( resi  82 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  64 and name  HG# ) ( resi  76 and name  HB# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  64 and name  HD# ) ( resi  76 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  64 and name  HE# ) ( resi  76 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  64 and name   HA ) ( resi  78 and name   HA )  3.00  1.20  0.30 !    0 { long}
assi  ( resi  64 and name   HA ) ( resi  78 and name  HZ3 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  64 and name  HB# ) ( resi  78 and name  HZ2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  64 and name  HG# ) ( resi  78 and name  HZ2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  64 and name  HD# ) ( resi  78 and name  HZ2 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  64 and name  HD# ) ( resi  78 and name  HZ3 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  64 and name  HE# ) ( resi  78 and name  HZ2 )  3.00  1.20  0.30 !    0 { long}
assi  ( resi  64 and name  HE# ) ( resi  78 and name  HZ3 )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  64 and name   HA ) ( resi  79 and name   HN )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  64 and name   HA ) ( resi  79 and name HG2# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  65 and name   HN ) ( resi  77 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  65 and name   HB ) ( resi  77 and name  HB# )  3.00  1.20  0.30 !    0 { long}
assi  ( resi  65 and name   HB ) ( resi  77 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  65 and name  HG# ) ( resi  77 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  65 and name  HG# ) ( resi  77 and name  HB# )  2.50  0.70  0.70 !    1 { long}
assi  ( resi  65 and name  HG# ) ( resi  77 and name  HD# )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  65 and name   HN ) ( resi  78 and name   HA )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  65 and name  HG# ) ( resi  78 and name   HN )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  65 and name  HG# ) ( resi  78 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  65 and name   HN ) ( resi  79 and name HG2# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  65 and name  HG# ) ( resi  79 and name   HN )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  65 and name  HG# ) ( resi  79 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  65 and name  HG# ) ( resi  79 and name   HB )  3.00  1.20  0.80 !    1 { long}
assi  ( resi  65 and name  HG# ) ( resi  79 and name HG2# )  2.50  0.70  1.20 !    2 { long}
assi  ( resi  66 and name   HA ) ( resi  76 and name   HA )  3.00  1.20  0.30 !    0 { long}
assi  ( resi  66 and name   HA ) ( resi  76 and name  HB# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  67 and name  HD# ) ( resi  72 and name   HA )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  67 and name  HD# ) ( resi  74 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  67 and name   HN ) ( resi  76 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  67 and name  HG# ) ( resi  76 and name   HA )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  67 and name   HA ) ( resi  77 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  67 and name   HA ) ( resi  77 and name  HE# )  3.00  1.20  0.30 !    0 { long}
assi  ( resi  67 and name  HB# ) ( resi  77 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  67 and name  HB# ) ( resi  77 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  67 and name  HD# ) ( resi  77 and name  HD# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  67 and name  HD# ) ( resi  77 and name  HE# )  4.00  2.20  1.00 !    0 { long}
assi  ( resi  68 and name   HN ) ( resi  77 and name  HD# )  6.00  4.20  2.00 !    0 { long}
assi  ( resi  87 and name  HE# ) ( resi  93 and name  HB# )  4.00  2.20  1.00 !    0 { long}

! S12 ambiguous distance restraints

assi (resi 9    and name HA  ) ((resi 13   and name HD1#)
                             or (resi 12   and name HD#)
                             or (resi 37   and name HG#))   2.50  0.70  0.70
assi (resi 9    and name HA  ) ((resi 37   and name HB# )
                             or (resi 52   and name HD# ))  4.00  2.20  1.50
assi (resi 9    and name HA  ) ((resi 51   and name HB# )
                             or (resi 52   and name HA ))   4.00  2.20  1.50
assi (resi 9    and name HN  ) ((resi  8   and name HA )
                             or (resi  9   and name HA ))   2.50  0.70  0.70
assi (resi 10   and name HN  ) ((resi  8   and name HA )
                             or (resi  9   and name HA ))   3.00  1.20  1.00
assi (resi 12   and name HB# ) ((resi 12   and name HG )
                             or (resi 11   and name HB#)
                             or (resi 52   and name HG1#))  4.00  2.20  1.50
assi (resi 15   and name HA  ) ((resi 15   and name HG# )
                             or (resi 18   and name HG# ))  4.00  2.20  1.50
assi (resi 16   and name HB# ) ((resi 17   and name HD#  )
                             or (resi 25   and name HD1# )) 2.50  0.70  0.70
assi (resi 17   and name HN  ) ((resi 17   and name HB  )
                             or (resi 17   and name HG# ))  2.50  0.70  0.70
assi (resi 18   and name HN  ) ((resi 17   and name HB  )
                             or (resi 17   and name HG# ))  3.00  1.20  1.00
assi (resi 18   and name HE2#) ((resi 18   and name HB# )
                             or (resi 18   and name HG# ))  3.00  1.20  1.00
assi (resi 18   and name HN  ) ((resi 18   and name HB# )
                             or (resi 18   and name HG# ))  2.50  0.70  0.70
assi (resi 25   and name HG2#) ((resi 17   and name HB  )
                             or (resi 17   and name HG# ))  4.00  2.20  1.50
assi ((resi 17   and name HD1# ) or
      (resi 25   and name HD1#))  (resi 20   and name HB#)  4.00  2.20  1.50
assi ((resi 17   and name HD1# ) or
      (resi 25   and name HD1#))  (resi 20   and name HN )  4.00  2.20  1.50
assi ((resi 21   and name HD1 ) or
      (resi 22   and name HA ))  (resi 20   and name HB#)   4.00  2.20  1.50
assi ((resi 13   and name HD1#) or
      (resi 37   and name HG#) or
      (resi 12   and name HD2#)) (resi 34   and name HA  )  4.00  2.20  1.50
assi ((resi 12   and name HB#) or
      (resi 16   and name HB#)) (resi 34   and name HN  )   4.00  2.20  1.50
assi ((resi 16   and name HB# ) or
      (resi 12   and name HB#))  (resi 30   and name HG2#)  2.50  0.70  0.70
assi ((resi 25   and name HD1# ) or
      (resi 25   and name HG2#))  (resi 30   and name HN )  4.00  2.20  1.50
assi (resi 20    and name HN  ) ((resi 18   and name HN  )
                             or (resi 23   and name HN  ))  3.00  1.20  1.00
assi ((resi 27   and name HD#) or
      (resi 56   and name HB#) or
      (resi 30   and name HD1#) or
      (resi 13   and name HG1#))  (resi 25   and name HG2#) 2.50  0.70  0.70
assi ((resi 25   and name HD1# ) or
      (resi 25   and name HG2#))  (resi 29   and name HN )  4.00  2.20  1.50
assi ((resi 27   and name HD# ) or
      (resi 30   and name HD1#))  (resi 27   and name HA )  2.50  0.70  0.70
assi ((resi 27   and name HA ) or
      (resi 53   and name HA ))  (resi 27   and name HD# )  2.50  0.70  0.70
assi (resi 30   and name HA  ) ((resi 56   and name HG )
                             or (resi 13   and name HG1#)
                             or (resi 27   and name HD#))   4.00  2.20  1.50
assi ((resi 30   and name HG1#) or
      (resi 12   and name HD#) or
      (resi 13   and name HD1#) or
      (resi 37   and name HG#)) (resi 34   and name HG2#)   3.00  1.20  1.00
assi ((resi 33   and name HB#) or
      (resi 35   and name HG#))   (resi 35   and name HA )  4.00  2.20  1.50
assi ((resi 34   and name HG1#) or
      (resi  5   and name HB#))   (resi 12   and name HB#)  4.00  2.20  1.50
assi ((resi 39   and name HA  ) or
      (resi 42   and name HA  ))  (resi 35   and name HA )  4.00  2.20  1.50
assi ((resi 37   and name HB2 ) or
      (resi 37   and name HG# ))  (resi 37   and name HN )  2.50  0.70  0.70
assi ((resi 39   and name HA  ) or
      (resi 42   and name HA  ))  (resi 42   and name HG# ) 4.00  2.20  1.50
assi ((resi 39   and name HG#) or
      (resi 39   and name HB#))   (resi 38   and name HA )  4.00  2.20  1.50
assi ((resi 38   and name HB#) or
      (resi 39   and name HD#))   (resi 38   and name HA )  2.50  0.70  0.70
assi ((resi 12   and name HD#) or
      (resi 37   and name HG#))   (resi 38   and name HE#)  2.50  0.70  0.70
assi ((resi  5   and name HB#) or
      (resi 34   and name HG1#))  (resi 38   and name HD#)  4.00  2.20  1.50
assi ((resi 42   and name HG# ) or
      (resi 43   and name HB#))  (resi 43   and name HN  )  3.00  1.20  1.00
assi ((resi 44   and name HA  ) or
      (resi 48   and name HA ))  (resi 48   and name HD1 )  4.00  2.20  1.50
assi ((resi 43   and name HG# ) or
      (resi 46   and name HB#))  (resi 45   and name HN  )  4.00  2.20  1.50
assi ((resi 52   and name HD1#) or
      (resi 34   and name HD1#) or
      (resi 37   and name HB#))   (resi 35   and name HN )  4.00  2.20  1.50
assi ((resi 49   and name HA  ) or
      (resi 51   and name HB# )) (resi 52   and name HN  )  4.00  2.20  1.50
assi ((resi 30   and name HG1#) or
      (resi 53   and name HB#) or
      (resi 13   and name HG1#)) (resi 52   and name HD1#)  3.00  1.20  1.00
assi ((resi 30   and name HG1#) or
      (resi 12   and name HD#) or
      (resi 13   and name HD1#) or
      (resi 37   and name HG#)) (resi 52   and name HD1#)   2.50  0.70  0.70
assi ((resi 27   and name HD#) or
      (resi 56   and name HB#) or
      (resi 30   and name HD1#) or
      (resi 13   and name HG1#))  (resi 52   and name HD1#) 4.00  2.20  1.50
assi ((resi 27   and name HD#) or
      (resi 56   and name HB#) or
      (resi 30   and name HD1#) or
      (resi 13   and name HG1#))  (resi 52   and name HG2#) 2.50  0.70  0.70
assi ((resi 27   and name HD# ) or
      (resi 56   and name HB# ))  (resi 53   and name HA )  4.00  2.20  1.50
assi ((resi 27   and name HG  ) or
      (resi 27   and name HD# )) (resi 53   and name HD#  ) 2.50  0.70  0.70
assi ((resi 52   and name HG2#) or
      (resi 58   and name HD# )) (resi 54   and name HB#  ) 4.00  2.20  1.50
assi ((resi 30   and name HG1#) or
      (resi 12   and name HD#) or
      (resi 13   and name HD1#)) (resi 56   and name HA  )  4.00  2.20  1.50
assi ((resi 27   and name HD#) or
      (resi 30   and name HD1#) or
      (resi 56   and name HB#) or
      (resi 56   and name HG))  (resi 56   and name HD#)    2.50  0.70  0.70
assi ((resi 58   and name HB#) or
      (resi 58   and name HG )) (resi 57   and name HB#  )  4.00  2.20  1.50
assi ((resi 54   and name HA ) or
      (resi 57   and name HA )) (resi 57   and name HB#  )  2.50  0.70  0.70
assi (resi 52   and name HN  ) ((resi 53   and name HN  )
                             or (resi 51   and name HN))    2.50  0.70  0.70
assi (resi 53   and name HN  ) ((resi 52   and name HN  )
                             or (resi 54   and name HN))    2.50  0.70  0.70
assi (resi 55   and name HB# ) ((resi 12   and name HD# )
                             or (resi 13   and name HD1# )) 4.00 2.20  1.50
assi (resi 59   and name HA  ) ((resi 58   and name HB# )
                             or (resi 58   and name HG  ))  4.00 2.20  1.50
assi (resi 62   and name HN  ) ((resi 60   and name HA  )
                             or (resi 61   and name HA  ))  4.00 2.20  1.50
assi (resi 63   and name HA  ) ((resi 63   and name HG# )
                             or (resi 80   and name HD# ))  2.50 0.70  0.70
assi (resi 63   and name HA  ) ((resi 24   and name HD# )
                             or (resi 79   and name HG2# )) 4.00 2.20  1.50
assi (resi 64   and name HA  ) ((resi 63   and name HG# )
                             or (resi 65   and name HG# ))  3.00 1.20  1.00
assi (resi 68   and name HN  ) ((resi 66   and name HB# )
                             or (resi 72   and name HB# ))  4.00 2.20  1.50
assi (resi 68   and name HN  ) ((resi 66   and name HA  )
                             or (resi 65   and name HA  )
                             or (resi 69   and name HA   )) 4.00 2.20  1.50
assi (resi 69   and name HN  ) ((resi 70   and name HD# )
                             or (resi 71   and name HB# ))  4.00 2.20  1.50
assi (resi 77   and name HD# ) ((resi 25   and name HA )
                             or (resi 26   and name HA ))   3.00 1.20  1.00
assi (resi 77   and name HE# ) ((resi 25   and name HA )
                             or (resi 26   and name HA ))   4.00 2.20  1.50
assi (resi 77   and name HD# ) ((resi 24   and name HE# )
                             or (resi 68   and name HB# ))  4.00 2.20  1.50
assi (resi 77   and name HE# ) ((resi 24   and name HE# )
                             or (resi 68   and name HB# ))  4.00 2.20  1.50
assi (resi 78   and name HN  ) ((resi 78   and name HA  )
                             or (resi 24   and name HA  ))  4.00 2.20  1.50
assi (resi 78   and name HD1 ) ((resi 27   and name HD# )
                             or (resi 30   and name HD1#))  3.00 1.20  1.00
assi (resi 78   and name HD1 ) ((resi 77   and name HA  )
                             or (resi 26   and name HB  ))  4.00 2.20  1.50
assi (resi 78   and name HZ2 ) ((resi 27   and name HD# )
                             or (resi 56   and name HB# ))  4.00 2.20  1.50
assi (resi 79   and name HA  ) ((resi 78   and name HA  )
                             or (resi 24   and name HA  ))  4.00 2.20  1.50
assi (resi 79   and name HN  ) ((resi 63   and name HG# )
                             or (resi 65   and name HD# )
                             or (resi 80   and name HD#  )) 4.00 2.20  1.50
assi (resi 80   and name HA  ) ((resi 61   and name HB# )
                             or (resi 81   and name HB# ))  4.00 2.20  1.50
assi (resi 80   and name HG  ) ((resi 17   and name HD1# )
                             or (resi 17   and name HG# ))  4.00  2.20  1.50
assi (resi 80   and name HN  ) ((resi 17   and name HG2# )
                             or (resi 80   and name HD# ))  3.00  1.20  1.00
assi (resi 82   and name HD# ) ((resi 63   and name HG# )
                             or (resi 80   and name HD# ))  3.00 1.20  1.00

!S12 H-bonds

!L12
assign (resid  12 and name  N   ) (resid  8 and name   O  )  3.3  0.7  0.2
assign (resid  12 and name  HN  ) (resid  8 and name   O  )  2.3  0.7  0.2
!I13
assign (resid  13 and name  N   ) (resid  9 and name   O  )  3.3  0.7  0.2
assign (resid  13 and name  HN  ) (resid  9 and name   O  )  2.3  0.7  0.2
!T14
assign (resid  14 and name  N   ) (resid  10 and name   O  )  3.3  0.7  0.2
assign (resid  14 and name  HN  ) (resid  10 and name   O  )  2.3  0.7  0.2
!M15
assign (resid  15 and name  N   ) (resid  11 and name   O  )  3.3  0.7  0.2
assign (resid  15 and name  HN  ) (resid  11 and name   O  )  2.3  0.7  0.2
!A16
assign (resid  16 and name  N   ) (resid  12 and name   O  )  3.3  0.7  0.2
assign (resid  16 and name  HN  ) (resid  12 and name   O  )  2.3  0.7  0.2
!I17
assign (resid  17 and name  N   ) (resid  13 and name   O  )  3.3  0.7  0.2
assign (resid  17 and name  HN  ) (resid  13 and name   O  )  2.3  0.7  0.2
!Q18
assign (resid  18 and name  N   ) (resid  14 and name   O  )  3.3  0.7  0.2
assign (resid  18 and name  HN  ) (resid  14 and name   O  )  2.3  0.7  0.2
!N19
assign (resid  19 and name  N   ) (resid  15 and name   O  )  3.3  0.7  0.2
assign (resid  19 and name  HN  ) (resid  15 and name   O  )  2.3  0.7  0.2
!A20
assign (resid  20 and name  N   ) (resid  16 and name   O  )  3.3  0.7  0.2
assign (resid  20 and name  HN  ) (resid  16 and name   O  )  2.3  0.7  0.2
!I30
assign (resid  30 and name  N   ) (resid  26 and name   O  )  3.3  0.7  0.2
assign (resid  30 and name  HN  ) (resid  26 and name   O  )  2.3  0.7  0.2
!Y31
assign (resid  31 and name  N   ) (resid  27 and name   O  )  3.3  0.7  0.2
assign (resid  31 and name  HN  ) (resid  27 and name   O  )  2.3  0.7  0.2
!Q32
assign (resid  32 and name  N   ) (resid  28 and name   O  )  3.3  0.7  0.2
assign (resid  32 and name  HN  ) (resid  28 and name   O  )  2.3  0.7  0.2
!F33
assign (resid  33 and name  N   ) (resid  29 and name   O  )  3.3  0.7  0.2
assign (resid  33 and name  HN  ) (resid  29 and name   O  )  2.3  0.7  0.2
!I34
assign (resid  34 and name  N   ) (resid  30 and name   O  )  3.3  0.7  0.2
assign (resid  34 and name  HN  ) (resid  30 and name   O  )  2.3  0.7  0.2
!M35
assign (resid  35 and name  N   ) (resid  31 and name   O  )  3.3  0.7  0.2
assign (resid  35 and name  HN  ) (resid  31 and name   O  )  2.3  0.7  0.2
!D36
assign (resid  36 and name  N   ) (resid  32 and name   O  )  3.3  0.7  0.2
assign (resid  36 and name  HN  ) (resid  32 and name   O  )  2.3  0.7  0.2
!R37
assign (resid  37 and name  N   ) (resid  33 and name   O  )  3.3  0.7  0.2
assign (resid  37 and name  HN  ) (resid  33 and name   O  )  2.3  0.7  0.2
!I38
assign (resid  38 and name  N   ) (resid  34 and name   O  )  3.3  0.7  0.2
assign (resid  38 and name  HN  ) (resid  34 and name   O  )  2.3  0.7  0.2

end


restraints dihed
  nass=5000

! phi dihedral angles
! L 2
  assign (resid   1 and name c ) (resid   2 and name n )
         (resid   2 and name ca) (resid   2 and name c )        1        -90.00   88.00 2
!  V 3
  assign (resid   2 and name c ) (resid   3 and name n )
         (resid   3 and name ca) (resid   3 and name c )        1        -90.00   88.00 2
! K 4 
  assign (resid   3 and name c ) (resid   4 and name n )
         (resid   4 and name ca) (resid   4 and name c ) 1  -65.00   25.00 2
! P 5 
  assign (resid   4 and name c ) (resid   5 and name n )
         (resid   5 and name ca) (resid   5 and name c ) 1  -60.00   30.00 2
! P 6 
  assign (resid   5 and name c ) (resid   6 and name n )
         (resid   6 and name ca) (resid   6 and name c ) 1  -60.00   30.00 2
! Y 7
  assign (resid   6 and name c ) (resid   7 and name n )
         (resid   7 and name ca) (resid   7 and name c )        1        -90.00   88.00 2
! S 8
  assign (resid   7 and name c ) (resid   8 and name n )
         (resid   8 and name ca) (resid   8 and name c )        1        -65.00   25.00 2
! Y 9 
  assign (resid   8 and name c ) (resid   9 and name n )
         (resid   9 and name ca) (resid   9 and name c ) 1  -65.00   25.00 2
! I 10 
  assign (resid   9 and name c ) (resid  10 and name n )
         (resid  10 and name ca) (resid  10 and name c ) 1  -65.00   25.00 2
! A 11 
  assign (resid  10 and name c ) (resid  11 and name n )
         (resid  11 and name ca) (resid  11 and name c ) 1  -65.00   25.00 2
! L 12 
  assign (resid  11 and name c ) (resid  12 and name n )
         (resid  12 and name ca) (resid  12 and name c ) 1  -65.00   25.00 2
! I 13
  assign (resid  12 and name c ) (resid  13 and name n )
         (resid  13 and name ca) (resid  13 and name c )        1        -65.00   25.00 2
! T 14 
  assign (resid  13 and name c ) (resid  14 and name n )
         (resid  14 and name ca) (resid  14 and name c ) 1  -65.00   25.00 2
! M 15 
  assign (resid  14 and name c ) (resid  15 and name n )
         (resid  15 and name ca) (resid  15 and name c ) 1  -65.00   25.00 2
! A 16 
  assign (resid  15 and name c ) (resid  16 and name n )
         (resid  16 and name ca) (resid  16 and name c ) 1  -65.00   25.00 2
! I 17 
  assign (resid  16 and name c ) (resid  17 and name n )
         (resid  17 and name ca) (resid  17 and name c ) 1  -65.00   25.00 2
! Q 18 
  assign (resid  17 and name c ) (resid  18 and name n )
         (resid  18 and name ca) (resid  18 and name c ) 1  -65.00   25.00 2
! N 19 
  assign (resid  18 and name c ) (resid  19 and name n )
         (resid  19 and name ca) (resid  19 and name c ) 1  -65.00   25.00 2
! A 20 
  assign (resid  19 and name c ) (resid  20 and name n )
         (resid  20 and name ca) (resid  20 and name c ) 1 -120.00   40.00 2
! P 21
  assign (resid  20 and name c ) (resid  21 and name n )
         (resid  21 and name ca) (resid  21 and name c ) 1  -60.00   30.00 2 
! E 22
  assign (resid   21 and name c ) (resid   22 and name n )
         (resid   22 and name ca) (resid   22 and name c )      1        -90.00   88.00 2
! K 23
  assign (resid   22 and name c ) (resid   23 and name n )
         (resid   23 and name ca) (resid   23 and name c )      1        -90.00   88.00 2
! K 24
  assign (resid   23 and name c ) (resid   24 and name n )
         (resid   24 and name ca) (resid   24 and name c )      1       -120.00   40.00 2
! I 25
  assign (resid  24 and name c ) (resid  25 and name n )
         (resid  25 and name ca) (resid  25 and name c )        1        -90.00   88.00 2
! T 26 
  assign (resid  25 and name c ) (resid  26 and name n )
         (resid  26 and name ca) (resid  26 and name c ) 1 -120.00   40.00 2
! L 27 
  assign (resid  26 and name c ) (resid  27 and name n )
         (resid  27 and name ca) (resid  27 and name c ) 1  -65.00   25.00 2
! N 28 
  assign (resid  27 and name c ) (resid  28 and name n )
         (resid  28 and name ca) (resid  28 and name c ) 1  -65.00   25.00 2
! I 30 
  assign (resid  29 and name c ) (resid  30 and name n )
         (resid  30 and name ca) (resid  30 and name c ) 1  -65.00   25.00 2
! Y 31
  assign (resid  30 and name c ) (resid  31 and name n )
         (resid  31 and name ca) (resid  31 and name c )        1        -65.00   25.00 2
! Q 32 
  assign (resid  31 and name c ) (resid  32 and name n )
         (resid  32 and name ca) (resid  32 and name c ) 1  -65.00   25.00 2
! F 33
  assign (resid   32 and name c ) (resid   33 and name n )
         (resid   33 and name ca) (resid   33 and name c )      1        -65.00   25.00 2
! I 34 
  assign (resid  33 and name c ) (resid  34 and name n )
         (resid  34 and name ca) (resid  34 and name c ) 1  -65.00   25.00 2
! M 35
  assign (resid  34 and name c ) (resid  35 and name n )
         (resid  35 and name ca) (resid  35 and name c )        1        -65.00   25.00 2
! D 36 
  assign (resid  35 and name c ) (resid  36 and name n )
         (resid  36 and name ca) (resid  36 and name c ) 1  -65.00   25.00 2
! R 37
  assign (resid   36 and name c ) (resid   37 and name n )
         (resid   37 and name ca) (resid   37 and name c )      1        -90.00   88.00 2
! F 38 
  assign (resid  37 and name c ) (resid  38 and name n )
         (resid  38 and name ca) (resid  38 and name c ) 1 -120.00   40.00 2
! P 39 
  assign (resid  38 and name c ) (resid  39 and name n )
         (resid  39 and name ca) (resid  39 and name c ) 1  -65.00   25.00 2
! F 40 
  assign (resid  39 and name c ) (resid  40 and name n )
         (resid  40 and name ca) (resid  40 and name c ) 1  -65.00   25.00 2
! Y 41 
  assign (resid  40 and name c ) (resid  41 and name n )
         (resid  41 and name ca) (resid  41 and name c ) 1  -90.00   88.00 2
! R 42 
  assign (resid  41 and name c ) (resid  42 and name n )
         (resid  42 and name ca) (resid  42 and name c ) 1  -65.00   25.00 2
! E 43
  assign (resid  42 and name c ) (resid  43 and name n )
         (resid  43 and name ca) (resid  43 and name c )        1        -90.00   88.00 2
! N 44
  assign (resid   43 and name c ) (resid   44 and name n )
         (resid   44 and name ca) (resid   44 and name c )      1        -90.00   88.00 2
! K 45
  assign (resid   44 and name c ) (resid   45 and name n )
         (resid   45 and name ca) (resid   45 and name c )      1        -90.00   88.00 2
! Q 46 
  assign (resid  45 and name c ) (resid  46 and name n )
         (resid  46 and name ca) (resid  46 and name c ) 1        -65.00   25.00 2
! W 48
  assign (resid   47 and name c ) (resid   48 and name n )
         (resid   48 and name ca) (resid   48 and name c )      1        -65.00   25.00 2
! Q 49 
  assign (resid  48 and name c ) (resid  49 and name n )
         (resid  49 and name ca) (resid  49 and name c ) 1  -65.00   25.00 2
! N 50 
  assign (resid  49 and name c ) (resid  50 and name n )
         (resid  50 and name ca) (resid  50 and name c ) 1  -65.00   25.00 2
! S 51
  assign (resid  50 and name c ) (resid  51 and name n )
         (resid  51 and name ca) (resid  51 and name c )        1        -65.00   25.00 2
! I 52 
  assign (resid  51 and name c ) (resid  52 and name n )
         (resid  52 and name ca) (resid  52 and name c ) 1  -65.00   25.00 2
! R 53
  assign (resid  52 and name c ) (resid  53 and name n )
         (resid  53 and name ca) (resid  53 and name c )        1        -65.00   25.00 2
! H 54
  assign (resid  53 and name c ) (resid  54 and name n )
         (resid  54 and name ca) (resid  54 and name c )        1        -65.00   25.00 2
! N 55
  assign (resid   54 and name c ) (resid   55 and name n )
         (resid   55 and name ca) (resid   55 and name c )      1        -65.00   25.00 2
! L 56 
  assign (resid  55 and name c ) (resid  56 and name n )
         (resid  56 and name ca) (resid  56 and name c ) 1  -65.00   25.00 2
! S 57
  assign (resid   56 and name c ) (resid   57 and name n )
         (resid   57 and name ca) (resid   57 and name c )      1        -90.00   88.00 2
! L 58
  assign (resid   57 and name c ) (resid   58 and name n )
         (resid   58 and name ca) (resid   58 and name c )      1        -90.00   88.00 2
! N 59
  assign (resid   58 and name c ) (resid   59 and name n )
         (resid   59 and name ca) (resid   59 and name c )      1        -90.00   88.00 2
! E 60
  assign (resid  59 and name c ) (resid  60 and name n )
         (resid  60 and name ca) (resid  60 and name c )        1        -65.00   25.00 2
! C 61 
  assign (resid  60 and name c ) (resid  61 and name n )
         (resid  61 and name ca) (resid  61 and name c ) 1  -65.00   25.00 2
! F 62 
  assign (resid  61 and name c ) (resid  62 and name n )
         (resid  62 and name ca) (resid  62 and name c ) 1 -120.00   40.00 2
! V 63 
  assign (resid  62 and name c ) (resid  63 and name n )
         (resid  63 and name ca) (resid  63 and name c ) 1 -120.00   40.00 2
! K 64
  assign (resid  63 and name c ) (resid  64 and name n )
         (resid  64 and name ca) (resid  64 and name c )        1        -90.00   88.00 2
! V 65
  assign (resid   64 and name c ) (resid   65 and name n )
         (resid   65 and name ca) (resid   65 and name c )      1        -90.00   88.00 2
! P 66
  assign (resid  65 and name c ) (resid  66 and name n )
         (resid  66 and name ca) (resid  66 and name c ) 1  -60.00   30.00 2
! R 67
  assign (resid   66 and name c ) (resid   67 and name n )
         (resid   67 and name ca) (resid   67 and name c )      1        -90.00   88.00 2
! D 68
  assign (resid   67 and name c ) (resid   68 and name n )
         (resid   68 and name ca) (resid   68 and name c )      1        -90.00   88.00 2
! D 69 
  assign (resid  68 and name c ) (resid  69 and name n )
         (resid  69 and name ca) (resid  69 and name c ) 1  -65.00   25.00 2
! K 70
  assign (resid   69 and name c ) (resid   70 and name n )
         (resid   70 and name ca) (resid   70 and name c )      1        -90.00   88.00 2
! K 71 
  assign (resid  70 and name c ) (resid  71 and name n )
         (resid  71 and name ca) (resid  71 and name c ) 1 -120.00   40.00 2
! P 72
  assign (resid  71 and name c ) (resid  72 and name n )
         (resid  72 and name ca) (resid  72 and name c ) 1  -60.00   30.00 2 
! K 74
  assign (resid   73 and name c ) (resid   74 and name n )
         (resid   74 and name ca) (resid   74 and name c )      1        -90.00   88.00 2
! S 76
  assign (resid   75 and name c ) (resid   76 and name n )
         (resid   76 and name ca) (resid   76 and name c )      1       -120.00   40.00 2
! Y 77
  assign (resid  76 and name c ) (resid  77 and name n )
         (resid  77 and name ca) (resid  77 and name c )        1        -90.00   88.00 2
! W 78
  assign (resid  77 and name c ) (resid  78 and name n )
         (resid  78 and name ca) (resid  78 and name c )        1       -120.00   40.00 2
! T 79 
  assign (resid  78 and name c ) (resid  79 and name n )
         (resid  79 and name ca) (resid  79 and name c ) 1 -120.00   40.00 2
! L 80 
  assign (resid  79 and name c ) (resid  80 and name n )
         (resid  80 and name ca) (resid  80 and name c ) 1 -90.00   88.00 2
! D 81
  assign (resid  80 and name c ) (resid  81 and name n )
         (resid  81 and name ca) (resid  81 and name c )        1       -90.00    88.00 2
! P 82 
  assign (resid  81 and name c ) (resid  82 and name n )
         (resid  82 and name ca) (resid  82 and name c ) 1 -65.00   25.00 2
! D 83
  assign (resid   82 and name c ) (resid   83 and name n )
         (resid   83 and name ca) (resid   83 and name c )      1       -90.00    88.00 2
! S 84
  assign (resid   83 and name c ) (resid   84 and name n )
         (resid   84 and name ca) (resid   84 and name c )      1       -90.00    88.00 2
! Y 85 
  assign (resid  84 and name c ) (resid  85 and name n )
         (resid  85 and name ca) (resid  85 and name c ) 1  -65.00   25.00 2
! N  86
  assign (resid   85 and name c ) (resid   86 and name n )
         (resid   86 and name ca) (resid   86 and name c )      1        -90.00   88.00 2
! M 87 
  assign (resid  86 and name c ) (resid  87 and name n )
         (resid  87 and name ca) (resid  87 and name c ) 1  -65.00   25.00 2
! F 88
  assign (resid   87 and name c ) (resid   88 and name n )
         (resid   88 and name ca) (resid   88 and name c )      1        -90.00   88.00 2
! E 89
  assign (resid   88 and name c ) (resid   89 and name n )
         (resid   89 and name ca) (resid   89 and name c )      1        -90.00   88.00 2
! N 90
  assign (resid   89 and name c ) (resid   90 and name n )
         (resid   90 and name ca) (resid   90 and name c )      1        -90.00   88.00 2
! S 92
  assign (resid   91 and name c ) (resid   92 and name n )
         (resid   92 and name ca) (resid   92 and name c )      1        -90.00   88.00 2
! F 93
  assign (resid   92 and name c ) (resid   93 and name n )
         (resid   93 and name ca) (resid   93 and name c )      1        -90.00   88.00 2
! L 94
  assign (resid   93 and name c ) (resid   94 and name n )
         (resid   94 and name ca) (resid   94 and name c )      1        -90.00   88.00 2
! R 95
  assign (resid   94 and name c ) (resid   95 and name n )
         (resid   95 and name ca) (resid   95 and name c )      1        -90.00   88.00 2
! R 96
  assign (resid   95 and name c ) (resid   96 and name n )
         (resid   96 and name ca) (resid   96 and name c )      1        -90.00   88.00 2
! R 97
  assign (resid   96 and name c ) (resid   97 and name n )
         (resid   97 and name ca) (resid   97 and name c )      1        -90.00   88.00 2
! R 98
  assign (resid   97 and name c ) (resid   98 and name n )
         (resid   98 and name ca) (resid   98 and name c )      1        -90.00   88.00 2
! R 99
  assign (resid   98 and name c ) (resid   99 and name n )
         (resid   99 and name ca) (resid   99 and name c )      1        -90.00   88.00 2
! F 100
  assign (resid   99 and name c ) (resid   100 and name n )
         (resid   100 and name ca) (resid   100 and name c )    1        -90.00   88.00 2
! K 101
  assign (resid   100 and name c ) (resid   101 and name n )
         (resid   101 and name ca) (resid   101 and name c )    1        -90.00   88.00 2
! K 102
  assign (resid   101 and name c ) (resid   102 and name n )
         (resid   102 and name ca) (resid   102 and name c )    1        -90.00   88.00 2
! S12
! psi dihedral angles

! Tyr 9 
  assign (resid   9 and name n ) (resid   9 and name ca)
         (resid   9 and name c ) (resid  10 and name n )       1  -40.00     30.00   2
! Ala 11 
  assign (resid  11 and name n ) (resid  11 and name ca)
         (resid  11 and name c ) (resid  12 and name n )       1  -40.00     30.00   2
! Leu 12 
  assign (resid  12 and name n ) (resid  12 and name ca)
         (resid  12 and name c ) (resid  13 and name n )       1  -40.00     30.00   2
! Met 15 
  assign (resid  15 and name n ) (resid  15 and name ca)
         (resid  15 and name c ) (resid  16 and name n )       1  -40.00     30.00   2
! Ala 16 
  assign (resid  16 and name n ) (resid  16 and name ca)
         (resid  16 and name c ) (resid  17 and name n )       1  -40.00     30.00   2
! Leu 27 
  assign (resid  27 and name n ) (resid  27 and name ca)
         (resid  27 and name c ) (resid  28 and name n )       1  -40.00     30.00   2
! Asn 28 
  assign (resid  28 and name n ) (resid  28 and name ca)
         (resid  28 and name c ) (resid  29 and name n )       1  -40.00     30.00   2
! Tyr 31 
  assign (resid  31 and name n ) (resid  31 and name ca)
         (resid  31 and name c ) (resid  32 and name n )       1  -40.00     30.00   2
! Gln 32 
  assign (resid  32 and name n ) (resid  32 and name ca)
         (resid  32 and name c ) (resid  33 and name n )       1  -40.00     30.00   2
! Phe 33 
  assign (resid  33 and name n ) (resid  33 and name ca)
         (resid  33 and name c ) (resid  34 and name n )       1  -40.00     30.00   2
! Asp 36 
  assign (resid  36 and name n ) (resid  36 and name ca)
         (resid  36 and name c ) (resid  37 and name n )       1  -40.00     30.00   2
! Phe 40 
  assign (resid  40 and name n ) (resid  40 and name ca)
         (resid  40 and name c ) (resid  41 and name n )       1  -40.00     30.00   2
! Gln 49 
  assign (resid  49 and name n ) (resid  49 and name ca)
         (resid  49 and name c ) (resid  50 and name n )       1  -40.00     30.00   2
! Asn 50 
  assign (resid  50 and name n ) (resid  50 and name ca)
         (resid  50 and name c ) (resid  51 and name n )       1  -40.00     30.00   2
! Ile 52 
  assign (resid  52 and name n ) (resid  52 and name ca)
         (resid  52 and name c ) (resid  53 and name n )       1  -40.00     30.00   2
! Arg 53 
  assign (resid  53 and name n ) (resid  53 and name ca)
         (resid  53 and name c ) (resid  54 and name n )       1  -40.00     30.00   2
! His 54 
  assign (resid  54 and name n ) (resid  54 and name ca)
         (resid  54 and name c ) (resid  55 and name n )       1  -40.00     30.00   2

! Restraints for Chi 1 angles on the basis of the HNCOCG experiment

! Chi 1 angle restraints

!! I10
assign (resid 10 and name n)   (resid 10 and name ca)
       (resid 10 and name cb)  (resid 10 and name cg1) 1.0 -60.0 30.0 2
!! L12
assign (resid 12 and name n)   (resid 12 and name ca)
       (resid 12 and name cb)  (resid 12 and name cg)  1.0 -60.0 30.0 2
!! M15
assign (resid 15 and name n)   (resid 15 and name ca)
       (resid 15 and name cb)  (resid 15 and name cg)  1.0 -60.0 30.0 2
!! Q18
assign (resid 18 and name n)   (resid 18 and name ca)
       (resid 18 and name cb)  (resid 18 and name cg)  1.0 -60.0 30.0 2
!! N28
assign (resid 28 and name n)   (resid 28 and name ca)
       (resid 28 and name cb)  (resid 28 and name cg)  1.0 -60.0 30.0 2
!! I30
assign (resid 30 and name n)   (resid 30 and name ca)
       (resid 30 and name cb)  (resid 30 and name cg1) 1.0 -60.0 30.0 2
!! Y31
assign (resid 31 and name n)   (resid 31 and name ca)
       (resid 31 and name cb)  (resid 31 and name cg)  1.0 -60.0 30.0 2
!! M35
assign (resid 35 and name n)   (resid 35 and name ca)
       (resid 35 and name cb)  (resid 35 and name cg)  1.0 -60.0 30.0 2
!! D36
assign (resid 36 and name n)   (resid 36 and name ca)
       (resid 36 and name cb)  (resid 36 and name cg)  1.0 -60.0 30.0 2
!! Y41
assign (resid 41 and name n)   (resid 41 and name ca)
       (resid 41 and name cb)  (resid 41 and name cg)  1.0 -60.0 30.0 2
!! N50
assign (resid 50 and name n)   (resid 50 and name ca)
       (resid 50 and name cb)  (resid 50 and name cg)  1.0 -60.0 30.0 2
!! I52
assign (resid 52 and name n)   (resid 52 and name ca)
       (resid 52 and name cb)  (resid 52 and name cg1) 1.0 -60.0 30.0 2
!! D69
assign (resid 69 and name n)   (resid 69 and name ca)
       (resid 69 and name cb)  (resid 69 and name cg)  1.0 -60.0 30.0 2
!! K70
assign (resid 70 and name n)   (resid 70 and name ca)
       (resid 70 and name cb)  (resid 70 and name cg)  1.0 -60.0 30.0 2
!! K74
assign (resid 74 and name n)   (resid 74 and name ca)
       (resid 74 and name cb)  (resid 74 and name cg)  1.0 -60.0 30.0 2

! Chi 2 angle restraints, as follows from Chi 1

!! I10
assign (resid 10 and name ca)  (resid 10 and name cb)
       (resid 10 and name cg1) (resid 10 and name cd1) 1.0 -120.0 90.0 2
!! L12
assign (resid 12 and name ca)  (resid 12 and name cb)
       (resid 12 and name cg)  (resid 12 and name cd1) 1.0  180.0 30.0 2
!! I30
assign (resid 30 and name ca)  (resid 30 and name cb)
       (resid 30 and name cg1) (resid 30 and name cd1) 1.0 -120.0 90.0 2
!! I52
assign (resid 52 and name ca)  (resid 52 and name cb)
       (resid 52 and name cg1) (resid 52 and name cd1) 1.0 -120.0 90.0 2

! Restraints for Chi 1 angles on the basis of prel. structure calculations

! Chi 1 angle restraints
!! L2
assign (resid  2 and name n)   (resid  2 and name ca)
       (resid  2 and name cb)  (resid  2 and name cg)  1.0 -60.0 30.0 2
!! Y7
assign (resid  7 and name n)   (resid  7 and name ca)
       (resid  7 and name cb)  (resid  7 and name cg)  1.0 -60.0 30.0 2
!! Y9
assign (resid  9 and name n)   (resid  9 and name ca)
       (resid  9 and name cb)  (resid  9 and name cg)  1.0 -60.0 30.0 2
!! L27
assign (resid 27 and name n)   (resid 27 and name ca)
       (resid 27 and name cb)  (resid 27 and name cg)  1.0 180.0 30.0 2
!! F33
assign (resid 33 and name n)   (resid 33 and name ca)
       (resid 33 and name cb)  (resid 33 and name cg)  1.0 180.0 30.0 2
!! F38
assign (resid 38 and name n)   (resid 38 and name ca)
       (resid 38 and name cb)  (resid 38 and name cg)  1.0 -60.0 30.0 2
!! K45
assign (resid 45 and name n)   (resid 45 and name ca)
       (resid 45 and name cb)  (resid 45 and name cg)  1.0 -60.0 30.0 2
!! L56
assign (resid 56 and name n)   (resid 56 and name ca)
       (resid 56 and name cb)  (resid 56 and name cg)  1.0 -60.0 30.0 2
!! Q60
assign (resid 60 and name n)   (resid 60 and name ca)
       (resid 60 and name cb)  (resid 60 and name cg)  1.0 -60.0 30.0 2
!! W78
assign (resid 78 and name n)   (resid 78 and name ca)
       (resid 78 and name cb)  (resid 78 and name cg)  1.0 -60.0 30.0 2

! Chi 2 angle restraints, as follows from Chi 1

!! L2
assign (resid  2 and name ca)  (resid  2 and name cb)
       (resid  2 and name cg)  (resid  2 and name cd1) 1.0  180.0 30.0 2
!! L27
assign (resid 27 and name ca)  (resid 27 and name cb)
       (resid 27 and name cg)  (resid 27 and name cd1) 1.0   60.0 30.0 2
!! L56
assign (resid 56 and name ca)  (resid 56 and name cb)
       (resid 56 and name cg)  (resid 56 and name cd1) 1.0  180.0 30.0 2

end


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    MET   1          HT1       MET   1 -23.259  17.381   7.611
    2   2H    MET   1          HT2       MET   1 -24.213  16.385   6.620
    3   3H    MET   1          HT3       MET   1 -24.580  18.037   6.773
    4    HA   MET   1           HA       MET   1 -23.490  17.563   4.656
    5   1HB   MET   1          HB2       MET   1 -23.182  19.745   5.905
    6   2HB   MET   1          HB1       MET   1 -21.661  19.096   6.521
    7   1HG   MET   1          HG2       MET   1 -20.901  18.730   4.179
    8   2HG   MET   1          HG1       MET   1 -22.390  19.479   3.602
    9   1HE   MET   1          HE1       MET   1 -23.048  21.974   5.233
   10   2HE   MET   1          HE2       MET   1 -22.943  21.743   3.489
   11   3HE   MET   1          HE3       MET   1 -22.139  23.119   4.239
   12    H    LEU   2           HN       LEU   2 -21.785  16.591   3.555
   13    HA   LEU   2           HA       LEU   2 -19.799  15.046   5.202
   14   1HB   LEU   2          HB2       LEU   2 -21.070  14.255   2.561
   15   2HB   LEU   2          HB1       LEU   2 -19.879  13.316   3.455
   16    HG   LEU   2           HG       LEU   2 -22.609  14.087   4.527
   17   1HD1  LEU   2          HD11      LEU   2 -22.606  12.481   2.566
   18   2HD1  LEU   2          HD12      LEU   2 -23.298  11.831   4.052
   19   3HD1  LEU   2          HD13      LEU   2 -21.665  11.373   3.566
   20   1HD2  LEU   2          HD21      LEU   2 -21.234  13.700   6.405
   21   2HD2  LEU   2          HD22      LEU   2 -20.305  12.446   5.583
   22   3HD2  LEU   2          HD23      LEU   2 -21.952  12.118   6.117
   23    H    VAL   3           HN       VAL   3 -17.683  14.963   4.348
   24    HA   VAL   3           HA       VAL   3 -17.132  16.597   1.903
   25    HB   VAL   3           HB       VAL   3 -15.173  17.590   3.078
   26   1HG1  VAL   3          HG11      VAL   3 -16.522  19.120   4.555
   27   2HG1  VAL   3          HG12      VAL   3 -17.904  18.051   4.312
   28   3HG1  VAL   3          HG13      VAL   3 -17.201  18.911   2.941
   29   1HG2  VAL   3          HG21      VAL   3 -14.824  15.915   4.802
   30   2HG2  VAL   3          HG22      VAL   3 -16.432  16.203   5.465
   31   3HG2  VAL   3          HG23      VAL   3 -15.190  17.448   5.593
   32    H    LYS   4           HN       LYS   4 -15.455  15.762   0.652
   33    HA   LYS   4           HA       LYS   4 -14.667  13.043   1.228
   34   1HB   LYS   4          HB2       LYS   4 -13.469  14.877  -0.868
   35   2HB   LYS   4          HB1       LYS   4 -13.474  13.113  -0.875
   36   1HG   LYS   4          HG2       LYS   4 -15.947  14.865  -1.012
   37   2HG   LYS   4          HG1       LYS   4 -15.207  14.043  -2.386
   38   1HD   LYS   4          HD2       LYS   4 -15.493  11.879  -0.978
   39   2HD   LYS   4          HD1       LYS   4 -16.613  12.831  -0.005
   40   1HE   LYS   4          HE2       LYS   4 -16.828  12.106  -2.925
   41   2HE   LYS   4          HE1       LYS   4 -17.989  11.806  -1.633
   42   1HZ   LYS   4          HZ1       LYS   4 -18.679  13.651  -3.028
   43   2HZ   LYS   4          HZ2       LYS   4 -17.232  14.475  -2.694
   44   3HZ   LYS   4          HZ3       LYS   4 -18.353  14.185  -1.451
   45    HA   PRO   5           HA       PRO   5 -10.877  14.011   3.332
   46   1HB   PRO   5          HB2       PRO   5  -9.330  11.808   2.289
   47   2HB   PRO   5          HB1       PRO   5 -10.227  11.876   3.814
   48   1HG   PRO   5          HG2       PRO   5 -10.878  10.260   1.679
   49   2HG   PRO   5          HG1       PRO   5 -12.020  10.778   2.931
   50   1HD   PRO   5          HD2       PRO   5 -11.610  11.904   0.171
   51   2HD   PRO   5          HD1       PRO   5 -13.121  11.603   1.053
   52    HA   PRO   6           HA       PRO   6  -8.601  16.400   0.117
   53   1HB   PRO   6          HB2       PRO   6  -6.909  16.928   2.543
   54   2HB   PRO   6          HB1       PRO   6  -7.505  18.066   1.320
   55   1HG   PRO   6          HG2       PRO   6  -8.634  17.919   3.725
   56   2HG   PRO   6          HG1       PRO   6  -9.606  18.192   2.268
   57   1HD   PRO   6          HD2       PRO   6  -9.356  15.715   3.923
   58   2HD   PRO   6          HD1       PRO   6 -10.734  16.300   2.965
   59    H    TYR   7           HN       TYR   7  -7.693  13.700   1.968
   60    HA   TYR   7           HA       TYR   7  -4.902  13.513   1.276
   61   1HB   TYR   7          HB2       TYR   7  -6.775  11.192   1.802
   62   2HB   TYR   7          HB1       TYR   7  -5.041  11.256   2.099
   63    HD1  TYR   7           HD1      TYR   7  -7.886  11.025   3.852
   64    HD2  TYR   7           HD2      TYR   7  -4.603  13.777   3.502
   65    HE1  TYR   7           HE1      TYR   7  -8.375  11.890   6.110
   66    HE2  TYR   7           HE2      TYR   7  -5.084  14.631   5.771
   67    HH   TYR   7           HH       TYR   7  -6.563  13.240   7.987
   68    H    SER   8           HN       SER   8  -3.942  12.622  -0.521
   69    HA   SER   8           HA       SER   8  -5.566  12.333  -2.912
   70   1HB   SER   8          HB2       SER   8  -3.235  13.203  -2.971
   71   2HB   SER   8          HB1       SER   8  -2.650  11.623  -2.457
   72    HG   SER   8           HG       SER   8  -3.974  12.341  -4.855
   73    H    TYR   9           HN       TYR   9  -5.446  10.282  -4.252
   74    HA   TYR   9           HA       TYR   9  -6.426   8.063  -2.762
   75   1HB   TYR   9          HB2       TYR   9  -5.333   8.310  -5.572
   76   2HB   TYR   9          HB1       TYR   9  -5.928   6.777  -4.934
   77    HD1  TYR   9           HD1      TYR   9  -8.314   6.724  -3.955
   78    HD2  TYR   9           HD2      TYR   9  -6.842   9.924  -6.417
   79    HE1  TYR   9           HE1      TYR   9 -10.642   7.429  -4.430
   80    HE2  TYR   9           HE2      TYR   9  -9.173  10.626  -6.894
   81    HH   TYR   9           HH       TYR   9 -11.422  10.406  -5.779
   82    H    ILE  10           HN       ILE  10  -3.177   8.817  -3.984
   83    HA   ILE  10           HA       ILE  10  -1.990   6.308  -3.222
   84    HB   ILE  10           HB       ILE  10  -0.712   9.054  -3.452
   85   1HG1  ILE  10          HG12      ILE  10  -1.757   8.446  -5.559
   86   2HG1  ILE  10          HG11      ILE  10  -0.017   8.234  -5.715
   87   1HG2  ILE  10          HG21      ILE  10   0.452   6.260  -3.377
   88   2HG2  ILE  10          HG22      ILE  10   0.737   7.567  -2.227
   89   3HG2  ILE  10          HG23      ILE  10   1.364   7.686  -3.871
   90   1HD1  ILE  10          HD11      ILE  10  -2.171   6.151  -5.549
   91   2HD1  ILE  10          HD12      ILE  10  -0.550   5.750  -4.984
   92   3HD1  ILE  10          HD13      ILE  10  -0.803   6.254  -6.653
   93    H    ALA  11           HN       ALA  11  -2.420   9.404  -1.517
   94    HA   ALA  11           HA       ALA  11  -0.919   8.637   0.818
   95   1HB   ALA  11          HB1       ALA  11  -1.390  10.980   0.469
   96   2HB   ALA  11          HB2       ALA  11  -2.251  10.491   1.927
   97   3HB   ALA  11          HB3       ALA  11  -3.127  10.680   0.409
   98    H    LEU  12           HN       LEU  12  -4.367   8.357  -0.039
   99    HA   LEU  12           HA       LEU  12  -5.258   7.389   2.493
  100   1HB   LEU  12          HB2       LEU  12  -6.263   6.868  -0.311
  101   2HB   LEU  12          HB1       LEU  12  -7.098   6.297   1.131
  102    HG   LEU  12           HG       LEU  12  -6.385   9.205   0.626
  103   1HD1  LEU  12          HD11      LEU  12  -8.002   8.308  -1.050
  104   2HD1  LEU  12          HD12      LEU  12  -8.732   9.516   0.007
  105   3HD1  LEU  12          HD13      LEU  12  -9.056   7.803   0.272
  106   1HD2  LEU  12          HD21      LEU  12  -6.745   9.114   2.912
  107   2HD2  LEU  12          HD22      LEU  12  -7.803   7.708   2.812
  108   3HD2  LEU  12          HD23      LEU  12  -8.412   9.301   2.381
  109    H    ILE  13           HN       ILE  13  -3.966   5.673  -0.349
  110    HA   ILE  13           HA       ILE  13  -4.230   3.035   0.711
  111    HB   ILE  13           HB       ILE  13  -2.155   4.207  -1.167
  112   1HG1  ILE  13          HG12      ILE  13  -4.559   2.458  -1.766
  113   2HG1  ILE  13          HG11      ILE  13  -4.589   4.218  -1.877
  114   1HG2  ILE  13          HG21      ILE  13  -1.196   2.210  -0.266
  115   2HG2  ILE  13          HG22      ILE  13  -1.874   1.755  -1.828
  116   3HG2  ILE  13          HG23      ILE  13  -2.736   1.355  -0.342
  117   1HD1  ILE  13          HD11      ILE  13  -4.109   3.469  -4.086
  118   2HD1  ILE  13          HD12      ILE  13  -2.945   2.277  -3.510
  119   3HD1  ILE  13          HD13      ILE  13  -2.557   3.996  -3.437
  120    H    THR  14           HN       THR  14  -1.674   5.475   0.973
  121    HA   THR  14           HA       THR  14   0.168   3.878   2.464
  122    HB   THR  14           HB       THR  14  -0.196   6.882   2.440
  123    HG1  THR  14           HG1      THR  14   0.535   6.646   0.503
  124   1HG2  THR  14          HG21      THR  14   2.090   5.112   3.338
  125   2HG2  THR  14          HG22      THR  14   1.157   6.230   4.334
  126   3HG2  THR  14          HG23      THR  14   2.235   6.851   3.085
  127    H    MET  15           HN       MET  15  -2.451   6.060   3.489
  128    HA   MET  15           HA       MET  15  -1.833   5.879   6.301
  129   1HB   MET  15          HB2       MET  15  -4.360   6.636   4.818
  130   2HB   MET  15          HB1       MET  15  -4.202   6.726   6.572
  131   1HG   MET  15          HG2       MET  15  -2.287   8.262   6.325
  132   2HG   MET  15          HG1       MET  15  -2.443   8.176   4.571
  133   1HE   MET  15          HE1       MET  15  -3.547  11.729   5.697
  134   2HE   MET  15          HE2       MET  15  -2.988  10.979   4.204
  135   3HE   MET  15          HE3       MET  15  -2.159  10.632   5.720
  136    H    ALA  16           HN       ALA  16  -4.046   4.093   4.175
  137    HA   ALA  16           HA       ALA  16  -5.444   2.612   6.122
  138   1HB   ALA  16          HB1       ALA  16  -4.603   2.001   3.293
  139   2HB   ALA  16          HB2       ALA  16  -6.208   2.407   3.899
  140   3HB   ALA  16          HB3       ALA  16  -5.516   0.821   4.239
  141    H    ILE  17           HN       ILE  17  -2.310   1.909   4.599
  142    HA   ILE  17           HA       ILE  17  -1.914  -0.637   5.849
  143    HB   ILE  17           HB       ILE  17   0.167   1.401   4.980
  144   1HG1  ILE  17          HG12      ILE  17  -0.984  -0.919   3.410
  145   2HG1  ILE  17          HG11      ILE  17  -1.585   0.733   3.265
  146   1HG2  ILE  17          HG21      ILE  17   1.242  -0.305   6.259
  147   2HG2  ILE  17          HG22      ILE  17   1.465  -0.780   4.575
  148   3HG2  ILE  17          HG23      ILE  17   0.231  -1.569   5.557
  149   1HD1  ILE  17          HD11      ILE  17   1.320  -0.016   2.863
  150   2HD1  ILE  17          HD12      ILE  17   0.554   1.532   2.501
  151   3HD1  ILE  17          HD13      ILE  17   0.157   0.106   1.543
  152    H    GLN  18           HN       GLN  18  -1.066   2.666   6.807
  153    HA   GLN  18           HA       GLN  18   0.427   1.951   9.157
  154   1HB   GLN  18          HB2       GLN  18  -1.086   4.477   8.446
  155   2HB   GLN  18          HB1       GLN  18  -0.057   4.321   9.869
  156   1HG   GLN  18          HG2       GLN  18   1.845   3.703   8.372
  157   2HG   GLN  18          HG1       GLN  18   0.800   4.005   6.982
  158   1HE2  GLN  18          HE21      GLN  18  -0.372   6.329   7.226
  159   2HE2  GLN  18          HE22      GLN  18   0.670   7.594   7.664
  160    H    ASN  19           HN       ASN  19  -3.013   2.754   8.690
  161    HA   ASN  19           HA       ASN  19  -3.541   2.297  11.565
  162   1HB   ASN  19          HB2       ASN  19  -5.885   2.913  10.925
  163   2HB   ASN  19          HB1       ASN  19  -4.697   4.155  10.526
  164   1HD2  ASN  19          HD21      ASN  19  -4.942   4.966   8.455
  165   2HD2  ASN  19          HD22      ASN  19  -5.567   4.106   7.133
  166    H    ALA  20           HN       ALA  20  -2.990   0.229   9.147
  167    HA   ALA  20           HA       ALA  20  -5.343  -1.480   9.350
  168   1HB   ALA  20          HB1       ALA  20  -3.858  -3.131   8.137
  169   2HB   ALA  20          HB2       ALA  20  -2.577  -1.920   8.196
  170   3HB   ALA  20          HB3       ALA  20  -4.067  -1.588   7.310
  171    HA   PRO  21           HA       PRO  21  -4.064  -3.046  13.450
  172   1HB   PRO  21          HB2       PRO  21  -5.697  -5.353  12.410
  173   2HB   PRO  21          HB1       PRO  21  -5.705  -4.612  14.024
  174   1HG   PRO  21          HG2       PRO  21  -7.620  -4.062  12.268
  175   2HG   PRO  21          HG1       PRO  21  -6.969  -2.805  13.334
  176   1HD   PRO  21          HD2       PRO  21  -6.543  -3.187  10.406
  177   2HD   PRO  21          HD1       PRO  21  -6.496  -1.691  11.366
  178    H    GLU  22           HN       GLU  22  -3.789  -4.652  10.369
  179    HA   GLU  22           HA       GLU  22  -1.398  -6.184  11.347
  180   1HB   GLU  22          HB2       GLU  22  -3.335  -7.656  10.749
  181   2HB   GLU  22          HB1       GLU  22  -3.335  -6.954   9.134
  182   1HG   GLU  22          HG2       GLU  22  -2.108  -9.039   9.049
  183   2HG   GLU  22          HG1       GLU  22  -0.949  -7.722   8.876
  184    H    LYS  23           HN       LYS  23   0.466  -5.661  10.218
  185    HA   LYS  23           HA       LYS  23   0.482  -3.477   8.392
  186   1HB   LYS  23          HB2       LYS  23   2.519  -5.692   8.811
  187   2HB   LYS  23          HB1       LYS  23   2.822  -4.246   7.850
  188   1HG   LYS  23          HG2       LYS  23   1.876  -4.005  10.704
  189   2HG   LYS  23          HG1       LYS  23   3.579  -4.279  10.349
  190   1HD   LYS  23          HD2       LYS  23   3.685  -2.251   9.014
  191   2HD   LYS  23          HD1       LYS  23   1.952  -1.992   9.189
  192   1HE   LYS  23          HE2       LYS  23   3.870  -2.119  11.524
  193   2HE   LYS  23          HE1       LYS  23   3.344  -0.617  10.766
  194   1HZ   LYS  23          HZ1       LYS  23   1.893  -0.959  12.554
  195   2HZ   LYS  23          HZ2       LYS  23   1.701  -2.612  12.207
  196   3HZ   LYS  23          HZ3       LYS  23   1.010  -1.441  11.188
  197    H    LYS  24           HN       LYS  24   0.433  -6.985   7.841
  198    HA   LYS  24           HA       LYS  24   0.392  -6.573   4.916
  199   1HB   LYS  24          HB2       LYS  24   0.167  -9.053   6.652
  200   2HB   LYS  24          HB1       LYS  24   0.095  -9.082   4.890
  201   1HG   LYS  24          HG2       LYS  24   2.325  -8.040   4.771
  202   2HG   LYS  24          HG1       LYS  24   2.404  -8.012   6.533
  203   1HD   LYS  24          HD2       LYS  24   2.226 -10.473   6.585
  204   2HD   LYS  24          HD1       LYS  24   2.148 -10.505   4.822
  205   1HE   LYS  24          HE2       LYS  24   4.376  -9.560   4.652
  206   2HE   LYS  24          HE1       LYS  24   4.455  -9.330   6.400
  207   1HZ   LYS  24          HZ1       LYS  24   4.723 -11.550   6.776
  208   2HZ   LYS  24          HZ2       LYS  24   5.507 -11.420   5.274
  209   3HZ   LYS  24          HZ3       LYS  24   3.918 -12.016   5.357
  210    H    ILE  25           HN       ILE  25  -1.486  -5.995   3.982
  211    HA   ILE  25           HA       ILE  25  -4.065  -7.042   5.106
  212    HB   ILE  25           HB       ILE  25  -3.764  -4.662   5.707
  213   1HG1  ILE  25          HG12      ILE  25  -5.777  -4.920   3.458
  214   2HG1  ILE  25          HG11      ILE  25  -6.014  -5.658   5.043
  215   1HG2  ILE  25          HG21      ILE  25  -3.749  -4.119   2.728
  216   2HG2  ILE  25          HG22      ILE  25  -2.273  -4.199   3.691
  217   3HG2  ILE  25          HG23      ILE  25  -3.486  -2.966   4.037
  218   1HD1  ILE  25          HD11      ILE  25  -5.893  -3.486   6.128
  219   2HD1  ILE  25          HD12      ILE  25  -7.092  -3.406   4.838
  220   3HD1  ILE  25          HD13      ILE  25  -5.492  -2.705   4.599
  221    H    THR  26           HN       THR  26  -5.617  -7.597   3.564
  222    HA   THR  26           HA       THR  26  -4.568  -8.166   0.899
  223    HB   THR  26           HB       THR  26  -6.628  -9.342   0.535
  224    HG1  THR  26           HG1      THR  26  -7.550  -7.448   2.252
  225   1HG2  THR  26          HG21      THR  26  -6.096  -9.602   3.499
  226   2HG2  THR  26          HG22      THR  26  -5.004 -10.247   2.273
  227   3HG2  THR  26          HG23      THR  26  -6.657 -10.848   2.385
  228    H    LEU  27           HN       LEU  27  -5.754  -7.534  -1.053
  229    HA   LEU  27           HA       LEU  27  -6.047  -4.719  -1.321
  230   1HB   LEU  27          HB2       LEU  27  -5.522  -6.312  -3.150
  231   2HB   LEU  27          HB1       LEU  27  -7.144  -6.981  -3.030
  232    HG   LEU  27           HG       LEU  27  -8.114  -4.826  -3.729
  233   1HD1  LEU  27          HD11      LEU  27  -5.232  -3.951  -3.517
  234   2HD1  LEU  27          HD12      LEU  27  -6.680  -3.153  -2.900
  235   3HD1  LEU  27          HD13      LEU  27  -6.330  -3.131  -4.625
  236   1HD2  LEU  27          HD21      LEU  27  -5.961  -6.116  -5.406
  237   2HD2  LEU  27          HD22      LEU  27  -6.833  -4.723  -6.024
  238   3HD2  LEU  27          HD23      LEU  27  -7.712  -6.185  -5.590
  239    H    ASN  28           HN       ASN  28  -8.419  -7.328  -0.962
  240    HA   ASN  28           HA       ASN  28 -10.766  -5.721  -1.122
  241   1HB   ASN  28          HB2       ASN  28 -10.218  -8.349   0.268
  242   2HB   ASN  28          HB1       ASN  28 -11.825  -7.630   0.159
  243   1HD2  ASN  28          HD21      ASN  28 -10.880 -10.166  -1.104
  244   2HD2  ASN  28          HD22      ASN  28 -11.109  -9.966  -2.774
  245    H    GLY  29           HN       GLY  29  -8.732  -6.661   1.627
  246   1HA   GLY  29          HA2       GLY  29 -10.377  -5.638   3.702
  247   2HA   GLY  29          HA1       GLY  29  -8.629  -5.825   3.812
  248    H    ILE  30           HN       ILE  30  -7.946  -4.013   1.680
  249    HA   ILE  30           HA       ILE  30  -7.857  -1.573   3.133
  250    HB   ILE  30           HB       ILE  30  -7.449  -2.152   0.188
  251   1HG1  ILE  30          HG12      ILE  30  -5.480  -1.492   2.398
  252   2HG1  ILE  30          HG11      ILE  30  -5.900  -3.139   1.935
  253   1HG2  ILE  30          HG21      ILE  30  -6.257   0.096   0.230
  254   2HG2  ILE  30          HG22      ILE  30  -7.051   0.399   1.775
  255   3HG2  ILE  30          HG23      ILE  30  -8.016   0.184   0.314
  256   1HD1  ILE  30          HD11      ILE  30  -4.958  -1.182  -0.152
  257   2HD1  ILE  30          HD12      ILE  30  -4.891  -2.944  -0.171
  258   3HD1  ILE  30          HD13      ILE  30  -3.793  -2.030   0.864
  259    H    TYR  31           HN       TYR  31 -10.119  -2.642   0.560
  260    HA   TYR  31           HA       TYR  31 -11.467  -0.128   0.316
  261   1HB   TYR  31          HB2       TYR  31 -12.708  -2.888   0.110
  262   2HB   TYR  31          HB1       TYR  31 -13.403  -1.402  -0.513
  263    HD1  TYR  31           HD1      TYR  31 -12.243  -4.205  -1.739
  264    HD2  TYR  31           HD2      TYR  31 -11.087  -0.066  -1.829
  265    HE1  TYR  31           HE1      TYR  31 -11.016  -4.587  -3.860
  266    HE2  TYR  31           HE2      TYR  31  -9.888  -0.453  -3.947
  267    HH   TYR  31           HH       TYR  31  -9.620  -1.906  -5.659
  268    H    GLN  32           HN       GLN  32 -12.039  -2.854   2.532
  269    HA   GLN  32           HA       GLN  32 -14.388  -1.820   3.731
  270   1HB   GLN  32          HB2       GLN  32 -13.550  -4.127   4.074
  271   2HB   GLN  32          HB1       GLN  32 -12.225  -3.487   5.045
  272   1HG   GLN  32          HG2       GLN  32 -13.805  -2.565   6.665
  273   2HG   GLN  32          HG1       GLN  32 -15.165  -3.086   5.671
  274   1HE2  GLN  32          HE21      GLN  32 -16.091  -4.767   6.884
  275   2HE2  GLN  32          HE22      GLN  32 -15.235  -6.113   7.462
  276    H    PHE  33           HN       PHE  33 -10.969  -1.247   4.585
  277    HA   PHE  33           HA       PHE  33 -11.459   0.228   6.965
  278   1HB   PHE  33          HB2       PHE  33  -9.204  -0.507   6.366
  279   2HB   PHE  33          HB1       PHE  33  -9.216   0.543   4.948
  280    HD1  PHE  33           HD1      PHE  33  -9.022   0.423   8.623
  281    HD2  PHE  33           HD2      PHE  33  -9.058   2.972   5.166
  282    HE1  PHE  33           HE1      PHE  33  -8.239   2.321  10.013
  283    HE2  PHE  33           HE2      PHE  33  -8.274   4.870   6.556
  284    HZ   PHE  33           HZ       PHE  33  -7.865   4.544   8.980
  285    H    ILE  34           HN       ILE  34 -11.049   1.402   3.622
  286    HA   ILE  34           HA       ILE  34 -11.387   4.156   4.197
  287    HB   ILE  34           HB       ILE  34 -11.953   2.533   1.706
  288   1HG1  ILE  34          HG12      ILE  34  -9.713   4.460   2.388
  289   2HG1  ILE  34          HG11      ILE  34  -9.607   2.719   2.642
  290   1HG2  ILE  34          HG21      ILE  34 -11.794   4.822   0.577
  291   2HG2  ILE  34          HG22      ILE  34 -12.037   5.522   2.177
  292   3HG2  ILE  34          HG23      ILE  34 -13.287   4.507   1.461
  293   1HD1  ILE  34          HD11      ILE  34 -10.315   3.895  -0.047
  294   2HD1  ILE  34          HD12      ILE  34  -9.755   2.261   0.320
  295   3HD1  ILE  34          HD13      ILE  34  -8.642   3.625   0.442
  296    H    MET  35           HN       MET  35 -13.836   1.666   3.462
  297    HA   MET  35           HA       MET  35 -16.067   3.427   3.262
  298   1HB   MET  35          HB2       MET  35 -15.930   0.577   4.290
  299   2HB   MET  35          HB1       MET  35 -17.422   1.429   3.893
  300   1HG   MET  35          HG2       MET  35 -16.804   1.612   1.577
  301   2HG   MET  35          HG1       MET  35 -15.166   1.055   1.916
  302   1HE   MET  35          HE1       MET  35 -16.843  -1.128  -0.393
  303   2HE   MET  35          HE2       MET  35 -15.496  -1.989   0.343
  304   3HE   MET  35          HE3       MET  35 -15.372  -0.258   0.058
  305    H    ASP  36           HN       ASP  36 -14.674   1.778   6.115
  306    HA   ASP  36           HA       ASP  36 -16.644   2.872   7.939
  307   1HB   ASP  36          HB2       ASP  36 -13.966   1.529   8.339
  308   2HB   ASP  36          HB1       ASP  36 -14.948   2.097   9.690
  309    H    ARG  37           HN       ARG  37 -13.176   3.639   7.415
  310    HA   ARG  37           HA       ARG  37 -13.107   5.822   9.233
  311   1HB   ARG  37          HB2       ARG  37 -11.112   4.710   8.126
  312   2HB   ARG  37          HB1       ARG  37 -11.514   5.605   6.664
  313   1HG   ARG  37          HG2       ARG  37  -9.922   6.991   7.690
  314   2HG   ARG  37          HG1       ARG  37 -11.444   7.710   8.202
  315   1HD   ARG  37          HD2       ARG  37 -11.298   6.602  10.366
  316   2HD   ARG  37          HD1       ARG  37  -9.879   5.696   9.845
  317    HE   ARG  37           HE       ARG  37  -9.166   8.366   9.518
  318   1HH1  ARG  37          HH21      ARG  37 -10.354   6.342  12.047
  319   2HH1  ARG  37          HH22      ARG  37  -9.596   7.255  13.311
  320   1HH2  ARG  37          HH11      ARG  37  -8.174   9.566  11.153
  321   2HH2  ARG  37          HH12      ARG  37  -8.363   9.077  12.804
  322    H    PHE  38           HN       PHE  38 -13.738   5.759   5.734
  323    HA   PHE  38           HA       PHE  38 -14.962   8.487   5.968
  324   1HB   PHE  38          HB2       PHE  38 -13.652   7.309   3.509
  325   2HB   PHE  38          HB1       PHE  38 -14.177   8.976   3.753
  326    HD1  PHE  38           HD1      PHE  38 -13.078  10.315   5.664
  327    HD2  PHE  38           HD2      PHE  38 -11.474   6.637   4.136
  328    HE1  PHE  38           HE1      PHE  38 -10.869  10.867   6.649
  329    HE2  PHE  38           HE2      PHE  38  -9.267   7.188   5.119
  330    HZ   PHE  38           HZ       PHE  38  -8.965   9.303   6.377
  331    HA   PRO  39           HA       PRO  39 -18.330   5.747   4.525
  332   1HB   PRO  39          HB2       PRO  39 -20.431   7.195   5.387
  333   2HB   PRO  39          HB1       PRO  39 -19.389   6.310   6.521
  334   1HG   PRO  39          HG2       PRO  39 -19.392   9.217   5.836
  335   2HG   PRO  39          HG1       PRO  39 -19.233   8.437   7.420
  336   1HD   PRO  39          HD2       PRO  39 -17.088   9.371   5.927
  337   2HD   PRO  39          HD1       PRO  39 -16.958   8.098   7.160
  338    H    PHE  40           HN       PHE  40 -17.492   8.870   3.443
  339    HA   PHE  40           HA       PHE  40 -19.690   9.513   1.753
  340   1HB   PHE  40          HB2       PHE  40 -16.963  10.109   0.694
  341   2HB   PHE  40          HB1       PHE  40 -18.336  11.184   0.924
  342    HD1  PHE  40           HD1      PHE  40 -19.033  11.159   3.655
  343    HD2  PHE  40           HD2      PHE  40 -15.110  10.758   1.945
  344    HE1  PHE  40           HE1      PHE  40 -18.025  12.027   5.751
  345    HE2  PHE  40           HE2      PHE  40 -14.110  11.628   4.037
  346    HZ   PHE  40           HZ       PHE  40 -15.566  12.262   5.941
  347    H    TYR  41           HN       TYR  41 -16.972   7.334   1.347
  348    HA   TYR  41           HA       TYR  41 -17.287   6.816  -1.448
  349   1HB   TYR  41          HB2       TYR  41 -16.072   5.192   0.800
  350   2HB   TYR  41          HB1       TYR  41 -15.961   4.738  -0.903
  351    HD1  TYR  41           HD1      TYR  41 -14.587   5.989  -2.454
  352    HD2  TYR  41           HD2      TYR  41 -15.009   7.264   1.618
  353    HE1  TYR  41           HE1      TYR  41 -12.718   7.585  -2.769
  354    HE2  TYR  41           HE2      TYR  41 -13.140   8.864   1.317
  355    HH   TYR  41           HH       TYR  41 -11.635   9.689  -0.092
  356    H    ARG  42           HN       ARG  42 -18.969   5.559   1.371
  357    HA   ARG  42           HA       ARG  42 -19.993   3.172   0.206
  358   1HB   ARG  42          HB2       ARG  42 -21.159   5.016   2.307
  359   2HB   ARG  42          HB1       ARG  42 -21.899   3.480   1.852
  360   1HG   ARG  42          HG2       ARG  42 -19.817   2.296   2.436
  361   2HG   ARG  42          HG1       ARG  42 -19.072   3.828   2.894
  362   1HD   ARG  42          HD2       ARG  42 -19.972   2.545   4.849
  363   2HD   ARG  42          HD1       ARG  42 -20.699   4.143   4.674
  364    HE   ARG  42           HE       ARG  42 -22.428   2.510   3.278
  365   1HH1  ARG  42          HH21      ARG  42 -20.977   2.451   6.405
  366   2HH1  ARG  42          HH22      ARG  42 -22.333   1.687   7.164
  367   1HH2  ARG  42          HH11      ARG  42 -24.209   1.516   4.255
  368   2HH2  ARG  42          HH12      ARG  42 -24.161   1.157   5.949
  369    H    GLU  43           HN       GLU  43 -21.149   6.534   0.029
  370    HA   GLU  43           HA       GLU  43 -23.590   5.966  -1.321
  371   1HB   GLU  43          HB2       GLU  43 -21.772   8.383  -1.451
  372   2HB   GLU  43          HB1       GLU  43 -23.352   8.319  -2.232
  373   1HG   GLU  43          HG2       GLU  43 -24.417   7.864  -0.054
  374   2HG   GLU  43          HG1       GLU  43 -22.839   7.931   0.732
  375    H    ASN  44           HN       ASN  44 -20.329   6.428  -2.470
  376    HA   ASN  44           HA       ASN  44 -21.157   5.471  -5.199
  377   1HB   ASN  44          HB2       ASN  44 -18.930   7.345  -4.356
  378   2HB   ASN  44          HB1       ASN  44 -19.078   6.670  -5.980
  379   1HD2  ASN  44          HD21      ASN  44 -19.350   9.543  -5.146
  380   2HD2  ASN  44          HD22      ASN  44 -20.904  10.015  -5.642
  381    H    LYS  45           HN       LYS  45 -20.681   3.298  -5.122
  382    HA   LYS  45           HA       LYS  45 -18.226   2.368  -3.768
  383   1HB   LYS  45          HB2       LYS  45 -20.424   0.862  -5.205
  384   2HB   LYS  45          HB1       LYS  45 -19.096   0.115  -4.315
  385   1HG   LYS  45          HG2       LYS  45 -19.829   1.267  -2.258
  386   2HG   LYS  45          HG1       LYS  45 -21.158   2.010  -3.148
  387   1HD   LYS  45          HD2       LYS  45 -22.053  -0.240  -3.670
  388   2HD   LYS  45          HD1       LYS  45 -20.737  -0.967  -2.745
  389   1HE   LYS  45          HE2       LYS  45 -21.511   0.376  -0.751
  390   2HE   LYS  45          HE1       LYS  45 -22.925   0.845  -1.694
  391   1HZ   LYS  45          HZ1       LYS  45 -22.634  -1.437  -0.199
  392   2HZ   LYS  45          HZ2       LYS  45 -22.489  -1.961  -1.808
  393   3HZ   LYS  45          HZ3       LYS  45 -23.871  -1.106  -1.312
  394    H    GLN  46           HN       GLN  46 -19.677   1.817  -6.989
  395    HA   GLN  46           HA       GLN  46 -17.213   0.844  -8.119
  396   1HB   GLN  46          HB2       GLN  46 -19.733   1.914  -9.418
  397   2HB   GLN  46          HB1       GLN  46 -18.419   1.130 -10.297
  398   1HG   GLN  46          HG2       GLN  46 -18.721  -0.909  -8.945
  399   2HG   GLN  46          HG1       GLN  46 -20.032  -0.130  -8.059
  400   1HE2  GLN  46          HE21      GLN  46 -22.036   0.368  -9.276
  401   2HE2  GLN  46          HE22      GLN  46 -22.389  -0.458 -10.716
  402    H    GLY  47           HN       GLY  47 -15.641   1.919  -9.271
  403   1HA   GLY  47          HA2       GLY  47 -15.031   3.867 -10.705
  404   2HA   GLY  47          HA1       GLY  47 -15.932   4.891  -9.591
  405    H    TRP  48           HN       TRP  48 -15.086   4.393  -7.149
  406    HA   TRP  48           HA       TRP  48 -12.277   5.224  -7.241
  407   1HB   TRP  48          HB2       TRP  48 -12.504   5.696  -4.908
  408   2HB   TRP  48          HB1       TRP  48 -13.988   6.225  -5.692
  409    HD1  TRP  48           HD1      TRP  48 -16.214   4.820  -5.205
  410    HE1  TRP  48           HE1      TRP  48 -16.818   3.220  -3.290
  411    HE3  TRP  48           HE3      TRP  48 -11.556   3.828  -3.354
  412    HZ2  TRP  48           HZ2      TRP  48 -15.524   1.698  -1.249
  413    HZ3  TRP  48           HZ3      TRP  48 -11.277   2.291  -1.436
  414    HH2  TRP  48           HH2      TRP  48 -13.249   1.228  -0.379
  415    H    GLN  49           HN       GLN  49 -14.043   2.297  -6.430
  416    HA   GLN  49           HA       GLN  49 -11.952   1.012  -4.951
  417   1HB   GLN  49          HB2       GLN  49 -14.210  -0.102  -6.638
  418   2HB   GLN  49          HB1       GLN  49 -13.136  -1.108  -5.665
  419   1HG   GLN  49          HG2       GLN  49 -13.790   0.139  -3.640
  420   2HG   GLN  49          HG1       GLN  49 -14.867   1.146  -4.608
  421   1HE2  GLN  49          HE21      GLN  49 -15.394  -1.463  -6.282
  422   2HE2  GLN  49          HE22      GLN  49 -16.561  -2.275  -5.355
  423    H    ASN  50           HN       ASN  50 -12.703   1.073  -8.430
  424    HA   ASN  50           HA       ASN  50 -10.632  -0.785  -9.174
  425   1HB   ASN  50          HB2       ASN  50 -12.178   1.274 -10.755
  426   2HB   ASN  50          HB1       ASN  50 -11.008   0.177 -11.487
  427   1HD2  ASN  50          HD21      ASN  50 -13.832   0.090 -12.126
  428   2HD2  ASN  50          HD22      ASN  50 -14.439  -1.397 -11.574
  429    H    SER  51           HN       SER  51 -10.699   2.778  -9.018
  430    HA   SER  51           HA       SER  51  -8.224   3.225 -10.331
  431   1HB   SER  51          HB2       SER  51  -9.560   4.791  -8.109
  432   2HB   SER  51          HB1       SER  51  -8.168   5.366  -9.023
  433    HG   SER  51           HG       SER  51 -10.593   4.503 -10.214
  434    H    ILE  52           HN       ILE  52  -8.896   2.508  -6.908
  435    HA   ILE  52           HA       ILE  52  -6.249   2.906  -5.938
  436    HB   ILE  52           HB       ILE  52  -8.386   0.959  -5.035
  437   1HG1  ILE  52          HG12      ILE  52  -9.084   3.316  -4.943
  438   2HG1  ILE  52          HG11      ILE  52  -8.862   2.673  -3.321
  439   1HG2  ILE  52          HG21      ILE  52  -5.761   1.781  -3.796
  440   2HG2  ILE  52          HG22      ILE  52  -6.367   0.153  -4.099
  441   3HG2  ILE  52          HG23      ILE  52  -7.088   1.140  -2.828
  442   1HD1  ILE  52          HD11      ILE  52  -7.286   4.738  -4.781
  443   2HD1  ILE  52          HD12      ILE  52  -6.389   3.678  -3.699
  444   3HD1  ILE  52          HD13      ILE  52  -7.716   4.648  -3.076
  445    H    ARG  53           HN       ARG  53  -7.776   0.050  -7.419
  446    HA   ARG  53           HA       ARG  53  -5.538  -1.721  -7.009
  447   1HB   ARG  53          HB2       ARG  53  -7.548  -1.841  -9.282
  448   2HB   ARG  53          HB1       ARG  53  -6.633  -3.181  -8.586
  449   1HG   ARG  53          HG2       ARG  53  -7.773  -2.658  -6.386
  450   2HG   ARG  53          HG1       ARG  53  -8.830  -1.577  -7.280
  451   1HD   ARG  53          HD2       ARG  53  -9.063  -3.810  -8.821
  452   2HD   ARG  53          HD1       ARG  53  -8.789  -4.547  -7.238
  453    HE   ARG  53           HE       ARG  53 -10.730  -2.664  -6.723
  454   1HH1  ARG  53          HH21      ARG  53 -10.291  -5.179  -9.041
  455   2HH1  ARG  53          HH22      ARG  53 -11.979  -5.546  -9.160
  456   1HH2  ARG  53          HH11      ARG  53 -12.939  -3.132  -6.864
  457   2HH2  ARG  53          HH12      ARG  53 -13.477  -4.387  -7.929
  458    H    HIS  54           HN       HIS  54  -6.431   0.521  -9.609
  459    HA   HIS  54           HA       HIS  54  -4.489  -0.275 -11.523
  460   1HB   HIS  54          HB2       HIS  54  -6.329   1.294 -12.024
  461   2HB   HIS  54          HB1       HIS  54  -5.589   2.500 -10.973
  462    HD1  HIS  54           HD1      HIS  54  -4.541   0.400 -13.993
  463    HD2  HIS  54           HD2      HIS  54  -3.920   4.187 -12.366
  464    HE1  HIS  54           HE1      HIS  54  -3.075   1.652 -15.634
  465    H    ASN  55           HN       ASN  55  -4.276   2.107  -8.878
  466    HA   ASN  55           HA       ASN  55  -1.553   2.856  -9.467
  467   1HB   ASN  55          HB2       ASN  55  -3.260   3.112  -6.979
  468   2HB   ASN  55          HB1       ASN  55  -1.609   3.728  -7.072
  469   1HD2  ASN  55          HD21      ASN  55  -1.236   5.153  -9.171
  470   2HD2  ASN  55          HD22      ASN  55  -2.481   6.244  -9.546
  471    H    LEU  56           HN       LEU  56  -3.030   0.425  -7.343
  472    HA   LEU  56           HA       LEU  56  -0.552  -0.371  -6.116
  473   1HB   LEU  56          HB2       LEU  56  -3.226  -1.740  -6.391
  474   2HB   LEU  56          HB1       LEU  56  -1.875  -2.464  -5.521
  475    HG   LEU  56           HG       LEU  56  -2.974   0.298  -4.918
  476   1HD1  LEU  56          HD11      LEU  56  -4.156  -0.707  -3.046
  477   2HD1  LEU  56          HD12      LEU  56  -3.503  -2.297  -3.441
  478   3HD1  LEU  56          HD13      LEU  56  -4.650  -1.516  -4.532
  479   1HD2  LEU  56          HD21      LEU  56  -0.853   0.278  -3.948
  480   2HD2  LEU  56          HD22      LEU  56  -0.853  -1.468  -3.713
  481   3HD2  LEU  56          HD23      LEU  56  -1.788  -0.434  -2.640
  482    H    SER  57           HN       SER  57   0.340  -0.240  -8.544
  483    HA   SER  57           HA       SER  57   1.216  -2.898  -9.181
  484   1HB   SER  57          HB2       SER  57   0.219  -2.970 -11.504
  485   2HB   SER  57          HB1       SER  57  -0.949  -3.207 -10.207
  486    HG   SER  57           HG       SER  57  -1.896  -1.663 -11.359
  487    H    LEU  58           HN       LEU  58   0.528   0.213 -10.813
  488    HA   LEU  58           HA       LEU  58   3.012   0.234 -12.279
  489   1HB   LEU  58          HB2       LEU  58   1.126   2.473 -11.486
  490   2HB   LEU  58          HB1       LEU  58   2.489   2.683 -12.581
  491    HG   LEU  58           HG       LEU  58   0.478   0.514 -13.156
  492   1HD1  LEU  58          HD11      LEU  58   0.138   3.461 -13.789
  493   2HD1  LEU  58          HD12      LEU  58  -0.917   2.474 -12.777
  494   3HD1  LEU  58          HD13      LEU  58  -0.817   2.165 -14.511
  495   1HD2  LEU  58          HD21      LEU  58   2.697   0.957 -14.438
  496   2HD2  LEU  58          HD22      LEU  58   1.878   2.373 -15.089
  497   3HD2  LEU  58          HD23      LEU  58   1.227   0.762 -15.389
  498    H    ASN  59           HN       ASN  59   1.958   1.618  -9.181
  499    HA   ASN  59           HA       ASN  59   4.465   2.983  -8.685
  500   1HB   ASN  59          HB2       ASN  59   2.307   2.084  -6.748
  501   2HB   ASN  59          HB1       ASN  59   3.627   3.190  -6.361
  502   1HD2  ASN  59          HD21      ASN  59   0.464   3.404  -6.850
  503   2HD2  ASN  59          HD22      ASN  59   0.354   4.838  -7.753
  504    H    GLU  60           HN       GLU  60   6.341   2.031  -8.137
  505    HA   GLU  60           HA       GLU  60   6.358  -0.827  -7.390
  506   1HB   GLU  60          HB2       GLU  60   8.586   1.143  -7.988
  507   2HB   GLU  60          HB1       GLU  60   8.820  -0.579  -7.678
  508   1HG   GLU  60          HG2       GLU  60   7.399  -1.143  -9.598
  509   2HG   GLU  60          HG1       GLU  60   7.102   0.570  -9.902
  510    H    CYS  61           HN       CYS  61   6.012   2.001  -5.735
  511    HA   CYS  61           HA       CYS  61   7.871   1.730  -3.569
  512   1HB   CYS  61          HB2       CYS  61   5.138   3.027  -3.738
  513   2HB   CYS  61          HB1       CYS  61   6.171   3.130  -2.313
  514    HG   CYS  61           HG       CYS  61   7.531   4.852  -3.455
  515    H    PHE  62           HN       PHE  62   4.590   0.446  -4.083
  516    HA   PHE  62           HA       PHE  62   4.510  -0.792  -1.439
  517   1HB   PHE  62          HB2       PHE  62   2.760  -1.241  -3.877
  518   2HB   PHE  62          HB1       PHE  62   2.418  -1.828  -2.250
  519    HD1  PHE  62           HD1      PHE  62   1.943   0.864  -4.525
  520    HD2  PHE  62           HD2      PHE  62   2.424  -0.016  -0.348
  521    HE1  PHE  62           HE1      PHE  62   0.918   3.046  -3.946
  522    HE2  PHE  62           HE2      PHE  62   1.394   2.164   0.230
  523    HZ   PHE  62           HZ       PHE  62   0.642   3.695  -1.569
  524    H    VAL  63           HN       VAL  63   4.640  -3.046  -1.017
  525    HA   VAL  63           HA       VAL  63   6.036  -4.662  -3.132
  526    HB   VAL  63           HB       VAL  63   6.311  -4.856  -0.118
  527   1HG1  VAL  63          HG11      VAL  63   7.567  -6.326  -2.438
  528   2HG1  VAL  63          HG12      VAL  63   6.719  -6.999  -1.045
  529   3HG1  VAL  63          HG13      VAL  63   8.319  -6.284  -0.843
  530   1HG2  VAL  63          HG21      VAL  63   7.521  -2.928  -0.545
  531   2HG2  VAL  63          HG22      VAL  63   7.855  -3.366  -2.219
  532   3HG2  VAL  63          HG23      VAL  63   8.768  -4.118  -0.914
  533    H    LYS  64           HN       LYS  64   4.932  -6.457  -3.738
  534    HA   LYS  64           HA       LYS  64   2.527  -7.238  -2.185
  535   1HB   LYS  64          HB2       LYS  64   2.532  -6.939  -4.719
  536   2HB   LYS  64          HB1       LYS  64   3.503  -8.410  -4.804
  537   1HG   LYS  64          HG2       LYS  64   1.688  -9.562  -3.466
  538   2HG   LYS  64          HG1       LYS  64   0.706  -8.116  -3.679
  539   1HD   LYS  64          HD2       LYS  64   1.893  -9.726  -5.956
  540   2HD   LYS  64          HD1       LYS  64   0.233  -9.884  -5.387
  541   1HE   LYS  64          HE2       LYS  64   0.012  -8.381  -7.173
  542   2HE   LYS  64          HE1       LYS  64   0.117  -7.301  -5.788
  543   1HZ   LYS  64          HZ1       LYS  64   2.708  -7.937  -6.696
  544   2HZ   LYS  64          HZ2       LYS  64   1.951  -6.419  -6.618
  545   3HZ   LYS  64          HZ3       LYS  64   1.782  -7.385  -8.004
  546    H    VAL  65           HN       VAL  65   2.623  -8.899  -0.781
  547    HA   VAL  65           HA       VAL  65   4.734 -11.003  -1.121
  548    HB   VAL  65           HB       VAL  65   4.394 -10.912   1.605
  549   1HG1  VAL  65          HG11      VAL  65   6.327  -9.292  -0.077
  550   2HG1  VAL  65          HG12      VAL  65   6.570 -10.929   0.534
  551   3HG1  VAL  65          HG13      VAL  65   6.509  -9.569   1.655
  552   1HG2  VAL  65          HG21      VAL  65   4.299  -8.026   0.683
  553   2HG2  VAL  65          HG22      VAL  65   4.331  -8.612   2.347
  554   3HG2  VAL  65          HG23      VAL  65   2.913  -8.895   1.340
  555    HA   PRO  66           HA       PRO  66   0.454 -12.818  -0.878
  556   1HB   PRO  66          HB2       PRO  66   1.687 -14.832  -2.683
  557   2HB   PRO  66          HB1       PRO  66   0.186 -13.912  -2.885
  558   1HG   PRO  66          HG2       PRO  66   2.377 -13.384  -4.340
  559   2HG   PRO  66          HG1       PRO  66   1.261 -12.105  -3.828
  560   1HD   PRO  66          HD2       PRO  66   3.945 -12.833  -2.686
  561   2HD   PRO  66          HD1       PRO  66   3.223 -11.226  -2.926
  562    H    ARG  67           HN       ARG  67  -0.204 -14.746   0.231
  563    HA   ARG  67           HA       ARG  67   1.803 -15.856   2.011
  564   1HB   ARG  67          HB2       ARG  67  -0.380 -17.551   2.261
  565   2HB   ARG  67          HB1       ARG  67  -0.153 -16.069   3.176
  566   1HG   ARG  67          HG2       ARG  67  -1.442 -14.803   1.543
  567   2HG   ARG  67          HG1       ARG  67  -1.570 -16.223   0.506
  568   1HD   ARG  67          HD2       ARG  67  -3.606 -15.755   1.958
  569   2HD   ARG  67          HD1       ARG  67  -2.935 -17.379   2.101
  570    HE   ARG  67           HE       ARG  67  -1.651 -15.967   4.104
  571   1HH1  ARG  67          HH21      ARG  67  -4.917 -16.458   3.119
  572   2HH1  ARG  67          HH22      ARG  67  -5.555 -16.354   4.726
  573   1HH2  ARG  67          HH11      ARG  67  -2.460 -15.837   6.204
  574   2HH2  ARG  67          HH12      ARG  67  -4.163 -16.003   6.473
  575    H    ASP  68           HN       ASP  68   1.285 -18.583   2.065
  576    HA   ASP  68           HA       ASP  68   2.804 -19.506  -0.214
  577   1HB   ASP  68          HB2       ASP  68   1.308 -20.979   1.971
  578   2HB   ASP  68          HB1       ASP  68   2.275 -21.791   0.740
  579    H    ASP  69           HN       ASP  69   2.054 -20.820  -1.965
  580    HA   ASP  69           HA       ASP  69  -0.607 -20.194  -2.899
  581   1HB   ASP  69          HB2       ASP  69   1.487 -22.150  -3.879
  582   2HB   ASP  69          HB1       ASP  69  -0.044 -21.874  -4.711
  583    H    LYS  70           HN       LYS  70   0.703 -22.729  -0.939
  584    HA   LYS  70           HA       LYS  70  -1.143 -24.820  -1.488
  585   1HB   LYS  70          HB2       LYS  70   0.297 -24.047   1.062
  586   2HB   LYS  70          HB1       LYS  70  -0.649 -25.527   0.895
  587   1HG   LYS  70          HG2       LYS  70   0.765 -26.224  -1.001
  588   2HG   LYS  70          HG1       LYS  70   1.717 -24.747  -0.836
  589   1HD   LYS  70          HD2       LYS  70   2.349 -25.411   1.456
  590   2HD   LYS  70          HD1       LYS  70   1.403 -26.890   1.288
  591   1HE   LYS  70          HE2       LYS  70   3.828 -27.261   0.848
  592   2HE   LYS  70          HE1       LYS  70   2.825 -27.635  -0.553
  593   1HZ   LYS  70          HZ1       LYS  70   4.327 -25.114  -0.093
  594   2HZ   LYS  70          HZ2       LYS  70   3.307 -25.413  -1.418
  595   3HZ   LYS  70          HZ3       LYS  70   4.724 -26.327  -1.210
  596    H    LYS  71           HN       LYS  71  -1.394 -22.032   0.718
  597    HA   LYS  71           HA       LYS  71  -4.000 -22.872   1.701
  598   1HB   LYS  71          HB2       LYS  71  -2.471 -21.589   3.124
  599   2HB   LYS  71          HB1       LYS  71  -2.492 -20.256   1.967
  600   1HG   LYS  71          HG2       LYS  71  -4.856 -19.901   2.335
  601   2HG   LYS  71          HG1       LYS  71  -4.953 -21.335   3.355
  602   1HD   LYS  71          HD2       LYS  71  -3.290 -20.246   4.908
  603   2HD   LYS  71          HD1       LYS  71  -3.433 -18.779   3.939
  604   1HE   LYS  71          HE2       LYS  71  -5.764 -18.554   4.467
  605   2HE   LYS  71          HE1       LYS  71  -5.818 -20.160   5.192
  606   1HZ   LYS  71          HZ1       LYS  71  -5.130 -17.708   6.394
  607   2HZ   LYS  71          HZ2       LYS  71  -3.794 -18.755   6.470
  608   3HZ   LYS  71          HZ3       LYS  71  -5.290 -19.236   7.115
  609    HA   PRO  72           HA       PRO  72  -5.882 -20.809  -1.890
  610   1HB   PRO  72          HB2       PRO  72  -8.418 -21.645  -1.591
  611   2HB   PRO  72          HB1       PRO  72  -7.130 -22.790  -2.019
  612   1HG   PRO  72          HG2       PRO  72  -8.354 -22.252   0.657
  613   2HG   PRO  72          HG1       PRO  72  -8.000 -23.807  -0.118
  614   1HD   PRO  72          HD2       PRO  72  -6.335 -22.633   1.746
  615   2HD   PRO  72          HD1       PRO  72  -5.762 -23.745   0.482
  616    H    GLY  73           HN       GLY  73  -8.545 -19.835  -1.765
  617   1HA   GLY  73          HA2       GLY  73  -9.812 -18.012  -1.017
  618   2HA   GLY  73          HA1       GLY  73  -9.046 -18.220   0.555
  619    H    LYS  74           HN       LYS  74  -8.048 -16.399   1.166
  620    HA   LYS  74           HA       LYS  74  -7.377 -14.241  -0.573
  621   1HB   LYS  74          HB2       LYS  74  -6.438 -14.945   2.220
  622   2HB   LYS  74          HB1       LYS  74  -6.071 -13.415   1.420
  623   1HG   LYS  74          HG2       LYS  74  -8.405 -12.853   1.245
  624   2HG   LYS  74          HG1       LYS  74  -8.892 -14.455   1.794
  625   1HD   LYS  74          HD2       LYS  74  -7.127 -12.784   3.568
  626   2HD   LYS  74          HD1       LYS  74  -8.848 -12.417   3.489
  627   1HE   LYS  74          HE2       LYS  74  -7.975 -15.263   3.930
  628   2HE   LYS  74          HE1       LYS  74  -7.965 -14.131   5.281
  629   1HZ   LYS  74          HZ1       LYS  74 -10.174 -14.126   5.381
  630   2HZ   LYS  74          HZ2       LYS  74 -10.117 -15.520   4.410
  631   3HZ   LYS  74          HZ3       LYS  74 -10.356 -13.995   3.699
  632    H    GLY  75           HN       GLY  75  -5.437 -13.673  -1.556
  633   1HA   GLY  75          HA2       GLY  75  -3.017 -15.302  -1.065
  634   2HA   GLY  75          HA1       GLY  75  -3.696 -15.389  -2.688
  635    H    SER  76           HN       SER  76  -3.642 -12.494  -0.622
  636    HA   SER  76           HA       SER  76  -1.402 -11.349  -2.143
  637   1HB   SER  76          HB2       SER  76  -4.259 -10.469  -2.540
  638   2HB   SER  76          HB1       SER  76  -2.922  -9.352  -2.800
  639    HG   SER  76           HG       SER  76  -3.485 -10.468  -4.711
  640    H    TYR  77           HN       TYR  77  -0.356  -9.847  -0.921
  641    HA   TYR  77           HA       TYR  77  -1.800  -8.559   1.357
  642   1HB   TYR  77          HB2       TYR  77   0.869  -9.985   1.424
  643   2HB   TYR  77          HB1       TYR  77   0.456  -8.754   2.607
  644    HD1  TYR  77           HD1      TYR  77  -2.155  -9.119   3.523
  645    HD2  TYR  77           HD2      TYR  77   0.557 -12.170   2.173
  646    HE1  TYR  77           HE1      TYR  77  -3.363 -10.803   4.872
  647    HE2  TYR  77           HE2      TYR  77  -0.644 -13.844   3.521
  648    HH   TYR  77           HH       TYR  77  -2.532 -13.223   5.965
  649    H    TRP  78           HN       TRP  78  -0.851  -6.501   1.973
  650    HA   TRP  78           HA       TRP  78   0.970  -5.311  -0.098
  651   1HB   TRP  78          HB2       TRP  78  -1.486  -4.102   1.206
  652   2HB   TRP  78          HB1       TRP  78  -0.322  -3.181   0.252
  653    HD1  TRP  78           HD1      TRP  78  -3.412  -5.138  -0.095
  654    HE1  TRP  78           HE1      TRP  78  -3.884  -5.672  -2.571
  655    HE3  TRP  78           HE3      TRP  78   1.114  -3.936  -2.143
  656    HZ2  TRP  78           HZ2      TRP  78  -2.521  -5.608  -5.089
  657    HZ3  TRP  78           HZ3      TRP  78   1.499  -4.197  -4.576
  658    HH2  TRP  78           HH2      TRP  78  -0.311  -5.021  -6.050
  659    H    THR  79           HN       THR  79   2.691  -4.194   0.754
  660    HA   THR  79           HA       THR  79   2.589  -3.093   3.465
  661    HB   THR  79           HB       THR  79   3.088  -5.545   3.794
  662    HG1  THR  79           HG1      THR  79   4.995  -3.570   4.465
  663   1HG2  THR  79          HG21      THR  79   5.778  -4.906   2.581
  664   2HG2  THR  79          HG22      THR  79   4.479  -5.629   1.633
  665   3HG2  THR  79          HG23      THR  79   5.129  -6.483   3.033
  666    H    LEU  80           HN       LEU  80   4.688  -1.970   3.994
  667    HA   LEU  80           HA       LEU  80   5.806  -0.765   1.524
  668   1HB   LEU  80          HB2       LEU  80   6.122  -0.056   4.457
  669   2HB   LEU  80          HB1       LEU  80   6.852   0.846   3.132
  670    HG   LEU  80           HG       LEU  80   3.874   0.355   3.412
  671   1HD1  LEU  80          HD11      LEU  80   5.621   2.666   4.276
  672   2HD1  LEU  80          HD12      LEU  80   4.475   1.746   5.250
  673   3HD1  LEU  80          HD13      LEU  80   3.887   2.848   4.006
  674   1HD2  LEU  80          HD21      LEU  80   4.203   0.857   1.157
  675   2HD2  LEU  80          HD22      LEU  80   5.607   1.876   1.473
  676   3HD2  LEU  80          HD23      LEU  80   3.986   2.472   1.823
  677    H    ASP  81           HN       ASP  81   7.697  -1.515   0.714
  678    HA   ASP  81           HA       ASP  81   9.925  -2.149   2.450
  679   1HB   ASP  81          HB2       ASP  81   8.228  -4.322   1.304
  680   2HB   ASP  81          HB1       ASP  81   9.973  -4.583   1.282
  681    HA   PRO  82           HA       PRO  82  11.933  -1.198  -1.410
  682   1HB   PRO  82          HB2       PRO  82  14.456  -1.995  -0.958
  683   2HB   PRO  82          HB1       PRO  82  13.724  -0.717   0.037
  684   1HG   PRO  82          HG2       PRO  82  14.056  -3.627   0.656
  685   2HG   PRO  82          HG1       PRO  82  14.393  -2.221   1.683
  686   1HD   PRO  82          HD2       PRO  82  12.057  -3.683   1.846
  687   2HD   PRO  82          HD1       PRO  82  12.176  -1.965   2.291
  688    H    ASP  83           HN       ASP  83  13.967  -2.606  -2.732
  689    HA   ASP  83           HA       ASP  83  12.462  -4.840  -3.874
  690   1HB   ASP  83          HB2       ASP  83  15.265  -3.789  -4.390
  691   2HB   ASP  83          HB1       ASP  83  14.530  -5.113  -5.293
  692    H    SER  84           HN       SER  84  12.598  -5.603  -1.394
  693    HA   SER  84           HA       SER  84  15.075  -7.021  -0.731
  694   1HB   SER  84          HB2       SER  84  13.625  -7.845   1.219
  695   2HB   SER  84          HB1       SER  84  13.916  -6.110   1.132
  696    HG   SER  84           HG       SER  84  11.790  -6.125   1.276
  697    H    TYR  85           HN       TYR  85  14.222  -8.003  -3.144
  698    HA   TYR  85           HA       TYR  85  12.470 -10.276  -2.893
  699   1HB   TYR  85          HB2       TYR  85  13.396  -8.916  -5.010
  700   2HB   TYR  85          HB1       TYR  85  14.589 -10.208  -5.020
  701    HD1  TYR  85           HD1      TYR  85  13.321 -12.636  -4.391
  702    HD2  TYR  85           HD2      TYR  85  11.634  -9.286  -6.492
  703    HE1  TYR  85           HE1      TYR  85  11.680 -14.140  -5.475
  704    HE2  TYR  85           HE2      TYR  85   9.996 -10.796  -7.575
  705    HH   TYR  85           HH       TYR  85   8.954 -13.220  -6.823
  706    H    ASN  86           HN       ASN  86  16.036 -10.124  -3.294
  707    HA   ASN  86           HA       ASN  86  16.206 -12.839  -2.040
  708   1HB   ASN  86          HB2       ASN  86  18.093 -11.364  -3.887
  709   2HB   ASN  86          HB1       ASN  86  18.473 -12.903  -3.113
  710   1HD2  ASN  86          HD21      ASN  86  16.533 -14.603  -3.457
  711   2HD2  ASN  86          HD22      ASN  86  15.942 -14.688  -5.045
  712    H    MET  87           HN       MET  87  16.169 -10.008  -0.752
  713    HA   MET  87           HA       MET  87  18.815  -9.671   0.352
  714   1HB   MET  87          HB2       MET  87  16.097  -8.630   1.160
  715   2HB   MET  87          HB1       MET  87  17.531  -8.300   2.132
  716   1HG   MET  87          HG2       MET  87  17.324  -7.677  -0.827
  717   2HG   MET  87          HG1       MET  87  17.001  -6.503   0.448
  718   1HE   MET  87          HE1       MET  87  19.656  -7.775  -1.925
  719   2HE   MET  87          HE2       MET  87  20.668  -6.384  -1.540
  720   3HE   MET  87          HE3       MET  87  18.948  -6.155  -1.853
  721    H    PHE  88           HN       PHE  88  16.909 -12.211   0.639
  722    HA   PHE  88           HA       PHE  88  16.662 -12.751   3.428
  723   1HB   PHE  88          HB2       PHE  88  17.000 -14.547   1.014
  724   2HB   PHE  88          HB1       PHE  88  16.809 -15.200   2.640
  725    HD1  PHE  88           HD1      PHE  88  15.211 -13.048   0.066
  726    HD2  PHE  88           HD2      PHE  88  14.673 -15.267   3.704
  727    HE1  PHE  88           HE1      PHE  88  12.757 -12.756  -0.121
  728    HE2  PHE  88           HE2      PHE  88  12.218 -14.972   3.520
  729    HZ   PHE  88           HZ       PHE  88  11.259 -13.717   1.606
  730    H    GLU  89           HN       GLU  89  19.317 -13.298   1.142
  731    HA   GLU  89           HA       GLU  89  21.062 -14.241   3.374
  732   1HB   GLU  89          HB2       GLU  89  21.669 -14.211   0.405
  733   2HB   GLU  89          HB1       GLU  89  22.510 -15.108   1.666
  734   1HG   GLU  89          HG2       GLU  89  21.111 -16.738   0.699
  735   2HG   GLU  89          HG1       GLU  89  20.211 -16.227   2.124
  736    H    ASN  90           HN       ASN  90  22.842 -13.043   3.989
  737    HA   ASN  90           HA       ASN  90  23.415 -10.505   2.497
  738   1HB   ASN  90          HB2       ASN  90  23.260 -10.895   5.501
  739   2HB   ASN  90          HB1       ASN  90  23.825  -9.427   4.700
  740   1HD2  ASN  90          HD21      ASN  90  22.006  -9.079   2.639
  741   2HD2  ASN  90          HD22      ASN  90  20.434  -8.902   3.256
  742    H    GLY  91           HN       GLY  91  25.605  -9.824   2.596
  743   1HA   GLY  91          HA2       GLY  91  27.932 -10.068   3.095
  744   2HA   GLY  91          HA1       GLY  91  27.581 -11.597   3.906
  745    H    SER  92           HN       SER  92  25.816 -12.068   1.349
  746    HA   SER  92           HA       SER  92  27.841 -13.641  -0.045
  747   1HB   SER  92          HB2       SER  92  26.052 -14.614  -1.190
  748   2HB   SER  92          HB1       SER  92  25.260 -14.103   0.299
  749    HG   SER  92           HG       SER  92  24.932 -13.224  -2.268
  750    H    PHE  93           HN       PHE  93  26.501 -10.476  -0.319
  751    HA   PHE  93           HA       PHE  93  28.032 -10.052  -2.853
  752   1HB   PHE  93          HB2       PHE  93  26.221  -8.680  -3.741
  753   2HB   PHE  93          HB1       PHE  93  25.594 -10.282  -3.360
  754    HD1  PHE  93           HD1      PHE  93  25.637  -6.734  -2.372
  755    HD2  PHE  93           HD2      PHE  93  24.090 -10.640  -1.473
  756    HE1  PHE  93           HE1      PHE  93  23.942  -5.719  -0.873
  757    HE2  PHE  93           HE2      PHE  93  22.397  -9.624   0.029
  758    HZ   PHE  93           HZ       PHE  93  22.324  -7.163   0.328
  759    H    LEU  94           HN       LEU  94  29.007  -8.025  -2.995
  760    HA   LEU  94           HA       LEU  94  28.829  -6.278  -0.554
  761   1HB   LEU  94          HB2       LEU  94  31.182  -6.720  -2.423
  762   2HB   LEU  94          HB1       LEU  94  31.168  -5.661  -1.013
  763    HG   LEU  94           HG       LEU  94  30.742  -8.664  -0.949
  764   1HD1  LEU  94          HD11      LEU  94  33.128  -6.897  -0.383
  765   2HD1  LEU  94          HD12      LEU  94  33.035  -8.310  -1.434
  766   3HD1  LEU  94          HD13      LEU  94  32.984  -8.510   0.317
  767   1HD2  LEU  94          HD21      LEU  94  31.218  -8.116   1.586
  768   2HD2  LEU  94          HD22      LEU  94  29.601  -7.865   0.938
  769   3HD2  LEU  94          HD23      LEU  94  30.690  -6.492   1.144
  Start of MODEL    2
    1   1H    MET   1          HT1       MET   1 -22.337  19.881   1.926
    2   2H    MET   1          HT2       MET   1 -23.550  19.431   0.825
    3   3H    MET   1          HT3       MET   1 -21.913  19.270   0.400
    4    HA   MET   1           HA       MET   1 -23.142  17.804   2.665
    5   1HB   MET   1          HB2       MET   1 -23.216  15.860   1.128
    6   2HB   MET   1          HB1       MET   1 -24.273  17.160   0.574
    7   1HG   MET   1          HG2       MET   1 -22.388  17.946  -0.911
    8   2HG   MET   1          HG1       MET   1 -21.508  16.484  -0.465
    9   1HE   MET   1          HE1       MET   1 -24.792  17.919  -1.582
   10   2HE   MET   1          HE2       MET   1 -25.304  16.938  -2.952
   11   3HE   MET   1          HE3       MET   1 -23.886  17.972  -3.099
   12    H    LEU   2           HN       LEU   2 -21.650  15.462   1.932
   13    HA   LEU   2           HA       LEU   2 -19.036  16.229   3.001
   14   1HB   LEU   2          HB2       LEU   2 -20.062  13.541   2.033
   15   2HB   LEU   2          HB1       LEU   2 -18.569  13.801   2.932
   16    HG   LEU   2           HG       LEU   2 -21.332  14.527   3.954
   17   1HD1  LEU   2          HD11      LEU   2 -20.926  12.547   5.485
   18   2HD1  LEU   2          HD12      LEU   2 -19.570  12.112   4.443
   19   3HD1  LEU   2          HD13      LEU   2 -21.211  12.130   3.796
   20   1HD2  LEU   2          HD21      LEU   2 -19.924  14.453   6.169
   21   2HD2  LEU   2          HD22      LEU   2 -19.817  15.878   5.143
   22   3HD2  LEU   2          HD23      LEU   2 -18.540  14.663   5.096
   23    H    VAL   3           HN       VAL   3 -17.018  15.785   1.892
   24    HA   VAL   3           HA       VAL   3 -17.236  15.616  -1.094
   25    HB   VAL   3           HB       VAL   3 -15.435  17.291  -1.253
   26   1HG1  VAL   3          HG11      VAL   3 -17.815  18.146   0.423
   27   2HG1  VAL   3          HG12      VAL   3 -17.736  18.098  -1.338
   28   3HG1  VAL   3          HG13      VAL   3 -16.751  19.256  -0.443
   29   1HG2  VAL   3          HG21      VAL   3 -14.308  16.878   0.874
   30   2HG2  VAL   3          HG22      VAL   3 -15.739  17.392   1.766
   31   3HG2  VAL   3          HG23      VAL   3 -14.824  18.564   0.818
   32    H    LYS   4           HN       LYS   4 -15.223  14.811  -2.107
   33    HA   LYS   4           HA       LYS   4 -14.212  12.501  -0.823
   34   1HB   LYS   4          HB2       LYS   4 -12.324  12.781  -2.616
   35   2HB   LYS   4          HB1       LYS   4 -13.976  12.481  -3.147
   36   1HG   LYS   4          HG2       LYS   4 -14.319  14.706  -3.803
   37   2HG   LYS   4          HG1       LYS   4 -13.009  15.314  -2.792
   38   1HD   LYS   4          HD2       LYS   4 -11.340  14.417  -4.252
   39   2HD   LYS   4          HD1       LYS   4 -12.531  13.468  -5.140
   40   1HE   LYS   4          HE2       LYS   4 -11.942  15.447  -6.442
   41   2HE   LYS   4          HE1       LYS   4 -13.610  15.588  -5.888
   42   1HZ   LYS   4          HZ1       LYS   4 -12.717  17.632  -5.361
   43   2HZ   LYS   4          HZ2       LYS   4 -11.209  16.988  -4.915
   44   3HZ   LYS   4          HZ3       LYS   4 -12.554  16.794  -3.896
   45    HA   PRO   5           HA       PRO   5 -11.538  14.487   2.267
   46   1HB   PRO   5          HB2       PRO   5 -10.055  11.911   1.777
   47   2HB   PRO   5          HB1       PRO   5 -10.395  12.728   3.319
   48   1HG   PRO   5          HG2       PRO   5 -11.845  10.650   2.548
   49   2HG   PRO   5          HG1       PRO   5 -12.608  12.041   3.338
   50   1HD   PRO   5          HD2       PRO   5 -12.725  11.217   0.471
   51   2HD   PRO   5          HD1       PRO   5 -13.909  12.128   1.433
   52    HA   PRO   6           HA       PRO   6  -8.301  16.105  -0.340
   53   1HB   PRO   6          HB2       PRO   6  -6.510  17.017   1.499
   54   2HB   PRO   6          HB1       PRO   6  -8.094  17.782   1.256
   55   1HG   PRO   6          HG2       PRO   6  -7.250  15.827   3.355
   56   2HG   PRO   6          HG1       PRO   6  -8.208  17.310   3.523
   57   1HD   PRO   6          HD2       PRO   6  -9.359  14.833   3.414
   58   2HD   PRO   6          HD1       PRO   6 -10.166  16.291   2.791
   59    H    TYR   7           HN       TYR   7  -7.923  13.263   1.340
   60    HA   TYR   7           HA       TYR   7  -5.040  12.918   0.983
   61   1HB   TYR   7          HB2       TYR   7  -7.139  10.799   1.523
   62   2HB   TYR   7          HB1       TYR   7  -5.406  10.679   1.823
   63    HD1  TYR   7           HD1      TYR   7  -4.442  12.741   3.288
   64    HD2  TYR   7           HD2      TYR   7  -8.484  11.291   3.371
   65    HE1  TYR   7           HE1      TYR   7  -4.757  13.740   5.537
   66    HE2  TYR   7           HE2      TYR   7  -8.802  12.294   5.610
   67    HH   TYR   7           HH       TYR   7  -7.691  13.165   7.408
   68    H    SER   8           HN       SER   8  -4.054  12.055  -0.804
   69    HA   SER   8           HA       SER   8  -5.574  11.671  -3.232
   70   1HB   SER   8          HB2       SER   8  -2.700  11.039  -2.504
   71   2HB   SER   8          HB1       SER   8  -3.363  10.793  -4.116
   72    HG   SER   8           HG       SER   8  -3.960  13.247  -3.093
   73    H    TYR   9           HN       TYR   9  -5.412   9.521  -4.474
   74    HA   TYR   9           HA       TYR   9  -6.636   7.441  -2.962
   75   1HB   TYR   9          HB2       TYR   9  -5.202   7.401  -5.630
   76   2HB   TYR   9          HB1       TYR   9  -6.019   5.991  -4.962
   77    HD1  TYR   9           HD1      TYR   9  -6.421   9.058  -6.795
   78    HD2  TYR   9           HD2      TYR   9  -8.508   6.218  -4.336
   79    HE1  TYR   9           HE1      TYR   9  -8.586   9.883  -7.679
   80    HE2  TYR   9           HE2      TYR   9 -10.673   7.047  -5.218
   81    HH   TYR   9           HH       TYR   9 -11.103   9.874  -6.682
   82    H    ILE  10           HN       ILE  10  -3.273   7.963  -3.940
   83    HA   ILE  10           HA       ILE  10  -2.249   5.471  -2.970
   84    HB   ILE  10           HB       ILE  10  -0.952   8.168  -3.443
   85   1HG1  ILE  10          HG12      ILE  10  -0.767   5.573  -4.995
   86   2HG1  ILE  10          HG11      ILE  10  -1.925   6.846  -5.378
   87   1HG2  ILE  10          HG21      ILE  10   0.267   5.500  -2.689
   88   2HG2  ILE  10          HG22      ILE  10   0.456   7.040  -1.851
   89   3HG2  ILE  10          HG23      ILE  10   1.192   6.801  -3.434
   90   1HD1  ILE  10          HD11      ILE  10   0.163   6.992  -6.745
   91   2HD1  ILE  10          HD12      ILE  10   1.078   7.246  -5.259
   92   3HD1  ILE  10          HD13      ILE  10  -0.120   8.434  -5.770
   93    H    ALA  11           HN       ALA  11  -2.591   8.665  -1.429
   94    HA   ALA  11           HA       ALA  11  -1.228   7.992   0.998
   95   1HB   ALA  11          HB1       ALA  11  -1.758  10.320   0.341
   96   2HB   ALA  11          HB2       ALA  11  -2.388   9.951   1.947
   97   3HB   ALA  11          HB3       ALA  11  -3.477   9.987   0.560
   98    H    LEU  12           HN       LEU  12  -4.648   7.682   0.055
   99    HA   LEU  12           HA       LEU  12  -5.655   6.937   2.611
  100   1HB   LEU  12          HB2       LEU  12  -6.533   6.149  -0.177
  101   2HB   LEU  12          HB1       LEU  12  -7.453   5.763   1.274
  102    HG   LEU  12           HG       LEU  12  -6.642   8.584   0.501
  103   1HD1  LEU  12          HD11      LEU  12  -8.186   7.480  -1.162
  104   2HD1  LEU  12          HD12      LEU  12  -8.880   8.890  -0.363
  105   3HD1  LEU  12          HD13      LEU  12  -9.351   7.269   0.145
  106   1HD2  LEU  12          HD21      LEU  12  -8.324   7.365   2.687
  107   2HD2  LEU  12          HD22      LEU  12  -8.732   8.969   2.083
  108   3HD2  LEU  12          HD23      LEU  12  -7.146   8.673   2.782
  109    H    ILE  13           HN       ILE  13  -4.175   5.003   0.036
  110    HA   ILE  13           HA       ILE  13  -4.563   2.465   1.364
  111    HB   ILE  13           HB       ILE  13  -2.502   3.299  -0.697
  112   1HG1  ILE  13          HG12      ILE  13  -5.130   1.843  -1.102
  113   2HG1  ILE  13          HG11      ILE  13  -4.948   3.585  -1.320
  114   1HG2  ILE  13          HG21      ILE  13  -1.808   1.250   0.365
  115   2HG2  ILE  13          HG22      ILE  13  -2.519   0.814  -1.189
  116   3HG2  ILE  13          HG23      ILE  13  -3.445   0.596   0.297
  117   1HD1  ILE  13          HD11      ILE  13  -4.690   2.148  -3.429
  118   2HD1  ILE  13          HD12      ILE  13  -3.168   1.596  -2.736
  119   3HD1  ILE  13          HD13      ILE  13  -3.399   3.303  -3.107
  120    H    THR  14           HN       THR  14  -1.920   4.842   1.280
  121    HA   THR  14           HA       THR  14  -0.034   3.280   2.747
  122    HB   THR  14           HB       THR  14  -0.321   6.293   2.623
  123    HG1  THR  14           HG1      THR  14   0.755   6.156   0.791
  124   1HG2  THR  14          HG21      THR  14   2.036   4.523   3.335
  125   2HG2  THR  14          HG22      THR  14   1.154   5.566   4.451
  126   3HG2  THR  14          HG23      THR  14   2.102   6.274   3.146
  127    H    MET  15           HN       MET  15  -2.530   5.585   3.812
  128    HA   MET  15           HA       MET  15  -1.789   5.439   6.603
  129   1HB   MET  15          HB2       MET  15  -4.348   6.304   5.234
  130   2HB   MET  15          HB1       MET  15  -4.105   6.397   6.977
  131   1HG   MET  15          HG2       MET  15  -2.016   7.761   6.511
  132   2HG   MET  15          HG1       MET  15  -2.523   7.822   4.824
  133   1HE   MET  15          HE1       MET  15  -5.695   9.750   4.690
  134   2HE   MET  15          HE2       MET  15  -5.872   8.072   5.197
  135   3HE   MET  15          HE3       MET  15  -4.641   8.502   4.012
  136    H    ALA  16           HN       ALA  16  -4.049   3.671   4.554
  137    HA   ALA  16           HA       ALA  16  -5.460   2.253   6.559
  138   1HB   ALA  16          HB1       ALA  16  -6.302   2.028   4.369
  139   2HB   ALA  16          HB2       ALA  16  -5.583   0.447   4.673
  140   3HB   ALA  16          HB3       ALA  16  -4.716   1.639   3.703
  141    H    ILE  17           HN       ILE  17  -2.432   1.393   4.868
  142    HA   ILE  17           HA       ILE  17  -1.984  -1.095   6.185
  143    HB   ILE  17           HB       ILE  17   0.046   0.940   5.197
  144   1HG1  ILE  17          HG12      ILE  17  -1.085  -1.487   3.783
  145   2HG1  ILE  17          HG11      ILE  17  -1.718   0.144   3.564
  146   1HG2  ILE  17          HG21      ILE  17   0.219  -1.981   5.957
  147   2HG2  ILE  17          HG22      ILE  17   1.222  -0.647   6.529
  148   3HG2  ILE  17          HG23      ILE  17   1.394  -1.236   4.875
  149   1HD1  ILE  17          HD11      ILE  17   0.462   0.924   2.777
  150   2HD1  ILE  17          HD12      ILE  17  -0.054  -0.460   1.812
  151   3HD1  ILE  17          HD13      ILE  17   1.162  -0.668   3.073
  152    H    GLN  18           HN       GLN  18  -0.801   2.165   6.938
  153    HA   GLN  18           HA       GLN  18   0.578   1.497   9.343
  154   1HB   GLN  18          HB2       GLN  18  -0.741   4.073   8.446
  155   2HB   GLN  18          HB1       GLN  18   0.288   3.946   9.873
  156   1HG   GLN  18          HG2       GLN  18   1.188   3.102   7.110
  157   2HG   GLN  18          HG1       GLN  18   1.474   4.714   7.764
  158   1HE2  GLN  18          HE21      GLN  18   2.211   4.266  10.375
  159   2HE2  GLN  18          HE22      GLN  18   3.586   3.274  10.455
  160    H    ASN  19           HN       ASN  19  -2.794   2.474   8.772
  161    HA   ASN  19           HA       ASN  19  -3.442   2.463  11.619
  162   1HB   ASN  19          HB2       ASN  19  -5.167   2.614   9.132
  163   2HB   ASN  19          HB1       ASN  19  -5.795   2.741  10.775
  164   1HD2  ASN  19          HD21      ASN  19  -4.794   4.635   8.218
  165   2HD2  ASN  19          HD22      ASN  19  -4.327   6.027   9.071
  166    H    ALA  20           HN       ALA  20  -3.066   0.033   9.282
  167    HA   ALA  20           HA       ALA  20  -5.161  -1.739  10.248
  168   1HB   ALA  20          HB1       ALA  20  -4.188  -1.856   7.940
  169   2HB   ALA  20          HB2       ALA  20  -4.155  -3.400   8.791
  170   3HB   ALA  20          HB3       ALA  20  -2.683  -2.438   8.653
  171    HA   PRO  21           HA       PRO  21  -3.052  -3.063  14.026
  172   1HB   PRO  21          HB2       PRO  21  -4.141  -5.737  13.169
  173   2HB   PRO  21          HB1       PRO  21  -4.173  -4.973  14.771
  174   1HG   PRO  21          HG2       PRO  21  -6.332  -5.001  13.208
  175   2HG   PRO  21          HG1       PRO  21  -5.950  -3.609  14.234
  176   1HD   PRO  21          HD2       PRO  21  -5.755  -3.857  11.273
  177   2HD   PRO  21          HD1       PRO  21  -5.969  -2.404  12.275
  178    H    GLU  22           HN       GLU  22  -2.869  -4.980  11.058
  179    HA   GLU  22           HA       GLU  22   0.017  -5.580  11.631
  180   1HB   GLU  22          HB2       GLU  22  -2.024  -7.202  10.071
  181   2HB   GLU  22          HB1       GLU  22  -0.310  -7.599  10.211
  182   1HG   GLU  22          HG2       GLU  22  -2.160  -7.285  12.590
  183   2HG   GLU  22          HG1       GLU  22  -1.782  -8.838  11.842
  184    H    LYS  23           HN       LYS  23   1.431  -4.868  10.048
  185    HA   LYS  23           HA       LYS  23   0.545  -3.027   8.072
  186   1HB   LYS  23          HB2       LYS  23   3.133  -4.575   8.310
  187   2HB   LYS  23          HB1       LYS  23   2.858  -3.334   7.087
  188   1HG   LYS  23          HG2       LYS  23   2.267  -1.740   8.960
  189   2HG   LYS  23          HG1       LYS  23   2.803  -2.978  10.097
  190   1HD   LYS  23          HD2       LYS  23   5.023  -3.000   8.895
  191   2HD   LYS  23          HD1       LYS  23   4.461  -1.606   7.968
  192   1HE   LYS  23          HE2       LYS  23   4.188  -0.301  10.007
  193   2HE   LYS  23          HE1       LYS  23   4.603  -1.702  10.996
  194   1HZ   LYS  23          HZ1       LYS  23   6.454  -0.687   8.933
  195   2HZ   LYS  23          HZ2       LYS  23   6.795  -1.656  10.286
  196   3HZ   LYS  23          HZ3       LYS  23   6.426  -0.011  10.488
  197    H    LYS  24           HN       LYS  24   1.089  -6.524   7.878
  198    HA   LYS  24           HA       LYS  24   0.745  -6.555   4.972
  199   1HB   LYS  24          HB2       LYS  24   0.609  -8.806   7.010
  200   2HB   LYS  24          HB1       LYS  24   0.666  -9.019   5.258
  201   1HG   LYS  24          HG2       LYS  24   2.851  -7.876   5.186
  202   2HG   LYS  24          HG1       LYS  24   2.802  -7.662   6.936
  203   1HD   LYS  24          HD2       LYS  24   2.731 -10.116   7.228
  204   2HD   LYS  24          HD1       LYS  24   2.799 -10.319   5.477
  205   1HE   LYS  24          HE2       LYS  24   4.908  -8.788   7.011
  206   2HE   LYS  24          HE1       LYS  24   5.032 -10.520   6.707
  207   1HZ   LYS  24          HZ1       LYS  24   5.189 -10.196   4.437
  208   2HZ   LYS  24          HZ2       LYS  24   6.098  -8.900   5.053
  209   3HZ   LYS  24          HZ3       LYS  24   4.515  -8.640   4.495
  210    H    ILE  25           HN       ILE  25  -1.204  -6.086   4.125
  211    HA   ILE  25           HA       ILE  25  -3.668  -7.172   5.447
  212    HB   ILE  25           HB       ILE  25  -3.487  -4.749   5.869
  213   1HG1  ILE  25          HG12      ILE  25  -5.543  -5.250   3.701
  214   2HG1  ILE  25          HG11      ILE  25  -5.707  -5.877   5.342
  215   1HG2  ILE  25          HG21      ILE  25  -3.328  -3.154   4.092
  216   2HG2  ILE  25          HG22      ILE  25  -3.575  -4.397   2.864
  217   3HG2  ILE  25          HG23      ILE  25  -2.071  -4.354   3.786
  218   1HD1  ILE  25          HD11      ILE  25  -6.908  -3.774   5.208
  219   2HD1  ILE  25          HD12      ILE  25  -5.496  -2.966   4.526
  220   3HD1  ILE  25          HD13      ILE  25  -5.468  -3.529   6.198
  221    H    THR  26           HN       THR  26  -5.460  -7.489   3.921
  222    HA   THR  26           HA       THR  26  -4.454  -8.458   1.318
  223    HB   THR  26           HB       THR  26  -6.540  -9.638   1.159
  224    HG1  THR  26           HG1      THR  26  -8.094  -9.182   2.941
  225   1HG2  THR  26          HG21      THR  26  -6.550 -10.906   3.237
  226   2HG2  THR  26          HG22      THR  26  -5.746  -9.585   4.084
  227   3HG2  THR  26          HG23      THR  26  -4.886 -10.485   2.835
  228    H    LEU  27           HN       LEU  27  -5.807  -8.064  -0.621
  229    HA   LEU  27           HA       LEU  27  -6.054  -5.299  -1.261
  230   1HB   LEU  27          HB2       LEU  27  -5.794  -7.287  -2.833
  231   2HB   LEU  27          HB1       LEU  27  -7.494  -7.635  -2.552
  232    HG   LEU  27           HG       LEU  27  -7.904  -5.177  -3.303
  233   1HD1  LEU  27          HD11      LEU  27  -5.102  -5.135  -3.388
  234   2HD1  LEU  27          HD12      LEU  27  -6.189  -3.947  -4.089
  235   3HD1  LEU  27          HD13      LEU  27  -5.578  -5.267  -5.080
  236   1HD2  LEU  27          HD21      LEU  27  -7.069  -7.472  -5.088
  237   2HD2  LEU  27          HD22      LEU  27  -7.704  -5.975  -5.760
  238   3HD2  LEU  27          HD23      LEU  27  -8.698  -6.941  -4.675
  239    H    ASN  28           HN       ASN  28  -8.521  -7.758  -0.590
  240    HA   ASN  28           HA       ASN  28 -10.811  -6.069  -0.715
  241   1HB   ASN  28          HB2       ASN  28 -10.275  -8.643   0.791
  242   2HB   ASN  28          HB1       ASN  28 -11.864  -7.884   0.702
  243   1HD2  ASN  28          HD21      ASN  28 -10.905 -10.504  -0.490
  244   2HD2  ASN  28          HD22      ASN  28 -11.245 -10.381  -2.147
  245    H    GLY  29           HN       GLY  29  -8.693  -6.955   2.005
  246   1HA   GLY  29          HA2       GLY  29 -10.227  -5.781   4.083
  247   2HA   GLY  29          HA1       GLY  29  -8.481  -6.011   4.139
  248    H    ILE  30           HN       ILE  30  -7.784  -4.324   1.937
  249    HA   ILE  30           HA       ILE  30  -7.641  -1.809   3.256
  250    HB   ILE  30           HB       ILE  30  -7.242  -2.568   0.352
  251   1HG1  ILE  30          HG12      ILE  30  -5.232  -1.765   2.473
  252   2HG1  ILE  30          HG11      ILE  30  -5.713  -3.440   2.210
  253   1HG2  ILE  30          HG21      ILE  30  -6.910   0.081   1.774
  254   2HG2  ILE  30          HG22      ILE  30  -7.734  -0.246   0.248
  255   3HG2  ILE  30          HG23      ILE  30  -5.974  -0.315   0.332
  256   1HD1  ILE  30          HD11      ILE  30  -4.739  -3.525   0.084
  257   2HD1  ILE  30          HD12      ILE  30  -3.599  -2.519   0.978
  258   3HD1  ILE  30          HD13      ILE  30  -4.767  -1.771  -0.111
  259    H    TYR  31           HN       TYR  31  -9.881  -2.958   0.716
  260    HA   TYR  31           HA       TYR  31 -11.225  -0.470   0.330
  261   1HB   TYR  31          HB2       TYR  31 -12.066  -3.349   0.008
  262   2HB   TYR  31          HB1       TYR  31 -13.229  -2.052  -0.240
  263    HD1  TYR  31           HD1      TYR  31 -10.718  -4.018  -1.812
  264    HD2  TYR  31           HD2      TYR  31 -12.440  -0.094  -1.766
  265    HE1  TYR  31           HE1      TYR  31  -9.879  -3.620  -4.109
  266    HE2  TYR  31           HE2      TYR  31 -11.601   0.310  -4.056
  267    HH   TYR  31           HH       TYR  31 -10.649  -0.595  -5.837
  268    H    GLN  32           HN       GLN  32 -11.783  -3.067   2.697
  269    HA   GLN  32           HA       GLN  32 -14.177  -2.033   3.823
  270   1HB   GLN  32          HB2       GLN  32 -13.317  -4.290   4.306
  271   2HB   GLN  32          HB1       GLN  32 -11.953  -3.592   5.175
  272   1HG   GLN  32          HG2       GLN  32 -13.508  -2.559   6.795
  273   2HG   GLN  32          HG1       GLN  32 -14.875  -3.252   5.921
  274   1HE2  GLN  32          HE21      GLN  32 -13.011  -5.716   5.406
  275   2HE2  GLN  32          HE22      GLN  32 -13.127  -6.593   6.856
  276    H    PHE  33           HN       PHE  33 -10.782  -1.371   4.638
  277    HA   PHE  33           HA       PHE  33 -11.258   0.249   6.917
  278   1HB   PHE  33          HB2       PHE  33  -9.032  -0.600   6.269
  279   2HB   PHE  33          HB1       PHE  33  -9.028   0.481   4.877
  280    HD1  PHE  33           HD1      PHE  33  -8.800   0.257   8.539
  281    HD2  PHE  33           HD2      PHE  33  -8.778   2.905   5.158
  282    HE1  PHE  33           HE1      PHE  33  -7.909   2.075   9.971
  283    HE2  PHE  33           HE2      PHE  33  -7.889   4.725   6.590
  284    HZ   PHE  33           HZ       PHE  33  -7.457   4.310   8.996
  285    H    ILE  34           HN       ILE  34 -10.866   1.249   3.498
  286    HA   ILE  34           HA       ILE  34 -11.164   4.030   3.948
  287    HB   ILE  34           HB       ILE  34 -11.877   2.357   1.528
  288   1HG1  ILE  34          HG12      ILE  34  -9.459   4.104   2.047
  289   2HG1  ILE  34          HG11      ILE  34  -9.485   2.381   2.425
  290   1HG2  ILE  34          HG21      ILE  34 -11.619   5.357   1.898
  291   2HG2  ILE  34          HG22      ILE  34 -13.030   4.472   1.315
  292   3HG2  ILE  34          HG23      ILE  34 -11.578   4.567   0.321
  293   1HD1  ILE  34          HD11      ILE  34  -8.524   2.954   0.152
  294   2HD1  ILE  34          HD12      ILE  34 -10.140   3.486  -0.316
  295   3HD1  ILE  34          HD13      ILE  34  -9.859   1.800   0.122
  296    H    MET  35           HN       MET  35 -13.724   1.670   3.012
  297    HA   MET  35           HA       MET  35 -15.833   3.583   2.993
  298   1HB   MET  35          HB2       MET  35 -15.863   0.610   3.544
  299   2HB   MET  35          HB1       MET  35 -17.329   1.584   3.405
  300   1HG   MET  35          HG2       MET  35 -16.587   2.326   1.148
  301   2HG   MET  35          HG1       MET  35 -15.183   1.272   1.291
  302   1HE   MET  35          HE1       MET  35 -15.044  -1.031   0.967
  303   2HE   MET  35          HE2       MET  35 -16.342  -2.220   0.900
  304   3HE   MET  35          HE3       MET  35 -15.953  -1.437   2.428
  305    H    ASP  36           HN       ASP  36 -14.789   1.409   5.646
  306    HA   ASP  36           HA       ASP  36 -16.674   2.506   7.531
  307   1HB   ASP  36          HB2       ASP  36 -14.099   0.951   7.889
  308   2HB   ASP  36          HB1       ASP  36 -15.153   1.399   9.231
  309    H    ARG  37           HN       ARG  37 -13.274   3.203   6.784
  310    HA   ARG  37           HA       ARG  37 -12.871   5.093   8.903
  311   1HB   ARG  37          HB2       ARG  37 -11.013   4.051   7.658
  312   2HB   ARG  37          HB1       ARG  37 -11.520   4.889   6.194
  313   1HG   ARG  37          HG2       ARG  37  -9.665   6.095   7.230
  314   2HG   ARG  37          HG1       ARG  37 -11.125   7.070   7.339
  315   1HD   ARG  37          HD2       ARG  37 -11.359   6.692   9.640
  316   2HD   ARG  37          HD1       ARG  37 -10.391   5.217   9.599
  317    HE   ARG  37           HE       ARG  37  -8.616   7.219   8.855
  318   1HH1  ARG  37          HH21      ARG  37 -10.782   6.614  11.470
  319   2HH1  ARG  37          HH22      ARG  37  -9.830   7.478  12.631
  320   1HH2  ARG  37          HH11      ARG  37  -7.359   8.343  10.357
  321   2HH2  ARG  37          HH12      ARG  37  -7.897   8.462  11.999
  322    H    PHE  38           HN       PHE  38 -13.687   5.554   5.450
  323    HA   PHE  38           HA       PHE  38 -14.661   8.307   6.123
  324   1HB   PHE  38          HB2       PHE  38 -13.453   7.247   3.554
  325   2HB   PHE  38          HB1       PHE  38 -14.192   8.839   3.723
  326    HD1  PHE  38           HD1      PHE  38 -13.239  10.482   5.384
  327    HD2  PHE  38           HD2      PHE  38 -11.241   6.824   4.348
  328    HE1  PHE  38           HE1      PHE  38 -11.120  11.378   6.309
  329    HE2  PHE  38           HE2      PHE  38  -9.121   7.721   5.270
  330    HZ   PHE  38           HZ       PHE  38  -9.060   9.998   6.251
  331    HA   PRO  39           HA       PRO  39 -18.465   6.278   4.668
  332   1HB   PRO  39          HB2       PRO  39 -20.254   8.161   5.418
  333   2HB   PRO  39          HB1       PRO  39 -19.438   7.124   6.607
  334   1HG   PRO  39          HG2       PRO  39 -18.835   9.945   5.834
  335   2HG   PRO  39          HG1       PRO  39 -18.861   9.202   7.443
  336   1HD   PRO  39          HD2       PRO  39 -16.547   9.638   5.993
  337   2HD   PRO  39          HD1       PRO  39 -16.710   8.381   7.239
  338    H    PHE  40           HN       PHE  40 -17.007   9.099   3.496
  339    HA   PHE  40           HA       PHE  40 -18.949  10.140   1.700
  340   1HB   PHE  40          HB2       PHE  40 -17.041  11.476   1.980
  341   2HB   PHE  40          HB1       PHE  40 -15.940  10.116   1.777
  342    HD1  PHE  40           HD1      PHE  40 -14.942   9.711  -0.310
  343    HD2  PHE  40           HD2      PHE  40 -18.484  12.142  -0.094
  344    HE1  PHE  40           HE1      PHE  40 -14.750  10.216  -2.733
  345    HE2  PHE  40           HE2      PHE  40 -18.283  12.651  -2.513
  346    HZ   PHE  40           HZ       PHE  40 -16.418  11.685  -3.832
  347    H    TYR  41           HN       TYR  41 -16.596   7.514   1.289
  348    HA   TYR  41           HA       TYR  41 -17.113   7.075  -1.489
  349   1HB   TYR  41          HB2       TYR  41 -16.011   5.264   0.671
  350   2HB   TYR  41          HB1       TYR  41 -16.013   4.860  -1.051
  351    HD1  TYR  41           HD1      TYR  41 -14.635   6.085  -2.638
  352    HD2  TYR  41           HD2      TYR  41 -14.646   7.109   1.526
  353    HE1  TYR  41           HE1      TYR  41 -12.635   7.496  -2.990
  354    HE2  TYR  41           HE2      TYR  41 -12.649   8.529   1.185
  355    HH   TYR  41           HH       TYR  41 -10.932   8.576  -1.899
  356    H    ARG  42           HN       ARG  42 -18.779   5.993   1.399
  357    HA   ARG  42           HA       ARG  42 -20.167   3.777   0.309
  358   1HB   ARG  42          HB2       ARG  42 -20.998   5.799   2.405
  359   2HB   ARG  42          HB1       ARG  42 -21.940   4.358   2.024
  360   1HG   ARG  42          HG2       ARG  42 -19.994   2.941   2.552
  361   2HG   ARG  42          HG1       ARG  42 -19.051   4.376   2.946
  362   1HD   ARG  42          HD2       ARG  42 -20.632   4.945   4.737
  363   2HD   ARG  42          HD1       ARG  42 -21.618   3.545   4.338
  364    HE   ARG  42           HE       ARG  42 -19.261   3.600   6.003
  365   1HH1  ARG  42          HH21      ARG  42 -20.803   1.686   3.575
  366   2HH1  ARG  42          HH22      ARG  42 -19.907   0.256   3.964
  367   1HH2  ARG  42          HH11      ARG  42 -18.097   1.753   6.507
  368   2HH2  ARG  42          HH12      ARG  42 -18.375   0.296   5.613
  369    H    GLU  43           HN       GLU  43 -20.593   7.212  -0.205
  370    HA   GLU  43           HA       GLU  43 -23.233   6.845  -1.474
  371   1HB   GLU  43          HB2       GLU  43 -21.454   9.276  -1.134
  372   2HB   GLU  43          HB1       GLU  43 -23.041   9.310  -1.902
  373   1HG   GLU  43          HG2       GLU  43 -24.071   8.467   0.173
  374   2HG   GLU  43          HG1       GLU  43 -22.485   8.424   0.945
  375    H    ASN  44           HN       ASN  44 -20.180   6.219  -2.423
  376    HA   ASN  44           HA       ASN  44 -20.884   6.503  -5.294
  377   1HB   ASN  44          HB2       ASN  44 -19.592   8.561  -4.581
  378   2HB   ASN  44          HB1       ASN  44 -18.236   7.497  -4.208
  379   1HD2  ASN  44          HD21      ASN  44 -17.104   8.768  -5.988
  380   2HD2  ASN  44          HD22      ASN  44 -17.357   8.295  -7.599
  381    H    LYS  45           HN       LYS  45 -20.833   4.288  -5.673
  382    HA   LYS  45           HA       LYS  45 -18.627   2.665  -4.572
  383   1HB   LYS  45          HB2       LYS  45 -21.005   1.949  -6.311
  384   2HB   LYS  45          HB1       LYS  45 -19.841   0.785  -5.681
  385   1HG   LYS  45          HG2       LYS  45 -20.415   1.451  -3.375
  386   2HG   LYS  45          HG1       LYS  45 -21.584   2.613  -4.005
  387   1HD   LYS  45          HD2       LYS  45 -22.832   0.779  -5.087
  388   2HD   LYS  45          HD1       LYS  45 -21.668  -0.386  -4.456
  389   1HE   LYS  45          HE2       LYS  45 -22.263   0.222  -2.159
  390   2HE   LYS  45          HE1       LYS  45 -23.380   1.450  -2.754
  391   1HZ   LYS  45          HZ1       LYS  45 -23.643  -1.459  -2.739
  392   2HZ   LYS  45          HZ2       LYS  45 -24.304  -0.627  -4.065
  393   3HZ   LYS  45          HZ3       LYS  45 -24.818  -0.261  -2.488
  394    H    GLN  46           HN       GLN  46 -20.000   2.938  -7.877
  395    HA   GLN  46           HA       GLN  46 -17.591   1.908  -9.076
  396   1HB   GLN  46          HB2       GLN  46 -19.930   3.415 -10.274
  397   2HB   GLN  46          HB1       GLN  46 -18.640   2.672 -11.221
  398   1HG   GLN  46          HG2       GLN  46 -19.179   0.473 -10.239
  399   2HG   GLN  46          HG1       GLN  46 -20.472   1.213  -9.294
  400   1HE2  GLN  46          HE21      GLN  46 -20.352  -0.764 -11.758
  401   2HE2  GLN  46          HE22      GLN  46 -21.528  -0.121 -12.800
  402    H    GLY  47           HN       GLY  47 -15.920   2.995 -10.110
  403   1HA   GLY  47          HA2       GLY  47 -15.008   5.077 -11.096
  404   2HA   GLY  47          HA1       GLY  47 -15.857   5.984  -9.847
  405    H    TRP  48           HN       TRP  48 -15.220   4.922  -7.511
  406    HA   TRP  48           HA       TRP  48 -12.298   5.327  -7.367
  407   1HB   TRP  48          HB2       TRP  48 -12.609   5.721  -5.057
  408   2HB   TRP  48          HB1       TRP  48 -14.017   6.442  -5.826
  409    HD1  TRP  48           HD1      TRP  48 -16.354   5.071  -5.636
  410    HE1  TRP  48           HE1      TRP  48 -17.179   3.435  -3.830
  411    HE3  TRP  48           HE3      TRP  48 -11.909   3.892  -3.416
  412    HZ2  TRP  48           HZ2      TRP  48 -16.104   1.840  -1.714
  413    HZ3  TRP  48           HZ3      TRP  48 -11.842   2.318  -1.506
  414    HH2  TRP  48           HH2      TRP  48 -13.929   1.290  -0.655
  415    H    GLN  49           HN       GLN  49 -14.438   2.680  -7.522
  416    HA   GLN  49           HA       GLN  49 -13.047   0.875  -5.768
  417   1HB   GLN  49          HB2       GLN  49 -15.355   0.472  -6.582
  418   2HB   GLN  49          HB1       GLN  49 -14.725   0.237  -8.211
  419   1HG   GLN  49          HG2       GLN  49 -13.371  -1.670  -7.423
  420   2HG   GLN  49          HG1       GLN  49 -13.989  -1.435  -5.788
  421   1HE2  GLN  49          HE21      GLN  49 -15.469  -3.100  -5.421
  422   2HE2  GLN  49          HE22      GLN  49 -16.689  -3.566  -6.505
  423    H    ASN  50           HN       ASN  50 -12.966   1.106  -9.351
  424    HA   ASN  50           HA       ASN  50 -10.762  -0.740  -9.565
  425   1HB   ASN  50          HB2       ASN  50 -11.840   1.313 -11.518
  426   2HB   ASN  50          HB1       ASN  50 -10.625   0.099 -11.920
  427   1HD2  ASN  50          HD21      ASN  50 -13.058   0.008 -13.314
  428   2HD2  ASN  50          HD22      ASN  50 -13.966  -1.330 -12.796
  429    H    SER  51           HN       SER  51 -10.945   2.767  -9.228
  430    HA   SER  51           HA       SER  51  -8.311   3.413 -10.068
  431   1HB   SER  51          HB2       SER  51  -8.589   5.461  -8.800
  432   2HB   SER  51          HB1       SER  51 -10.133   5.054  -9.545
  433    HG   SER  51           HG       SER  51 -10.719   4.087  -7.540
  434    H    ILE  52           HN       ILE  52  -9.483   2.350  -6.865
  435    HA   ILE  52           HA       ILE  52  -7.048   2.759  -5.459
  436    HB   ILE  52           HB       ILE  52  -9.207   0.672  -5.073
  437   1HG1  ILE  52          HG12      ILE  52  -9.721   3.223  -4.960
  438   2HG1  ILE  52          HG11      ILE  52 -10.287   2.193  -3.654
  439   1HG2  ILE  52          HG21      ILE  52  -7.276  -0.108  -3.898
  440   2HG2  ILE  52          HG22      ILE  52  -8.332   0.636  -2.698
  441   3HG2  ILE  52          HG23      ILE  52  -6.918   1.507  -3.287
  442   1HD1  ILE  52          HD11      ILE  52  -8.466   2.894  -2.224
  443   2HD1  ILE  52          HD12      ILE  52  -9.223   4.336  -2.892
  444   3HD1  ILE  52          HD13      ILE  52  -7.693   3.765  -3.548
  445    H    ARG  53           HN       ARG  53  -8.219  -0.227  -7.062
  446    HA   ARG  53           HA       ARG  53  -5.762  -1.675  -6.571
  447   1HB   ARG  53          HB2       ARG  53  -8.060  -2.098  -8.499
  448   2HB   ARG  53          HB1       ARG  53  -6.692  -3.206  -8.388
  449   1HG   ARG  53          HG2       ARG  53  -7.193  -3.797  -6.171
  450   2HG   ARG  53          HG1       ARG  53  -8.245  -2.412  -5.932
  451   1HD   ARG  53          HD2       ARG  53  -9.565  -4.482  -6.224
  452   2HD   ARG  53          HD1       ARG  53  -9.861  -3.350  -7.545
  453    HE   ARG  53           HE       ARG  53  -7.814  -4.966  -8.490
  454   1HH1  ARG  53          HH21      ARG  53 -10.949  -5.413  -7.124
  455   2HH1  ARG  53          HH22      ARG  53 -11.265  -6.878  -7.991
  456   1HH2  ARG  53          HH11      ARG  53  -8.212  -6.882  -9.633
  457   2HH2  ARG  53          HH12      ARG  53  -9.718  -7.710  -9.408
  458    H    HIS  54           HN       HIS  54  -6.984   0.253  -9.282
  459    HA   HIS  54           HA       HIS  54  -4.997  -0.427 -11.184
  460   1HB   HIS  54          HB2       HIS  54  -7.025   0.847 -11.752
  461   2HB   HIS  54          HB1       HIS  54  -6.430   2.219 -10.815
  462    HD1  HIS  54           HD1      HIS  54  -5.017   3.858 -12.053
  463    HD2  HIS  54           HD2      HIS  54  -5.132   0.166 -13.984
  464    HE1  HIS  54           HE1      HIS  54  -3.750   4.148 -14.226
  465    H    ASN  55           HN       ASN  55  -4.952   2.077  -8.640
  466    HA   ASN  55           HA       ASN  55  -2.436   3.196  -9.500
  467   1HB   ASN  55          HB2       ASN  55  -2.435   4.377  -7.377
  468   2HB   ASN  55          HB1       ASN  55  -4.066   4.396  -8.040
  469   1HD2  ASN  55          HD21      ASN  55  -5.202   4.498  -6.037
  470   2HD2  ASN  55          HD22      ASN  55  -5.157   3.254  -4.883
  471    H    LEU  56           HN       LEU  56  -3.220   0.319  -7.747
  472    HA   LEU  56           HA       LEU  56  -0.830   0.126  -6.186
  473   1HB   LEU  56          HB2       LEU  56  -2.675  -2.011  -7.256
  474   2HB   LEU  56          HB1       LEU  56  -1.334  -2.348  -6.167
  475    HG   LEU  56           HG       LEU  56  -3.622  -0.448  -5.563
  476   1HD1  LEU  56          HD11      LEU  56  -4.084  -3.008  -5.685
  477   2HD1  LEU  56          HD12      LEU  56  -4.587  -2.141  -4.235
  478   3HD1  LEU  56          HD13      LEU  56  -3.109  -3.102  -4.220
  479   1HD2  LEU  56          HD21      LEU  56  -1.902   0.331  -4.197
  480   2HD2  LEU  56          HD22      LEU  56  -1.112  -1.242  -4.105
  481   3HD2  LEU  56          HD23      LEU  56  -2.565  -0.925  -3.159
  482    H    SER  57           HN       SER  57  -1.553  -0.985  -9.492
  483    HA   SER  57           HA       SER  57   0.956  -2.372  -9.800
  484   1HB   SER  57          HB2       SER  57  -1.018  -2.807 -11.236
  485   2HB   SER  57          HB1       SER  57  -0.850  -1.198 -11.932
  486    HG   SER  57           HG       SER  57   0.752  -1.892 -13.107
  487    H    LEU  58           HN       LEU  58  -0.118   0.863 -10.893
  488    HA   LEU  58           HA       LEU  58   2.356   1.582 -12.109
  489   1HB   LEU  58          HB2       LEU  58   0.151   3.261 -10.908
  490   2HB   LEU  58          HB1       LEU  58   1.526   3.953 -11.765
  491    HG   LEU  58           HG       LEU  58  -0.305   1.854 -12.957
  492   1HD1  LEU  58          HD11      LEU  58  -0.425   4.874 -13.019
  493   2HD1  LEU  58          HD12      LEU  58  -1.712   3.735 -12.626
  494   3HD1  LEU  58          HD13      LEU  58  -1.156   3.895 -14.290
  495   1HD2  LEU  58          HD21      LEU  58   2.003   3.505 -13.968
  496   2HD2  LEU  58          HD22      LEU  58   0.715   3.071 -15.089
  497   3HD2  LEU  58          HD23      LEU  58   1.623   1.810 -14.268
  498    H    ASN  59           HN       ASN  59   1.188   2.027  -8.777
  499    HA   ASN  59           HA       ASN  59   3.536   3.552  -7.997
  500   1HB   ASN  59          HB2       ASN  59   1.382   2.156  -6.385
  501   2HB   ASN  59          HB1       ASN  59   2.657   3.145  -5.670
  502   1HD2  ASN  59          HD21      ASN  59  -0.509   3.352  -6.622
  503   2HD2  ASN  59          HD22      ASN  59  -0.582   5.001  -7.021
  504    H    GLU  60           HN       GLU  60   5.497   2.616  -7.919
  505    HA   GLU  60           HA       GLU  60   5.776  -0.270  -7.349
  506   1HB   GLU  60          HB2       GLU  60   7.832   1.849  -8.037
  507   2HB   GLU  60          HB1       GLU  60   8.151   0.118  -7.911
  508   1HG   GLU  60          HG2       GLU  60   6.081   1.289  -9.782
  509   2HG   GLU  60          HG1       GLU  60   7.741   0.944 -10.273
  510    H    CYS  61           HN       CYS  61   5.624   2.568  -5.581
  511    HA   CYS  61           HA       CYS  61   7.711   2.240  -3.664
  512   1HB   CYS  61          HB2       CYS  61   6.337   3.692  -2.216
  513   2HB   CYS  61          HB1       CYS  61   6.405   4.316  -3.863
  514    HG   CYS  61           HG       CYS  61   3.905   3.105  -2.503
  515    H    PHE  62           HN       PHE  62   4.471   0.829  -3.867
  516    HA   PHE  62           HA       PHE  62   4.646  -0.355  -1.204
  517   1HB   PHE  62          HB2       PHE  62   2.764  -0.947  -3.507
  518   2HB   PHE  62          HB1       PHE  62   2.582  -1.537  -1.856
  519    HD1  PHE  62           HD1      PHE  62   2.785   0.393   0.006
  520    HD2  PHE  62           HD2      PHE  62   1.577   0.993  -4.075
  521    HE1  PHE  62           HE1      PHE  62   1.642   2.494   0.652
  522    HE2  PHE  62           HE2      PHE  62   0.431   3.095  -3.424
  523    HZ   PHE  62           HZ       PHE  62   0.464   3.844  -1.059
  524    H    VAL  63           HN       VAL  63   4.881  -2.616  -0.770
  525    HA   VAL  63           HA       VAL  63   6.398  -4.115  -2.884
  526    HB   VAL  63           HB       VAL  63   6.527  -4.409   0.131
  527   1HG1  VAL  63          HG11      VAL  63   8.130  -5.581  -2.156
  528   2HG1  VAL  63          HG12      VAL  63   7.152  -6.457  -0.980
  529   3HG1  VAL  63          HG13      VAL  63   8.641  -5.659  -0.470
  530   1HG2  VAL  63          HG21      VAL  63   8.194  -2.840  -1.846
  531   2HG2  VAL  63          HG22      VAL  63   8.860  -3.376  -0.307
  532   3HG2  VAL  63          HG23      VAL  63   7.480  -2.284  -0.332
  533    H    LYS  64           HN       LYS  64   5.506  -6.000  -3.572
  534    HA   LYS  64           HA       LYS  64   2.949  -6.878  -2.441
  535   1HB   LYS  64          HB2       LYS  64   4.661  -8.018  -4.672
  536   2HB   LYS  64          HB1       LYS  64   3.036  -8.568  -4.264
  537   1HG   LYS  64          HG2       LYS  64   2.143  -6.325  -4.723
  538   2HG   LYS  64          HG1       LYS  64   3.766  -5.753  -5.115
  539   1HD   LYS  64          HD2       LYS  64   3.913  -7.190  -7.023
  540   2HD   LYS  64          HD1       LYS  64   2.467  -8.080  -6.548
  541   1HE   LYS  64          HE2       LYS  64   1.041  -6.269  -7.078
  542   2HE   LYS  64          HE1       LYS  64   2.375  -5.116  -7.123
  543   1HZ   LYS  64          HZ1       LYS  64   1.551  -5.816  -9.340
  544   2HZ   LYS  64          HZ2       LYS  64   2.090  -7.391  -9.005
  545   3HZ   LYS  64          HZ3       LYS  64   3.204  -6.113  -9.101
  546    H    VAL  65           HN       VAL  65   2.565  -8.929  -1.487
  547    HA   VAL  65           HA       VAL  65   4.948 -10.556  -0.733
  548    HB   VAL  65           HB       VAL  65   2.818  -9.519   1.162
  549   1HG1  VAL  65          HG11      VAL  65   5.100 -11.463   1.631
  550   2HG1  VAL  65          HG12      VAL  65   3.378 -11.832   1.736
  551   3HG1  VAL  65          HG13      VAL  65   4.119 -10.742   2.904
  552   1HG2  VAL  65          HG21      VAL  65   4.840  -8.557   2.317
  553   2HG2  VAL  65          HG22      VAL  65   4.521  -7.857   0.730
  554   3HG2  VAL  65          HG23      VAL  65   5.803  -9.052   0.925
  555    HA   PRO  66           HA       PRO  66   1.821 -13.550  -2.057
  556   1HB   PRO  66          HB2       PRO  66   3.221 -15.860  -1.649
  557   2HB   PRO  66          HB1       PRO  66   3.545 -14.774  -3.015
  558   1HG   PRO  66          HG2       PRO  66   5.005 -15.038  -0.425
  559   2HG   PRO  66          HG1       PRO  66   5.649 -14.826  -2.062
  560   1HD   PRO  66          HD2       PRO  66   5.425 -12.765  -0.268
  561   2HD   PRO  66          HD1       PRO  66   5.345 -12.524  -2.027
  562    H    ARG  67           HN       ARG  67   1.015 -15.803  -1.023
  563    HA   ARG  67           HA       ARG  67   0.611 -15.292   1.907
  564   1HB   ARG  67          HB2       ARG  67  -1.134 -16.825  -0.042
  565   2HB   ARG  67          HB1       ARG  67  -1.480 -16.553   1.667
  566   1HG   ARG  67          HG2       ARG  67  -1.337 -14.063   1.178
  567   2HG   ARG  67          HG1       ARG  67  -1.312 -14.488  -0.531
  568   1HD   ARG  67          HD2       ARG  67  -3.612 -14.031   0.090
  569   2HD   ARG  67          HD1       ARG  67  -3.448 -15.767  -0.180
  570    HE   ARG  67           HE       ARG  67  -2.981 -15.456   2.539
  571   1HH1  ARG  67          HH21      ARG  67  -5.445 -14.579   0.290
  572   2HH1  ARG  67          HH22      ARG  67  -6.721 -14.647   1.460
  573   1HH2  ARG  67          HH11      ARG  67  -4.635 -15.546   4.078
  574   2HH2  ARG  67          HH12      ARG  67  -6.263 -15.192   3.603
  575    H    ASP  68           HN       ASP  68   0.417 -17.239   3.246
  576    HA   ASP  68           HA       ASP  68   2.567 -19.075   2.845
  577   1HB   ASP  68          HB2       ASP  68   0.121 -19.201   4.635
  578   2HB   ASP  68          HB1       ASP  68   1.434 -20.377   4.700
  579    H    ASP  69           HN       ASP  69   2.386 -21.412   2.450
  580    HA   ASP  69           HA       ASP  69   0.867 -22.040   0.130
  581   1HB   ASP  69          HB2       ASP  69   2.211 -23.814   2.185
  582   2HB   ASP  69          HB1       ASP  69   1.489 -24.431   0.699
  583    H    LYS  70           HN       LYS  70  -0.003 -22.107   3.490
  584    HA   LYS  70           HA       LYS  70  -2.061 -24.074   3.439
  585   1HB   LYS  70          HB2       LYS  70  -1.788 -21.515   5.038
  586   2HB   LYS  70          HB1       LYS  70  -3.044 -22.718   5.335
  587   1HG   LYS  70          HG2       LYS  70  -1.316 -24.437   5.716
  588   2HG   LYS  70          HG1       LYS  70  -0.057 -23.234   5.426
  589   1HD   LYS  70          HD2       LYS  70  -0.885 -21.904   7.331
  590   2HD   LYS  70          HD1       LYS  70  -2.140 -23.108   7.626
  591   1HE   LYS  70          HE2       LYS  70  -0.225 -23.482   9.126
  592   2HE   LYS  70          HE1       LYS  70  -0.395 -24.825   7.995
  593   1HZ   LYS  70          HZ1       LYS  70   1.478 -24.257   6.890
  594   2HZ   LYS  70          HZ2       LYS  70   1.897 -23.588   8.394
  595   3HZ   LYS  70          HZ3       LYS  70   1.284 -22.594   7.159
  596    H    LYS  71           HN       LYS  71  -2.124 -20.609   2.634
  597    HA   LYS  71           HA       LYS  71  -4.972 -20.727   1.930
  598   1HB   LYS  71          HB2       LYS  71  -2.864 -18.562   1.778
  599   2HB   LYS  71          HB1       LYS  71  -4.483 -18.340   1.120
  600   1HG   LYS  71          HG2       LYS  71  -4.256 -17.478   3.453
  601   2HG   LYS  71          HG1       LYS  71  -5.482 -18.734   3.304
  602   1HD   LYS  71          HD2       LYS  71  -4.108 -20.367   4.323
  603   2HD   LYS  71          HD1       LYS  71  -2.642 -19.418   4.073
  604   1HE   LYS  71          HE2       LYS  71  -3.564 -17.704   5.664
  605   2HE   LYS  71          HE1       LYS  71  -4.901 -18.806   5.999
  606   1HZ   LYS  71          HZ1       LYS  71  -2.024 -19.445   6.364
  607   2HZ   LYS  71          HZ2       LYS  71  -3.333 -20.459   6.747
  608   3HZ   LYS  71          HZ3       LYS  71  -3.090 -19.016   7.611
  609    HA   PRO  72           HA       PRO  72  -4.125 -21.889  -2.277
  610   1HB   PRO  72          HB2       PRO  72  -6.354 -20.988  -3.561
  611   2HB   PRO  72          HB1       PRO  72  -6.390 -22.370  -2.449
  612   1HG   PRO  72          HG2       PRO  72  -7.160 -19.526  -1.950
  613   2HG   PRO  72          HG1       PRO  72  -7.980 -21.017  -1.450
  614   1HD   PRO  72          HD2       PRO  72  -6.374 -19.572   0.240
  615   2HD   PRO  72          HD1       PRO  72  -6.581 -21.334   0.376
  616    H    GLY  73           HN       GLY  73  -3.960 -18.794  -1.244
  617   1HA   GLY  73          HA2       GLY  73  -2.688 -17.016  -2.183
  618   2HA   GLY  73          HA1       GLY  73  -2.628 -17.901  -3.707
  619    H    LYS  74           HN       LYS  74  -5.288 -16.615  -1.675
  620    HA   LYS  74           HA       LYS  74  -6.985 -16.002  -3.873
  621   1HB   LYS  74          HB2       LYS  74  -6.837 -14.816  -1.089
  622   2HB   LYS  74          HB1       LYS  74  -8.136 -14.466  -2.230
  623   1HG   LYS  74          HG2       LYS  74  -8.776 -16.801  -2.315
  624   2HG   LYS  74          HG1       LYS  74  -7.376 -17.263  -1.355
  625   1HD   LYS  74          HD2       LYS  74  -9.219 -17.226   0.166
  626   2HD   LYS  74          HD1       LYS  74  -8.287 -15.768   0.492
  627   1HE   LYS  74          HE2       LYS  74  -9.868 -14.373  -0.556
  628   2HE   LYS  74          HE1       LYS  74 -10.603 -15.708  -1.442
  629   1HZ   LYS  74          HZ1       LYS  74 -10.742 -15.232   1.483
  630   2HZ   LYS  74          HZ2       LYS  74 -11.332 -16.624   0.710
  631   3HZ   LYS  74          HZ3       LYS  74 -12.017 -15.106   0.371
  632    H    GLY  75           HN       GLY  75  -4.587 -14.138  -2.175
  633   1HA   GLY  75          HA2       GLY  75  -4.042 -12.462  -4.474
  634   2HA   GLY  75          HA1       GLY  75  -4.904 -11.574  -3.214
  635    H    SER  76           HN       SER  76  -2.458 -10.596  -3.652
  636    HA   SER  76           HA       SER  76  -0.564 -11.910  -1.752
  637   1HB   SER  76          HB2       SER  76   1.062 -10.243  -2.702
  638   2HB   SER  76          HB1       SER  76   0.391 -11.338  -3.907
  639    HG   SER  76           HG       SER  76  -0.123  -9.539  -4.874
  640    H    TYR  77           HN       TYR  77  -0.062 -10.940   0.213
  641    HA   TYR  77           HA       TYR  77  -1.731  -8.748   1.141
  642   1HB   TYR  77          HB2       TYR  77   0.851  -9.693   2.416
  643   2HB   TYR  77          HB1       TYR  77  -0.475  -8.845   3.195
  644    HD1  TYR  77           HD1      TYR  77  -2.711 -10.619   1.761
  645    HD2  TYR  77           HD2      TYR  77   0.872 -11.501   3.973
  646    HE1  TYR  77           HE1      TYR  77  -3.669 -12.784   2.455
  647    HE2  TYR  77           HE2      TYR  77  -0.095 -13.674   4.660
  648    HH   TYR  77           HH       TYR  77  -1.760 -15.191   4.143
  649    H    TRP  78           HN       TRP  78  -0.887  -6.646   1.836
  650    HA   TRP  78           HA       TRP  78   1.426  -5.733   0.151
  651   1HB   TRP  78          HB2       TRP  78  -1.148  -4.305   0.874
  652   2HB   TRP  78          HB1       TRP  78   0.203  -3.564   0.010
  653    HD1  TRP  78           HD1      TRP  78  -2.163  -6.608  -0.340
  654    HE1  TRP  78           HE1      TRP  78  -2.495  -7.084  -2.852
  655    HE3  TRP  78           HE3      TRP  78   0.948  -3.087  -2.324
  656    HZ2  TRP  78           HZ2      TRP  78  -1.557  -6.099  -5.373
  657    HZ3  TRP  78           HZ3      TRP  78   1.208  -2.869  -4.778
  658    HH2  TRP  78           HH2      TRP  78  -0.044  -4.364  -6.303
  659    H    THR  79           HN       THR  79   3.012  -4.652   1.185
  660    HA   THR  79           HA       THR  79   2.541  -3.336   3.776
  661    HB   THR  79           HB       THR  79   3.016  -5.670   4.434
  662    HG1  THR  79           HG1      THR  79   4.554  -3.514   5.035
  663   1HG2  THR  79          HG21      THR  79   5.690  -5.305   3.071
  664   2HG2  THR  79          HG22      THR  79   4.341  -6.164   2.331
  665   3HG2  THR  79          HG23      THR  79   5.059  -6.769   3.823
  666    H    LEU  80           HN       LEU  80   4.719  -2.294   4.500
  667    HA   LEU  80           HA       LEU  80   6.001  -1.167   2.062
  668   1HB   LEU  80          HB2       LEU  80   5.960  -0.297   4.959
  669   2HB   LEU  80          HB1       LEU  80   6.936   0.499   3.729
  670    HG   LEU  80           HG       LEU  80   3.956   0.104   3.384
  671   1HD1  LEU  80          HD11      LEU  80   3.712   2.449   4.206
  672   2HD1  LEU  80          HD12      LEU  80   5.410   2.429   4.679
  673   3HD1  LEU  80          HD13      LEU  80   4.264   1.344   5.465
  674   1HD2  LEU  80          HD21      LEU  80   4.341   2.232   1.981
  675   2HD2  LEU  80          HD22      LEU  80   5.000   0.740   1.326
  676   3HD2  LEU  80          HD23      LEU  80   6.062   1.892   2.132
  677    H    ASP  81           HN       ASP  81   7.912  -1.944   1.440
  678    HA   ASP  81           HA       ASP  81   9.891  -2.806   3.486
  679   1HB   ASP  81          HB2       ASP  81   8.492  -4.542   1.650
  680   2HB   ASP  81          HB1       ASP  81  10.201  -4.534   1.223
  681    HA   PRO  82           HA       PRO  82  11.468   0.470   0.577
  682   1HB   PRO  82          HB2       PRO  82  13.407   0.566   2.866
  683   2HB   PRO  82          HB1       PRO  82  12.642   1.901   1.980
  684   1HG   PRO  82          HG2       PRO  82  11.785   1.230   4.390
  685   2HG   PRO  82          HG1       PRO  82  10.632   1.674   3.116
  686   1HD   PRO  82          HD2       PRO  82  11.299  -1.050   4.186
  687   2HD   PRO  82          HD1       PRO  82   9.735  -0.411   3.630
  688    H    ASP  83           HN       ASP  83  14.474   0.591   1.282
  689    HA   ASP  83           HA       ASP  83  15.315  -1.280  -0.772
  690   1HB   ASP  83          HB2       ASP  83  16.871   0.504   1.119
  691   2HB   ASP  83          HB1       ASP  83  17.640  -0.524  -0.091
  692    H    SER  84           HN       SER  84  14.149  -2.967   0.777
  693    HA   SER  84           HA       SER  84  15.512  -3.986   3.054
  694   1HB   SER  84          HB2       SER  84  13.221  -4.659   2.444
  695   2HB   SER  84          HB1       SER  84  13.835  -5.456   0.998
  696    HG   SER  84           HG       SER  84  14.443  -7.085   2.182
  697    H    TYR  85           HN       TYR  85  15.974  -4.488  -0.397
  698    HA   TYR  85           HA       TYR  85  17.726  -6.725  -0.281
  699   1HB   TYR  85          HB2       TYR  85  16.761  -5.863  -2.389
  700   2HB   TYR  85          HB1       TYR  85  17.742  -4.403  -2.236
  701    HD1  TYR  85           HD1      TYR  85  17.778  -8.014  -2.932
  702    HD2  TYR  85           HD2      TYR  85  20.166  -4.463  -2.556
  703    HE1  TYR  85           HE1      TYR  85  19.681  -9.182  -4.011
  704    HE2  TYR  85           HE2      TYR  85  22.070  -5.632  -3.638
  705    HH   TYR  85           HH       TYR  85  22.652  -8.428  -3.804
  706    H    ASN  86           HN       ASN  86  18.369  -3.238   0.001
  707    HA   ASN  86           HA       ASN  86  21.260  -3.693   0.293
  708   1HB   ASN  86          HB2       ASN  86  20.229  -1.666  -0.843
  709   2HB   ASN  86          HB1       ASN  86  19.736  -1.126   0.762
  710   1HD2  ASN  86          HD21      ASN  86  21.471   0.583  -0.474
  711   2HD2  ASN  86          HD22      ASN  86  23.039   0.438   0.158
  712    H    MET  87           HN       MET  87  19.221  -4.715   2.338
  713    HA   MET  87           HA       MET  87  19.696  -3.133   4.732
  714   1HB   MET  87          HB2       MET  87  18.451  -5.793   4.135
  715   2HB   MET  87          HB1       MET  87  18.949  -5.475   5.792
  716   1HG   MET  87          HG2       MET  87  17.339  -3.377   4.383
  717   2HG   MET  87          HG1       MET  87  16.516  -4.828   4.955
  718   1HE   MET  87          HE1       MET  87  18.246  -1.595   5.712
  719   2HE   MET  87          HE2       MET  87  17.569  -1.220   7.295
  720   3HE   MET  87          HE3       MET  87  16.493  -1.503   5.928
  721    H    PHE  88           HN       PHE  88  21.906  -2.903   5.037
  722    HA   PHE  88           HA       PHE  88  23.646  -5.299   5.107
  723   1HB   PHE  88          HB2       PHE  88  24.065  -2.322   5.233
  724   2HB   PHE  88          HB1       PHE  88  25.316  -3.374   5.890
  725    HD1  PHE  88           HD1      PHE  88  27.079  -3.295   4.342
  726    HD2  PHE  88           HD2      PHE  88  23.065  -3.887   2.929
  727    HE1  PHE  88           HE1      PHE  88  27.941  -3.687   2.052
  728    HE2  PHE  88           HE2      PHE  88  23.928  -4.283   0.642
  729    HZ   PHE  88           HZ       PHE  88  26.366  -4.182   0.202
  730    H    GLU  89           HN       GLU  89  21.740  -3.368   7.199
  731    HA   GLU  89           HA       GLU  89  23.244  -3.918   9.638
  732   1HB   GLU  89          HB2       GLU  89  20.412  -2.916   9.212
  733   2HB   GLU  89          HB1       GLU  89  21.245  -2.959  10.766
  734   1HG   GLU  89          HG2       GLU  89  22.297  -1.477   8.341
  735   2HG   GLU  89          HG1       GLU  89  21.340  -0.717   9.611
  736    H    ASN  90           HN       ASN  90  22.328  -5.250  11.409
  737    HA   ASN  90           HA       ASN  90  21.540  -7.856  10.468
  738   1HB   ASN  90          HB2       ASN  90  21.466  -6.706  13.275
  739   2HB   ASN  90          HB1       ASN  90  21.364  -8.419  12.863
  740   1HD2  ASN  90          HD21      ASN  90  23.326  -8.979  11.150
  741   2HD2  ASN  90          HD22      ASN  90  24.849  -8.458  11.688
  742    H    GLY  91           HN       GLY  91  19.502  -8.662  10.141
  743   1HA   GLY  91          HA2       GLY  91  17.184  -8.162  11.598
  744   2HA   GLY  91          HA1       GLY  91  17.208  -6.906  10.360
  745    H    SER  92           HN       SER  92  16.054  -7.457   8.607
  746    HA   SER  92           HA       SER  92  15.227 -10.187   8.083
  747   1HB   SER  92          HB2       SER  92  13.740  -8.369   7.482
  748   2HB   SER  92          HB1       SER  92  14.974  -7.637   6.463
  749    HG   SER  92           HG       SER  92  14.471  -8.985   4.933
  750    H    PHE  93           HN       PHE  93  18.025  -8.426   7.354
  751    HA   PHE  93           HA       PHE  93  18.692  -9.363   4.763
  752   1HB   PHE  93          HB2       PHE  93  19.931  -7.571   5.888
  753   2HB   PHE  93          HB1       PHE  93  20.529  -8.718   7.086
  754    HD1  PHE  93           HD1      PHE  93  22.281 -10.292   6.562
  755    HD2  PHE  93           HD2      PHE  93  20.664  -7.728   3.519
  756    HE1  PHE  93           HE1      PHE  93  24.148 -10.909   5.051
  757    HE2  PHE  93           HE2      PHE  93  22.531  -8.347   2.007
  758    HZ   PHE  93           HZ       PHE  93  24.273  -9.936   2.773
  759    H    LEU  94           HN       LEU  94  19.234 -10.910   7.942
  760    HA   LEU  94           HA       LEU  94  20.700 -13.124   6.725
  761   1HB   LEU  94          HB2       LEU  94  20.205 -14.178   9.064
  762   2HB   LEU  94          HB1       LEU  94  21.305 -12.809   8.963
  763    HG   LEU  94           HG       LEU  94  18.421 -12.102   9.295
  764   1HD1  LEU  94          HD11      LEU  94  18.531 -12.487  11.756
  765   2HD1  LEU  94          HD12      LEU  94  20.024 -13.396  11.516
  766   3HD1  LEU  94          HD13      LEU  94  18.512 -13.986  10.827
  767   1HD2  LEU  94          HD21      LEU  94  19.331 -10.369  10.702
  768   2HD2  LEU  94          HD22      LEU  94  20.361 -10.473   9.274
  769   3HD2  LEU  94          HD23      LEU  94  20.889 -11.187  10.797
  Start of MODEL    3
    1   1H    MET   1          HT1       MET   1 -23.723  13.785   2.952
    2   2H    MET   1          HT2       MET   1 -24.014  14.466   1.421
    3   3H    MET   1          HT3       MET   1 -25.224  14.501   2.613
    4    HA   MET   1           HA       MET   1 -23.901  16.625   2.195
    5   1HB   MET   1          HB2       MET   1 -23.933  17.144   4.627
    6   2HB   MET   1          HB1       MET   1 -25.410  16.337   4.102
    7   1HG   MET   1          HG2       MET   1 -24.448  14.163   4.859
    8   2HG   MET   1          HG1       MET   1 -23.039  15.031   5.470
    9   1HE   MET   1          HE1       MET   1 -26.705  14.790   5.274
   10   2HE   MET   1          HE2       MET   1 -27.372  15.254   6.836
   11   3HE   MET   1          HE3       MET   1 -26.589  13.688   6.651
   12    H    LEU   2           HN       LEU   2 -22.219  13.859   2.676
   13    HA   LEU   2           HA       LEU   2 -19.807  14.999   3.903
   14   1HB   LEU   2          HB2       LEU   2 -20.192  12.346   2.480
   15   2HB   LEU   2          HB1       LEU   2 -18.828  12.788   3.503
   16    HG   LEU   2           HG       LEU   2 -21.695  12.733   4.480
   17   1HD1  LEU   2          HD11      LEU   2 -20.976  10.482   3.770
   18   2HD1  LEU   2          HD12      LEU   2 -21.115  10.576   5.526
   19   3HD1  LEU   2          HD13      LEU   2 -19.526  10.631   4.763
   20   1HD2  LEU   2          HD21      LEU   2 -20.407  12.509   6.710
   21   2HD2  LEU   2          HD22      LEU   2 -20.395  14.091   5.937
   22   3HD2  LEU   2          HD23      LEU   2 -18.990  13.033   5.803
   23    H    VAL   3           HN       VAL   3 -17.735  15.044   2.714
   24    HA   VAL   3           HA       VAL   3 -18.047  15.387  -0.250
   25    HB   VAL   3           HB       VAL   3 -16.526  17.319  -0.122
   26   1HG1  VAL   3          HG11      VAL   3 -18.086  18.893   0.966
   27   2HG1  VAL   3          HG12      VAL   3 -18.891  17.544   1.767
   28   3HG1  VAL   3          HG13      VAL   3 -18.965  17.698   0.011
   29   1HG2  VAL   3          HG21      VAL   3 -16.624  16.674   2.833
   30   2HG2  VAL   3          HG22      VAL   3 -16.159  18.269   2.243
   31   3HG2  VAL   3          HG23      VAL   3 -15.203  16.854   1.804
   32    H    LYS   4           HN       LYS   4 -15.978  15.091  -1.408
   33    HA   LYS   4           HA       LYS   4 -14.587  12.766  -0.629
   34   1HB   LYS   4          HB2       LYS   4 -13.267  14.879  -2.326
   35   2HB   LYS   4          HB1       LYS   4 -13.192  13.128  -2.478
   36   1HG   LYS   4          HG2       LYS   4 -14.756  13.410  -4.125
   37   2HG   LYS   4          HG1       LYS   4 -15.900  13.562  -2.796
   38   1HD   LYS   4          HD2       LYS   4 -15.488  16.044  -2.811
   39   2HD   LYS   4          HD1       LYS   4 -14.483  15.821  -4.243
   40   1HE   LYS   4          HE2       LYS   4 -16.768  16.459  -4.890
   41   2HE   LYS   4          HE1       LYS   4 -16.408  14.820  -5.432
   42   1HZ   LYS   4          HZ1       LYS   4 -17.674  13.902  -3.713
   43   2HZ   LYS   4          HZ2       LYS   4 -18.617  15.194  -4.287
   44   3HZ   LYS   4          HZ3       LYS   4 -17.735  15.359  -2.845
   45    HA   PRO   5           HA       PRO   5 -12.304  14.611   2.879
   46   1HB   PRO   5          HB2       PRO   5 -10.617  12.192   2.292
   47   2HB   PRO   5          HB1       PRO   5 -11.172  12.814   3.861
   48   1HG   PRO   5          HG2       PRO   5 -12.359  10.729   2.732
   49   2HG   PRO   5          HG1       PRO   5 -13.302  11.959   3.590
   50   1HD   PRO   5          HD2       PRO   5 -13.083  11.475   0.649
   51   2HD   PRO   5          HD1       PRO   5 -14.436  12.143   1.587
   52    HA   PRO   6           HA       PRO   6  -8.930  16.524   0.672
   53   1HB   PRO   6          HB2       PRO   6  -7.383  17.462   2.669
   54   2HB   PRO   6          HB1       PRO   6  -9.037  18.061   2.427
   55   1HG   PRO   6          HG2       PRO   6  -8.037  16.028   4.379
   56   2HG   PRO   6          HG1       PRO   6  -9.161  17.373   4.641
   57   1HD   PRO   6          HD2       PRO   6  -9.984  14.772   4.221
   58   2HD   PRO   6          HD1       PRO   6 -10.971  16.194   3.813
   59    H    TYR   7           HN       TYR   7  -8.486  13.571   2.117
   60    HA   TYR   7           HA       TYR   7  -5.561  13.483   2.066
   61   1HB   TYR   7          HB2       TYR   7  -7.577  11.223   2.254
   62   2HB   TYR   7          HB1       TYR   7  -5.851  11.108   2.598
   63    HD1  TYR   7           HD1      TYR   7  -9.069  11.806   3.970
   64    HD2  TYR   7           HD2      TYR   7  -4.901  12.737   4.398
   65    HE1  TYR   7           HE1      TYR   7  -9.495  12.597   6.273
   66    HE2  TYR   7           HE2      TYR   7  -5.315  13.521   6.713
   67    HH   TYR   7           HH       TYR   7  -7.735  14.508   7.912
   68    H    SER   8           HN       SER   8  -4.296  12.546   0.473
   69    HA   SER   8           HA       SER   8  -5.421  12.429  -2.210
   70   1HB   SER   8          HB2       SER   8  -3.143  13.215  -1.955
   71   2HB   SER   8          HB1       SER   8  -2.685  11.750  -1.091
   72    HG   SER   8           HG       SER   8  -3.786  11.034  -3.392
   73    H    TYR   9           HN       TYR   9  -5.261  10.433  -3.572
   74    HA   TYR   9           HA       TYR   9  -6.468   8.187  -2.300
   75   1HB   TYR   9          HB2       TYR   9  -4.970   8.404  -4.927
   76   2HB   TYR   9          HB1       TYR   9  -5.838   6.955  -4.418
   77    HD1  TYR   9           HD1      TYR   9  -8.284   6.940  -4.236
   78    HD2  TYR   9           HD2      TYR   9  -6.160  10.444  -5.524
   79    HE1  TYR   9           HE1      TYR   9 -10.413   7.930  -5.041
   80    HE2  TYR   9           HE2      TYR   9  -8.285  11.434  -6.333
   81    HH   TYR   9           HH       TYR   9 -10.449  10.958  -6.856
   82    H    ILE  10           HN       ILE  10  -3.092   8.888  -3.132
   83    HA   ILE  10           HA       ILE  10  -2.040   6.336  -2.340
   84    HB   ILE  10           HB       ILE  10  -0.702   9.062  -2.309
   85   1HG1  ILE  10          HG12      ILE  10  -1.569   8.579  -4.529
   86   2HG1  ILE  10          HG11      ILE  10   0.176   8.352  -4.543
   87   1HG2  ILE  10          HG21      ILE  10   0.346   6.233  -2.173
   88   2HG2  ILE  10          HG22      ILE  10   0.660   7.567  -1.063
   89   3HG2  ILE  10          HG23      ILE  10   1.361   7.584  -2.681
   90   1HD1  ILE  10          HD11      ILE  10  -2.006   6.298  -4.692
   91   2HD1  ILE  10          HD12      ILE  10  -0.454   5.837  -3.992
   92   3HD1  ILE  10          HD13      ILE  10  -0.533   6.431  -5.650
   93    H    ALA  11           HN       ALA  11  -2.609   9.375  -0.582
   94    HA   ALA  11           HA       ALA  11  -1.391   8.595   1.888
   95   1HB   ALA  11          HB1       ALA  11  -2.580  10.425   2.872
   96   2HB   ALA  11          HB2       ALA  11  -3.845  10.359   1.644
   97   3HB   ALA  11          HB3       ALA  11  -2.230  10.927   1.217
   98    H    LEU  12           HN       LEU  12  -4.782   8.258   0.769
   99    HA   LEU  12           HA       LEU  12  -5.734   7.025   3.157
  100   1HB   LEU  12          HB2       LEU  12  -6.618   6.626   0.283
  101   2HB   LEU  12          HB1       LEU  12  -7.519   6.067   1.688
  102    HG   LEU  12           HG       LEU  12  -6.764   8.962   1.179
  103   1HD1  LEU  12          HD11      LEU  12  -9.286   9.147   0.761
  104   2HD1  LEU  12          HD12      LEU  12  -9.283   7.390   0.609
  105   3HD1  LEU  12          HD13      LEU  12  -8.337   8.374  -0.509
  106   1HD2  LEU  12          HD21      LEU  12  -7.125   8.833   3.484
  107   2HD2  LEU  12          HD22      LEU  12  -8.289   7.516   3.340
  108   3HD2  LEU  12          HD23      LEU  12  -8.757   9.161   2.914
  109    H    ILE  13           HN       ILE  13  -4.275   5.633   0.223
  110    HA   ILE  13           HA       ILE  13  -4.469   2.896   1.126
  111    HB   ILE  13           HB       ILE  13  -2.552   4.163  -0.856
  112   1HG1  ILE  13          HG12      ILE  13  -5.108   2.636  -1.395
  113   2HG1  ILE  13          HG11      ILE  13  -5.053   4.395  -1.302
  114   1HG2  ILE  13          HG21      ILE  13  -1.704   2.013  -0.191
  115   2HG2  ILE  13          HG22      ILE  13  -2.505   1.790  -1.746
  116   3HG2  ILE  13          HG23      ILE  13  -3.314   1.294  -0.260
  117   1HD1  ILE  13          HD11      ILE  13  -3.364   4.439  -3.104
  118   2HD1  ILE  13          HD12      ILE  13  -4.837   3.636  -3.643
  119   3HD1  ILE  13          HD13      ILE  13  -3.423   2.680  -3.201
  120    H    THR  14           HN       THR  14  -1.768   5.231   1.061
  121    HA   THR  14           HA       THR  14   0.127   3.569   2.366
  122    HB   THR  14           HB       THR  14  -0.085   6.585   2.407
  123    HG1  THR  14           HG1      THR  14   1.738   5.957   0.785
  124   1HG2  THR  14          HG21      THR  14   2.113   4.651   3.139
  125   2HG2  THR  14          HG22      THR  14   1.452   5.967   4.108
  126   3HG2  THR  14          HG23      THR  14   2.453   6.325   2.698
  127    H    MET  15           HN       MET  15  -2.251   5.839   3.654
  128    HA   MET  15           HA       MET  15  -1.398   5.632   6.400
  129   1HB   MET  15          HB2       MET  15  -3.997   6.501   5.106
  130   2HB   MET  15          HB1       MET  15  -3.696   6.603   6.839
  131   1HG   MET  15          HG2       MET  15  -1.990   8.202   6.583
  132   2HG   MET  15          HG1       MET  15  -1.742   7.810   4.882
  133   1HE   MET  15          HE1       MET  15  -5.019   8.515   7.022
  134   2HE   MET  15          HE2       MET  15  -5.120  10.255   6.776
  135   3HE   MET  15          HE3       MET  15  -3.702   9.564   7.560
  136    H    ALA  16           HN       ALA  16  -3.812   3.919   4.446
  137    HA   ALA  16           HA       ALA  16  -5.071   2.481   6.546
  138   1HB   ALA  16          HB1       ALA  16  -4.691   2.031   3.599
  139   2HB   ALA  16          HB2       ALA  16  -6.179   2.330   4.496
  140   3HB   ALA  16          HB3       ALA  16  -5.408   0.748   4.576
  141    H    ILE  17           HN       ILE  17  -2.177   1.676   4.619
  142    HA   ILE  17           HA       ILE  17  -1.747  -0.933   5.691
  143    HB   ILE  17           HB       ILE  17   0.295   1.116   4.765
  144   1HG1  ILE  17          HG12      ILE  17  -1.001  -1.150   3.229
  145   2HG1  ILE  17          HG11      ILE  17  -1.573   0.515   3.171
  146   1HG2  ILE  17          HG21      ILE  17   1.489  -0.606   5.900
  147   2HG2  ILE  17          HG22      ILE  17   1.549  -1.069   4.199
  148   3HG2  ILE  17          HG23      ILE  17   0.412  -1.861   5.288
  149   1HD1  ILE  17          HD11      ILE  17   1.185  -0.459   2.376
  150   2HD1  ILE  17          HD12      ILE  17   0.694   1.235   2.421
  151   3HD1  ILE  17          HD13      ILE  17  -0.074   0.124   1.285
  152    H    GLN  18           HN       GLN  18  -0.401   2.209   6.666
  153    HA   GLN  18           HA       GLN  18   0.986   1.164   8.973
  154   1HB   GLN  18          HB2       GLN  18   0.132   3.966   8.207
  155   2HB   GLN  18          HB1       GLN  18   1.092   3.607   9.642
  156   1HG   GLN  18          HG2       GLN  18   2.835   2.585   8.249
  157   2HG   GLN  18          HG1       GLN  18   1.868   2.876   6.803
  158   1HE2  GLN  18          HE21      GLN  18   4.501   4.009   7.154
  159   2HE2  GLN  18          HE22      GLN  18   4.334   5.695   7.265
  160    H    ASN  19           HN       ASN  19  -2.177   2.704   8.518
  161    HA   ASN  19           HA       ASN  19  -2.788   2.693  11.361
  162   1HB   ASN  19          HB2       ASN  19  -4.470   3.159   8.890
  163   2HB   ASN  19          HB1       ASN  19  -5.114   3.263  10.529
  164   1HD2  ASN  19          HD21      ASN  19  -3.302   4.970   8.109
  165   2HD2  ASN  19          HD22      ASN  19  -2.907   6.322   9.055
  166    H    ALA  20           HN       ALA  20  -2.750   0.274   8.992
  167    HA   ALA  20           HA       ALA  20  -5.022  -1.255   9.993
  168   1HB   ALA  20          HB1       ALA  20  -3.947  -3.096   8.581
  169   2HB   ALA  20          HB2       ALA  20  -2.726  -1.904   8.132
  170   3HB   ALA  20          HB3       ALA  20  -4.419  -1.637   7.710
  171    HA   PRO  21           HA       PRO  21  -3.121  -3.043  13.672
  172   1HB   PRO  21          HB2       PRO  21  -4.194  -5.578  12.441
  173   2HB   PRO  21          HB1       PRO  21  -4.264  -5.040  14.131
  174   1HG   PRO  21          HG2       PRO  21  -6.375  -4.802  12.526
  175   2HG   PRO  21          HG1       PRO  21  -5.989  -3.562  13.731
  176   1HD   PRO  21          HD2       PRO  21  -5.740  -3.424  10.771
  177   2HD   PRO  21          HD1       PRO  21  -5.895  -2.105  11.953
  178    H    GLU  22           HN       GLU  22  -2.952  -5.403  11.004
  179    HA   GLU  22           HA       GLU  22  -0.015  -5.685  11.462
  180   1HB   GLU  22          HB2       GLU  22  -2.038  -7.389   9.973
  181   2HB   GLU  22          HB1       GLU  22  -0.302  -7.694   9.945
  182   1HG   GLU  22          HG2       GLU  22  -0.296  -7.914  12.403
  183   2HG   GLU  22          HG1       GLU  22  -2.035  -7.612  12.433
  184    H    LYS  23           HN       LYS  23   1.411  -5.035   9.832
  185    HA   LYS  23           HA       LYS  23   0.469  -3.171   7.883
  186   1HB   LYS  23          HB2       LYS  23   3.087  -4.682   8.088
  187   2HB   LYS  23          HB1       LYS  23   2.780  -3.436   6.877
  188   1HG   LYS  23          HG2       LYS  23   2.232  -1.841   8.723
  189   2HG   LYS  23          HG1       LYS  23   2.689  -3.085   9.887
  190   1HD   LYS  23          HD2       LYS  23   4.949  -3.184   8.824
  191   2HD   LYS  23          HD1       LYS  23   4.475  -1.839   7.783
  192   1HE   LYS  23          HE2       LYS  23   4.678  -1.813  10.808
  193   2HE   LYS  23          HE1       LYS  23   5.697  -0.932   9.671
  194   1HZ   LYS  23          HZ1       LYS  23   3.310  -0.082   8.914
  195   2HZ   LYS  23          HZ2       LYS  23   4.225   0.696  10.115
  196   3HZ   LYS  23          HZ3       LYS  23   2.980  -0.375  10.552
  197    H    LYS  24           HN       LYS  24   0.908  -6.645   7.794
  198    HA   LYS  24           HA       LYS  24   0.663  -6.805   4.880
  199   1HB   LYS  24          HB2       LYS  24   0.411  -8.948   7.020
  200   2HB   LYS  24          HB1       LYS  24   0.511  -9.250   5.285
  201   1HG   LYS  24          HG2       LYS  24   2.727  -8.171   5.219
  202   2HG   LYS  24          HG1       LYS  24   2.634  -7.873   6.955
  203   1HD   LYS  24          HD2       LYS  24   2.475 -10.303   7.365
  204   2HD   LYS  24          HD1       LYS  24   2.573 -10.602   5.630
  205   1HE   LYS  24          HE2       LYS  24   4.788  -9.380   5.638
  206   2HE   LYS  24          HE1       LYS  24   4.700  -9.373   7.399
  207   1HZ   LYS  24          HZ1       LYS  24   4.389 -11.884   5.884
  208   2HZ   LYS  24          HZ2       LYS  24   4.861 -11.664   7.502
  209   3HZ   LYS  24          HZ3       LYS  24   5.933 -11.280   6.242
  210    H    ILE  25           HN       ILE  25  -1.283  -5.891   4.264
  211    HA   ILE  25           HA       ILE  25  -3.793  -7.092   5.397
  212    HB   ILE  25           HB       ILE  25  -3.546  -4.686   5.925
  213   1HG1  ILE  25          HG12      ILE  25  -5.618  -5.163   3.761
  214   2HG1  ILE  25          HG11      ILE  25  -5.790  -5.694   5.435
  215   1HG2  ILE  25          HG21      ILE  25  -2.124  -4.225   3.868
  216   2HG2  ILE  25          HG22      ILE  25  -3.377  -3.029   4.200
  217   3HG2  ILE  25          HG23      ILE  25  -3.621  -4.231   2.934
  218   1HD1  ILE  25          HD11      ILE  25  -6.931  -3.600   5.301
  219   2HD1  ILE  25          HD12      ILE  25  -5.610  -2.860   4.398
  220   3HD1  ILE  25          HD13      ILE  25  -5.397  -3.259   6.103
  221    H    THR  26           HN       THR  26  -5.426  -7.619   3.879
  222    HA   THR  26           HA       THR  26  -4.404  -8.344   1.242
  223    HB   THR  26           HB       THR  26  -6.690  -9.297   0.925
  224    HG1  THR  26           HG1      THR  26  -7.132  -8.468   3.591
  225   1HG2  THR  26          HG21      THR  26  -6.530 -10.875   2.947
  226   2HG2  THR  26          HG22      THR  26  -5.136  -9.915   3.439
  227   3HG2  THR  26          HG23      THR  26  -5.114 -10.778   1.901
  228    H    LEU  27           HN       LEU  27  -5.564  -7.764  -0.749
  229    HA   LEU  27           HA       LEU  27  -5.788  -4.955  -1.130
  230   1HB   LEU  27          HB2       LEU  27  -5.325  -6.684  -2.897
  231   2HB   LEU  27          HB1       LEU  27  -7.011  -7.177  -2.798
  232    HG   LEU  27           HG       LEU  27  -7.707  -4.886  -3.448
  233   1HD1  LEU  27          HD11      LEU  27  -4.739  -4.448  -3.281
  234   2HD1  LEU  27          HD12      LEU  27  -6.060  -3.370  -2.831
  235   3HD1  LEU  27          HD13      LEU  27  -5.631  -3.576  -4.526
  236   1HD2  LEU  27          HD21      LEU  27  -5.664  -5.971  -5.401
  237   2HD2  LEU  27          HD22      LEU  27  -7.175  -5.144  -5.770
  238   3HD2  LEU  27          HD23      LEU  27  -7.205  -6.775  -5.100
  239    H    ASN  28           HN       ASN  28  -8.286  -7.466  -0.815
  240    HA   ASN  28           HA       ASN  28 -10.566  -5.768  -0.999
  241   1HB   ASN  28          HB2       ASN  28 -10.079  -8.425   0.353
  242   2HB   ASN  28          HB1       ASN  28 -11.650  -7.626   0.431
  243   1HD2  ASN  28          HD21      ASN  28 -10.384 -10.083  -1.175
  244   2HD2  ASN  28          HD22      ASN  28 -11.020  -9.846  -2.732
  245    H    GLY  29           HN       GLY  29  -8.543  -6.722   1.750
  246   1HA   GLY  29          HA2       GLY  29 -10.101  -5.586   3.825
  247   2HA   GLY  29          HA1       GLY  29  -8.358  -5.822   3.898
  248    H    ILE  30           HN       ILE  30  -7.621  -4.058   1.745
  249    HA   ILE  30           HA       ILE  30  -7.502  -1.593   3.158
  250    HB   ILE  30           HB       ILE  30  -7.171  -2.089   0.184
  251   1HG1  ILE  30          HG12      ILE  30  -5.074  -1.795   2.357
  252   2HG1  ILE  30          HG11      ILE  30  -5.662  -3.357   1.785
  253   1HG2  ILE  30          HG21      ILE  30  -7.484   0.253   0.450
  254   2HG2  ILE  30          HG22      ILE  30  -5.735   0.039   0.440
  255   3HG2  ILE  30          HG23      ILE  30  -6.584   0.283   1.965
  256   1HD1  ILE  30          HD11      ILE  30  -4.262  -1.232   0.140
  257   2HD1  ILE  30          HD12      ILE  30  -4.998  -2.682  -0.543
  258   3HD1  ILE  30          HD13      ILE  30  -3.635  -2.823   0.567
  259    H    TYR  31           HN       TYR  31  -9.732  -2.656   0.573
  260    HA   TYR  31           HA       TYR  31 -11.041  -0.136   0.258
  261   1HB   TYR  31          HB2       TYR  31 -11.954  -2.983  -0.183
  262   2HB   TYR  31          HB1       TYR  31 -13.021  -1.613  -0.489
  263    HD1  TYR  31           HD1      TYR  31 -10.379  -3.638  -1.818
  264    HD2  TYR  31           HD2      TYR  31 -12.131   0.270  -2.008
  265    HE1  TYR  31           HE1      TYR  31  -9.283  -3.258  -4.006
  266    HE2  TYR  31           HE2      TYR  31 -11.038   0.654  -4.191
  267    HH   TYR  31           HH       TYR  31  -8.645  -0.608  -5.295
  268    H    GLN  32           HN       GLN  32 -11.667  -2.818   2.512
  269    HA   GLN  32           HA       GLN  32 -14.077  -1.803   3.633
  270   1HB   GLN  32          HB2       GLN  32 -13.229  -4.078   4.071
  271   2HB   GLN  32          HB1       GLN  32 -11.876  -3.400   4.978
  272   1HG   GLN  32          HG2       GLN  32 -13.362  -2.487   6.648
  273   2HG   GLN  32          HG1       GLN  32 -14.782  -2.917   5.693
  274   1HE2  GLN  32          HE21      GLN  32 -14.571  -3.927   8.317
  275   2HE2  GLN  32          HE22      GLN  32 -14.267  -5.596   8.257
  276    H    PHE  33           HN       PHE  33 -10.688  -1.178   4.459
  277    HA   PHE  33           HA       PHE  33 -11.130   0.376   6.790
  278   1HB   PHE  33          HB2       PHE  33  -8.921  -0.460   6.129
  279   2HB   PHE  33          HB1       PHE  33  -8.930   0.597   4.720
  280    HD1  PHE  33           HD1      PHE  33  -8.681   0.453   8.395
  281    HD2  PHE  33           HD2      PHE  33  -8.612   2.997   4.936
  282    HE1  PHE  33           HE1      PHE  33  -7.741   2.292   9.768
  283    HE2  PHE  33           HE2      PHE  33  -7.676   4.838   6.308
  284    HZ   PHE  33           HZ       PHE  33  -7.241   4.486   8.724
  285    H    ILE  34           HN       ILE  34 -10.745   1.478   3.404
  286    HA   ILE  34           HA       ILE  34 -11.076   4.247   3.931
  287    HB   ILE  34           HB       ILE  34 -11.730   2.618   1.467
  288   1HG1  ILE  34          HG12      ILE  34  -9.379   4.433   2.063
  289   2HG1  ILE  34          HG11      ILE  34  -9.348   2.691   2.339
  290   1HG2  ILE  34          HG21      ILE  34 -12.963   4.624   1.181
  291   2HG2  ILE  34          HG22      ILE  34 -11.437   4.939   0.356
  292   3HG2  ILE  34          HG23      ILE  34 -11.721   5.599   1.967
  293   1HD1  ILE  34          HD11      ILE  34  -9.985   2.375  -0.078
  294   2HD1  ILE  34          HD12      ILE  34  -8.397   3.108   0.157
  295   3HD1  ILE  34          HD13      ILE  34  -9.774   4.112  -0.302
  296    H    MET  35           HN       MET  35 -13.556   1.879   2.884
  297    HA   MET  35           HA       MET  35 -15.706   3.732   2.837
  298   1HB   MET  35          HB2       MET  35 -15.662   0.742   3.253
  299   2HB   MET  35          HB1       MET  35 -17.154   1.671   3.083
  300   1HG   MET  35          HG2       MET  35 -16.312   2.547   0.901
  301   2HG   MET  35          HG1       MET  35 -14.896   1.511   1.059
  302   1HE   MET  35          HE1       MET  35 -15.964  -1.973   0.609
  303   2HE   MET  35          HE2       MET  35 -16.161  -1.359   2.248
  304   3HE   MET  35          HE3       MET  35 -14.817  -0.796   1.258
  305    H    ASP  36           HN       ASP  36 -14.516   1.701   5.525
  306    HA   ASP  36           HA       ASP  36 -16.666   2.267   7.311
  307   1HB   ASP  36          HB2       ASP  36 -13.788   1.491   7.793
  308   2HB   ASP  36          HB1       ASP  36 -14.948   1.680   9.106
  309    H    ARG  37           HN       ARG  37 -13.439   3.861   7.151
  310    HA   ARG  37           HA       ARG  37 -14.228   5.779   9.175
  311   1HB   ARG  37          HB2       ARG  37 -11.867   5.734   7.280
  312   2HB   ARG  37          HB1       ARG  37 -12.083   6.925   8.565
  313   1HG   ARG  37          HG2       ARG  37 -12.301   4.981  10.187
  314   2HG   ARG  37          HG1       ARG  37 -11.789   3.926   8.871
  315   1HD   ARG  37          HD2       ARG  37  -9.836   4.479  10.169
  316   2HD   ARG  37          HD1       ARG  37  -9.723   5.363   8.641
  317    HE   ARG  37           HE       ARG  37 -10.955   7.183  10.272
  318   1HH1  ARG  37          HH21      ARG  37  -8.189   5.147  10.578
  319   2HH1  ARG  37          HH22      ARG  37  -7.315   6.262  11.575
  320   1HH2  ARG  37          HH11      ARG  37  -9.831   8.648  11.571
  321   2HH2  ARG  37          HH12      ARG  37  -8.245   8.243  12.138
  322    H    PHE  38           HN       PHE  38 -14.503   5.713   5.697
  323    HA   PHE  38           HA       PHE  38 -15.656   8.483   5.814
  324   1HB   PHE  38          HB2       PHE  38 -14.028   7.334   3.528
  325   2HB   PHE  38          HB1       PHE  38 -14.691   8.965   3.640
  326    HD1  PHE  38           HD1      PHE  38 -13.891  10.492   5.512
  327    HD2  PHE  38           HD2      PHE  38 -11.954   6.781   4.539
  328    HE1  PHE  38           HE1      PHE  38 -11.862  11.226   6.739
  329    HE2  PHE  38           HE2      PHE  38  -9.931   7.516   5.767
  330    HZ   PHE  38           HZ       PHE  38  -9.885   9.738   6.868
  331    HA   PRO  39           HA       PRO  39 -18.823   5.336   4.394
  332   1HB   PRO  39          HB2       PRO  39 -20.442   7.641   5.442
  333   2HB   PRO  39          HB1       PRO  39 -20.708   5.897   5.643
  334   1HG   PRO  39          HG2       PRO  39 -19.716   7.347   7.627
  335   2HG   PRO  39          HG1       PRO  39 -19.107   5.714   7.306
  336   1HD   PRO  39          HD2       PRO  39 -17.818   8.352   6.710
  337   2HD   PRO  39          HD1       PRO  39 -17.063   6.810   7.171
  338    H    PHE  40           HN       PHE  40 -17.780   8.414   3.504
  339    HA   PHE  40           HA       PHE  40 -19.762   9.274   1.656
  340   1HB   PHE  40          HB2       PHE  40 -18.069  10.830   2.199
  341   2HB   PHE  40          HB1       PHE  40 -16.781   9.672   1.882
  342    HD1  PHE  40           HD1      PHE  40 -15.532  10.119  -0.041
  343    HD2  PHE  40           HD2      PHE  40 -19.730  11.061   0.005
  344    HE1  PHE  40           HE1      PHE  40 -15.375  10.963  -2.368
  345    HE2  PHE  40           HE2      PHE  40 -19.567  11.902  -2.322
  346    HZ   PHE  40           HZ       PHE  40 -17.390  11.853  -3.508
  347    H    TYR  41           HN       TYR  41 -17.019   7.050   1.288
  348    HA   TYR  41           HA       TYR  41 -17.387   6.665  -1.537
  349   1HB   TYR  41          HB2       TYR  41 -15.965   5.007   0.552
  350   2HB   TYR  41          HB1       TYR  41 -15.909   4.671  -1.181
  351    HD1  TYR  41           HD1      TYR  41 -14.739   6.172  -2.726
  352    HD2  TYR  41           HD2      TYR  41 -14.978   7.035   1.464
  353    HE1  TYR  41           HE1      TYR  41 -13.007   7.913  -3.000
  354    HE2  TYR  41           HE2      TYR  41 -13.246   8.787   1.208
  355    HH   TYR  41           HH       TYR  41 -11.626   9.317  -1.918
  356    H    ARG  42           HN       ARG  42 -18.942   5.287   1.269
  357    HA   ARG  42           HA       ARG  42 -19.857   2.854   0.103
  358   1HB   ARG  42          HB2       ARG  42 -21.115   4.632   2.207
  359   2HB   ARG  42          HB1       ARG  42 -21.789   3.076   1.737
  360   1HG   ARG  42          HG2       ARG  42 -19.664   1.977   2.331
  361   2HG   ARG  42          HG1       ARG  42 -18.997   3.531   2.823
  362   1HD   ARG  42          HD2       ARG  42 -20.713   3.762   4.547
  363   2HD   ARG  42          HD1       ARG  42 -21.477   2.264   4.034
  364    HE   ARG  42           HE       ARG  42 -19.233   2.553   5.829
  365   1HH1  ARG  42          HH21      ARG  42 -20.401   0.577   3.251
  366   2HH1  ARG  42          HH22      ARG  42 -19.331  -0.737   3.611
  367   1HH2  ARG  42          HH11      ARG  42 -17.843   0.853   6.301
  368   2HH2  ARG  42          HH12      ARG  42 -17.889  -0.581   5.332
  369    H    GLU  43           HN       GLU  43 -21.109   6.162  -0.062
  370    HA   GLU  43           HA       GLU  43 -23.409   5.318  -1.697
  371   1HB   GLU  43          HB2       GLU  43 -22.399   8.096  -1.004
  372   2HB   GLU  43          HB1       GLU  43 -23.948   7.722  -1.758
  373   1HG   GLU  43          HG2       GLU  43 -23.063   6.796   0.992
  374   2HG   GLU  43          HG1       GLU  43 -24.206   8.100   0.670
  375    H    ASN  44           HN       ASN  44 -20.299   5.391  -2.381
  376    HA   ASN  44           HA       ASN  44 -20.747   6.252  -5.210
  377   1HB   ASN  44          HB2       ASN  44 -19.543   8.044  -3.841
  378   2HB   ASN  44          HB1       ASN  44 -18.219   6.892  -3.680
  379   1HD2  ASN  44          HD21      ASN  44 -19.515   6.155  -6.624
  380   2HD2  ASN  44          HD22      ASN  44 -18.572   7.161  -7.614
  381    H    LYS  45           HN       LYS  45 -20.266   4.534  -6.470
  382    HA   LYS  45           HA       LYS  45 -18.116   2.630  -5.590
  383   1HB   LYS  45          HB2       LYS  45 -20.633   2.109  -7.195
  384   2HB   LYS  45          HB1       LYS  45 -19.390   0.911  -6.842
  385   1HG   LYS  45          HG2       LYS  45 -19.791   1.205  -4.422
  386   2HG   LYS  45          HG1       LYS  45 -21.041   2.398  -4.776
  387   1HD   LYS  45          HD2       LYS  45 -22.296   0.667  -6.049
  388   2HD   LYS  45          HD1       LYS  45 -21.068  -0.518  -5.606
  389   1HE   LYS  45          HE2       LYS  45 -22.630   1.078  -3.564
  390   2HE   LYS  45          HE1       LYS  45 -23.130  -0.514  -4.129
  391   1HZ   LYS  45          HZ1       LYS  45 -20.887   0.237  -2.427
  392   2HZ   LYS  45          HZ2       LYS  45 -20.621  -1.033  -3.523
  393   3HZ   LYS  45          HZ3       LYS  45 -21.872  -1.142  -2.378
  394    H    GLN  46           HN       GLN  46 -18.465   5.130  -7.486
  395    HA   GLN  46           HA       GLN  46 -18.038   4.275 -10.148
  396   1HB   GLN  46          HB2       GLN  46 -17.178   6.792  -8.712
  397   2HB   GLN  46          HB1       GLN  46 -16.959   6.551 -10.446
  398   1HG   GLN  46          HG2       GLN  46 -19.385   6.176 -10.704
  399   2HG   GLN  46          HG1       GLN  46 -19.608   6.421  -8.972
  400   1HE2  GLN  46          HE21      GLN  46 -17.340   8.571  -9.195
  401   2HE2  GLN  46          HE22      GLN  46 -18.162   9.934  -9.784
  402    H    GLY  47           HN       GLY  47 -15.759   5.349 -11.095
  403   1HA   GLY  47          HA2       GLY  47 -13.885   3.329 -11.028
  404   2HA   GLY  47          HA1       GLY  47 -13.473   4.992 -11.420
  405    H    TRP  48           HN       TRP  48 -14.469   5.428  -8.368
  406    HA   TRP  48           HA       TRP  48 -11.810   5.630  -7.353
  407   1HB   TRP  48          HB2       TRP  48 -12.754   6.398  -5.379
  408   2HB   TRP  48          HB1       TRP  48 -14.113   6.639  -6.468
  409    HD1  TRP  48           HD1      TRP  48 -16.268   5.289  -6.030
  410    HE1  TRP  48           HE1      TRP  48 -17.002   3.619  -4.207
  411    HE3  TRP  48           HE3      TRP  48 -11.773   4.405  -3.777
  412    HZ2  TRP  48           HZ2      TRP  48 -15.836   2.119  -2.050
  413    HZ3  TRP  48           HZ3      TRP  48 -11.612   2.859  -1.849
  414    HH2  TRP  48           HH2      TRP  48 -13.635   1.714  -0.986
  415    H    GLN  49           HN       GLN  49 -14.231   3.077  -7.137
  416    HA   GLN  49           HA       GLN  49 -12.903   1.375  -5.299
  417   1HB   GLN  49          HB2       GLN  49 -15.243   1.086  -6.140
  418   2HB   GLN  49          HB1       GLN  49 -14.587   0.564  -7.689
  419   1HG   GLN  49          HG2       GLN  49 -13.336  -1.256  -6.425
  420   2HG   GLN  49          HG1       GLN  49 -14.276  -0.804  -5.003
  421   1HE2  GLN  49          HE21      GLN  49 -16.760  -0.839  -5.368
  422   2HE2  GLN  49          HE22      GLN  49 -17.372  -2.047  -6.391
  423    H    ASN  50           HN       ASN  50 -12.768   1.386  -8.877
  424    HA   ASN  50           HA       ASN  50 -10.727  -0.677  -8.955
  425   1HB   ASN  50          HB2       ASN  50 -11.876   1.186 -11.038
  426   2HB   ASN  50          HB1       ASN  50 -10.615   0.008 -11.408
  427   1HD2  ASN  50          HD21      ASN  50 -13.986   0.402 -11.237
  428   2HD2  ASN  50          HD22      ASN  50 -14.422  -1.238 -11.188
  429    H    SER  51           HN       SER  51 -10.686   2.847  -9.087
  430    HA   SER  51           HA       SER  51  -8.047   3.216 -10.046
  431   1HB   SER  51          HB2       SER  51  -9.733   4.882  -8.170
  432   2HB   SER  51          HB1       SER  51  -8.173   5.414  -8.791
  433    HG   SER  51           HG       SER  51 -10.410   5.763  -9.960
  434    H    ILE  52           HN       ILE  52  -9.182   2.641  -6.726
  435    HA   ILE  52           HA       ILE  52  -6.767   3.230  -5.372
  436    HB   ILE  52           HB       ILE  52  -8.900   1.179  -4.772
  437   1HG1  ILE  52          HG12      ILE  52  -9.402   3.757  -4.952
  438   2HG1  ILE  52          HG11      ILE  52 -10.047   2.839  -3.598
  439   1HG2  ILE  52          HG21      ILE  52  -7.078   0.518  -3.442
  440   2HG2  ILE  52          HG22      ILE  52  -8.042   1.536  -2.372
  441   3HG2  ILE  52          HG23      ILE  52  -6.590   2.182  -3.132
  442   1HD1  ILE  52          HD11      ILE  52  -8.954   5.061  -3.015
  443   2HD1  ILE  52          HD12      ILE  52  -7.414   4.326  -3.449
  444   3HD1  ILE  52          HD13      ILE  52  -8.363   3.666  -2.119
  445    H    ARG  53           HN       ARG  53  -7.881   0.000  -6.533
  446    HA   ARG  53           HA       ARG  53  -5.289  -1.160  -5.832
  447   1HB   ARG  53          HB2       ARG  53  -6.201  -3.234  -6.796
  448   2HB   ARG  53          HB1       ARG  53  -7.331  -2.499  -5.661
  449   1HG   ARG  53          HG2       ARG  53  -8.539  -1.462  -7.573
  450   2HG   ARG  53          HG1       ARG  53  -7.449  -2.294  -8.681
  451   1HD   ARG  53          HD2       ARG  53  -8.955  -3.872  -6.595
  452   2HD   ARG  53          HD1       ARG  53  -9.750  -3.406  -8.101
  453    HE   ARG  53           HE       ARG  53  -7.375  -4.528  -8.954
  454   1HH1  ARG  53          HH21      ARG  53  -9.950  -5.458  -6.856
  455   2HH1  ARG  53          HH22      ARG  53  -9.785  -7.150  -7.189
  456   1HH2  ARG  53          HH11      ARG  53  -7.149  -6.728  -9.402
  457   2HH2  ARG  53          HH12      ARG  53  -8.202  -7.868  -8.632
  458    H    HIS  54           HN       HIS  54  -6.766   0.138  -8.743
  459    HA   HIS  54           HA       HIS  54  -4.996  -1.018 -10.656
  460   1HB   HIS  54          HB2       HIS  54  -7.021   0.252 -11.285
  461   2HB   HIS  54          HB1       HIS  54  -6.280   1.732 -10.676
  462    HD1  HIS  54           HD1      HIS  54  -4.884  -1.027 -12.927
  463    HD2  HIS  54           HD2      HIS  54  -5.434   3.106 -12.912
  464    HE1  HIS  54           HE1      HIS  54  -3.864  -0.159 -15.076
  465    H    ASN  55           HN       ASN  55  -4.707   1.917  -8.666
  466    HA   ASN  55           HA       ASN  55  -2.199   2.777  -9.767
  467   1HB   ASN  55          HB2       ASN  55  -3.543   3.287  -7.108
  468   2HB   ASN  55          HB1       ASN  55  -2.013   4.039  -7.566
  469   1HD2  ASN  55          HD21      ASN  55  -2.413   4.619 -10.263
  470   2HD2  ASN  55          HD22      ASN  55  -3.709   5.700 -10.442
  471    H    LEU  56           HN       LEU  56  -3.029   0.653  -7.040
  472    HA   LEU  56           HA       LEU  56  -0.394   0.325  -6.036
  473   1HB   LEU  56          HB2       LEU  56  -2.849  -1.418  -5.970
  474   2HB   LEU  56          HB1       LEU  56  -1.338  -1.965  -5.251
  475    HG   LEU  56           HG       LEU  56  -2.663   0.680  -4.580
  476   1HD1  LEU  56          HD11      LEU  56  -3.173  -0.593  -2.380
  477   2HD1  LEU  56          HD12      LEU  56  -2.921  -2.055  -3.332
  478   3HD1  LEU  56          HD13      LEU  56  -4.197  -0.921  -3.776
  479   1HD2  LEU  56          HD21      LEU  56  -1.109   0.073  -2.440
  480   2HD2  LEU  56          HD22      LEU  56  -0.512   0.991  -3.815
  481   3HD2  LEU  56          HD23      LEU  56  -0.176  -0.733  -3.695
  482    H    SER  57           HN       SER  57  -2.128  -1.584  -8.523
  483    HA   SER  57           HA       SER  57  -0.005  -3.453  -8.929
  484   1HB   SER  57          HB2       SER  57  -2.156  -2.495 -10.833
  485   2HB   SER  57          HB1       SER  57  -1.087  -3.859 -11.148
  486    HG   SER  57           HG       SER  57  -2.108  -4.109  -8.701
  487    H    LEU  58           HN       LEU  58  -0.741  -0.381 -10.619
  488    HA   LEU  58           HA       LEU  58   1.532  -0.592 -12.389
  489   1HB   LEU  58          HB2       LEU  58  -0.139   1.773 -11.514
  490   2HB   LEU  58          HB1       LEU  58   1.145   1.893 -12.712
  491    HG   LEU  58           HG       LEU  58  -1.103  -0.107 -13.003
  492   1HD1  LEU  58          HD11      LEU  58  -2.070   1.663 -14.602
  493   2HD1  LEU  58          HD12      LEU  58  -1.021   2.815 -13.777
  494   3HD1  LEU  58          HD13      LEU  58  -2.273   1.963 -12.876
  495   1HD2  LEU  58          HD21      LEU  58   0.705  -0.551 -14.517
  496   2HD2  LEU  58          HD22      LEU  58   0.918   1.162 -14.878
  497   3HD2  LEU  58          HD23      LEU  58  -0.504   0.307 -15.465
  498    H    ASN  59           HN       ASN  59   1.006   1.008  -9.259
  499    HA   ASN  59           HA       ASN  59   3.633   2.235  -9.223
  500   1HB   ASN  59          HB2       ASN  59   1.585   1.675  -7.066
  501   2HB   ASN  59          HB1       ASN  59   3.119   2.477  -6.735
  502   1HD2  ASN  59          HD21      ASN  59   2.501   3.470  -9.803
  503   2HD2  ASN  59          HD22      ASN  59   1.596   4.871  -9.490
  504    H    GLU  60           HN       GLU  60   5.477   1.103  -9.044
  505    HA   GLU  60           HA       GLU  60   5.444  -1.621  -7.901
  506   1HB   GLU  60          HB2       GLU  60   7.618   0.000  -9.257
  507   2HB   GLU  60          HB1       GLU  60   7.806  -1.667  -8.709
  508   1HG   GLU  60          HG2       GLU  60   5.621  -0.795 -10.615
  509   2HG   GLU  60          HG1       GLU  60   7.182  -1.413 -11.161
  510    H    CYS  61           HN       CYS  61   5.762   1.462  -6.699
  511    HA   CYS  61           HA       CYS  61   8.015   1.278  -4.957
  512   1HB   CYS  61          HB2       CYS  61   5.400   2.788  -4.746
  513   2HB   CYS  61          HB1       CYS  61   6.677   2.937  -3.538
  514    HG   CYS  61           HG       CYS  61   7.305   3.562  -6.534
  515    H    PHE  62           HN       PHE  62   4.640   0.237  -4.559
  516    HA   PHE  62           HA       PHE  62   5.100  -0.695  -1.826
  517   1HB   PHE  62          HB2       PHE  62   2.794  -1.175  -3.738
  518   2HB   PHE  62          HB1       PHE  62   2.805  -1.616  -2.029
  519    HD1  PHE  62           HD1      PHE  62   2.197   1.016  -4.404
  520    HD2  PHE  62           HD2      PHE  62   3.230   0.243  -0.307
  521    HE1  PHE  62           HE1      PHE  62   1.511   3.322  -3.796
  522    HE2  PHE  62           HE2      PHE  62   2.543   2.546   0.301
  523    HZ   PHE  62           HZ       PHE  62   1.683   4.086  -1.444
  524    H    VAL  63           HN       VAL  63   5.118  -2.919  -1.185
  525    HA   VAL  63           HA       VAL  63   5.969  -4.820  -3.350
  526    HB   VAL  63           HB       VAL  63   6.708  -4.794  -0.408
  527   1HG1  VAL  63          HG11      VAL  63   7.390  -6.613  -2.722
  528   2HG1  VAL  63          HG12      VAL  63   6.753  -7.051  -1.137
  529   3HG1  VAL  63          HG13      VAL  63   8.422  -6.503  -1.297
  530   1HG2  VAL  63          HG21      VAL  63   8.312  -4.090  -2.888
  531   2HG2  VAL  63          HG22      VAL  63   8.965  -4.197  -1.254
  532   3HG2  VAL  63          HG23      VAL  63   7.772  -2.959  -1.647
  533    H    LYS  64           HN       LYS  64   4.506  -6.408  -3.698
  534    HA   LYS  64           HA       LYS  64   2.377  -6.909  -1.718
  535   1HB   LYS  64          HB2       LYS  64   1.784  -8.689  -3.594
  536   2HB   LYS  64          HB1       LYS  64   1.472  -6.976  -3.864
  537   1HG   LYS  64          HG2       LYS  64   3.492  -6.720  -5.138
  538   2HG   LYS  64          HG1       LYS  64   4.051  -8.327  -4.687
  539   1HD   LYS  64          HD2       LYS  64   3.209  -8.569  -6.895
  540   2HD   LYS  64          HD1       LYS  64   1.947  -9.221  -5.853
  541   1HE   LYS  64          HE2       LYS  64   1.073  -7.706  -7.646
  542   2HE   LYS  64          HE1       LYS  64   0.669  -7.160  -6.022
  543   1HZ   LYS  64          HZ1       LYS  64   2.124  -5.424  -6.144
  544   2HZ   LYS  64          HZ2       LYS  64   1.693  -5.539  -7.783
  545   3HZ   LYS  64          HZ3       LYS  64   3.158  -6.205  -7.239
  546    H    VAL  65           HN       VAL  65   2.500  -8.512  -0.235
  547    HA   VAL  65           HA       VAL  65   4.777 -10.412  -0.381
  548    HB   VAL  65           HB       VAL  65   2.813  -9.904   1.867
  549   1HG1  VAL  65          HG11      VAL  65   5.487 -11.326   1.730
  550   2HG1  VAL  65          HG12      VAL  65   3.918 -12.061   2.064
  551   3HG1  VAL  65          HG13      VAL  65   4.636 -10.949   3.228
  552   1HG2  VAL  65          HG21      VAL  65   5.568  -8.761   1.316
  553   2HG2  VAL  65          HG22      VAL  65   4.701  -8.580   2.841
  554   3HG2  VAL  65          HG23      VAL  65   4.050  -7.864   1.367
  555    HA   PRO  66           HA       PRO  66   1.450 -13.289  -1.632
  556   1HB   PRO  66          HB2       PRO  66   3.009 -15.265  -2.661
  557   2HB   PRO  66          HB1       PRO  66   2.682 -13.760  -3.542
  558   1HG   PRO  66          HG2       PRO  66   5.112 -14.574  -2.029
  559   2HG   PRO  66          HG1       PRO  66   4.980 -13.651  -3.533
  560   1HD   PRO  66          HD2       PRO  66   5.411 -12.522  -1.026
  561   2HD   PRO  66          HD1       PRO  66   4.746 -11.644  -2.420
  562    H    ARG  67           HN       ARG  67   0.494 -14.882  -0.392
  563    HA   ARG  67           HA       ARG  67   1.909 -15.809   1.983
  564   1HB   ARG  67          HB2       ARG  67  -0.157 -16.976   2.550
  565   2HB   ARG  67          HB1       ARG  67  -0.518 -15.327   2.064
  566   1HG   ARG  67          HG2       ARG  67  -0.708 -17.708   0.184
  567   2HG   ARG  67          HG1       ARG  67  -2.064 -17.084   1.111
  568   1HD   ARG  67          HD2       ARG  67  -2.392 -15.885  -0.824
  569   2HD   ARG  67          HD1       ARG  67  -1.270 -14.777  -0.037
  570    HE   ARG  67           HE       ARG  67   0.398 -16.474  -1.430
  571   1HH1  ARG  67          HH21      ARG  67  -2.417 -14.624  -2.165
  572   2HH1  ARG  67          HH22      ARG  67  -1.943 -14.302  -3.799
  573   1HH2  ARG  67          HH11      ARG  67   1.037 -16.061  -3.559
  574   2HH2  ARG  67          HH12      ARG  67   0.015 -15.114  -4.589
  575    H    ASP  68           HN       ASP  68   2.143 -18.122   2.486
  576    HA   ASP  68           HA       ASP  68   3.520 -19.526   0.418
  577   1HB   ASP  68          HB2       ASP  68   2.363 -20.484   3.051
  578   2HB   ASP  68          HB1       ASP  68   3.393 -21.474   2.017
  579    H    ASP  69           HN       ASP  69   2.880 -21.553  -0.612
  580    HA   ASP  69           HA       ASP  69   0.290 -21.476  -1.787
  581   1HB   ASP  69          HB2       ASP  69   2.317 -23.715  -1.559
  582   2HB   ASP  69          HB1       ASP  69   0.836 -23.847  -2.511
  583    H    LYS  70           HN       LYS  70   1.503 -23.127   1.084
  584    HA   LYS  70           HA       LYS  70  -0.688 -24.897   1.508
  585   1HB   LYS  70          HB2       LYS  70   1.134 -23.486   3.478
  586   2HB   LYS  70          HB1       LYS  70  -0.036 -24.717   3.947
  587   1HG   LYS  70          HG2       LYS  70   1.057 -26.336   2.438
  588   2HG   LYS  70          HG1       LYS  70   2.232 -25.105   1.969
  589   1HD   LYS  70          HD2       LYS  70   2.926 -24.906   4.356
  590   2HD   LYS  70          HD1       LYS  70   1.817 -26.216   4.759
  591   1HE   LYS  70          HE2       LYS  70   3.049 -27.792   3.449
  592   2HE   LYS  70          HE1       LYS  70   4.001 -26.517   2.691
  593   1HZ   LYS  70          HZ1       LYS  70   4.083 -26.652   5.598
  594   2HZ   LYS  70          HZ2       LYS  70   5.321 -26.296   4.489
  595   3HZ   LYS  70          HZ3       LYS  70   4.862 -27.909   4.766
  596    H    LYS  71           HN       LYS  71  -0.297 -21.444   2.169
  597    HA   LYS  71           HA       LYS  71  -2.711 -21.247   3.778
  598   1HB   LYS  71          HB2       LYS  71  -1.182 -19.097   2.290
  599   2HB   LYS  71          HB1       LYS  71  -2.410 -18.811   3.516
  600   1HG   LYS  71          HG2       LYS  71   0.030 -20.487   4.112
  601   2HG   LYS  71          HG1       LYS  71   0.085 -18.730   4.228
  602   1HD   LYS  71          HD2       LYS  71  -2.003 -18.953   5.748
  603   2HD   LYS  71          HD1       LYS  71  -1.584 -20.663   5.844
  604   1HE   LYS  71          HE2       LYS  71   0.721 -19.979   6.590
  605   2HE   LYS  71          HE1       LYS  71   0.149 -18.312   6.654
  606   1HZ   LYS  71          HZ1       LYS  71  -0.961 -18.687   8.537
  607   2HZ   LYS  71          HZ2       LYS  71  -0.002 -20.082   8.683
  608   3HZ   LYS  71          HZ3       LYS  71  -1.561 -20.185   8.015
  609    HA   PRO  72           HA       PRO  72  -5.227 -21.082  -0.015
  610   1HB   PRO  72          HB2       PRO  72  -7.671 -21.237   1.074
  611   2HB   PRO  72          HB1       PRO  72  -6.565 -22.625   1.140
  612   1HG   PRO  72          HG2       PRO  72  -7.184 -20.605   3.256
  613   2HG   PRO  72          HG1       PRO  72  -7.043 -22.367   3.397
  614   1HD   PRO  72          HD2       PRO  72  -4.998 -20.607   4.037
  615   2HD   PRO  72          HD1       PRO  72  -4.738 -22.299   3.554
  616    H    GLY  73           HN       GLY  73  -4.516 -18.698   1.945
  617   1HA   GLY  73          HA2       GLY  73  -6.470 -16.767   2.123
  618   2HA   GLY  73          HA1       GLY  73  -4.796 -16.363   1.750
  619    H    LYS  74           HN       LYS  74  -6.741 -14.763   0.731
  620    HA   LYS  74           HA       LYS  74  -7.459 -15.591  -1.987
  621   1HB   LYS  74          HB2       LYS  74  -7.789 -13.014  -0.453
  622   2HB   LYS  74          HB1       LYS  74  -8.319 -13.213  -2.123
  623   1HG   LYS  74          HG2       LYS  74  -9.727 -15.143  -1.412
  624   2HG   LYS  74          HG1       LYS  74  -9.260 -14.838   0.259
  625   1HD   LYS  74          HD2       LYS  74 -10.481 -12.644  -1.414
  626   2HD   LYS  74          HD1       LYS  74 -11.506 -13.833  -0.614
  627   1HE   LYS  74          HE2       LYS  74  -9.487 -12.017   0.744
  628   2HE   LYS  74          HE1       LYS  74 -11.240 -11.868   0.819
  629   1HZ   LYS  74          HZ1       LYS  74 -11.210 -13.244   2.532
  630   2HZ   LYS  74          HZ2       LYS  74  -9.539 -13.500   2.368
  631   3HZ   LYS  74          HZ3       LYS  74 -10.638 -14.477   1.517
  632    H    GLY  75           HN       GLY  75  -6.540 -12.360  -1.788
  633   1HA   GLY  75          HA2       GLY  75  -4.442 -12.757  -3.795
  634   2HA   GLY  75          HA1       GLY  75  -5.037 -11.202  -3.211
  635    H    SER  76           HN       SER  76  -2.461 -11.118  -3.405
  636    HA   SER  76           HA       SER  76  -1.032 -12.197  -1.094
  637   1HB   SER  76          HB2       SER  76   0.878 -10.935  -2.002
  638   2HB   SER  76          HB1       SER  76   0.086 -11.854  -3.278
  639    HG   SER  76           HG       SER  76  -0.176  -9.094  -2.681
  640    H    TYR  77           HN       TYR  77   0.070 -10.747   0.485
  641    HA   TYR  77           HA       TYR  77  -1.756  -8.576   1.325
  642   1HB   TYR  77          HB2       TYR  77   0.752  -9.338   2.809
  643   2HB   TYR  77          HB1       TYR  77  -0.775  -8.723   3.438
  644    HD1  TYR  77           HD1      TYR  77  -2.810 -10.415   2.273
  645    HD2  TYR  77           HD2      TYR  77   1.105 -11.478   3.691
  646    HE1  TYR  77           HE1      TYR  77  -3.589 -12.730   2.688
  647    HE2  TYR  77           HE2      TYR  77   0.325 -13.796   4.104
  648    HH   TYR  77           HH       TYR  77  -1.993 -14.889   4.593
  649    H    TRP  78           HN       TRP  78  -0.987  -6.435   1.778
  650    HA   TRP  78           HA       TRP  78   1.382  -5.642   0.117
  651   1HB   TRP  78          HB2       TRP  78  -1.083  -4.084   0.944
  652   2HB   TRP  78          HB1       TRP  78   0.260  -3.426   0.006
  653    HD1  TRP  78           HD1      TRP  78  -2.606  -5.946  -0.214
  654    HE1  TRP  78           HE1      TRP  78  -3.009  -6.529  -2.693
  655    HE3  TRP  78           HE3      TRP  78   1.344  -3.511  -2.341
  656    HZ2  TRP  78           HZ2      TRP  78  -1.806  -6.026  -5.245
  657    HZ3  TRP  78           HZ3      TRP  78   1.693  -3.580  -4.792
  658    HH2  TRP  78           HH2      TRP  78   0.124  -4.828  -6.245
  659    H    THR  79           HN       THR  79   3.022  -4.517   1.089
  660    HA   THR  79           HA       THR  79   2.614  -3.353   3.790
  661    HB   THR  79           HB       THR  79   3.423  -5.716   4.096
  662    HG1  THR  79           HG1      THR  79   4.235  -3.545   5.207
  663   1HG2  THR  79          HG21      THR  79   5.992  -4.732   2.845
  664   2HG2  THR  79          HG22      THR  79   4.786  -5.642   1.934
  665   3HG2  THR  79          HG23      THR  79   5.578  -6.377   3.327
  666    H    LEU  80           HN       LEU  80   4.411  -1.888   4.366
  667    HA   LEU  80           HA       LEU  80   5.385  -0.456   2.008
  668   1HB   LEU  80          HB2       LEU  80   5.916   0.017   4.959
  669   2HB   LEU  80          HB1       LEU  80   6.332   1.127   3.655
  670    HG   LEU  80           HG       LEU  80   3.521   0.198   4.314
  671   1HD1  LEU  80          HD11      LEU  80   5.069   2.703   4.989
  672   2HD1  LEU  80          HD12      LEU  80   4.173   1.642   6.076
  673   3HD1  LEU  80          HD13      LEU  80   3.307   2.685   4.949
  674   1HD2  LEU  80          HD21      LEU  80   3.425   0.759   2.047
  675   2HD2  LEU  80          HD22      LEU  80   4.709   1.961   2.180
  676   3HD2  LEU  80          HD23      LEU  80   3.095   2.322   2.788
  677    H    ASP  81           HN       ASP  81   7.739   0.120   1.824
  678    HA   ASP  81           HA       ASP  81   9.334  -2.207   1.657
  679   1HB   ASP  81          HB2       ASP  81  11.214  -0.633   1.251
  680   2HB   ASP  81          HB1       ASP  81   9.774  -0.162   0.353
  681    HA   PRO  82           HA       PRO  82  10.887  -2.909   5.768
  682   1HB   PRO  82          HB2       PRO  82  13.696  -2.760   4.741
  683   2HB   PRO  82          HB1       PRO  82  12.898  -4.054   5.654
  684   1HG   PRO  82          HG2       PRO  82  13.385  -4.301   3.051
  685   2HG   PRO  82          HG1       PRO  82  11.899  -4.942   3.775
  686   1HD   PRO  82          HD2       PRO  82  12.271  -2.482   2.105
  687   2HD   PRO  82          HD1       PRO  82  10.907  -3.619   2.163
  688    H    ASP  83           HN       ASP  83  13.671  -1.938   6.494
  689    HA   ASP  83           HA       ASP  83  12.847   0.725   7.410
  690   1HB   ASP  83          HB2       ASP  83  15.400  -0.869   7.795
  691   2HB   ASP  83          HB1       ASP  83  15.093   0.703   8.534
  692    H    SER  84           HN       SER  84  12.956   0.663   4.637
  693    HA   SER  84           HA       SER  84  15.398   1.380   3.411
  694   1HB   SER  84          HB2       SER  84  13.321   0.952   2.141
  695   2HB   SER  84          HB1       SER  84  12.616   2.428   2.794
  696    HG   SER  84           HG       SER  84  15.091   2.435   1.434
  697    H    TYR  85           HN       TYR  85  13.339   3.165   5.561
  698    HA   TYR  85           HA       TYR  85  14.147   5.823   4.958
  699   1HB   TYR  85          HB2       TYR  85  12.286   5.365   6.467
  700   2HB   TYR  85          HB1       TYR  85  13.368   4.568   7.607
  701    HD1  TYR  85           HD1      TYR  85  12.547   7.833   6.022
  702    HD2  TYR  85           HD2      TYR  85  14.688   5.815   9.151
  703    HE1  TYR  85           HE1      TYR  85  13.026  10.014   7.103
  704    HE2  TYR  85           HE2      TYR  85  15.170   7.995  10.229
  705    HH   TYR  85           HH       TYR  85  15.247  10.293   9.774
  706    H    ASN  86           HN       ASN  86  15.638   3.335   7.016
  707    HA   ASN  86           HA       ASN  86  17.708   5.053   8.027
  708   1HB   ASN  86          HB2       ASN  86  17.005   2.788   8.983
  709   2HB   ASN  86          HB1       ASN  86  17.912   2.058   7.658
  710   1HD2  ASN  86          HD21      ASN  86  20.230   2.118   7.761
  711   2HD2  ASN  86          HD22      ASN  86  21.073   2.717   9.107
  712    H    MET  87           HN       MET  87  17.156   3.487   5.062
  713    HA   MET  87           HA       MET  87  19.987   3.617   4.212
  714   1HB   MET  87          HB2       MET  87  17.465   2.733   2.778
  715   2HB   MET  87          HB1       MET  87  19.067   2.729   2.043
  716   1HG   MET  87          HG2       MET  87  19.875   1.199   3.802
  717   2HG   MET  87          HG1       MET  87  18.274   1.201   4.540
  718   1HE   MET  87          HE1       MET  87  19.601  -1.193   4.118
  719   2HE   MET  87          HE2       MET  87  18.905  -2.300   2.939
  720   3HE   MET  87          HE3       MET  87  17.891  -1.632   4.216
  721    H    PHE  88           HN       PHE  88  20.655   5.693   3.707
  722    HA   PHE  88           HA       PHE  88  18.822   7.742   2.813
  723   1HB   PHE  88          HB2       PHE  88  21.851   7.592   2.622
  724   2HB   PHE  88          HB1       PHE  88  20.892   9.043   2.335
  725    HD1  PHE  88           HD1      PHE  88  19.081   9.515   4.303
  726    HD2  PHE  88           HD2      PHE  88  22.776   7.363   4.759
  727    HE1  PHE  88           HE1      PHE  88  19.058   9.986   6.735
  728    HE2  PHE  88           HE2      PHE  88  22.750   7.839   7.191
  729    HZ   PHE  88           HZ       PHE  88  20.892   9.150   8.179
  730    H    GLU  89           HN       GLU  89  21.116   5.590   1.198
  731    HA   GLU  89           HA       GLU  89  19.647   5.977  -1.355
  732   1HB   GLU  89          HB2       GLU  89  22.655   6.256  -1.036
  733   2HB   GLU  89          HB1       GLU  89  21.817   6.146  -2.584
  734   1HG   GLU  89          HG2       GLU  89  20.531   8.181  -2.033
  735   2HG   GLU  89          HG1       GLU  89  21.375   8.291  -0.488
  736    H    ASN  90           HN       ASN  90  19.961   4.114  -2.796
  737    HA   ASN  90           HA       ASN  90  20.129   1.625  -1.420
  738   1HB   ASN  90          HB2       ASN  90  20.366   2.315  -4.357
  739   2HB   ASN  90          HB1       ASN  90  20.396   0.653  -3.764
  740   1HD2  ASN  90          HD21      ASN  90  18.465   0.511  -1.859
  741   2HD2  ASN  90          HD22      ASN  90  16.950   0.985  -2.461
  742    H    GLY  91           HN       GLY  91  21.835   0.184  -1.129
  743   1HA   GLY  91          HA2       GLY  91  24.073  -0.640  -1.393
  744   2HA   GLY  91          HA1       GLY  91  24.488   0.825  -2.286
  745    H    SER  92           HN       SER  92  22.829   2.055   0.176
  746    HA   SER  92           HA       SER  92  25.094   3.096   1.557
  747   1HB   SER  92          HB2       SER  92  22.872   4.185   1.583
  748   2HB   SER  92          HB1       SER  92  22.234   2.849   2.539
  749    HG   SER  92           HG       SER  92  23.841   3.386   4.122
  750    H    PHE  93           HN       PHE  93  22.997   0.321   2.237
  751    HA   PHE  93           HA       PHE  93  23.747  -0.381   4.819
  752   1HB   PHE  93          HB2       PHE  93  22.158  -1.658   3.346
  753   2HB   PHE  93          HB1       PHE  93  23.553  -2.335   2.507
  754    HD1  PHE  93           HD1      PHE  93  21.634  -2.294   5.645
  755    HD2  PHE  93           HD2      PHE  93  25.056  -3.917   3.619
  756    HE1  PHE  93           HE1      PHE  93  21.858  -4.024   7.409
  757    HE2  PHE  93           HE2      PHE  93  25.279  -5.648   5.383
  758    HZ   PHE  93           HZ       PHE  93  23.681  -5.701   7.277
  759    H    LEU  94           HN       LEU  94  25.793  -0.079   2.115
  760    HA   LEU  94           HA       LEU  94  27.795  -2.015   2.641
  761   1HB   LEU  94          HB2       LEU  94  27.709  -0.673   0.573
  762   2HB   LEU  94          HB1       LEU  94  28.094   0.778   1.496
  763    HG   LEU  94           HG       LEU  94  30.264  -0.242   2.160
  764   1HD1  LEU  94          HD11      LEU  94  29.977  -2.566   2.110
  765   2HD1  LEU  94          HD12      LEU  94  30.904  -2.284   0.640
  766   3HD1  LEU  94          HD13      LEU  94  29.160  -2.534   0.546
  767   1HD2  LEU  94          HD21      LEU  94  29.797  -0.271  -0.835
  768   2HD2  LEU  94          HD22      LEU  94  31.336   0.000  -0.015
  769   3HD2  LEU  94          HD23      LEU  94  30.040   1.188   0.127
  Start of MODEL    4
    1   1H    MET   1          HT1       MET   1 -24.714  17.755   0.196
    2   2H    MET   1          HT2       MET   1 -24.661  17.011  -1.330
    3   3H    MET   1          HT3       MET   1 -23.241  17.634  -0.635
    4    HA   MET   1           HA       MET   1 -24.704  15.606   0.877
    5   1HB   MET   1          HB2       MET   1 -23.054  15.072  -1.611
    6   2HB   MET   1          HB1       MET   1 -23.434  13.838  -0.409
    7   1HG   MET   1          HG2       MET   1 -25.847  14.234  -0.764
    8   2HG   MET   1          HG1       MET   1 -25.465  15.452  -1.979
    9   1HE   MET   1          HE1       MET   1 -22.895  13.963  -3.664
   10   2HE   MET   1          HE2       MET   1 -24.146  15.185  -3.884
   11   3HE   MET   1          HE3       MET   1 -24.111  13.770  -4.933
   12    H    LEU   2           HN       LEU   2 -22.380  13.951   1.034
   13    HA   LEU   2           HA       LEU   2 -20.797  15.530   2.902
   14   1HB   LEU   2          HB2       LEU   2 -20.373  12.721   1.836
   15   2HB   LEU   2          HB1       LEU   2 -19.536  13.426   3.217
   16    HG   LEU   2           HG       LEU   2 -22.547  13.111   3.036
   17   1HD1  LEU   2          HD11      LEU   2 -20.515  11.423   4.518
   18   2HD1  LEU   2          HD12      LEU   2 -21.373  10.927   3.061
   19   3HD1  LEU   2          HD13      LEU   2 -22.264  11.207   4.558
   20   1HD2  LEU   2          HD21      LEU   2 -22.182  13.348   5.618
   21   2HD2  LEU   2          HD22      LEU   2 -22.130  14.801   4.627
   22   3HD2  LEU   2          HD23      LEU   2 -20.629  14.053   5.171
   23    H    VAL   3           HN       VAL   3 -18.448  15.807   2.700
   24    HA   VAL   3           HA       VAL   3 -17.613  16.211  -0.150
   25    HB   VAL   3           HB       VAL   3 -16.025  17.859   0.757
   26   1HG1  VAL   3          HG11      VAL   3 -18.178  18.743   0.155
   27   2HG1  VAL   3          HG12      VAL   3 -17.743  19.470   1.701
   28   3HG1  VAL   3          HG13      VAL   3 -18.906  18.145   1.647
   29   1HG2  VAL   3          HG21      VAL   3 -16.344  18.467   3.223
   30   2HG2  VAL   3          HG22      VAL   3 -15.499  16.952   2.904
   31   3HG2  VAL   3          HG23      VAL   3 -17.194  16.931   3.389
   32    H    LYS   4           HN       LYS   4 -15.616  15.404  -0.843
   33    HA   LYS   4           HA       LYS   4 -14.619  13.075   0.532
   34   1HB   LYS   4          HB2       LYS   4 -12.910  13.038  -1.262
   35   2HB   LYS   4          HB1       LYS   4 -14.524  13.293  -1.919
   36   1HG   LYS   4          HG2       LYS   4 -14.054  15.777  -1.871
   37   2HG   LYS   4          HG1       LYS   4 -12.383  15.384  -1.460
   38   1HD   LYS   4          HD2       LYS   4 -12.055  14.215  -3.529
   39   2HD   LYS   4          HD1       LYS   4 -13.779  14.253  -3.899
   40   1HE   LYS   4          HE2       LYS   4 -12.684  15.964  -5.218
   41   2HE   LYS   4          HE1       LYS   4 -13.648  16.758  -3.973
   42   1HZ   LYS   4          HZ1       LYS   4 -11.824  17.490  -2.900
   43   2HZ   LYS   4          HZ2       LYS   4 -11.097  17.322  -4.427
   44   3HZ   LYS   4          HZ3       LYS   4 -10.909  16.106  -3.254
   45    HA   PRO   5           HA       PRO   5 -11.680  15.144   3.149
   46   1HB   PRO   5          HB2       PRO   5  -9.941  13.168   3.727
   47   2HB   PRO   5          HB1       PRO   5 -11.626  13.113   4.282
   48   1HG   PRO   5          HG2       PRO   5 -10.385  11.778   1.910
   49   2HG   PRO   5          HG1       PRO   5 -11.468  11.095   3.138
   50   1HD   PRO   5          HD2       PRO   5 -12.374  11.931   0.702
   51   2HD   PRO   5          HD1       PRO   5 -13.371  12.022   2.171
   52    HA   PRO   6           HA       PRO   6  -8.273  16.558   0.678
   53   1HB   PRO   6          HB2       PRO   6  -6.490  17.388   2.557
   54   2HB   PRO   6          HB1       PRO   6  -8.040  18.211   2.294
   55   1HG   PRO   6          HG2       PRO   6  -7.318  16.183   4.372
   56   2HG   PRO   6          HG1       PRO   6  -8.188  17.719   4.561
   57   1HD   PRO   6          HD2       PRO   6  -9.494  15.338   4.403
   58   2HD   PRO   6          HD1       PRO   6 -10.191  16.839   3.754
   59    H    TYR   7           HN       TYR   7  -8.195  13.585   1.420
   60    HA   TYR   7           HA       TYR   7  -5.217  13.192   1.404
   61   1HB   TYR   7          HB2       TYR   7  -7.361  11.126   1.965
   62   2HB   TYR   7          HB1       TYR   7  -5.625  10.944   2.192
   63    HD1  TYR   7           HD1      TYR   7  -4.622  13.118   3.632
   64    HD2  TYR   7           HD2      TYR   7  -8.535  11.372   3.958
   65    HE1  TYR   7           HE1      TYR   7  -4.837  14.022   5.929
   66    HE2  TYR   7           HE2      TYR   7  -8.755  12.290   6.246
   67    HH   TYR   7           HH       TYR   7  -7.223  14.630   7.449
   68    H    SER   8           HN       SER   8  -4.307  12.321  -0.402
   69    HA   SER   8           HA       SER   8  -5.998  11.931  -2.758
   70   1HB   SER   8          HB2       SER   8  -3.885  11.563  -3.943
   71   2HB   SER   8          HB1       SER   8  -3.749  12.988  -2.915
   72    HG   SER   8           HG       SER   8  -2.090  11.982  -2.113
   73    H    TYR   9           HN       TYR   9  -5.418   9.855  -4.120
   74    HA   TYR   9           HA       TYR   9  -6.405   7.588  -2.712
   75   1HB   TYR   9          HB2       TYR   9  -4.826   7.715  -5.297
   76   2HB   TYR   9          HB1       TYR   9  -5.711   6.302  -4.723
   77    HD1  TYR   9           HD1      TYR   9  -5.960   9.578  -6.292
   78    HD2  TYR   9           HD2      TYR   9  -8.199   6.409  -4.450
   79    HE1  TYR   9           HE1      TYR   9  -8.053  10.495  -7.258
   80    HE2  TYR   9           HE2      TYR   9 -10.294   7.325  -5.415
   81    HH   TYR   9           HH       TYR   9 -10.567  10.385  -6.638
   82    H    ILE  10           HN       ILE  10  -3.083   8.630  -3.395
   83    HA   ILE  10           HA       ILE  10  -1.834   6.188  -2.510
   84    HB   ILE  10           HB       ILE  10  -0.728   9.015  -2.538
   85   1HG1  ILE  10          HG12      ILE  10  -1.498   8.401  -4.760
   86   2HG1  ILE  10          HG11      ILE  10   0.260   8.315  -4.728
   87   1HG2  ILE  10          HG21      ILE  10   0.650   6.313  -2.490
   88   2HG2  ILE  10          HG22      ILE  10   0.635   7.495  -1.182
   89   3HG2  ILE  10          HG23      ILE  10   1.468   7.861  -2.690
   90   1HD1  ILE  10          HD11      ILE  10  -0.171   5.778  -4.119
   91   2HD1  ILE  10          HD12      ILE  10  -0.277   6.317  -5.793
   92   3HD1  ILE  10          HD13      ILE  10  -1.747   6.087  -4.849
   93    H    ALA  11           HN       ALA  11  -2.673   9.214  -0.820
   94    HA   ALA  11           HA       ALA  11  -1.377   8.479   1.646
   95   1HB   ALA  11          HB1       ALA  11  -1.900  10.808   1.188
   96   2HB   ALA  11          HB2       ALA  11  -2.782  10.304   2.629
   97   3HB   ALA  11          HB3       ALA  11  -3.621  10.440   1.084
   98    H    LEU  12           HN       LEU  12  -4.724   8.089   0.487
   99    HA   LEU  12           HA       LEU  12  -5.821   7.153   2.944
  100   1HB   LEU  12          HB2       LEU  12  -6.533   6.484   0.073
  101   2HB   LEU  12          HB1       LEU  12  -7.508   5.997   1.457
  102    HG   LEU  12           HG       LEU  12  -6.758   8.878   0.887
  103   1HD1  LEU  12          HD11      LEU  12  -9.342   7.442   0.212
  104   2HD1  LEU  12          HD12      LEU  12  -8.104   7.886  -0.963
  105   3HD1  LEU  12          HD13      LEU  12  -8.977   9.142  -0.087
  106   1HD2  LEU  12          HD21      LEU  12  -7.432   8.764   3.139
  107   2HD2  LEU  12          HD22      LEU  12  -8.603   7.482   2.830
  108   3HD2  LEU  12          HD23      LEU  12  -8.945   9.132   2.320
  109    H    ILE  13           HN       ILE  13  -4.134   5.479   0.329
  110    HA   ILE  13           HA       ILE  13  -4.435   2.818   1.392
  111    HB   ILE  13           HB       ILE  13  -2.308   4.017  -0.403
  112   1HG1  ILE  13          HG12      ILE  13  -4.720   2.352  -1.165
  113   2HG1  ILE  13          HG11      ILE  13  -4.762   4.110  -1.137
  114   1HG2  ILE  13          HG21      ILE  13  -1.425   1.967   0.409
  115   2HG2  ILE  13          HG22      ILE  13  -2.133   1.564  -1.155
  116   3HG2  ILE  13          HG23      ILE  13  -2.996   1.168   0.332
  117   1HD1  ILE  13          HD11      ILE  13  -4.196   3.720  -3.359
  118   2HD1  ILE  13          HD12      ILE  13  -3.262   2.275  -2.979
  119   3HD1  ILE  13          HD13      ILE  13  -2.591   3.872  -2.654
  120    H    THR  14           HN       THR  14  -1.964   5.339   1.737
  121    HA   THR  14           HA       THR  14  -0.093   3.777   3.233
  122    HB   THR  14           HB       THR  14  -0.555   6.766   3.233
  123    HG1  THR  14           HG1      THR  14   0.470   5.018   1.444
  124   1HG2  THR  14          HG21      THR  14   1.925   6.738   3.862
  125   2HG2  THR  14          HG22      THR  14   1.702   5.031   4.239
  126   3HG2  THR  14          HG23      THR  14   0.794   6.255   5.126
  127    H    MET  15           HN       MET  15  -2.783   5.865   4.253
  128    HA   MET  15           HA       MET  15  -2.195   5.648   7.069
  129   1HB   MET  15          HB2       MET  15  -4.710   6.397   5.566
  130   2HB   MET  15          HB1       MET  15  -4.590   6.446   7.325
  131   1HG   MET  15          HG2       MET  15  -2.585   7.955   7.066
  132   2HG   MET  15          HG1       MET  15  -2.925   8.018   5.338
  133   1HE   MET  15          HE1       MET  15  -4.800   8.913   4.239
  134   2HE   MET  15          HE2       MET  15  -6.095   9.913   4.893
  135   3HE   MET  15          HE3       MET  15  -6.145   8.166   5.112
  136    H    ALA  16           HN       ALA  16  -4.308   3.857   4.864
  137    HA   ALA  16           HA       ALA  16  -5.655   2.258   6.777
  138   1HB   ALA  16          HB1       ALA  16  -4.772   1.669   3.941
  139   2HB   ALA  16          HB2       ALA  16  -6.358   2.230   4.471
  140   3HB   ALA  16          HB3       ALA  16  -5.821   0.597   4.870
  141    H    ILE  17           HN       ILE  17  -2.591   1.623   5.047
  142    HA   ILE  17           HA       ILE  17  -2.020  -0.888   6.267
  143    HB   ILE  17           HB       ILE  17  -0.092   1.267   5.335
  144   1HG1  ILE  17          HG12      ILE  17  -1.096  -1.159   3.829
  145   2HG1  ILE  17          HG11      ILE  17  -1.853   0.428   3.695
  146   1HG2  ILE  17          HG21      ILE  17   1.428  -0.703   4.992
  147   2HG2  ILE  17          HG22      ILE  17   0.239  -1.710   5.820
  148   3HG2  ILE  17          HG23      ILE  17   1.046  -0.403   6.688
  149   1HD1  ILE  17          HD11      ILE  17   0.247   1.407   2.918
  150   2HD1  ILE  17          HD12      ILE  17  -0.173   0.029   1.898
  151   3HD1  ILE  17          HD13      ILE  17   1.071  -0.138   3.136
  152    H    GLN  18           HN       GLN  18  -0.973   2.396   7.146
  153    HA   GLN  18           HA       GLN  18   0.445   1.684   9.515
  154   1HB   GLN  18          HB2       GLN  18  -0.964   4.235   8.698
  155   2HB   GLN  18          HB1       GLN  18  -0.041   4.096  10.194
  156   1HG   GLN  18          HG2       GLN  18   1.108   3.448   7.467
  157   2HG   GLN  18          HG1       GLN  18   1.265   5.027   8.238
  158   1HE2  GLN  18          HE21      GLN  18   3.086   2.381   7.744
  159   2HE2  GLN  18          HE22      GLN  18   3.955   2.315   9.200
  160    H    ASN  19           HN       ASN  19  -2.971   2.502   9.007
  161    HA   ASN  19           HA       ASN  19  -3.655   2.463  11.808
  162   1HB   ASN  19          HB2       ASN  19  -5.328   2.156   9.299
  163   2HB   ASN  19          HB1       ASN  19  -6.012   2.252  10.922
  164   1HD2  ASN  19          HD21      ASN  19  -3.290   4.108  11.122
  165   2HD2  ASN  19          HD22      ASN  19  -3.938   5.625  10.717
  166    H    ALA  20           HN       ALA  20  -3.022  -0.008   9.506
  167    HA   ALA  20           HA       ALA  20  -4.660  -2.051  10.774
  168   1HB   ALA  20          HB1       ALA  20  -2.277  -2.575   8.984
  169   2HB   ALA  20          HB2       ALA  20  -3.805  -1.981   8.332
  170   3HB   ALA  20          HB3       ALA  20  -3.748  -3.534   9.163
  171    HA   PRO  21           HA       PRO  21  -1.757  -3.111  14.004
  172   1HB   PRO  21          HB2       PRO  21  -2.311  -5.793  14.320
  173   2HB   PRO  21          HB1       PRO  21  -3.364  -4.505  14.933
  174   1HG   PRO  21          HG2       PRO  21  -3.625  -6.126  12.438
  175   2HG   PRO  21          HG1       PRO  21  -4.874  -5.628  13.593
  176   1HD   PRO  21          HD2       PRO  21  -4.515  -4.343  11.225
  177   2HD   PRO  21          HD1       PRO  21  -5.049  -3.486  12.689
  178    H    GLU  22           HN       GLU  22  -2.024  -5.597  11.460
  179    HA   GLU  22           HA       GLU  22   0.938  -5.972  11.504
  180   1HB   GLU  22          HB2       GLU  22  -1.314  -7.552  10.214
  181   2HB   GLU  22          HB1       GLU  22   0.396  -7.917   9.986
  182   1HG   GLU  22          HG2       GLU  22   0.659  -8.242  12.415
  183   2HG   GLU  22          HG1       GLU  22  -1.049  -7.867  12.653
  184    H    LYS  23           HN       LYS  23   2.144  -5.352   9.678
  185    HA   LYS  23           HA       LYS  23   0.977  -3.377   7.942
  186   1HB   LYS  23          HB2       LYS  23   3.562  -4.914   7.531
  187   2HB   LYS  23          HB1       LYS  23   3.132  -3.369   6.802
  188   1HG   LYS  23          HG2       LYS  23   3.419  -3.842   9.784
  189   2HG   LYS  23          HG1       LYS  23   4.659  -3.122   8.759
  190   1HD   LYS  23          HD2       LYS  23   2.832  -1.416   8.081
  191   2HD   LYS  23          HD1       LYS  23   1.950  -2.004   9.492
  192   1HE   LYS  23          HE2       LYS  23   4.089  -1.568  10.829
  193   2HE   LYS  23          HE1       LYS  23   4.654  -0.661   9.425
  194   1HZ   LYS  23          HZ1       LYS  23   3.604   1.002  10.511
  195   2HZ   LYS  23          HZ2       LYS  23   2.521  -0.034  11.311
  196   3HZ   LYS  23          HZ3       LYS  23   2.254   0.389   9.688
  197    H    LYS  24           HN       LYS  24   1.378  -6.851   7.667
  198    HA   LYS  24           HA       LYS  24   0.899  -6.870   4.784
  199   1HB   LYS  24          HB2       LYS  24   0.758  -9.109   6.830
  200   2HB   LYS  24          HB1       LYS  24   0.728  -9.325   5.079
  201   1HG   LYS  24          HG2       LYS  24   2.947  -8.264   4.905
  202   2HG   LYS  24          HG1       LYS  24   2.983  -8.050   6.655
  203   1HD   LYS  24          HD2       LYS  24   2.845 -10.494   6.960
  204   2HD   LYS  24          HD1       LYS  24   2.811 -10.710   5.210
  205   1HE   LYS  24          HE2       LYS  24   5.089 -11.048   5.903
  206   2HE   LYS  24          HE1       LYS  24   5.023  -9.468   5.122
  207   1HZ   LYS  24          HZ1       LYS  24   6.179  -9.063   7.069
  208   2HZ   LYS  24          HZ2       LYS  24   5.203 -10.099   7.998
  209   3HZ   LYS  24          HZ3       LYS  24   4.599  -8.600   7.476
  210    H    ILE  25           HN       ILE  25  -1.060  -6.382   3.983
  211    HA   ILE  25           HA       ILE  25  -3.500  -7.426   5.354
  212    HB   ILE  25           HB       ILE  25  -3.246  -5.057   5.988
  213   1HG1  ILE  25          HG12      ILE  25  -5.384  -5.274   3.857
  214   2HG1  ILE  25          HG11      ILE  25  -5.507  -6.109   5.406
  215   1HG2  ILE  25          HG21      ILE  25  -3.248  -3.309   4.279
  216   2HG2  ILE  25          HG22      ILE  25  -3.309  -4.523   3.002
  217   3HG2  ILE  25          HG23      ILE  25  -1.876  -4.387   4.022
  218   1HD1  ILE  25          HD11      ILE  25  -5.302  -3.958   6.592
  219   2HD1  ILE  25          HD12      ILE  25  -6.667  -3.927   5.476
  220   3HD1  ILE  25          HD13      ILE  25  -5.160  -3.115   5.050
  221    H    THR  26           HN       THR  26  -5.291  -7.741   3.896
  222    HA   THR  26           HA       THR  26  -4.433  -8.458   1.195
  223    HB   THR  26           HB       THR  26  -6.841  -9.164   0.955
  224    HG1  THR  26           HG1      THR  26  -7.091  -7.545   3.010
  225   1HG2  THR  26          HG21      THR  26  -6.682 -10.930   2.782
  226   2HG2  THR  26          HG22      THR  26  -5.213 -10.116   3.319
  227   3HG2  THR  26          HG23      THR  26  -5.289 -10.824   1.706
  228    H    LEU  27           HN       LEU  27  -5.372  -7.593  -0.746
  229    HA   LEU  27           HA       LEU  27  -5.583  -4.764  -0.816
  230   1HB   LEU  27          HB2       LEU  27  -4.950  -6.081  -2.778
  231   2HB   LEU  27          HB1       LEU  27  -6.527  -6.857  -2.804
  232    HG   LEU  27           HG       LEU  27  -7.617  -4.838  -3.476
  233   1HD1  LEU  27          HD11      LEU  27  -6.211  -2.708  -3.735
  234   2HD1  LEU  27          HD12      LEU  27  -5.019  -3.500  -2.704
  235   3HD1  LEU  27          HD13      LEU  27  -6.639  -3.166  -2.090
  236   1HD2  LEU  27          HD21      LEU  27  -4.944  -4.999  -4.894
  237   2HD2  LEU  27          HD22      LEU  27  -6.403  -4.240  -5.533
  238   3HD2  LEU  27          HD23      LEU  27  -6.362  -5.982  -5.260
  239    H    ASN  28           HN       ASN  28  -8.103  -7.280  -0.846
  240    HA   ASN  28           HA       ASN  28 -10.353  -5.557  -1.094
  241   1HB   ASN  28          HB2       ASN  28 -10.038  -8.245   0.256
  242   2HB   ASN  28          HB1       ASN  28 -11.594  -7.438   0.055
  243   1HD2  ASN  28          HD21      ASN  28 -11.167  -6.311  -2.553
  244   2HD2  ASN  28          HD22      ASN  28 -11.059  -7.585  -3.670
  245    H    GLY  29           HN       GLY  29  -8.577  -6.639   1.791
  246   1HA   GLY  29          HA2       GLY  29 -10.352  -5.590   3.739
  247   2HA   GLY  29          HA1       GLY  29  -8.627  -5.839   3.993
  248    H    ILE  30           HN       ILE  30  -7.653  -3.995   2.035
  249    HA   ILE  30           HA       ILE  30  -7.675  -1.590   3.547
  250    HB   ILE  30           HB       ILE  30  -6.985  -2.036   0.629
  251   1HG1  ILE  30          HG12      ILE  30  -5.187  -1.727   3.049
  252   2HG1  ILE  30          HG11      ILE  30  -5.685  -3.293   2.411
  253   1HG2  ILE  30          HG21      ILE  30  -5.639   0.095   0.996
  254   2HG2  ILE  30          HG22      ILE  30  -6.566   0.325   2.478
  255   3HG2  ILE  30          HG23      ILE  30  -7.386   0.316   0.918
  256   1HD1  ILE  30          HD11      ILE  30  -3.485  -2.635   1.508
  257   2HD1  ILE  30          HD12      ILE  30  -4.194  -1.155   0.861
  258   3HD1  ILE  30          HD13      ILE  30  -4.692  -2.723   0.226
  259    H    TYR  31           HN       TYR  31  -9.561  -2.494   0.652
  260    HA   TYR  31           HA       TYR  31 -10.800   0.037   0.250
  261   1HB   TYR  31          HB2       TYR  31 -11.637  -2.800  -0.345
  262   2HB   TYR  31          HB1       TYR  31 -12.717  -1.456  -0.703
  263    HD1  TYR  31           HD1      TYR  31 -11.535   0.604  -1.939
  264    HD2  TYR  31           HD2      TYR  31 -10.127  -3.455  -2.009
  265    HE1  TYR  31           HE1      TYR  31 -10.266   1.073  -4.011
  266    HE2  TYR  31           HE2      TYR  31  -8.863  -2.978  -4.083
  267    HH   TYR  31           HH       TYR  31  -7.861  -0.903  -5.166
  268    H    GLN  32           HN       GLN  32 -11.778  -2.700   2.295
  269    HA   GLN  32           HA       GLN  32 -14.283  -1.657   3.120
  270   1HB   GLN  32          HB2       GLN  32 -12.299  -3.477   4.493
  271   2HB   GLN  32          HB1       GLN  32 -13.905  -3.147   5.142
  272   1HG   GLN  32          HG2       GLN  32 -13.419  -4.202   2.344
  273   2HG   GLN  32          HG1       GLN  32 -13.751  -5.243   3.729
  274   1HE2  GLN  32          HE21      GLN  32 -15.899  -5.072   4.742
  275   2HE2  GLN  32          HE22      GLN  32 -17.200  -4.378   3.902
  276    H    PHE  33           HN       PHE  33 -11.025  -1.166   4.464
  277    HA   PHE  33           HA       PHE  33 -11.813   0.290   6.778
  278   1HB   PHE  33          HB2       PHE  33  -9.525  -0.565   6.437
  279   2HB   PHE  33          HB1       PHE  33  -9.290   0.588   5.124
  280    HD1  PHE  33           HD1      PHE  33  -9.638   0.176   8.764
  281    HD2  PHE  33           HD2      PHE  33  -9.063   2.986   5.568
  282    HE1  PHE  33           HE1      PHE  33  -8.976   1.909  10.409
  283    HE2  PHE  33           HE2      PHE  33  -8.401   4.720   7.214
  284    HZ   PHE  33           HZ       PHE  33  -8.357   4.181   9.635
  285    H    ILE  34           HN       ILE  34 -11.011   1.447   3.491
  286    HA   ILE  34           HA       ILE  34 -11.218   4.227   4.031
  287    HB   ILE  34           HB       ILE  34 -11.758   2.633   1.516
  288   1HG1  ILE  34          HG12      ILE  34  -9.428   4.418   2.263
  289   2HG1  ILE  34          HG11      ILE  34  -9.444   2.681   2.568
  290   1HG2  ILE  34          HG21      ILE  34 -12.947   4.684   1.187
  291   2HG2  ILE  34          HG22      ILE  34 -11.390   4.904   0.390
  292   3HG2  ILE  34          HG23      ILE  34 -11.678   5.624   1.972
  293   1HD1  ILE  34          HD11      ILE  34  -8.329   2.987   0.469
  294   2HD1  ILE  34          HD12      ILE  34  -9.583   4.085  -0.110
  295   3HD1  ILE  34          HD13      ILE  34  -9.936   2.368   0.090
  296    H    MET  35           HN       MET  35 -13.749   2.003   2.790
  297    HA   MET  35           HA       MET  35 -15.795   3.997   2.750
  298   1HB   MET  35          HB2       MET  35 -15.948   0.981   2.967
  299   2HB   MET  35          HB1       MET  35 -17.371   2.015   2.804
  300   1HG   MET  35          HG2       MET  35 -16.462   2.949   0.711
  301   2HG   MET  35          HG1       MET  35 -15.039   1.924   0.864
  302   1HE   MET  35          HE1       MET  35 -16.301  -1.044   1.799
  303   2HE   MET  35          HE2       MET  35 -14.925  -0.392   0.912
  304   3HE   MET  35          HE3       MET  35 -16.012  -1.530   0.123
  305    H    ASP  36           HN       ASP  36 -14.734   1.744   5.280
  306    HA   ASP  36           HA       ASP  36 -16.826   2.462   7.136
  307   1HB   ASP  36          HB2       ASP  36 -14.086   1.222   7.516
  308   2HB   ASP  36          HB1       ASP  36 -15.239   1.444   8.832
  309    H    ARG  37           HN       ARG  37 -13.499   3.643   6.608
  310    HA   ARG  37           HA       ARG  37 -13.579   5.447   8.867
  311   1HB   ARG  37          HB2       ARG  37 -11.453   4.618   7.849
  312   2HB   ARG  37          HB1       ARG  37 -11.808   5.557   6.404
  313   1HG   ARG  37          HG2       ARG  37 -10.348   6.945   7.631
  314   2HG   ARG  37          HG1       ARG  37 -11.937   7.601   8.001
  315   1HD   ARG  37          HD2       ARG  37 -11.982   6.423  10.133
  316   2HD   ARG  37          HD1       ARG  37 -10.473   5.597   9.744
  317    HE   ARG  37           HE       ARG  37  -9.789   8.260   9.583
  318   1HH1  ARG  37          HH21      ARG  37 -11.407   6.257  11.876
  319   2HH1  ARG  37          HH22      ARG  37 -10.855   7.155  13.252
  320   1HH2  ARG  37          HH11      ARG  37  -9.058   9.446  11.368
  321   2HH2  ARG  37          HH12      ARG  37  -9.530   8.962  12.964
  322    H    PHE  38           HN       PHE  38 -13.907   5.948   5.343
  323    HA   PHE  38           HA       PHE  38 -15.228   8.575   5.919
  324   1HB   PHE  38          HB2       PHE  38 -13.857   7.699   3.360
  325   2HB   PHE  38          HB1       PHE  38 -14.486   9.304   3.729
  326    HD1  PHE  38           HD1      PHE  38 -13.436  10.659   5.575
  327    HD2  PHE  38           HD2      PHE  38 -11.722   6.986   4.151
  328    HE1  PHE  38           HE1      PHE  38 -11.270  11.260   6.627
  329    HE2  PHE  38           HE2      PHE  38  -9.559   7.587   5.204
  330    HZ   PHE  38           HZ       PHE  38  -9.334   9.722   6.442
  331    HA   PRO  39           HA       PRO  39 -18.633   6.105   4.156
  332   1HB   PRO  39          HB2       PRO  39 -20.704   7.700   4.886
  333   2HB   PRO  39          HB1       PRO  39 -19.858   6.661   6.047
  334   1HG   PRO  39          HG2       PRO  39 -19.586   9.591   5.589
  335   2HG   PRO  39          HG1       PRO  39 -19.571   8.685   7.110
  336   1HD   PRO  39          HD2       PRO  39 -17.291   9.590   5.808
  337   2HD   PRO  39          HD1       PRO  39 -17.309   8.236   6.958
  338    H    PHE  40           HN       PHE  40 -17.427   9.069   3.202
  339    HA   PHE  40           HA       PHE  40 -19.366  10.032   1.348
  340   1HB   PHE  40          HB2       PHE  40 -17.563  11.488   1.801
  341   2HB   PHE  40          HB1       PHE  40 -16.361  10.226   1.559
  342    HD1  PHE  40           HD1      PHE  40 -15.213  10.126  -0.482
  343    HD2  PHE  40           HD2      PHE  40 -19.042  12.078  -0.308
  344    HE1  PHE  40           HE1      PHE  40 -14.973  10.817  -2.853
  345    HE2  PHE  40           HE2      PHE  40 -18.795  12.770  -2.677
  346    HZ   PHE  40           HZ       PHE  40 -16.762  12.138  -3.949
  347    H    TYR  41           HN       TYR  41 -16.818   7.593   1.062
  348    HA   TYR  41           HA       TYR  41 -17.189   7.116  -1.750
  349   1HB   TYR  41          HB2       TYR  41 -15.942   5.460   0.449
  350   2HB   TYR  41          HB1       TYR  41 -15.886   5.022  -1.262
  351    HD1  TYR  41           HD1      TYR  41 -14.785   7.428   1.276
  352    HD2  TYR  41           HD2      TYR  41 -14.618   6.360  -2.869
  353    HE1  TYR  41           HE1      TYR  41 -12.925   9.026   0.951
  354    HE2  TYR  41           HE2      TYR  41 -12.745   7.942  -3.215
  355    HH   TYR  41           HH       TYR  41 -11.346   9.743  -0.476
  356    H    ARG  42           HN       ARG  42 -18.965   6.012   1.056
  357    HA   ARG  42           HA       ARG  42 -19.969   3.572  -0.016
  358   1HB   ARG  42          HB2       ARG  42 -21.222   5.570   1.883
  359   2HB   ARG  42          HB1       ARG  42 -21.985   4.038   1.465
  360   1HG   ARG  42          HG2       ARG  42 -19.998   2.822   2.285
  361   2HG   ARG  42          HG1       ARG  42 -19.241   4.356   2.713
  362   1HD   ARG  42          HD2       ARG  42 -21.096   4.846   4.266
  363   2HD   ARG  42          HD1       ARG  42 -21.857   3.314   3.840
  364    HE   ARG  42           HE       ARG  42 -19.334   2.566   4.689
  365   1HH1  ARG  42          HH21      ARG  42 -21.914   4.489   5.925
  366   2HH1  ARG  42          HH22      ARG  42 -21.569   4.125   7.583
  367   1HH2  ARG  42          HH11      ARG  42 -18.869   2.078   6.846
  368   2HH2  ARG  42          HH12      ARG  42 -19.841   2.765   8.105
  369    H    GLU  43           HN       GLU  43 -21.076   6.934  -0.426
  370    HA   GLU  43           HA       GLU  43 -23.440   6.338  -1.897
  371   1HB   GLU  43          HB2       GLU  43 -21.590   8.727  -1.988
  372   2HB   GLU  43          HB1       GLU  43 -23.121   8.657  -2.859
  373   1HG   GLU  43          HG2       GLU  43 -22.885   8.218   0.129
  374   2HG   GLU  43          HG1       GLU  43 -23.255   9.783  -0.597
  375    H    ASN  44           HN       ASN  44 -20.143   6.892  -2.928
  376    HA   ASN  44           HA       ASN  44 -20.829   5.936  -5.687
  377   1HB   ASN  44          HB2       ASN  44 -19.784   8.207  -5.496
  378   2HB   ASN  44          HB1       ASN  44 -18.373   7.452  -4.752
  379   1HD2  ASN  44          HD21      ASN  44 -16.861   7.792  -6.466
  380   2HD2  ASN  44          HD22      ASN  44 -17.048   7.115  -8.012
  381    H    LYS  45           HN       LYS  45 -20.450   3.763  -5.765
  382    HA   LYS  45           HA       LYS  45 -18.115   2.641  -4.285
  383   1HB   LYS  45          HB2       LYS  45 -20.569   1.375  -5.514
  384   2HB   LYS  45          HB1       LYS  45 -19.230   0.446  -4.839
  385   1HG   LYS  45          HG2       LYS  45 -19.542   1.571  -2.664
  386   2HG   LYS  45          HG1       LYS  45 -20.883   2.498  -3.336
  387   1HD   LYS  45          HD2       LYS  45 -22.104   0.402  -3.796
  388   2HD   LYS  45          HD1       LYS  45 -20.765  -0.524  -3.118
  389   1HE   LYS  45          HE2       LYS  45 -21.070   0.647  -0.952
  390   2HE   LYS  45          HE1       LYS  45 -22.448   1.513  -1.632
  391   1HZ   LYS  45          HZ1       LYS  45 -23.241  -0.882  -2.203
  392   2HZ   LYS  45          HZ2       LYS  45 -23.474  -0.255  -0.641
  393   3HZ   LYS  45          HZ3       LYS  45 -22.193  -1.329  -0.946
  394    H    GLN  46           HN       GLN  46 -19.541   2.821  -7.529
  395    HA   GLN  46           HA       GLN  46 -17.305   1.269  -8.668
  396   1HB   GLN  46          HB2       GLN  46 -19.735   2.599  -9.887
  397   2HB   GLN  46          HB1       GLN  46 -18.520   1.733 -10.829
  398   1HG   GLN  46          HG2       GLN  46 -19.973   0.482  -8.489
  399   2HG   GLN  46          HG1       GLN  46 -20.552   0.356 -10.150
  400   1HE2  GLN  46          HE21      GLN  46 -18.247  -0.072 -11.616
  401   2HE2  GLN  46          HE22      GLN  46 -17.461  -1.483 -11.097
  402    H    GLY  47           HN       GLY  47 -15.631   2.129  -9.828
  403   1HA   GLY  47          HA2       GLY  47 -14.686   3.894 -11.256
  404   2HA   GLY  47          HA1       GLY  47 -15.588   5.082 -10.319
  405    H    TRP  48           HN       TRP  48 -15.005   4.965  -7.852
  406    HA   TRP  48           HA       TRP  48 -12.177   5.509  -7.663
  407   1HB   TRP  48          HB2       TRP  48 -12.615   6.231  -5.474
  408   2HB   TRP  48          HB1       TRP  48 -14.119   6.555  -6.326
  409    HD1  TRP  48           HD1      TRP  48 -16.235   5.100  -5.707
  410    HE1  TRP  48           HE1      TRP  48 -16.752   3.566  -3.706
  411    HE3  TRP  48           HE3      TRP  48 -11.531   4.483  -3.818
  412    HZ2  TRP  48           HZ2      TRP  48 -15.366   2.236  -1.593
  413    HZ3  TRP  48           HZ3      TRP  48 -11.158   3.074  -1.817
  414    HH2  TRP  48           HH2      TRP  48 -13.064   1.951  -0.701
  415    H    GLN  49           HN       GLN  49 -14.203   2.785  -6.644
  416    HA   GLN  49           HA       GLN  49 -12.286   1.439  -5.050
  417   1HB   GLN  49          HB2       GLN  49 -14.664   0.808  -5.131
  418   2HB   GLN  49          HB1       GLN  49 -14.467   0.261  -6.795
  419   1HG   GLN  49          HG2       GLN  49 -12.845  -1.445  -6.053
  420   2HG   GLN  49          HG1       GLN  49 -13.019  -0.886  -4.389
  421   1HE2  GLN  49          HE21      GLN  49 -13.669  -3.567  -5.038
  422   2HE2  GLN  49          HE22      GLN  49 -15.348  -3.776  -4.913
  423    H    ASN  50           HN       ASN  50 -12.958   0.973  -8.554
  424    HA   ASN  50           HA       ASN  50 -10.784  -0.934  -8.831
  425   1HB   ASN  50          HB2       ASN  50 -12.254   0.656 -10.955
  426   2HB   ASN  50          HB1       ASN  50 -11.201  -0.726 -11.253
  427   1HD2  ASN  50          HD21      ASN  50 -14.301  -0.208 -11.478
  428   2HD2  ASN  50          HD22      ASN  50 -14.963  -1.588 -10.745
  429    H    SER  51           HN       SER  51 -11.021   2.548  -9.044
  430    HA   SER  51           HA       SER  51  -8.758   3.082 -10.674
  431   1HB   SER  51          HB2       SER  51 -10.389   4.810  -9.934
  432   2HB   SER  51          HB1       SER  51  -9.744   4.687  -8.300
  433    HG   SER  51           HG       SER  51  -8.374   5.481 -10.656
  434    H    ILE  52           HN       ILE  52  -8.975   2.523  -7.167
  435    HA   ILE  52           HA       ILE  52  -6.216   3.077  -6.650
  436    HB   ILE  52           HB       ILE  52  -8.304   1.497  -5.164
  437   1HG1  ILE  52          HG12      ILE  52  -7.024   4.207  -4.763
  438   2HG1  ILE  52          HG11      ILE  52  -8.663   3.891  -5.321
  439   1HG2  ILE  52          HG21      ILE  52  -5.438   2.065  -4.394
  440   2HG2  ILE  52          HG22      ILE  52  -6.231   0.496  -4.497
  441   3HG2  ILE  52          HG23      ILE  52  -6.675   1.617  -3.220
  442   1HD1  ILE  52          HD11      ILE  52  -8.796   2.544  -3.017
  443   2HD1  ILE  52          HD12      ILE  52  -9.098   4.278  -3.096
  444   3HD1  ILE  52          HD13      ILE  52  -7.524   3.679  -2.575
  445    H    ARG  53           HN       ARG  53  -7.881  -0.002  -7.467
  446    HA   ARG  53           HA       ARG  53  -5.596  -1.676  -7.060
  447   1HB   ARG  53          HB2       ARG  53  -7.675  -2.058  -9.246
  448   2HB   ARG  53          HB1       ARG  53  -6.708  -3.305  -8.455
  449   1HG   ARG  53          HG2       ARG  53  -7.821  -2.504  -6.266
  450   2HG   ARG  53          HG1       ARG  53  -8.986  -1.698  -7.322
  451   1HD   ARG  53          HD2       ARG  53  -8.475  -4.641  -6.975
  452   2HD   ARG  53          HD1       ARG  53  -9.999  -3.762  -6.908
  453    HE   ARG  53           HE       ARG  53  -9.051  -3.413  -9.524
  454   1HH1  ARG  53          HH21      ARG  53  -9.903  -5.975  -7.385
  455   2HH1  ARG  53          HH22      ARG  53 -10.332  -7.075  -8.653
  456   1HH2  ARG  53          HH11      ARG  53  -9.593  -4.837 -11.199
  457   2HH2  ARG  53          HH12      ARG  53 -10.155  -6.429 -10.814
  458    H    HIS  54           HN       HIS  54  -6.702   0.141  -9.920
  459    HA   HIS  54           HA       HIS  54  -4.645  -0.699 -11.705
  460   1HB   HIS  54          HB2       HIS  54  -6.651   0.558 -12.438
  461   2HB   HIS  54          HB1       HIS  54  -6.070   1.980 -11.574
  462    HD1  HIS  54           HD1      HIS  54  -4.429  -0.438 -14.049
  463    HD2  HIS  54           HD2      HIS  54  -4.883   3.655 -13.402
  464    HE1  HIS  54           HE1      HIS  54  -3.173   0.726 -15.914
  465    H    ASN  55           HN       ASN  55  -4.788   1.922  -9.322
  466    HA   ASN  55           HA       ASN  55  -2.226   3.065  -9.974
  467   1HB   ASN  55          HB2       ASN  55  -3.919   3.151  -7.461
  468   2HB   ASN  55          HB1       ASN  55  -2.422   4.064  -7.651
  469   1HD2  ASN  55          HD21      ASN  55  -5.093   5.249  -7.348
  470   2HD2  ASN  55          HD22      ASN  55  -5.408   6.121  -8.770
  471    H    LEU  56           HN       LEU  56  -3.254   0.593  -7.618
  472    HA   LEU  56           HA       LEU  56  -0.767   0.345  -6.270
  473   1HB   LEU  56          HB2       LEU  56  -2.938  -1.688  -6.788
  474   2HB   LEU  56          HB1       LEU  56  -1.551  -2.001  -5.748
  475    HG   LEU  56           HG       LEU  56  -3.476   0.310  -5.367
  476   1HD1  LEU  56          HD11      LEU  56  -4.418  -2.052  -5.044
  477   2HD1  LEU  56          HD12      LEU  56  -4.560  -0.955  -3.670
  478   3HD1  LEU  56          HD13      LEU  56  -3.303  -2.192  -3.685
  479   1HD2  LEU  56          HD21      LEU  56  -1.005  -0.630  -3.949
  480   2HD2  LEU  56          HD22      LEU  56  -2.319   0.006  -2.963
  481   3HD2  LEU  56          HD23      LEU  56  -1.598   1.008  -4.214
  482    H    SER  57           HN       SER  57  -1.964  -1.234  -9.216
  483    HA   SER  57           HA       SER  57   0.243  -3.027  -9.540
  484   1HB   SER  57          HB2       SER  57  -1.840  -3.329 -10.781
  485   2HB   SER  57          HB1       SER  57  -1.600  -1.793 -11.608
  486    HG   SER  57           HG       SER  57  -0.127  -4.194 -11.822
  487    H    LEU  58           HN       LEU  58  -0.363   0.186 -10.999
  488    HA   LEU  58           HA       LEU  58   2.181   0.259 -12.352
  489   1HB   LEU  58          HB2       LEU  58   0.210   2.425 -11.599
  490   2HB   LEU  58          HB1       LEU  58   1.661   2.731 -12.550
  491    HG   LEU  58           HG       LEU  58  -0.413   0.660 -13.313
  492   1HD1  LEU  58          HD11      LEU  58  -1.313   2.310 -14.881
  493   2HD1  LEU  58          HD12      LEU  58  -0.136   3.504 -14.332
  494   3HD1  LEU  58          HD13      LEU  58  -1.400   2.943 -13.236
  495   1HD2  LEU  58          HD21      LEU  58   2.036   1.828 -14.629
  496   2HD2  LEU  58          HD22      LEU  58   0.704   1.259 -15.631
  497   3HD2  LEU  58          HD23      LEU  58   1.514   0.147 -14.538
  498    H    ASN  59           HN       ASN  59   1.092   1.272  -9.158
  499    HA   ASN  59           HA       ASN  59   3.495   2.796  -8.560
  500   1HB   ASN  59          HB2       ASN  59   1.295   1.641  -6.829
  501   2HB   ASN  59          HB1       ASN  59   2.634   2.584  -6.175
  502   1HD2  ASN  59          HD21      ASN  59  -0.354   3.237  -6.420
  503   2HD2  ASN  59          HD22      ASN  59  -0.392   4.733  -7.221
  504    H    GLU  60           HN       GLU  60   5.434   1.785  -8.435
  505    HA   GLU  60           HA       GLU  60   5.595  -1.034  -7.548
  506   1HB   GLU  60          HB2       GLU  60   7.643   0.910  -8.648
  507   2HB   GLU  60          HB1       GLU  60   8.040  -0.725  -8.119
  508   1HG   GLU  60          HG2       GLU  60   6.394  -1.636  -9.735
  509   2HG   GLU  60          HG1       GLU  60   6.043   0.005 -10.283
  510    H    CYS  61           HN       CYS  61   5.480   1.892  -6.013
  511    HA   CYS  61           HA       CYS  61   7.675   1.649  -4.155
  512   1HB   CYS  61          HB2       CYS  61   6.633   3.435  -2.951
  513   2HB   CYS  61          HB1       CYS  61   6.314   3.749  -4.656
  514    HG   CYS  61           HG       CYS  61   4.025   3.964  -3.443
  515    H    PHE  62           HN       PHE  62   4.568   0.143  -4.390
  516    HA   PHE  62           HA       PHE  62   4.509  -0.661  -1.554
  517   1HB   PHE  62          HB2       PHE  62   2.732  -1.381  -3.904
  518   2HB   PHE  62          HB1       PHE  62   2.463  -1.910  -2.244
  519    HD1  PHE  62           HD1      PHE  62   2.137  -0.175  -0.430
  520    HD2  PHE  62           HD2      PHE  62   2.087   0.805  -4.613
  521    HE1  PHE  62           HE1      PHE  62   1.008   1.970   0.087
  522    HE2  PHE  62           HE2      PHE  62   0.957   2.951  -4.095
  523    HZ   PHE  62           HZ       PHE  62   0.418   3.534  -1.746
  524    H    VAL  63           HN       VAL  63   4.645  -2.890  -0.880
  525    HA   VAL  63           HA       VAL  63   6.207  -4.635  -2.765
  526    HB   VAL  63           HB       VAL  63   6.200  -4.628   0.266
  527   1HG1  VAL  63          HG11      VAL  63   6.694  -6.822  -0.562
  528   2HG1  VAL  63          HG12      VAL  63   8.236  -6.090  -0.120
  529   3HG1  VAL  63          HG13      VAL  63   7.756  -6.179  -1.815
  530   1HG2  VAL  63          HG21      VAL  63   7.411  -2.698  -0.193
  531   2HG2  VAL  63          HG22      VAL  63   7.932  -3.266  -1.780
  532   3HG2  VAL  63          HG23      VAL  63   8.701  -3.892  -0.323
  533    H    LYS  64           HN       LYS  64   5.152  -6.457  -3.395
  534    HA   LYS  64           HA       LYS  64   2.608  -7.195  -2.138
  535   1HB   LYS  64          HB2       LYS  64   4.217  -8.607  -4.292
  536   2HB   LYS  64          HB1       LYS  64   2.560  -8.988  -3.830
  537   1HG   LYS  64          HG2       LYS  64   1.841  -6.735  -4.504
  538   2HG   LYS  64          HG1       LYS  64   3.498  -6.343  -4.972
  539   1HD   LYS  64          HD2       LYS  64   3.481  -8.189  -6.604
  540   2HD   LYS  64          HD1       LYS  64   1.828  -8.590  -6.144
  541   1HE   LYS  64          HE2       LYS  64   0.939  -6.763  -7.245
  542   2HE   LYS  64          HE1       LYS  64   2.376  -5.770  -6.996
  543   1HZ   LYS  64          HZ1       LYS  64   1.688  -7.348  -9.221
  544   2HZ   LYS  64          HZ2       LYS  64   3.133  -7.940  -8.553
  545   3HZ   LYS  64          HZ3       LYS  64   3.017  -6.312  -9.026
  546    H    VAL  65           HN       VAL  65   2.264  -9.426  -1.264
  547    HA   VAL  65           HA       VAL  65   4.749 -10.777  -0.303
  548    HB   VAL  65           HB       VAL  65   2.407 -10.170   1.513
  549   1HG1  VAL  65          HG11      VAL  65   5.211 -11.232   1.956
  550   2HG1  VAL  65          HG12      VAL  65   3.700 -12.113   2.178
  551   3HG1  VAL  65          HG13      VAL  65   4.110 -10.781   3.257
  552   1HG2  VAL  65          HG21      VAL  65   5.045  -8.720   1.162
  553   2HG2  VAL  65          HG22      VAL  65   3.995  -8.511   2.564
  554   3HG2  VAL  65          HG23      VAL  65   3.428  -8.047   0.960
  555    HA   PRO  66           HA       PRO  66   1.607 -13.636  -2.294
  556   1HB   PRO  66          HB2       PRO  66   4.230 -15.089  -2.503
  557   2HB   PRO  66          HB1       PRO  66   2.918 -14.961  -3.692
  558   1HG   PRO  66          HG2       PRO  66   5.128 -13.522  -3.962
  559   2HG   PRO  66          HG1       PRO  66   3.542 -12.827  -4.343
  560   1HD   PRO  66          HD2       PRO  66   5.297 -12.324  -1.968
  561   2HD   PRO  66          HD1       PRO  66   4.184 -11.215  -2.799
  562    H    ARG  67           HN       ARG  67   0.466 -14.927  -0.919
  563    HA   ARG  67           HA       ARG  67   1.680 -15.874   1.565
  564   1HB   ARG  67          HB2       ARG  67  -0.534 -16.732   2.085
  565   2HB   ARG  67          HB1       ARG  67  -0.684 -15.096   1.447
  566   1HG   ARG  67          HG2       ARG  67  -0.973 -16.307  -0.865
  567   2HG   ARG  67          HG1       ARG  67  -1.366 -17.712   0.119
  568   1HD   ARG  67          HD2       ARG  67  -2.816 -15.085  -0.089
  569   2HD   ARG  67          HD1       ARG  67  -3.464 -16.709  -0.268
  570    HE   ARG  67           HE       ARG  67  -3.360 -15.178   2.145
  571   1HH1  ARG  67          HH21      ARG  67  -2.676 -18.367   1.005
  572   2HH1  ARG  67          HH22      ARG  67  -2.751 -19.073   2.583
  573   1HH2  ARG  67          HH11      ARG  67  -3.471 -16.089   4.183
  574   2HH2  ARG  67          HH12      ARG  67  -3.205 -17.790   4.377
  575    H    ASP  68           HN       ASP  68   0.413 -18.421   1.794
  576    HA   ASP  68           HA       ASP  68   2.399 -20.087   0.608
  577   1HB   ASP  68          HB2       ASP  68   1.053 -21.961   1.402
  578   2HB   ASP  68          HB1       ASP  68   1.063 -20.691   2.626
  579    H    ASP  69           HN       ASP  69   2.389 -21.361  -1.245
  580    HA   ASP  69           HA       ASP  69   0.699 -20.526  -3.440
  581   1HB   ASP  69          HB2       ASP  69   2.640 -22.826  -3.092
  582   2HB   ASP  69          HB1       ASP  69   1.789 -22.509  -4.605
  583    H    LYS  70           HN       LYS  70   0.449 -22.915  -0.959
  584    HA   LYS  70           HA       LYS  70  -1.234 -24.828  -2.218
  585   1HB   LYS  70          HB2       LYS  70  -1.050 -23.901   0.659
  586   2HB   LYS  70          HB1       LYS  70  -2.042 -25.267   0.144
  587   1HG   LYS  70          HG2       LYS  70  -0.042 -26.372  -0.789
  588   2HG   LYS  70          HG1       LYS  70   0.952 -25.010  -0.272
  589   1HD   LYS  70          HD2       LYS  70   0.320 -25.435   2.076
  590   2HD   LYS  70          HD1       LYS  70  -0.671 -26.801   1.561
  591   1HE   LYS  70          HE2       LYS  70   1.578 -27.512   2.369
  592   2HE   LYS  70          HE1       LYS  70   1.300 -27.947   0.683
  593   1HZ   LYS  70          HZ1       LYS  70   2.507 -25.950   0.021
  594   2HZ   LYS  70          HZ2       LYS  70   3.478 -26.974   0.966
  595   3HZ   LYS  70          HZ3       LYS  70   2.800 -25.573   1.648
  596    H    LYS  71           HN       LYS  71  -2.027 -21.754  -0.592
  597    HA   LYS  71           HA       LYS  71  -4.747 -21.901  -1.807
  598   1HB   LYS  71          HB2       LYS  71  -4.791 -22.487   0.624
  599   2HB   LYS  71          HB1       LYS  71  -4.048 -20.930   0.978
  600   1HG   LYS  71          HG2       LYS  71  -6.294 -20.420   1.276
  601   2HG   LYS  71          HG1       LYS  71  -6.080 -19.971  -0.409
  602   1HD   LYS  71          HD2       LYS  71  -6.908 -22.241  -1.071
  603   2HD   LYS  71          HD1       LYS  71  -7.222 -22.580   0.630
  604   1HE   LYS  71          HE2       LYS  71  -9.300 -21.823  -0.250
  605   2HE   LYS  71          HE1       LYS  71  -8.643 -20.447   0.634
  606   1HZ   LYS  71          HZ1       LYS  71  -8.296 -19.289  -1.244
  607   2HZ   LYS  71          HZ2       LYS  71  -9.499 -20.309  -1.877
  608   3HZ   LYS  71          HZ3       LYS  71  -7.858 -20.653  -2.152
  609    HA   PRO  72           HA       PRO  72  -2.778 -17.811  -2.683
  610   1HB   PRO  72          HB2       PRO  72  -2.916 -17.841  -5.363
  611   2HB   PRO  72          HB1       PRO  72  -1.680 -18.784  -4.506
  612   1HG   PRO  72          HG2       PRO  72  -4.243 -19.698  -5.732
  613   2HG   PRO  72          HG1       PRO  72  -2.654 -20.481  -5.738
  614   1HD   PRO  72          HD2       PRO  72  -4.742 -21.121  -3.986
  615   2HD   PRO  72          HD1       PRO  72  -3.031 -21.516  -3.709
  616    H    GLY  73           HN       GLY  73  -5.735 -18.921  -2.511
  617   1HA   GLY  73          HA2       GLY  73  -7.374 -17.384  -4.249
  618   2HA   GLY  73          HA1       GLY  73  -7.889 -18.008  -2.684
  619    H    LYS  74           HN       LYS  74  -6.029 -16.569  -1.050
  620    HA   LYS  74           HA       LYS  74  -7.406 -13.999  -0.992
  621   1HB   LYS  74          HB2       LYS  74  -5.343 -15.362   0.727
  622   2HB   LYS  74          HB1       LYS  74  -5.632 -13.636   0.935
  623   1HG   LYS  74          HG2       LYS  74  -7.057 -14.842   2.483
  624   2HG   LYS  74          HG1       LYS  74  -8.076 -14.138   1.229
  625   1HD   LYS  74          HD2       LYS  74  -8.235 -16.258   0.076
  626   2HD   LYS  74          HD1       LYS  74  -7.036 -16.984   1.148
  627   1HE   LYS  74          HE2       LYS  74  -9.674 -15.857   2.120
  628   2HE   LYS  74          HE1       LYS  74  -9.434 -17.557   1.718
  629   1HZ   LYS  74          HZ1       LYS  74  -7.322 -16.834   3.350
  630   2HZ   LYS  74          HZ2       LYS  74  -8.637 -17.835   3.748
  631   3HZ   LYS  74          HZ3       LYS  74  -8.706 -16.167   4.071
  632    H    GLY  75           HN       GLY  75  -5.210 -14.966  -3.048
  633   1HA   GLY  75          HA2       GLY  75  -3.646 -13.861  -4.406
  634   2HA   GLY  75          HA1       GLY  75  -4.351 -12.359  -3.808
  635    H    SER  76           HN       SER  76  -2.675 -11.120  -3.139
  636    HA   SER  76           HA       SER  76  -0.686 -12.320  -1.238
  637   1HB   SER  76          HB2       SER  76  -0.142 -10.268  -3.408
  638   2HB   SER  76          HB1       SER  76   1.037 -10.902  -2.265
  639    HG   SER  76           HG       SER  76  -0.337 -12.247  -4.341
  640    H    TYR  77           HN       TYR  77  -0.076 -10.954   0.477
  641    HA   TYR  77           HA       TYR  77  -1.950  -8.790   1.085
  642   1HB   TYR  77          HB2       TYR  77   0.552  -9.366   2.671
  643   2HB   TYR  77          HB1       TYR  77  -1.007  -8.775   3.240
  644    HD1  TYR  77           HD1      TYR  77  -3.025 -10.487   2.368
  645    HD2  TYR  77           HD2      TYR  77   1.016 -11.545   3.373
  646    HE1  TYR  77           HE1      TYR  77  -3.749 -12.812   2.836
  647    HE2  TYR  77           HE2      TYR  77   0.292 -13.871   3.836
  648    HH   TYR  77           HH       TYR  77  -1.591 -15.379   3.156
  649    H    TRP  78           HN       TRP  78  -1.163  -6.576   1.607
  650    HA   TRP  78           HA       TRP  78   1.163  -5.792  -0.129
  651   1HB   TRP  78          HB2       TRP  78  -1.374  -4.285   0.571
  652   2HB   TRP  78          HB1       TRP  78  -0.038  -3.624  -0.375
  653    HD1  TRP  78           HD1      TRP  78  -2.586  -6.518  -0.482
  654    HE1  TRP  78           HE1      TRP  78  -2.976  -7.161  -2.948
  655    HE3  TRP  78           HE3      TRP  78   0.805  -3.450  -2.733
  656    HZ2  TRP  78           HZ2      TRP  78  -1.965  -6.465  -5.538
  657    HZ3  TRP  78           HZ3      TRP  78   1.073  -3.451  -5.192
  658    HH2  TRP  78           HH2      TRP  78  -0.315  -4.943  -6.599
  659    H    THR  79           HN       THR  79   2.761  -4.568   0.797
  660    HA   THR  79           HA       THR  79   2.303  -3.200   3.371
  661    HB   THR  79           HB       THR  79   2.890  -5.576   3.947
  662    HG1  THR  79           HG1      THR  79   3.916  -3.325   4.841
  663   1HG2  THR  79          HG21      THR  79   5.611  -4.900   2.817
  664   2HG2  THR  79          HG22      THR  79   4.410  -5.825   1.916
  665   3HG2  THR  79          HG23      THR  79   5.051  -6.453   3.434
  666    H    LEU  80           HN       LEU  80   4.202  -1.841   3.963
  667    HA   LEU  80           HA       LEU  80   5.514  -0.793   1.529
  668   1HB   LEU  80          HB2       LEU  80   5.548   0.175   4.402
  669   2HB   LEU  80          HB1       LEU  80   6.305   1.014   3.052
  670    HG   LEU  80           HG       LEU  80   3.352   0.347   3.199
  671   1HD1  LEU  80          HD11      LEU  80   3.927   1.942   4.956
  672   2HD1  LEU  80          HD12      LEU  80   3.084   2.790   3.660
  673   3HD1  LEU  80          HD13      LEU  80   4.836   2.921   3.805
  674   1HD2  LEU  80          HD21      LEU  80   3.845   0.661   0.923
  675   2HD2  LEU  80          HD22      LEU  80   5.099   1.854   1.253
  676   3HD2  LEU  80          HD23      LEU  80   3.400   2.286   1.427
  677    H    ASP  81           HN       ASP  81   7.597  -1.208   1.006
  678    HA   ASP  81           HA       ASP  81   9.688  -1.574   2.907
  679   1HB   ASP  81          HB2       ASP  81   8.278  -4.016   1.938
  680   2HB   ASP  81          HB1       ASP  81  10.038  -4.102   1.981
  681    HA   PRO  82           HA       PRO  82  11.796  -0.863  -0.961
  682   1HB   PRO  82          HB2       PRO  82  14.366  -1.225  -0.294
  683   2HB   PRO  82          HB1       PRO  82  13.408   0.057   0.480
  684   1HG   PRO  82          HG2       PRO  82  14.125  -2.651   1.523
  685   2HG   PRO  82          HG1       PRO  82  14.150  -1.087   2.356
  686   1HD   PRO  82          HD2       PRO  82  12.067  -2.921   2.557
  687   2HD   PRO  82          HD1       PRO  82  11.899  -1.174   2.851
  688    H    ASP  83           HN       ASP  83  14.072  -2.144  -1.989
  689    HA   ASP  83           HA       ASP  83  12.959  -4.786  -2.718
  690   1HB   ASP  83          HB2       ASP  83  15.348  -3.207  -3.712
  691   2HB   ASP  83          HB1       ASP  83  14.935  -4.818  -4.299
  692    H    SER  84           HN       SER  84  13.568  -4.935  -0.119
  693    HA   SER  84           HA       SER  84  16.242  -5.526   0.613
  694   1HB   SER  84          HB2       SER  84  14.446  -5.191   2.257
  695   2HB   SER  84          HB1       SER  84  13.668  -6.679   1.725
  696    HG   SER  84           HG       SER  84  15.025  -6.929   3.594
  697    H    TYR  85           HN       TYR  85  13.709  -7.648  -0.716
  698    HA   TYR  85           HA       TYR  85  15.111 -10.106  -0.409
  699   1HB   TYR  85          HB2       TYR  85  13.611 -10.968  -2.138
  700   2HB   TYR  85          HB1       TYR  85  12.720  -9.956  -1.006
  701    HD1  TYR  85           HD1      TYR  85  11.940  -7.714  -1.659
  702    HD2  TYR  85           HD2      TYR  85  13.989 -10.280  -4.430
  703    HE1  TYR  85           HE1      TYR  85  11.164  -6.300  -3.542
  704    HE2  TYR  85           HE2      TYR  85  13.216  -8.863  -6.313
  705    HH   TYR  85           HH       TYR  85  11.905  -7.164  -6.915
  706    H    ASN  86           HN       ASN  86  15.174  -7.745  -3.045
  707    HA   ASN  86           HA       ASN  86  16.895  -9.372  -4.705
  708   1HB   ASN  86          HB2       ASN  86  15.313  -7.477  -5.463
  709   2HB   ASN  86          HB1       ASN  86  16.603  -6.383  -4.964
  710   1HD2  ASN  86          HD21      ASN  86  17.461  -5.719  -6.977
  711   2HD2  ASN  86          HD22      ASN  86  18.052  -6.792  -8.153
  712    H    MET  87           HN       MET  87  17.474  -7.377  -2.027
  713    HA   MET  87           HA       MET  87  20.214  -6.672  -2.792
  714   1HB   MET  87          HB2       MET  87  18.637  -6.353  -0.234
  715   2HB   MET  87          HB1       MET  87  20.340  -5.907  -0.360
  716   1HG   MET  87          HG2       MET  87  19.817  -4.379  -2.215
  717   2HG   MET  87          HG1       MET  87  18.117  -4.831  -2.119
  718   1HE   MET  87          HE1       MET  87  17.784  -2.466  -2.215
  719   2HE   MET  87          HE2       MET  87  19.250  -1.619  -1.729
  720   3HE   MET  87          HE3       MET  87  17.755  -1.361  -0.834
  721    H    PHE  88           HN       PHE  88  21.835  -8.098  -2.691
  722    HA   PHE  88           HA       PHE  88  21.716 -10.329  -0.686
  723   1HB   PHE  88          HB2       PHE  88  23.120 -10.198  -3.374
  724   2HB   PHE  88          HB1       PHE  88  23.200 -11.555  -2.250
  725    HD1  PHE  88           HD1      PHE  88  21.157  -9.799  -4.722
  726    HD2  PHE  88           HD2      PHE  88  21.169 -12.891  -1.739
  727    HE1  PHE  88           HE1      PHE  88  19.039 -10.699  -5.646
  728    HE2  PHE  88           HE2      PHE  88  19.051 -13.791  -2.664
  729    HZ   PHE  88           HZ       PHE  88  17.987 -12.695  -4.617
  730    H    GLU  89           HN       GLU  89  22.939  -7.404  -0.904
  731    HA   GLU  89           HA       GLU  89  25.684  -8.151   0.057
  732   1HB   GLU  89          HB2       GLU  89  26.236  -5.747  -0.525
  733   2HB   GLU  89          HB1       GLU  89  25.874  -6.783  -1.905
  734   1HG   GLU  89          HG2       GLU  89  23.604  -5.921  -2.024
  735   2HG   GLU  89          HG1       GLU  89  23.847  -4.979  -0.553
  736    H    ASN  90           HN       ASN  90  26.481  -6.134   1.492
  737    HA   ASN  90           HA       ASN  90  25.026  -6.285   3.924
  738   1HB   ASN  90          HB2       ASN  90  27.045  -4.208   3.032
  739   2HB   ASN  90          HB1       ASN  90  26.524  -4.465   4.699
  740   1HD2  ASN  90          HD21      ASN  90  26.535  -7.183   5.019
  741   2HD2  ASN  90          HD22      ASN  90  28.070  -7.834   4.703
  742    H    GLY  91           HN       GLY  91  24.191  -4.673   1.179
  743   1HA   GLY  91          HA2       GLY  91  22.163  -3.387   0.949
  744   2HA   GLY  91          HA1       GLY  91  22.250  -2.980   2.663
  745    H    SER  92           HN       SER  92  23.980  -2.424  -0.409
  746    HA   SER  92           HA       SER  92  25.297  -0.039   0.666
  747   1HB   SER  92          HB2       SER  92  26.522  -1.342  -0.962
  748   2HB   SER  92          HB1       SER  92  25.187  -1.255  -2.107
  749    HG   SER  92           HG       SER  92  26.952   0.770  -1.244
  750    H    PHE  93           HN       PHE  93  23.407   1.213   1.227
  751    HA   PHE  93           HA       PHE  93  21.329   1.925  -0.584
  752   1HB   PHE  93          HB2       PHE  93  21.191   2.390   1.830
  753   2HB   PHE  93          HB1       PHE  93  22.513   3.549   1.690
  754    HD1  PHE  93           HD1      PHE  93  22.208   5.693   0.570
  755    HD2  PHE  93           HD2      PHE  93  18.963   2.900   0.934
  756    HE1  PHE  93           HE1      PHE  93  20.605   7.476  -0.058
  757    HE2  PHE  93           HE2      PHE  93  17.359   4.686   0.305
  758    HZ   PHE  93           HZ       PHE  93  18.180   6.973  -0.189
  759    H    LEU  94           HN       LEU  94  24.501   3.417   0.037
  760    HA   LEU  94           HA       LEU  94  24.143   5.686  -1.649
  761   1HB   LEU  94          HB2       LEU  94  26.025   5.484  -0.074
  762   2HB   LEU  94          HB1       LEU  94  26.677   4.140  -1.005
  763    HG   LEU  94           HG       LEU  94  26.978   5.632  -2.951
  764   1HD1  LEU  94          HD11      LEU  94  25.328   7.297  -2.797
  765   2HD1  LEU  94          HD12      LEU  94  26.785   8.172  -2.339
  766   3HD1  LEU  94          HD13      LEU  94  25.667   7.614  -1.095
  767   1HD2  LEU  94          HD21      LEU  94  28.735   5.357  -1.148
  768   2HD2  LEU  94          HD22      LEU  94  28.162   6.873  -0.454
  769   3HD2  LEU  94          HD23      LEU  94  28.863   6.854  -2.071
  Start of MODEL    5
    1   1H    MET   1          HT1       MET   1 -24.927  17.890   3.666
    2   2H    MET   1          HT2       MET   1 -23.447  18.289   4.398
    3   3H    MET   1          HT3       MET   1 -24.037  16.698   4.482
    4    HA   MET   1           HA       MET   1 -23.796  16.440   2.101
    5   1HB   MET   1          HB2       MET   1 -24.153  18.901   1.646
    6   2HB   MET   1          HB1       MET   1 -22.496  19.174   2.182
    7   1HG   MET   1          HG2       MET   1 -21.642  17.703   0.439
    8   2HG   MET   1          HG1       MET   1 -23.280  17.286  -0.059
    9   1HE   MET   1          HE1       MET   1 -24.707  20.134  -1.862
   10   2HE   MET   1          HE2       MET   1 -24.871  20.263  -0.114
   11   3HE   MET   1          HE3       MET   1 -24.931  18.679  -0.883
   12    H    LEU   2           HN       LEU   2 -21.785  15.638   1.282
   13    HA   LEU   2           HA       LEU   2 -19.439  15.877   3.134
   14   1HB   LEU   2          HB2       LEU   2 -20.506  13.358   1.821
   15   2HB   LEU   2          HB1       LEU   2 -18.997  13.463   2.725
   16    HG   LEU   2           HG       LEU   2 -21.732  14.114   3.861
   17   1HD1  LEU   2          HD11      LEU   2 -21.350  11.964   5.143
   18   2HD1  LEU   2          HD12      LEU   2 -20.003  11.635   4.054
   19   3HD1  LEU   2          HD13      LEU   2 -21.644  11.751   3.417
   20   1HD2  LEU   2          HD21      LEU   2 -18.924  14.161   4.945
   21   2HD2  LEU   2          HD22      LEU   2 -20.241  13.720   6.029
   22   3HD2  LEU   2          HD23      LEU   2 -20.252  15.286   5.227
   23    H    VAL   3           HN       VAL   3 -17.396  15.600   2.094
   24    HA   VAL   3           HA       VAL   3 -17.436  15.714  -0.900
   25    HB   VAL   3           HB       VAL   3 -15.603  17.380  -0.782
   26   1HG1  VAL   3          HG11      VAL   3 -18.201  18.066   0.615
   27   2HG1  VAL   3          HG12      VAL   3 -17.821  18.253  -1.098
   28   3HG1  VAL   3          HG13      VAL   3 -17.032  19.281   0.099
   29   1HG2  VAL   3          HG21      VAL   3 -16.255  17.414   2.184
   30   2HG2  VAL   3          HG22      VAL   3 -15.130  18.495   1.364
   31   3HG2  VAL   3          HG23      VAL   3 -14.771  16.774   1.479
   32    H    LYS   4           HN       LYS   4 -15.373  15.053  -1.868
   33    HA   LYS   4           HA       LYS   4 -14.361  12.636  -0.793
   34   1HB   LYS   4          HB2       LYS   4 -12.371  13.230  -2.443
   35   2HB   LYS   4          HB1       LYS   4 -13.971  12.852  -3.081
   36   1HG   LYS   4          HG2       LYS   4 -14.499  15.141  -3.427
   37   2HG   LYS   4          HG1       LYS   4 -13.156  15.686  -2.422
   38   1HD   LYS   4          HD2       LYS   4 -11.542  14.923  -4.057
   39   2HD   LYS   4          HD1       LYS   4 -12.808  14.154  -5.014
   40   1HE   LYS   4          HE2       LYS   4 -12.799  17.120  -4.418
   41   2HE   LYS   4          HE1       LYS   4 -12.027  16.435  -5.850
   42   1HZ   LYS   4          HZ1       LYS   4 -14.350  17.177  -6.206
   43   2HZ   LYS   4          HZ2       LYS   4 -14.866  15.979  -5.117
   44   3HZ   LYS   4          HZ3       LYS   4 -14.097  15.538  -6.567
   45    HA   PRO   5           HA       PRO   5 -11.922  14.414   2.619
   46   1HB   PRO   5          HB2       PRO   5 -10.395  11.878   2.083
   47   2HB   PRO   5          HB1       PRO   5 -10.879  12.593   3.638
   48   1HG   PRO   5          HG2       PRO   5 -12.230  10.558   2.600
   49   2HG   PRO   5          HG1       PRO   5 -13.067  11.879   3.434
   50   1HD   PRO   5          HD2       PRO   5 -12.961  11.277   0.513
   51   2HD   PRO   5          HD1       PRO   5 -14.225  12.104   1.452
   52    HA   PRO   6           HA       PRO   6  -8.980  16.507  -0.181
   53   1HB   PRO   6          HB2       PRO   6  -7.687  16.987   2.493
   54   2HB   PRO   6          HB1       PRO   6  -7.927  18.116   1.143
   55   1HG   PRO   6          HG2       PRO   6  -9.528  18.177   3.256
   56   2HG   PRO   6          HG1       PRO   6 -10.170  18.418   1.621
   57   1HD   PRO   6          HD2       PRO   6 -10.458  16.054   3.417
   58   2HD   PRO   6          HD1       PRO   6 -11.537  16.633   2.129
   59    H    TYR   7           HN       TYR   7  -8.274  13.824   1.883
   60    HA   TYR   7           HA       TYR   7  -5.440  13.658   1.420
   61   1HB   TYR   7          HB2       TYR   7  -7.335  11.346   1.907
   62   2HB   TYR   7          HB1       TYR   7  -5.608  11.402   2.253
   63    HD1  TYR   7           HD1      TYR   7  -8.756  11.663   3.729
   64    HD2  TYR   7           HD2      TYR   7  -4.908  13.570   3.735
   65    HE1  TYR   7           HE1      TYR   7  -9.241  12.617   5.960
   66    HE2  TYR   7           HE2      TYR   7  -5.385  14.519   5.976
   67    HH   TYR   7           HH       TYR   7  -7.935  15.052   7.242
   68    H    SER   8           HN       SER   8  -4.310  12.614  -0.215
   69    HA   SER   8           HA       SER   8  -5.668  12.273  -2.761
   70   1HB   SER   8          HB2       SER   8  -2.841  11.571  -1.910
   71   2HB   SER   8          HB1       SER   8  -3.429  11.572  -3.571
   72    HG   SER   8           HG       SER   8  -3.694  13.751  -3.473
   73    H    TYR   9           HN       TYR   9  -5.508  10.199  -4.010
   74    HA   TYR   9           HA       TYR   9  -6.653   8.016  -2.588
   75   1HB   TYR   9          HB2       TYR   9  -5.235   8.112  -5.266
   76   2HB   TYR   9          HB1       TYR   9  -6.109   6.700  -4.668
   77    HD1  TYR   9           HD1      TYR   9  -6.418  10.157  -5.894
   78    HD2  TYR   9           HD2      TYR   9  -8.547   6.718  -4.447
   79    HE1  TYR   9           HE1      TYR   9  -8.548  11.141  -6.694
   80    HE2  TYR   9           HE2      TYR   9 -10.679   7.703  -5.247
   81    HH   TYR   9           HH       TYR   9 -11.315  10.543  -5.741
   82    H    ILE  10           HN       ILE  10  -3.282   8.659  -3.557
   83    HA   ILE  10           HA       ILE  10  -2.258   6.117  -2.657
   84    HB   ILE  10           HB       ILE  10  -0.804   8.778  -2.812
   85   1HG1  ILE  10          HG12      ILE  10  -1.800   8.339  -4.975
   86   2HG1  ILE  10          HG11      ILE  10  -0.087   7.948  -5.077
   87   1HG2  ILE  10          HG21      ILE  10   0.103   5.893  -2.738
   88   2HG2  ILE  10          HG22      ILE  10   0.505   7.182  -1.603
   89   3HG2  ILE  10          HG23      ILE  10   1.157   7.214  -3.241
   90   1HD1  ILE  10          HD11      ILE  10  -0.855   5.522  -4.470
   91   2HD1  ILE  10          HD12      ILE  10  -1.095   6.106  -6.116
   92   3HD1  ILE  10          HD13      ILE  10  -2.446   6.083  -4.984
   93    H    ALA  11           HN       ALA  11  -2.646   9.283  -1.098
   94    HA   ALA  11           HA       ALA  11  -1.307   8.666   1.341
   95   1HB   ALA  11          HB1       ALA  11  -2.528  10.552   2.287
   96   2HB   ALA  11          HB2       ALA  11  -3.725  10.476   0.994
   97   3HB   ALA  11          HB3       ALA  11  -2.067  10.961   0.634
   98    H    LEU  12           HN       LEU  12  -4.761   8.342   0.466
   99    HA   LEU  12           HA       LEU  12  -5.617   7.336   2.988
  100   1HB   LEU  12          HB2       LEU  12  -6.674   6.852   0.191
  101   2HB   LEU  12          HB1       LEU  12  -7.508   6.322   1.649
  102    HG   LEU  12           HG       LEU  12  -6.712   9.201   1.124
  103   1HD1  LEU  12          HD11      LEU  12  -8.302   8.603  -0.574
  104   2HD1  LEU  12          HD12      LEU  12  -9.192   9.483   0.669
  105   3HD1  LEU  12          HD13      LEU  12  -9.299   7.725   0.586
  106   1HD2  LEU  12          HD21      LEU  12  -8.306   7.776   3.255
  107   2HD2  LEU  12          HD22      LEU  12  -8.686   9.449   2.856
  108   3HD2  LEU  12          HD23      LEU  12  -7.081   9.031   3.438
  109    H    ILE  13           HN       ILE  13  -4.310   5.664   0.139
  110    HA   ILE  13           HA       ILE  13  -4.662   3.013   1.243
  111    HB   ILE  13           HB       ILE  13  -2.781   4.049  -0.903
  112   1HG1  ILE  13          HG12      ILE  13  -5.370   2.492  -1.161
  113   2HG1  ILE  13          HG11      ILE  13  -5.280   4.249  -1.279
  114   1HG2  ILE  13          HG21      ILE  13  -3.523   1.222  -0.090
  115   2HG2  ILE  13          HG22      ILE  13  -1.918   1.951  -0.020
  116   3HG2  ILE  13          HG23      ILE  13  -2.676   1.635  -1.580
  117   1HD1  ILE  13          HD11      ILE  13  -3.885   2.240  -3.070
  118   2HD1  ILE  13          HD12      ILE  13  -3.608   3.981  -3.132
  119   3HD1  ILE  13          HD13      ILE  13  -5.199   3.327  -3.523
  120    H    THR  14           HN       THR  14  -2.030   5.379   1.221
  121    HA   THR  14           HA       THR  14  -0.043   3.769   2.468
  122    HB   THR  14           HB       THR  14  -0.476   6.755   2.671
  123    HG1  THR  14           HG1      THR  14   0.449   6.854   0.789
  124   1HG2  THR  14          HG21      THR  14   1.826   4.949   3.398
  125   2HG2  THR  14          HG22      THR  14   1.053   6.193   4.380
  126   3HG2  THR  14          HG23      THR  14   2.076   6.654   3.021
  127    H    MET  15           HN       MET  15  -2.612   5.800   3.824
  128    HA   MET  15           HA       MET  15  -1.799   5.496   6.571
  129   1HB   MET  15          HB2       MET  15  -4.454   6.219   5.309
  130   2HB   MET  15          HB1       MET  15  -4.177   6.220   7.051
  131   1HG   MET  15          HG2       MET  15  -2.314   7.834   6.729
  132   2HG   MET  15          HG1       MET  15  -2.669   7.871   5.003
  133   1HE   MET  15          HE1       MET  15  -2.320  10.212   6.111
  134   2HE   MET  15          HE2       MET  15  -3.668  11.253   6.562
  135   3HE   MET  15          HE3       MET  15  -3.492  10.726   4.890
  136    H    ALA  16           HN       ALA  16  -4.051   3.723   4.486
  137    HA   ALA  16           HA       ALA  16  -5.236   2.075   6.455
  138   1HB   ALA  16          HB1       ALA  16  -4.523   1.076   3.697
  139   2HB   ALA  16          HB2       ALA  16  -5.764   2.305   3.928
  140   3HB   ALA  16          HB3       ALA  16  -5.954   0.711   4.662
  141    H    ILE  17           HN       ILE  17  -2.290   1.507   4.519
  142    HA   ILE  17           HA       ILE  17  -1.650  -1.051   5.588
  143    HB   ILE  17           HB       ILE  17   0.258   1.131   4.681
  144   1HG1  ILE  17          HG12      ILE  17  -0.926  -1.140   3.066
  145   2HG1  ILE  17          HG11      ILE  17  -1.606   0.488   3.078
  146   1HG2  ILE  17          HG21      ILE  17   1.679  -0.867   4.094
  147   2HG2  ILE  17          HG22      ILE  17   0.510  -1.881   4.939
  148   3HG2  ILE  17          HG23      ILE  17   1.425  -0.663   5.828
  149   1HD1  ILE  17          HD11      ILE  17   1.217  -0.255   2.257
  150   2HD1  ILE  17          HD12      ILE  17   0.586   1.392   2.340
  151   3HD1  ILE  17          HD13      ILE  17  -0.083   0.248   1.176
  152    H    GLN  18           HN       GLN  18  -0.525   2.182   6.551
  153    HA   GLN  18           HA       GLN  18   1.008   1.272   8.807
  154   1HB   GLN  18          HB2       GLN  18  -0.172   3.967   8.102
  155   2HB   GLN  18          HB1       GLN  18   0.865   3.707   9.505
  156   1HG   GLN  18          HG2       GLN  18   2.681   2.940   8.076
  157   2HG   GLN  18          HG1       GLN  18   1.645   3.036   6.651
  158   1HE2  GLN  18          HE21      GLN  18   4.166   4.574   7.207
  159   2HE2  GLN  18          HE22      GLN  18   3.725   6.211   7.131
  160    H    ASN  19           HN       ASN  19  -2.328   2.463   8.505
  161    HA   ASN  19           HA       ASN  19  -2.841   2.463  11.343
  162   1HB   ASN  19          HB2       ASN  19  -4.606   2.503   8.897
  163   2HB   ASN  19          HB1       ASN  19  -5.290   2.429  10.520
  164   1HD2  ASN  19          HD21      ASN  19  -2.839   4.358   8.689
  165   2HD2  ASN  19          HD22      ASN  19  -3.231   5.830   9.437
  166    H    ALA  20           HN       ALA  20  -2.600  -0.084   9.050
  167    HA   ALA  20           HA       ALA  20  -4.442  -1.885  10.412
  168   1HB   ALA  20          HB1       ALA  20  -3.657  -3.563   8.873
  169   2HB   ALA  20          HB2       ALA  20  -2.198  -2.637   8.519
  170   3HB   ALA  20          HB3       ALA  20  -3.769  -2.053   7.967
  171    HA   PRO  21           HA       PRO  21  -1.610  -3.143  13.620
  172   1HB   PRO  21          HB2       PRO  21  -2.438  -5.758  14.022
  173   2HB   PRO  21          HB1       PRO  21  -3.287  -4.341  14.666
  174   1HG   PRO  21          HG2       PRO  21  -3.907  -5.980  12.254
  175   2HG   PRO  21          HG1       PRO  21  -5.008  -5.248  13.434
  176   1HD   PRO  21          HD2       PRO  21  -4.570  -4.152  10.974
  177   2HD   PRO  21          HD1       PRO  21  -4.943  -3.162  12.403
  178    H    GLU  22           HN       GLU  22  -2.150  -5.487  11.007
  179    HA   GLU  22           HA       GLU  22   0.753  -6.230  11.082
  180   1HB   GLU  22          HB2       GLU  22  -1.672  -7.622   9.894
  181   2HB   GLU  22          HB1       GLU  22  -0.011  -8.147   9.619
  182   1HG   GLU  22          HG2       GLU  22   0.322  -8.484  12.014
  183   2HG   GLU  22          HG1       GLU  22  -1.295  -7.863  12.352
  184    H    LYS  23           HN       LYS  23   1.981  -5.373   9.444
  185    HA   LYS  23           HA       LYS  23   0.904  -3.559   7.538
  186   1HB   LYS  23          HB2       LYS  23   3.482  -5.158   7.376
  187   2HB   LYS  23          HB1       LYS  23   3.101  -3.741   6.399
  188   1HG   LYS  23          HG2       LYS  23   3.153  -3.692   9.427
  189   2HG   LYS  23          HG1       LYS  23   4.554  -3.292   8.438
  190   1HD   LYS  23          HD2       LYS  23   3.039  -1.580   7.263
  191   2HD   LYS  23          HD1       LYS  23   1.906  -1.837   8.588
  192   1HE   LYS  23          HE2       LYS  23   3.373   0.084   9.047
  193   2HE   LYS  23          HE1       LYS  23   3.634  -1.210  10.215
  194   1HZ   LYS  23          HZ1       LYS  23   5.296  -1.545   7.941
  195   2HZ   LYS  23          HZ2       LYS  23   5.730  -1.397   9.577
  196   3HZ   LYS  23          HZ3       LYS  23   5.528  -0.008   8.619
  197    H    LYS  24           HN       LYS  24   1.151  -7.019   7.522
  198    HA   LYS  24           HA       LYS  24   0.729  -7.269   4.633
  199   1HB   LYS  24          HB2       LYS  24   0.379  -9.340   6.828
  200   2HB   LYS  24          HB1       LYS  24   0.534  -9.659   5.097
  201   1HG   LYS  24          HG2       LYS  24   2.794  -8.668   5.114
  202   2HG   LYS  24          HG1       LYS  24   2.643  -8.353   6.843
  203   1HD   LYS  24          HD2       LYS  24   2.359 -10.780   7.249
  204   2HD   LYS  24          HD1       LYS  24   2.560 -11.082   5.524
  205   1HE   LYS  24          HE2       LYS  24   4.717 -11.448   6.428
  206   2HE   LYS  24          HE1       LYS  24   4.805  -9.821   5.756
  207   1HZ   LYS  24          HZ1       LYS  24   3.944 -10.142   8.539
  208   2HZ   LYS  24          HZ2       LYS  24   4.797  -8.866   7.811
  209   3HZ   LYS  24          HZ3       LYS  24   5.594 -10.319   8.184
  210    H    ILE  25           HN       ILE  25  -1.185  -5.926   4.440
  211    HA   ILE  25           HA       ILE  25  -3.680  -7.053   5.654
  212    HB   ILE  25           HB       ILE  25  -3.270  -4.672   6.121
  213   1HG1  ILE  25          HG12      ILE  25  -5.461  -4.924   4.047
  214   2HG1  ILE  25          HG11      ILE  25  -5.594  -5.623   5.660
  215   1HG2  ILE  25          HG21      ILE  25  -3.156  -3.042   4.320
  216   2HG2  ILE  25          HG22      ILE  25  -3.392  -4.306   3.113
  217   3HG2  ILE  25          HG23      ILE  25  -1.905  -4.258   4.059
  218   1HD1  ILE  25          HD11      ILE  25  -4.931  -2.707   5.222
  219   2HD1  ILE  25          HD12      ILE  25  -5.473  -3.486   6.708
  220   3HD1  ILE  25          HD13      ILE  25  -6.592  -3.284   5.359
  221    H    THR  26           HN       THR  26  -5.435  -7.558   4.284
  222    HA   THR  26           HA       THR  26  -4.647  -8.351   1.591
  223    HB   THR  26           HB       THR  26  -7.492  -8.455   2.574
  224    HG1  THR  26           HG1      THR  26  -5.982  -9.113   4.260
  225   1HG2  THR  26          HG21      THR  26  -6.689  -9.284   0.289
  226   2HG2  THR  26          HG22      THR  26  -7.580 -10.449   1.268
  227   3HG2  THR  26          HG23      THR  26  -5.823 -10.545   1.167
  228    H    LEU  27           HN       LEU  27  -5.707  -7.719  -0.327
  229    HA   LEU  27           HA       LEU  27  -5.932  -4.926  -0.734
  230   1HB   LEU  27          HB2       LEU  27  -5.389  -6.645  -2.448
  231   2HB   LEU  27          HB1       LEU  27  -7.047  -7.223  -2.375
  232    HG   LEU  27           HG       LEU  27  -7.859  -5.054  -3.213
  233   1HD1  LEU  27          HD11      LEU  27  -5.914  -3.538  -4.138
  234   2HD1  LEU  27          HD12      LEU  27  -4.944  -4.338  -2.906
  235   3HD1  LEU  27          HD13      LEU  27  -6.370  -3.409  -2.442
  236   1HD2  LEU  27          HD21      LEU  27  -6.979  -5.294  -5.469
  237   2HD2  LEU  27          HD22      LEU  27  -7.132  -6.894  -4.750
  238   3HD2  LEU  27          HD23      LEU  27  -5.550  -6.124  -4.859
  239    H    ASN  28           HN       ASN  28  -8.485  -7.411  -0.481
  240    HA   ASN  28           HA       ASN  28 -10.713  -5.680  -0.822
  241   1HB   ASN  28          HB2       ASN  28 -10.417  -8.267   0.717
  242   2HB   ASN  28          HB1       ASN  28 -11.965  -7.467   0.444
  243   1HD2  ASN  28          HD21      ASN  28 -12.217  -6.819  -2.075
  244   2HD2  ASN  28          HD22      ASN  28 -11.815  -8.062  -3.158
  245    H    GLY  29           HN       GLY  29  -8.919  -6.599   2.107
  246   1HA   GLY  29          HA2       GLY  29 -10.647  -5.411   4.013
  247   2HA   GLY  29          HA1       GLY  29  -8.924  -5.671   4.257
  248    H    ILE  30           HN       ILE  30  -7.964  -3.942   2.164
  249    HA   ILE  30           HA       ILE  30  -7.948  -1.455   3.548
  250    HB   ILE  30           HB       ILE  30  -7.311  -2.070   0.649
  251   1HG1  ILE  30          HG12      ILE  30  -5.453  -1.563   2.987
  252   2HG1  ILE  30          HG11      ILE  30  -5.973  -3.183   2.517
  253   1HG2  ILE  30          HG21      ILE  30  -6.846   0.406   2.337
  254   2HG2  ILE  30          HG22      ILE  30  -7.738   0.303   0.819
  255   3HG2  ILE  30          HG23      ILE  30  -5.987   0.088   0.831
  256   1HD1  ILE  30          HD11      ILE  30  -5.094  -2.743   0.217
  257   2HD1  ILE  30          HD12      ILE  30  -3.836  -2.703   1.452
  258   3HD1  ILE  30          HD13      ILE  30  -4.470  -1.196   0.789
  259    H    TYR  31           HN       TYR  31  -9.929  -2.579   0.808
  260    HA   TYR  31           HA       TYR  31 -11.208  -0.085   0.271
  261   1HB   TYR  31          HB2       TYR  31 -12.047  -2.962  -0.083
  262   2HB   TYR  31          HB1       TYR  31 -13.157  -1.652  -0.475
  263    HD1  TYR  31           HD1      TYR  31 -12.422   0.127  -2.121
  264    HD2  TYR  31           HD2      TYR  31 -10.296  -3.560  -1.582
  265    HE1  TYR  31           HE1      TYR  31 -11.335   0.429  -4.323
  266    HE2  TYR  31           HE2      TYR  31  -9.212  -3.260  -3.791
  267    HH   TYR  31           HH       TYR  31  -8.767  -0.788  -5.298
  268    H    GLN  32           HN       GLN  32 -11.984  -2.644   2.613
  269    HA   GLN  32           HA       GLN  32 -14.458  -1.565   3.532
  270   1HB   GLN  32          HB2       GLN  32 -13.586  -3.854   4.064
  271   2HB   GLN  32          HB1       GLN  32 -12.422  -3.111   5.158
  272   1HG   GLN  32          HG2       GLN  32 -14.329  -3.827   6.467
  273   2HG   GLN  32          HG1       GLN  32 -14.353  -2.067   6.393
  274   1HE2  GLN  32          HE21      GLN  32 -16.594  -1.627   6.410
  275   2HE2  GLN  32          HE22      GLN  32 -17.692  -2.259   5.280
  276    H    PHE  33           HN       PHE  33 -11.121  -0.966   4.531
  277    HA   PHE  33           HA       PHE  33 -11.632   0.616   6.821
  278   1HB   PHE  33          HB2       PHE  33  -9.422  -0.273   6.233
  279   2HB   PHE  33          HB1       PHE  33  -9.353   0.793   4.832
  280    HD1  PHE  33           HD1      PHE  33  -8.990   3.188   5.080
  281    HD2  PHE  33           HD2      PHE  33  -9.221   0.615   8.512
  282    HE1  PHE  33           HE1      PHE  33  -8.052   4.994   6.497
  283    HE2  PHE  33           HE2      PHE  33  -8.283   2.421   9.929
  284    HZ   PHE  33           HZ       PHE  33  -7.697   4.610   8.922
  285    H    ILE  34           HN       ILE  34 -11.290   1.657   3.407
  286    HA   ILE  34           HA       ILE  34 -11.542   4.456   4.037
  287    HB   ILE  34           HB       ILE  34 -12.050   2.987   1.439
  288   1HG1  ILE  34          HG12      ILE  34  -9.622   4.546   2.373
  289   2HG1  ILE  34          HG11      ILE  34  -9.762   2.793   2.504
  290   1HG2  ILE  34          HG21      ILE  34 -11.935   5.910   2.179
  291   2HG2  ILE  34          HG22      ILE  34 -13.078   5.076   1.126
  292   3HG2  ILE  34          HG23      ILE  34 -11.434   5.385   0.571
  293   1HD1  ILE  34          HD11      ILE  34 -10.078   4.293  -0.107
  294   2HD1  ILE  34          HD12      ILE  34  -9.938   2.549   0.116
  295   3HD1  ILE  34          HD13      ILE  34  -8.552   3.593   0.434
  296    H    MET  35           HN       MET  35 -13.955   2.020   3.010
  297    HA   MET  35           HA       MET  35 -16.083   3.953   2.782
  298   1HB   MET  35          HB2       MET  35 -16.115   0.950   3.140
  299   2HB   MET  35          HB1       MET  35 -17.579   1.914   2.926
  300   1HG   MET  35          HG2       MET  35 -16.646   2.803   0.796
  301   2HG   MET  35          HG1       MET  35 -15.243   1.756   0.996
  302   1HE   MET  35          HE1       MET  35 -15.031  -0.468   0.255
  303   2HE   MET  35          HE2       MET  35 -16.289  -1.701   0.253
  304   3HE   MET  35          HE3       MET  35 -15.823  -0.931   1.766
  305    H    ASP  36           HN       ASP  36 -15.003   1.862   5.464
  306    HA   ASP  36           HA       ASP  36 -17.183   2.636   7.204
  307   1HB   ASP  36          HB2       ASP  36 -14.457   1.441   7.761
  308   2HB   ASP  36          HB1       ASP  36 -15.662   1.729   9.016
  309    H    ARG  37           HN       ARG  37 -13.785   3.691   6.934
  310    HA   ARG  37           HA       ARG  37 -14.011   5.677   9.008
  311   1HB   ARG  37          HB2       ARG  37 -12.027   5.242   6.771
  312   2HB   ARG  37          HB1       ARG  37 -11.872   6.576   7.911
  313   1HG   ARG  37          HG2       ARG  37 -12.245   3.779   8.968
  314   2HG   ARG  37          HG1       ARG  37 -10.658   4.276   8.392
  315   1HD   ARG  37          HD2       ARG  37 -10.511   6.036   9.993
  316   2HD   ARG  37          HD1       ARG  37 -12.219   5.923  10.396
  317    HE   ARG  37           HE       ARG  37 -11.192   3.418  11.035
  318   1HH1  ARG  37          HH21      ARG  37 -10.483   6.709  11.799
  319   2HH1  ARG  37          HH22      ARG  37  -9.884   6.348  13.384
  320   1HH2  ARG  37          HH11      ARG  37 -10.419   2.937  13.105
  321   2HH2  ARG  37          HH12      ARG  37  -9.849   4.218  14.121
  322    H    PHE  38           HN       PHE  38 -14.475   5.768   5.502
  323    HA   PHE  38           HA       PHE  38 -15.511   8.572   5.801
  324   1HB   PHE  38          HB2       PHE  38 -13.963   7.451   3.442
  325   2HB   PHE  38          HB1       PHE  38 -14.615   9.082   3.583
  326    HD1  PHE  38           HD1      PHE  38 -13.717  10.650   5.311
  327    HD2  PHE  38           HD2      PHE  38 -11.931   6.815   4.562
  328    HE1  PHE  38           HE1      PHE  38 -11.657  11.377   6.491
  329    HE2  PHE  38           HE2      PHE  38  -9.876   7.541   5.746
  330    HZ   PHE  38           HZ       PHE  38  -9.740   9.822   6.710
  331    HA   PRO  39           HA       PRO  39 -18.885   5.690   4.302
  332   1HB   PRO  39          HB2       PRO  39 -20.356   8.057   5.426
  333   2HB   PRO  39          HB1       PRO  39 -20.718   6.328   5.591
  334   1HG   PRO  39          HG2       PRO  39 -19.624   7.674   7.594
  335   2HG   PRO  39          HG1       PRO  39 -19.118   6.014   7.234
  336   1HD   PRO  39          HD2       PRO  39 -17.678   8.581   6.683
  337   2HD   PRO  39          HD1       PRO  39 -17.014   6.986   7.101
  338    H    PHE  40           HN       PHE  40 -17.653   8.698   3.464
  339    HA   PHE  40           HA       PHE  40 -19.590   9.771   1.682
  340   1HB   PHE  40          HB2       PHE  40 -17.778  11.173   2.239
  341   2HB   PHE  40          HB1       PHE  40 -16.584   9.928   1.892
  342    HD1  PHE  40           HD1      PHE  40 -19.202  12.040   0.241
  343    HD2  PHE  40           HD2      PHE  40 -15.510   9.878  -0.199
  344    HE1  PHE  40           HE1      PHE  40 -18.958  12.926  -2.063
  345    HE2  PHE  40           HE2      PHE  40 -15.272  10.765  -2.506
  346    HZ   PHE  40           HZ       PHE  40 -16.995  12.287  -3.436
  347    H    TYR  41           HN       TYR  41 -17.067   7.338   1.206
  348    HA   TYR  41           HA       TYR  41 -17.438   7.073  -1.634
  349   1HB   TYR  41          HB2       TYR  41 -16.197   5.280   0.460
  350   2HB   TYR  41          HB1       TYR  41 -16.164   4.914  -1.270
  351    HD1  TYR  41           HD1      TYR  41 -14.890   6.290  -2.825
  352    HD2  TYR  41           HD2      TYR  41 -14.997   7.208   1.360
  353    HE1  TYR  41           HE1      TYR  41 -13.009   7.871  -3.134
  354    HE2  TYR  41           HE2      TYR  41 -13.121   8.793   1.068
  355    HH   TYR  41           HH       TYR  41 -12.226  10.090  -1.689
  356    H    ARG  42           HN       ARG  42 -19.146   5.721   1.102
  357    HA   ARG  42           HA       ARG  42 -20.218   3.396  -0.127
  358   1HB   ARG  42          HB2       ARG  42 -21.358   5.255   1.969
  359   2HB   ARG  42          HB1       ARG  42 -22.170   3.774   1.468
  360   1HG   ARG  42          HG2       ARG  42 -20.220   2.452   2.133
  361   2HG   ARG  42          HG1       ARG  42 -19.353   3.919   2.583
  362   1HD   ARG  42          HD2       ARG  42 -21.034   4.426   4.281
  363   2HD   ARG  42          HD1       ARG  42 -21.984   3.026   3.811
  364    HE   ARG  42           HE       ARG  42 -19.720   3.097   5.613
  365   1HH1  ARG  42          HH21      ARG  42 -21.127   1.186   3.107
  366   2HH1  ARG  42          HH22      ARG  42 -20.280  -0.255   3.567
  367   1HH2  ARG  42          HH11      ARG  42 -18.627   1.240   6.216
  368   2HH2  ARG  42          HH12      ARG  42 -18.866  -0.223   5.321
  369    H    GLU  43           HN       GLU  43 -21.330   6.780  -0.220
  370    HA   GLU  43           HA       GLU  43 -23.741   6.214  -1.662
  371   1HB   GLU  43          HB2       GLU  43 -22.098   8.738  -1.393
  372   2HB   GLU  43          HB1       GLU  43 -23.642   8.680  -2.246
  373   1HG   GLU  43          HG2       GLU  43 -24.794   7.954  -0.242
  374   2HG   GLU  43          HG1       GLU  43 -23.269   7.788   0.626
  375    H    ASN  44           HN       ASN  44 -20.481   6.327  -2.606
  376    HA   ASN  44           HA       ASN  44 -21.278   6.012  -5.479
  377   1HB   ASN  44          HB2       ASN  44 -18.858   7.553  -4.488
  378   2HB   ASN  44          HB1       ASN  44 -19.335   7.321  -6.170
  379   1HD2  ASN  44          HD21      ASN  44 -21.634   8.191  -6.705
  380   2HD2  ASN  44          HD22      ASN  44 -22.113   9.623  -5.931
  381    H    LYS  45           HN       LYS  45 -20.954   3.764  -5.468
  382    HA   LYS  45           HA       LYS  45 -18.460   2.663  -4.339
  383   1HB   LYS  45          HB2       LYS  45 -20.825   1.377  -5.724
  384   2HB   LYS  45          HB1       LYS  45 -19.441   0.480  -5.097
  385   1HG   LYS  45          HG2       LYS  45 -19.877   1.373  -2.841
  386   2HG   LYS  45          HG1       LYS  45 -21.265   2.269  -3.462
  387   1HD   LYS  45          HD2       LYS  45 -22.318   0.144  -4.162
  388   2HD   LYS  45          HD1       LYS  45 -20.937  -0.746  -3.519
  389   1HE   LYS  45          HE2       LYS  45 -22.784  -0.727  -1.891
  390   2HE   LYS  45          HE1       LYS  45 -21.399   0.173  -1.268
  391   1HZ   LYS  45          HZ1       LYS  45 -23.232   1.758  -2.827
  392   2HZ   LYS  45          HZ2       LYS  45 -22.524   2.085  -1.317
  393   3HZ   LYS  45          HZ3       LYS  45 -23.920   1.120  -1.413
  394    H    GLN  46           HN       GLN  46 -20.001   2.890  -7.557
  395    HA   GLN  46           HA       GLN  46 -17.680   1.702  -8.867
  396   1HB   GLN  46          HB2       GLN  46 -20.146   3.107  -9.925
  397   2HB   GLN  46          HB1       GLN  46 -18.900   2.419 -10.967
  398   1HG   GLN  46          HG2       GLN  46 -19.262   0.202  -9.935
  399   2HG   GLN  46          HG1       GLN  46 -20.512   0.892  -8.900
  400   1HE2  GLN  46          HE21      GLN  46 -20.061  -0.720 -11.828
  401   2HE2  GLN  46          HE22      GLN  46 -21.519  -0.292 -12.585
  402    H    GLY  47           HN       GLY  47 -16.092   2.779 -10.064
  403   1HA   GLY  47          HA2       GLY  47 -15.268   4.804 -11.195
  404   2HA   GLY  47          HA1       GLY  47 -16.107   5.776  -9.992
  405    H    TRP  48           HN       TRP  48 -15.332   4.915  -7.603
  406    HA   TRP  48           HA       TRP  48 -12.431   5.481  -7.602
  407   1HB   TRP  48          HB2       TRP  48 -12.689   6.017  -5.316
  408   2HB   TRP  48          HB1       TRP  48 -14.186   6.572  -6.058
  409    HD1  TRP  48           HD1      TRP  48 -16.387   5.018  -5.682
  410    HE1  TRP  48           HE1      TRP  48 -16.983   3.416  -3.759
  411    HE3  TRP  48           HE3      TRP  48 -11.776   4.393  -3.581
  412    HZ2  TRP  48           HZ2      TRP  48 -15.687   2.040  -1.617
  413    HZ3  TRP  48           HZ3      TRP  48 -11.486   2.933  -1.600
  414    HH2  TRP  48           HH2      TRP  48 -13.433   1.757  -0.615
  415    H    GLN  49           HN       GLN  49 -14.466   2.748  -7.463
  416    HA   GLN  49           HA       GLN  49 -13.068   1.070  -5.666
  417   1HB   GLN  49          HB2       GLN  49 -15.286   0.579  -6.732
  418   2HB   GLN  49          HB1       GLN  49 -14.427   0.196  -8.223
  419   1HG   GLN  49          HG2       GLN  49 -13.115  -1.528  -6.979
  420   2HG   GLN  49          HG1       GLN  49 -14.089  -1.190  -5.548
  421   1HE2  GLN  49          HE21      GLN  49 -15.333  -3.113  -5.417
  422   2HE2  GLN  49          HE22      GLN  49 -16.354  -3.655  -6.660
  423    H    ASN  50           HN       ASN  50 -12.616   1.360  -9.213
  424    HA   ASN  50           HA       ASN  50 -10.378  -0.482  -9.202
  425   1HB   ASN  50          HB2       ASN  50 -11.359   1.457 -11.309
  426   2HB   ASN  50          HB1       ASN  50 -10.102   0.248 -11.570
  427   1HD2  ASN  50          HD21      ASN  50 -13.103   0.573 -12.509
  428   2HD2  ASN  50          HD22      ASN  50 -13.740  -0.978 -12.247
  429    H    SER  51           HN       SER  51 -10.631   3.061  -9.201
  430    HA   SER  51           HA       SER  51  -7.941   3.664  -9.818
  431   1HB   SER  51          HB2       SER  51  -8.334   5.816  -8.765
  432   2HB   SER  51          HB1       SER  51  -9.789   5.333  -9.630
  433    HG   SER  51           HG       SER  51  -9.600   5.987  -7.117
  434    H    ILE  52           HN       ILE  52  -9.271   2.334  -6.887
  435    HA   ILE  52           HA       ILE  52  -7.045   3.117  -5.193
  436    HB   ILE  52           HB       ILE  52  -9.174   0.995  -4.903
  437   1HG1  ILE  52          HG12      ILE  52  -9.716   3.555  -4.896
  438   2HG1  ILE  52          HG11      ILE  52 -10.392   2.531  -3.636
  439   1HG2  ILE  52          HG21      ILE  52  -6.964   1.846  -3.047
  440   2HG2  ILE  52          HG22      ILE  52  -7.454   0.216  -3.508
  441   3HG2  ILE  52          HG23      ILE  52  -8.465   1.165  -2.420
  442   1HD1  ILE  52          HD11      ILE  52  -7.749   3.898  -3.184
  443   2HD1  ILE  52          HD12      ILE  52  -8.928   3.338  -2.006
  444   3HD1  ILE  52          HD13      ILE  52  -9.256   4.783  -2.960
  445    H    ARG  53           HN       ARG  53  -8.033  -0.197  -6.132
  446    HA   ARG  53           HA       ARG  53  -5.419  -1.242  -5.561
  447   1HB   ARG  53          HB2       ARG  53  -6.239  -3.331  -6.443
  448   2HB   ARG  53          HB1       ARG  53  -7.524  -2.577  -5.502
  449   1HG   ARG  53          HG2       ARG  53  -8.285  -1.580  -7.783
  450   2HG   ARG  53          HG1       ARG  53  -7.279  -2.842  -8.492
  451   1HD   ARG  53          HD2       ARG  53  -8.723  -4.253  -6.584
  452   2HD   ARG  53          HD1       ARG  53  -9.902  -3.079  -7.155
  453    HE   ARG  53           HE       ARG  53  -9.154  -5.412  -8.540
  454   1HH1  ARG  53          HH21      ARG  53  -9.257  -2.012  -9.142
  455   2HH1  ARG  53          HH22      ARG  53  -9.399  -2.196 -10.856
  456   1HH2  ARG  53          HH11      ARG  53  -9.356  -5.658 -10.761
  457   2HH2  ARG  53          HH12      ARG  53  -9.462  -4.255 -11.771
  458    H    HIS  54           HN       HIS  54  -6.822   0.124  -8.478
  459    HA   HIS  54           HA       HIS  54  -5.009  -1.010 -10.368
  460   1HB   HIS  54          HB2       HIS  54  -6.984   0.335 -11.042
  461   2HB   HIS  54          HB1       HIS  54  -6.214   1.778 -10.376
  462    HD1  HIS  54           HD1      HIS  54  -5.387  -0.953 -12.908
  463    HD2  HIS  54           HD2      HIS  54  -4.654   3.099 -12.251
  464    HE1  HIS  54           HE1      HIS  54  -4.039  -0.139 -14.890
  465    H    ASN  55           HN       ASN  55  -4.766   1.857  -8.291
  466    HA   ASN  55           HA       ASN  55  -2.236   2.773  -9.249
  467   1HB   ASN  55          HB2       ASN  55  -3.605   3.083  -6.568
  468   2HB   ASN  55          HB1       ASN  55  -2.094   3.895  -6.983
  469   1HD2  ASN  55          HD21      ASN  55  -4.701   5.216  -6.471
  470   2HD2  ASN  55          HD22      ASN  55  -5.105   6.039  -7.899
  471    H    LEU  56           HN       LEU  56  -3.105   0.452  -6.694
  472    HA   LEU  56           HA       LEU  56  -0.428   0.063  -5.742
  473   1HB   LEU  56          HB2       LEU  56  -2.904  -1.662  -5.653
  474   2HB   LEU  56          HB1       LEU  56  -1.375  -2.206  -4.970
  475    HG   LEU  56           HG       LEU  56  -2.760   0.383  -4.208
  476   1HD1  LEU  56          HD11      LEU  56  -4.197  -1.278  -3.376
  477   2HD1  LEU  56          HD12      LEU  56  -3.116  -0.987  -2.016
  478   3HD1  LEU  56          HD13      LEU  56  -2.876  -2.398  -3.044
  479   1HD2  LEU  56          HD21      LEU  56  -0.207  -0.974  -3.386
  480   2HD2  LEU  56          HD22      LEU  56  -1.128  -0.142  -2.135
  481   3HD2  LEU  56          HD23      LEU  56  -0.566   0.745  -3.546
  482    H    SER  57           HN       SER  57   0.178   0.158  -8.282
  483    HA   SER  57           HA       SER  57   1.099  -2.544  -8.911
  484   1HB   SER  57          HB2       SER  57  -1.135  -2.635  -9.903
  485   2HB   SER  57          HB1       SER  57  -0.845  -1.118 -10.751
  486    HG   SER  57           HG       SER  57  -0.450  -2.908 -12.099
  487    H    LEU  58           HN       LEU  58   0.591   0.673 -10.443
  488    HA   LEU  58           HA       LEU  58   3.012   0.541 -11.983
  489   1HB   LEU  58          HB2       LEU  58   1.320   2.876 -11.066
  490   2HB   LEU  58          HB1       LEU  58   2.735   3.067 -12.099
  491    HG   LEU  58           HG       LEU  58   1.712   1.476 -13.729
  492   1HD1  LEU  58          HD11      LEU  58  -0.499   1.541 -11.677
  493   2HD1  LEU  58          HD12      LEU  58   0.203   0.153 -12.511
  494   3HD1  LEU  58          HD13      LEU  58  -0.870   1.249 -13.376
  495   1HD2  LEU  58          HD21      LEU  58   0.152   3.957 -12.959
  496   2HD2  LEU  58          HD22      LEU  58  -0.085   3.090 -14.475
  497   3HD2  LEU  58          HD23      LEU  58   1.470   3.846 -14.125
  498    H    ASN  59           HN       ASN  59   2.273   1.908  -8.780
  499    HA   ASN  59           HA       ASN  59   4.901   3.045  -8.418
  500   1HB   ASN  59          HB2       ASN  59   2.723   2.272  -6.462
  501   2HB   ASN  59          HB1       ASN  59   4.231   3.040  -5.966
  502   1HD2  ASN  59          HD21      ASN  59   1.152   3.905  -6.421
  503   2HD2  ASN  59          HD22      ASN  59   1.340   5.445  -7.108
  504    H    GLU  60           HN       GLU  60   6.752   2.006  -7.921
  505    HA   GLU  60           HA       GLU  60   6.666  -0.908  -7.448
  506   1HB   GLU  60          HB2       GLU  60   8.983   1.008  -7.863
  507   2HB   GLU  60          HB1       GLU  60   9.118  -0.749  -7.775
  508   1HG   GLU  60          HG2       GLU  60   7.709  -1.006  -9.745
  509   2HG   GLU  60          HG1       GLU  60   7.413   0.733  -9.802
  510    H    CYS  61           HN       CYS  61   6.502   1.793  -5.540
  511    HA   CYS  61           HA       CYS  61   8.353   1.206  -3.427
  512   1HB   CYS  61          HB2       CYS  61   5.713   2.696  -3.450
  513   2HB   CYS  61          HB1       CYS  61   6.762   2.604  -2.035
  514    HG   CYS  61           HG       CYS  61   8.350   3.564  -4.417
  515    H    PHE  62           HN       PHE  62   5.000   0.211  -4.040
  516    HA   PHE  62           HA       PHE  62   4.892  -1.346  -1.548
  517   1HB   PHE  62          HB2       PHE  62   2.955  -1.374  -3.882
  518   2HB   PHE  62          HB1       PHE  62   2.644  -1.912  -2.231
  519    HD1  PHE  62           HD1      PHE  62   2.518   0.866  -4.491
  520    HD2  PHE  62           HD2      PHE  62   2.927  -0.164  -0.340
  521    HE1  PHE  62           HE1      PHE  62   1.838   3.164  -3.853
  522    HE2  PHE  62           HE2      PHE  62   2.246   2.134   0.297
  523    HZ   PHE  62           HZ       PHE  62   1.701   3.798  -1.460
  524    H    VAL  63           HN       VAL  63   5.340  -3.514  -1.389
  525    HA   VAL  63           HA       VAL  63   6.022  -4.988  -3.919
  526    HB   VAL  63           HB       VAL  63   7.063  -5.429  -1.104
  527   1HG1  VAL  63          HG11      VAL  63   7.060  -7.512  -2.281
  528   2HG1  VAL  63          HG12      VAL  63   8.708  -6.896  -2.389
  529   3HG1  VAL  63          HG13      VAL  63   7.619  -6.750  -3.768
  530   1HG2  VAL  63          HG21      VAL  63   7.834  -3.326  -2.352
  531   2HG2  VAL  63          HG22      VAL  63   8.590  -4.418  -3.514
  532   3HG2  VAL  63          HG23      VAL  63   9.107  -4.428  -1.827
  533    H    LYS  64           HN       LYS  64   4.773  -6.744  -4.352
  534    HA   LYS  64           HA       LYS  64   2.532  -7.441  -2.683
  535   1HB   LYS  64          HB2       LYS  64   3.856  -8.868  -5.010
  536   2HB   LYS  64          HB1       LYS  64   2.362  -9.415  -4.251
  537   1HG   LYS  64          HG2       LYS  64   1.273  -7.288  -4.800
  538   2HG   LYS  64          HG1       LYS  64   2.770  -6.695  -5.523
  539   1HD   LYS  64          HD2       LYS  64   2.712  -8.461  -7.199
  540   2HD   LYS  64          HD1       LYS  64   1.289  -9.176  -6.443
  541   1HE   LYS  64          HE2       LYS  64  -0.049  -7.237  -6.979
  542   2HE   LYS  64          HE1       LYS  64   1.370  -6.358  -7.555
  543   1HZ   LYS  64          HZ1       LYS  64   1.602  -8.363  -9.138
  544   2HZ   LYS  64          HZ2       LYS  64   0.453  -7.163  -9.492
  545   3HZ   LYS  64          HZ3       LYS  64  -0.036  -8.632  -8.790
  546    H    VAL  65           HN       VAL  65   2.340  -9.088  -1.165
  547    HA   VAL  65           HA       VAL  65   4.824 -10.639  -0.517
  548    HB   VAL  65           HB       VAL  65   2.595  -9.620   1.264
  549   1HG1  VAL  65          HG11      VAL  65   3.101 -11.783   2.118
  550   2HG1  VAL  65          HG12      VAL  65   4.073 -10.675   3.086
  551   3HG1  VAL  65          HG13      VAL  65   4.822 -11.597   1.783
  552   1HG2  VAL  65          HG21      VAL  65   4.388  -8.370   2.340
  553   2HG2  VAL  65          HG22      VAL  65   4.425  -8.030   0.610
  554   3HG2  VAL  65          HG23      VAL  65   5.593  -9.149   1.314
  555    HA   PRO  66           HA       PRO  66   1.997 -13.965  -1.718
  556   1HB   PRO  66          HB2       PRO  66   3.647 -16.112  -1.298
  557   2HB   PRO  66          HB1       PRO  66   3.780 -15.052  -2.714
  558   1HG   PRO  66          HG2       PRO  66   5.405 -15.076  -0.214
  559   2HG   PRO  66          HG1       PRO  66   5.921 -14.824  -1.891
  560   1HD   PRO  66          HD2       PRO  66   5.563 -12.770  -0.101
  561   2HD   PRO  66          HD1       PRO  66   5.377 -12.568  -1.858
  562    H    ARG  67           HN       ARG  67   1.735 -16.405  -0.540
  563    HA   ARG  67           HA       ARG  67   1.309 -15.835   2.383
  564   1HB   ARG  67          HB2       ARG  67  -0.537 -17.377   0.535
  565   2HB   ARG  67          HB1       ARG  67  -0.827 -16.982   2.230
  566   1HG   ARG  67          HG2       ARG  67  -0.638 -14.550   1.593
  567   2HG   ARG  67          HG1       ARG  67  -0.642 -15.051  -0.096
  568   1HD   ARG  67          HD2       ARG  67  -2.799 -16.361   0.520
  569   2HD   ARG  67          HD1       ARG  67  -2.842 -15.339   1.952
  570    HE   ARG  67           HE       ARG  67  -3.734 -14.600  -0.639
  571   1HH1  ARG  67          HH21      ARG  67  -1.708 -13.347   1.860
  572   2HH1  ARG  67          HH22      ARG  67  -1.809 -11.723   1.283
  573   1HH2  ARG  67          HH11      ARG  67  -3.890 -12.481  -1.347
  574   2HH2  ARG  67          HH12      ARG  67  -3.047 -11.230  -0.497
  575    H    ASP  68           HN       ASP  68   1.528 -17.675   3.755
  576    HA   ASP  68           HA       ASP  68   3.198 -19.828   2.624
  577   1HB   ASP  68          HB2       ASP  68   3.572 -18.658   4.903
  578   2HB   ASP  68          HB1       ASP  68   2.241 -19.658   5.483
  579    H    ASP  69           HN       ASP  69   2.645 -22.115   3.372
  580    HA   ASP  69           HA       ASP  69  -0.007 -22.781   2.421
  581   1HB   ASP  69          HB2       ASP  69   2.197 -24.428   3.686
  582   2HB   ASP  69          HB1       ASP  69   0.697 -25.121   3.069
  583    H    LYS  70           HN       LYS  70   1.365 -22.176   5.562
  584    HA   LYS  70           HA       LYS  70  -0.424 -23.678   7.181
  585   1HB   LYS  70          HB2       LYS  70   0.983 -21.047   7.691
  586   2HB   LYS  70          HB1       LYS  70   0.065 -21.907   8.927
  587   1HG   LYS  70          HG2       LYS  70   1.511 -23.885   8.628
  588   2HG   LYS  70          HG1       LYS  70   2.435 -23.024   7.396
  589   1HD   LYS  70          HD2       LYS  70   3.045 -21.301   9.055
  590   2HD   LYS  70          HD1       LYS  70   2.128 -22.164  10.289
  591   1HE   LYS  70          HE2       LYS  70   4.489 -22.740  10.498
  592   2HE   LYS  70          HE1       LYS  70   3.595 -24.153   9.934
  593   1HZ   LYS  70          HZ1       LYS  70   5.725 -22.820   8.683
  594   2HZ   LYS  70          HZ2       LYS  70   4.349 -22.675   7.696
  595   3HZ   LYS  70          HZ3       LYS  70   4.901 -24.211   8.168
  596    H    LYS  71           HN       LYS  71  -0.728 -20.323   5.968
  597    HA   LYS  71           HA       LYS  71  -3.675 -20.527   6.386
  598   1HB   LYS  71          HB2       LYS  71  -2.977 -19.263   8.262
  599   2HB   LYS  71          HB1       LYS  71  -1.789 -18.367   7.319
  600   1HG   LYS  71          HG2       LYS  71  -3.416 -17.059   6.253
  601   2HG   LYS  71          HG1       LYS  71  -4.712 -18.193   6.616
  602   1HD   LYS  71          HD2       LYS  71  -5.108 -16.426   8.117
  603   2HD   LYS  71          HD1       LYS  71  -4.251 -17.596   9.112
  604   1HE   LYS  71          HE2       LYS  71  -3.100 -15.620   9.599
  605   2HE   LYS  71          HE1       LYS  71  -2.109 -16.285   8.302
  606   1HZ   LYS  71          HZ1       LYS  71  -2.578 -13.978   7.881
  607   2HZ   LYS  71          HZ2       LYS  71  -4.249 -14.247   8.018
  608   3HZ   LYS  71          HZ3       LYS  71  -3.380 -14.928   6.727
  609    HA   PRO  72           HA       PRO  72  -2.964 -18.832   2.199
  610   1HB   PRO  72          HB2       PRO  72  -5.183 -19.731   1.001
  611   2HB   PRO  72          HB1       PRO  72  -3.899 -20.860   1.486
  612   1HG   PRO  72          HG2       PRO  72  -6.481 -20.239   2.860
  613   2HG   PRO  72          HG1       PRO  72  -5.713 -21.812   2.579
  614   1HD   PRO  72          HD2       PRO  72  -5.522 -20.385   4.964
  615   2HD   PRO  72          HD1       PRO  72  -4.351 -21.615   4.437
  616    H    GLY  73           HN       GLY  73  -4.377 -17.374   0.728
  617   1HA   GLY  73          HA2       GLY  73  -6.607 -15.986   2.006
  618   2HA   GLY  73          HA1       GLY  73  -5.141 -15.011   1.914
  619    H    LYS  74           HN       LYS  74  -6.625 -13.673   0.486
  620    HA   LYS  74           HA       LYS  74  -6.969 -14.789  -2.255
  621   1HB   LYS  74          HB2       LYS  74  -8.025 -12.323  -0.874
  622   2HB   LYS  74          HB1       LYS  74  -8.242 -12.619  -2.603
  623   1HG   LYS  74          HG2       LYS  74  -9.319 -14.809  -2.040
  624   2HG   LYS  74          HG1       LYS  74  -9.205 -14.383  -0.331
  625   1HD   LYS  74          HD2       LYS  74 -10.551 -12.361  -0.736
  626   2HD   LYS  74          HD1       LYS  74 -10.658 -12.775  -2.447
  627   1HE   LYS  74          HE2       LYS  74 -11.860 -14.833  -1.911
  628   2HE   LYS  74          HE1       LYS  74 -11.682 -14.518  -0.185
  629   1HZ   LYS  74          HZ1       LYS  74 -13.754 -13.708  -1.760
  630   2HZ   LYS  74          HZ2       LYS  74 -12.816 -12.302  -1.589
  631   3HZ   LYS  74          HZ3       LYS  74 -13.390 -13.116  -0.213
  632    H    GLY  75           HN       GLY  75  -5.511 -14.312  -3.784
  633   1HA   GLY  75          HA2       GLY  75  -3.864 -13.162  -4.999
  634   2HA   GLY  75          HA1       GLY  75  -4.434 -11.693  -4.209
  635    H    SER  76           HN       SER  76  -2.781 -10.703  -3.206
  636    HA   SER  76           HA       SER  76  -0.954 -12.309  -1.470
  637   1HB   SER  76          HB2       SER  76   0.914 -10.776  -2.345
  638   2HB   SER  76          HB1       SER  76   0.363 -12.041  -3.441
  639    HG   SER  76           HG       SER  76  -1.195  -9.932  -3.785
  640    H    TYR  77           HN       TYR  77  -0.155 -11.075   0.343
  641    HA   TYR  77           HA       TYR  77  -1.862  -8.821   1.071
  642   1HB   TYR  77          HB2       TYR  77   0.610  -9.853   2.497
  643   2HB   TYR  77          HB1       TYR  77  -0.590  -8.755   3.168
  644    HD1  TYR  77           HD1      TYR  77  -3.169  -9.810   2.600
  645    HD2  TYR  77           HD2      TYR  77   0.445 -11.985   3.424
  646    HE1  TYR  77           HE1      TYR  77  -4.513 -11.758   3.309
  647    HE2  TYR  77           HE2      TYR  77  -0.900 -13.935   4.149
  648    HH   TYR  77           HH       TYR  77  -4.437 -13.757   4.353
  649    H    TRP  78           HN       TRP  78  -0.936  -6.706   1.728
  650    HA   TRP  78           HA       TRP  78   1.337  -5.922  -0.071
  651   1HB   TRP  78          HB2       TRP  78  -1.120  -4.365   0.776
  652   2HB   TRP  78          HB1       TRP  78   0.202  -3.719  -0.202
  653    HD1  TRP  78           HD1      TRP  78  -2.504  -6.459  -0.291
  654    HE1  TRP  78           HE1      TRP  78  -2.976  -7.046  -2.758
  655    HE3  TRP  78           HE3      TRP  78   1.053  -3.597  -2.579
  656    HZ2  TRP  78           HZ2      TRP  78  -1.970  -6.391  -5.359
  657    HZ3  TRP  78           HZ3      TRP  78   1.271  -3.592  -5.046
  658    HH2  TRP  78           HH2      TRP  78  -0.235  -4.978  -6.438
  659    H    THR  79           HN       THR  79   2.944  -4.691   0.778
  660    HA   THR  79           HA       THR  79   2.660  -3.487   3.464
  661    HB   THR  79           HB       THR  79   3.486  -5.840   3.809
  662    HG1  THR  79           HG1      THR  79   5.445  -3.861   4.321
  663   1HG2  THR  79          HG21      THR  79   5.973  -4.873   2.379
  664   2HG2  THR  79          HG22      THR  79   4.750  -5.889   1.615
  665   3HG2  THR  79          HG23      THR  79   5.653  -6.489   3.006
  666    H    LEU  80           HN       LEU  80   4.383  -1.892   3.836
  667    HA   LEU  80           HA       LEU  80   5.096  -0.467   1.483
  668   1HB   LEU  80          HB2       LEU  80   6.315  -0.303   4.249
  669   2HB   LEU  80          HB1       LEU  80   6.524   0.901   2.977
  670    HG   LEU  80           HG       LEU  80   3.837   0.056   4.100
  671   1HD1  LEU  80          HD11      LEU  80   3.929   2.403   5.117
  672   2HD1  LEU  80          HD12      LEU  80   5.661   2.368   4.780
  673   3HD1  LEU  80          HD13      LEU  80   4.950   1.181   5.874
  674   1HD2  LEU  80          HD21      LEU  80   4.739   2.054   2.033
  675   2HD2  LEU  80          HD22      LEU  80   3.302   2.402   2.994
  676   3HD2  LEU  80          HD23      LEU  80   3.362   0.955   1.997
  677    H    ASP  81           HN       ASP  81   6.899  -2.739   3.429
  678    HA   ASP  81           HA       ASP  81   8.554  -3.475   1.179
  679   1HB   ASP  81          HB2       ASP  81   9.753  -1.463   1.666
  680   2HB   ASP  81          HB1       ASP  81   9.758  -1.811   3.395
  681    HA   PRO  82           HA       PRO  82   8.545  -7.192   3.677
  682   1HB   PRO  82          HB2       PRO  82  11.312  -7.743   2.683
  683   2HB   PRO  82          HB1       PRO  82   9.869  -8.764   2.621
  684   1HG   PRO  82          HG2       PRO  82  10.806  -7.511   0.454
  685   2HG   PRO  82          HG1       PRO  82   9.072  -7.754   0.722
  686   1HD   PRO  82          HD2       PRO  82  10.690  -5.249   1.001
  687   2HD   PRO  82          HD1       PRO  82   8.997  -5.466   0.494
  688    H    ASP  83           HN       ASP  83  12.028  -6.523   3.721
  689    HA   ASP  83           HA       ASP  83  11.978  -5.360   6.389
  690   1HB   ASP  83          HB2       ASP  83  11.635  -7.863   6.771
  691   2HB   ASP  83          HB1       ASP  83  13.245  -8.098   6.092
  692    H    SER  84           HN       SER  84  12.947  -4.517   3.909
  693    HA   SER  84           HA       SER  84  15.537  -5.083   3.136
  694   1HB   SER  84          HB2       SER  84  14.337  -2.315   3.432
  695   2HB   SER  84          HB1       SER  84  15.749  -2.712   2.457
  696    HG   SER  84           HG       SER  84  14.494  -3.856   1.092
  697    H    TYR  85           HN       TYR  85  17.242  -5.441   4.499
  698    HA   TYR  85           HA       TYR  85  17.528  -3.814   6.954
  699   1HB   TYR  85          HB2       TYR  85  19.742  -5.671   6.448
  700   2HB   TYR  85          HB1       TYR  85  18.612  -5.630   7.795
  701    HD1  TYR  85           HD1      TYR  85  19.310  -7.000   4.468
  702    HD2  TYR  85           HD2      TYR  85  16.530  -6.918   7.739
  703    HE1  TYR  85           HE1      TYR  85  18.163  -8.998   3.543
  704    HE2  TYR  85           HE2      TYR  85  15.382  -8.914   6.816
  705    HH   TYR  85           HH       TYR  85  16.371 -10.965   5.085
  706    H    ASN  86           HN       ASN  86  20.052  -4.899   4.680
  707    HA   ASN  86           HA       ASN  86  21.260  -2.190   4.858
  708   1HB   ASN  86          HB2       ASN  86  22.632  -4.241   5.362
  709   2HB   ASN  86          HB1       ASN  86  22.446  -4.706   3.671
  710   1HD2  ASN  86          HD21      ASN  86  24.174  -4.043   2.404
  711   2HD2  ASN  86          HD22      ASN  86  25.112  -2.654   2.674
  712    H    MET  87           HN       MET  87  19.126  -3.673   2.881
  713    HA   MET  87           HA       MET  87  20.312  -2.736   0.329
  714   1HB   MET  87          HB2       MET  87  17.719  -4.163   0.979
  715   2HB   MET  87          HB1       MET  87  18.157  -3.634  -0.645
  716   1HG   MET  87          HG2       MET  87  20.233  -4.989  -0.507
  717   2HG   MET  87          HG1       MET  87  19.739  -5.559   1.086
  718   1HE   MET  87          HE1       MET  87  16.325  -6.053   0.488
  719   2HE   MET  87          HE2       MET  87  17.622  -6.426   1.622
  720   3HE   MET  87          HE3       MET  87  16.844  -7.727   0.722
  721    H    PHE  88           HN       PHE  88  20.079  -0.606  -0.148
  722    HA   PHE  88           HA       PHE  88  18.144   1.091   1.161
  723   1HB   PHE  88          HB2       PHE  88  19.864   1.507  -1.301
  724   2HB   PHE  88          HB1       PHE  88  18.837   2.762  -0.611
  725    HD1  PHE  88           HD1      PHE  88  21.900   0.795  -0.199
  726    HD2  PHE  88           HD2      PHE  88  19.304   3.686   1.632
  727    HE1  PHE  88           HE1      PHE  88  23.675   1.350   1.443
  728    HE2  PHE  88           HE2      PHE  88  21.076   4.239   3.275
  729    HZ   PHE  88           HZ       PHE  88  23.263   3.072   3.179
  730    H    GLU  89           HN       GLU  89  18.270  -0.594  -1.935
  731    HA   GLU  89           HA       GLU  89  15.893   0.619  -3.031
  732   1HB   GLU  89          HB2       GLU  89  17.296  -1.994  -3.665
  733   2HB   GLU  89          HB1       GLU  89  15.967  -1.328  -4.615
  734   1HG   GLU  89          HG2       GLU  89  18.532   0.179  -4.041
  735   2HG   GLU  89          HG1       GLU  89  18.260  -0.758  -5.511
  736    H    ASN  90           HN       ASN  90  13.830  -0.540  -3.366
  737    HA   ASN  90           HA       ASN  90  12.939  -1.778  -0.875
  738   1HB   ASN  90          HB2       ASN  90  11.531  -1.080  -3.460
  739   2HB   ASN  90          HB1       ASN  90  10.712  -1.827  -2.087
  740   1HD2  ASN  90          HD21      ASN  90  10.191   0.892  -3.125
  741   2HD2  ASN  90          HD22      ASN  90  10.556   1.966  -1.862
  742    H    GLY  91           HN       GLY  91  14.832  -3.462  -2.083
  743   1HA   GLY  91          HA2       GLY  91  14.927  -5.838  -2.248
  744   2HA   GLY  91          HA1       GLY  91  13.178  -5.875  -2.459
  745    H    SER  92           HN       SER  92  14.186  -3.539  -4.542
  746    HA   SER  92           HA       SER  92  13.678  -5.088  -6.882
  747   1HB   SER  92          HB2       SER  92  14.427  -3.172  -8.136
  748   2HB   SER  92          HB1       SER  92  13.601  -2.556  -6.707
  749    HG   SER  92           HG       SER  92  15.662  -1.565  -7.126
  750    H    PHE  93           HN       PHE  93  16.685  -4.222  -5.223
  751    HA   PHE  93           HA       PHE  93  18.335  -5.591  -7.235
  752   1HB   PHE  93          HB2       PHE  93  19.125  -3.561  -5.983
  753   2HB   PHE  93          HB1       PHE  93  19.122  -4.523  -4.505
  754    HD1  PHE  93           HD1      PHE  93  20.746  -6.334  -4.171
  755    HD2  PHE  93           HD2      PHE  93  20.754  -3.965  -7.754
  756    HE1  PHE  93           HE1      PHE  93  22.995  -7.206  -4.744
  757    HE2  PHE  93           HE2      PHE  93  23.002  -4.840  -8.328
  758    HZ   PHE  93           HZ       PHE  93  24.122  -6.461  -6.823
  759    H    LEU  94           HN       LEU  94  18.783  -7.740  -7.161
  760    HA   LEU  94           HA       LEU  94  17.892  -9.324  -4.835
  761   1HB   LEU  94          HB2       LEU  94  19.276 -10.240  -7.378
  762   2HB   LEU  94          HB1       LEU  94  18.430 -11.260  -6.216
  763    HG   LEU  94           HG       LEU  94  17.155  -9.062  -7.872
  764   1HD1  LEU  94          HD11      LEU  94  16.159 -10.825  -9.169
  765   2HD1  LEU  94          HD12      LEU  94  16.777 -12.060  -8.072
  766   3HD1  LEU  94          HD13      LEU  94  17.890 -11.156  -9.098
  767   1HD2  LEU  94          HD21      LEU  94  16.134 -10.929  -5.733
  768   2HD2  LEU  94          HD22      LEU  94  15.046 -10.352  -6.995
  769   3HD2  LEU  94          HD23      LEU  94  15.842  -9.201  -5.926
  Start of MODEL    6
    1   1H    MET   1          HT1       MET   1 -22.280  19.899   1.221
    2   2H    MET   1          HT2       MET   1 -23.963  19.989   1.004
    3   3H    MET   1          HT3       MET   1 -22.932  19.918  -0.344
    4    HA   MET   1           HA       MET   1 -23.946  17.793   1.321
    5   1HB   MET   1          HB2       MET   1 -22.776  18.038  -1.463
    6   2HB   MET   1          HB1       MET   1 -23.349  16.515  -0.785
    7   1HG   MET   1          HG2       MET   1 -25.172  17.426  -2.051
    8   2HG   MET   1          HG1       MET   1 -25.570  17.669  -0.351
    9   1HE   MET   1          HE1       MET   1 -26.915  19.920   0.020
   10   2HE   MET   1          HE2       MET   1 -27.322  19.080  -1.473
   11   3HE   MET   1          HE3       MET   1 -27.148  20.832  -1.477
   12    H    LEU   2           HN       LEU   2 -22.465  15.660   0.859
   13    HA   LEU   2           HA       LEU   2 -20.102  16.062   2.505
   14   1HB   LEU   2          HB2       LEU   2 -21.029  13.625   0.957
   15   2HB   LEU   2          HB1       LEU   2 -19.777  13.633   2.199
   16    HG   LEU   2           HG       LEU   2 -22.658  14.465   2.648
   17   1HD1  LEU   2          HD11      LEU   2 -21.471  12.006   3.887
   18   2HD1  LEU   2          HD12      LEU   2 -21.995  11.918   2.206
   19   3HD1  LEU   2          HD13      LEU   2 -23.143  12.361   3.464
   20   1HD2  LEU   2          HD21      LEU   2 -21.468  15.588   4.306
   21   2HD2  LEU   2          HD22      LEU   2 -20.202  14.362   4.384
   22   3HD2  LEU   2          HD23      LEU   2 -21.777  14.053   5.112
   23    H    VAL   3           HN       VAL   3 -17.936  15.925   1.864
   24    HA   VAL   3           HA       VAL   3 -17.382  15.811  -1.081
   25    HB   VAL   3           HB       VAL   3 -15.665  17.579  -0.727
   26   1HG1  VAL   3          HG11      VAL   3 -18.491  18.297   0.118
   27   2HG1  VAL   3          HG12      VAL   3 -17.891  18.210  -1.539
   28   3HG1  VAL   3          HG13      VAL   3 -17.283  19.452  -0.444
   29   1HG2  VAL   3          HG21      VAL   3 -15.744  18.875   1.384
   30   2HG2  VAL   3          HG22      VAL   3 -15.300  17.195   1.688
   31   3HG2  VAL   3          HG23      VAL   3 -16.940  17.748   2.024
   32    H    LYS   4           HN       LYS   4 -15.139  15.164  -1.563
   33    HA   LYS   4           HA       LYS   4 -14.292  13.011   0.189
   34   1HB   LYS   4          HB2       LYS   4 -13.249  14.162  -2.398
   35   2HB   LYS   4          HB1       LYS   4 -12.341  12.927  -1.526
   36   1HG   LYS   4          HG2       LYS   4 -13.888  12.014  -3.295
   37   2HG   LYS   4          HG1       LYS   4 -14.177  11.367  -1.682
   38   1HD   LYS   4          HD2       LYS   4 -16.097  12.737  -1.361
   39   2HD   LYS   4          HD1       LYS   4 -15.694  13.756  -2.744
   40   1HE   LYS   4          HE2       LYS   4 -16.224  12.023  -4.299
   41   2HE   LYS   4          HE1       LYS   4 -16.289  10.805  -3.026
   42   1HZ   LYS   4          HZ1       LYS   4 -18.501  11.303  -3.413
   43   2HZ   LYS   4          HZ2       LYS   4 -18.208  12.965  -3.619
   44   3HZ   LYS   4          HZ3       LYS   4 -18.137  12.272  -2.068
   45    HA   PRO   5           HA       PRO   5 -11.370  15.351   2.597
   46   1HB   PRO   5          HB2       PRO   5  -9.625  13.422   3.355
   47   2HB   PRO   5          HB1       PRO   5 -11.286  13.483   3.970
   48   1HG   PRO   5          HG2       PRO   5 -10.166  11.826   1.747
   49   2HG   PRO   5          HG1       PRO   5 -11.232  11.338   3.080
   50   1HD   PRO   5          HD2       PRO   5 -12.200  11.871   0.595
   51   2HD   PRO   5          HD1       PRO   5 -13.131  12.234   2.067
   52    HA   PRO   6           HA       PRO   6  -7.980  16.418  -0.054
   53   1HB   PRO   6          HB2       PRO   6  -6.166  17.474   1.672
   54   2HB   PRO   6          HB1       PRO   6  -7.720  18.261   1.331
   55   1HG   PRO   6          HG2       PRO   6  -6.946  16.544   3.653
   56   2HG   PRO   6          HG1       PRO   6  -7.851  18.068   3.638
   57   1HD   PRO   6          HD2       PRO   6  -9.078  15.625   3.816
   58   2HD   PRO   6          HD1       PRO   6  -9.846  17.034   3.052
   59    H    TYR   7           HN       TYR   7  -7.894  13.558   1.080
   60    HA   TYR   7           HA       TYR   7  -4.934  13.147   1.174
   61   1HB   TYR   7          HB2       TYR   7  -7.169  11.150   1.647
   62   2HB   TYR   7          HB1       TYR   7  -5.450  10.872   1.905
   63    HD1  TYR   7           HD1      TYR   7  -8.384  11.522   3.594
   64    HD2  TYR   7           HD2      TYR   7  -4.330  12.930   3.388
   65    HE1  TYR   7           HE1      TYR   7  -8.596  12.460   5.874
   66    HE2  TYR   7           HE2      TYR   7  -4.538  13.858   5.675
   67    HH   TYR   7           HH       TYR   7  -7.042  14.627   7.127
   68    H    SER   8           HN       SER   8  -3.893  12.236  -0.544
   69    HA   SER   8           HA       SER   8  -5.293  11.912  -3.055
   70   1HB   SER   8          HB2       SER   8  -2.966  12.590  -3.091
   71   2HB   SER   8          HB1       SER   8  -2.489  11.164  -2.174
   72    HG   SER   8           HG       SER   8  -3.791  10.228  -4.203
   73    H    TYR   9           HN       TYR   9  -5.309   9.807  -4.285
   74    HA   TYR   9           HA       TYR   9  -6.526   7.723  -2.772
   75   1HB   TYR   9          HB2       TYR   9  -5.160   7.668  -5.481
   76   2HB   TYR   9          HB1       TYR   9  -6.060   6.307  -4.817
   77    HD1  TYR   9           HD1      TYR   9  -6.285   9.437  -6.577
   78    HD2  TYR   9           HD2      TYR   9  -8.511   6.686  -4.143
   79    HE1  TYR   9           HE1      TYR   9  -8.406  10.439  -7.383
   80    HE2  TYR   9           HE2      TYR   9 -10.631   7.685  -4.950
   81    HH   TYR   9           HH       TYR   9 -11.279   9.028  -7.216
   82    H    ILE  10           HN       ILE  10  -3.190   8.142  -3.938
   83    HA   ILE  10           HA       ILE  10  -2.207   5.656  -2.884
   84    HB   ILE  10           HB       ILE  10  -0.838   8.274  -3.563
   85   1HG1  ILE  10          HG12      ILE  10  -0.781   5.574  -4.943
   86   2HG1  ILE  10          HG11      ILE  10  -1.902   6.863  -5.377
   87   1HG2  ILE  10          HG21      ILE  10   0.290   5.652  -2.568
   88   2HG2  ILE  10          HG22      ILE  10   0.615   7.279  -1.969
   89   3HG2  ILE  10          HG23      ILE  10   1.253   6.771  -3.532
   90   1HD1  ILE  10          HD11      ILE  10   1.121   6.933  -5.536
   91   2HD1  ILE  10          HD12      ILE  10   0.108   8.365  -5.723
   92   3HD1  ILE  10          HD13      ILE  10  -0.028   7.031  -6.871
   93    H    ALA  11           HN       ALA  11  -2.473   8.936  -1.549
   94    HA   ALA  11           HA       ALA  11  -1.083   8.453   0.895
   95   1HB   ALA  11          HB1       ALA  11  -2.272  10.424   1.747
   96   2HB   ALA  11          HB2       ALA  11  -3.436  10.319   0.426
   97   3HB   ALA  11          HB3       ALA  11  -1.751  10.718   0.087
   98    H    LEU  12           HN       LEU  12  -4.552   8.060   0.078
   99    HA   LEU  12           HA       LEU  12  -5.389   7.290   2.697
  100   1HB   LEU  12          HB2       LEU  12  -6.444   6.452  -0.022
  101   2HB   LEU  12          HB1       LEU  12  -7.248   6.075   1.498
  102    HG   LEU  12           HG       LEU  12  -6.616   8.877   0.521
  103   1HD1  LEU  12          HD11      LEU  12  -8.325   7.731  -0.854
  104   2HD1  LEU  12          HD12      LEU  12  -9.037   9.034   0.098
  105   3HD1  LEU  12          HD13      LEU  12  -9.243   7.357   0.605
  106   1HD2  LEU  12          HD21      LEU  12  -8.468   9.285   2.386
  107   2HD2  LEU  12          HD22      LEU  12  -6.778   9.116   2.838
  108   3HD2  LEU  12          HD23      LEU  12  -7.876   7.747   3.014
  109    H    ILE  13           HN       ILE  13  -4.042   5.431   0.003
  110    HA   ILE  13           HA       ILE  13  -4.296   2.833   1.183
  111    HB   ILE  13           HB       ILE  13  -2.222   3.939  -0.735
  112   1HG1  ILE  13          HG12      ILE  13  -4.622   2.190  -1.326
  113   2HG1  ILE  13          HG11      ILE  13  -4.676   3.946  -1.439
  114   1HG2  ILE  13          HG21      ILE  13  -1.289   1.959   0.200
  115   2HG2  ILE  13          HG22      ILE  13  -2.010   1.455  -1.327
  116   3HG2  ILE  13          HG23      ILE  13  -2.846   1.131   0.191
  117   1HD1  ILE  13          HD11      ILE  13  -3.821   2.152  -3.435
  118   2HD1  ILE  13          HD12      ILE  13  -2.345   2.916  -2.854
  119   3HD1  ILE  13          HD13      ILE  13  -3.672   3.906  -3.457
  120    H    THR  14           HN       THR  14  -1.740   5.290   1.296
  121    HA   THR  14           HA       THR  14   0.177   3.793   2.748
  122    HB   THR  14           HB       THR  14  -0.329   6.775   2.791
  123    HG1  THR  14           HG1      THR  14   0.954   6.826   1.049
  124   1HG2  THR  14          HG21      THR  14   1.121   6.128   4.634
  125   2HG2  THR  14          HG22      THR  14   2.106   6.867   3.373
  126   3HG2  THR  14          HG23      THR  14   2.086   5.114   3.560
  127    H    MET  15           HN       MET  15  -2.455   5.903   3.945
  128    HA   MET  15           HA       MET  15  -1.722   5.557   6.721
  129   1HB   MET  15          HB2       MET  15  -4.319   6.403   5.411
  130   2HB   MET  15          HB1       MET  15  -4.076   6.373   7.156
  131   1HG   MET  15          HG2       MET  15  -2.070   7.880   6.807
  132   2HG   MET  15          HG1       MET  15  -2.579   8.047   5.127
  133   1HE   MET  15          HE1       MET  15  -5.816   9.877   5.117
  134   2HE   MET  15          HE2       MET  15  -5.885   8.134   5.360
  135   3HE   MET  15          HE3       MET  15  -4.650   8.823   4.308
  136    H    ALA  16           HN       ALA  16  -3.992   3.929   4.551
  137    HA   ALA  16           HA       ALA  16  -5.380   2.297   6.341
  138   1HB   ALA  16          HB1       ALA  16  -4.287   1.310   3.702
  139   2HB   ALA  16          HB2       ALA  16  -5.618   2.463   3.803
  140   3HB   ALA  16          HB3       ALA  16  -5.797   0.847   4.489
  141    H    ILE  17           HN       ILE  17  -2.284   1.517   4.739
  142    HA   ILE  17           HA       ILE  17  -1.838  -0.966   6.051
  143    HB   ILE  17           HB       ILE  17   0.262   1.045   5.175
  144   1HG1  ILE  17          HG12      ILE  17  -0.859  -1.220   3.510
  145   2HG1  ILE  17          HG11      ILE  17  -1.565   0.395   3.464
  146   1HG2  ILE  17          HG21      ILE  17   0.257  -1.948   5.639
  147   2HG2  ILE  17          HG22      ILE  17   1.248  -0.736   6.450
  148   3HG2  ILE  17          HG23      ILE  17   1.538  -1.120   4.753
  149   1HD1  ILE  17          HD11      ILE  17   0.646   1.339   2.866
  150   2HD1  ILE  17          HD12      ILE  17   0.091   0.162   1.674
  151   3HD1  ILE  17          HD13      ILE  17   1.322  -0.292   2.851
  152    H    GLN  18           HN       GLN  18  -0.836   2.326   6.904
  153    HA   GLN  18           HA       GLN  18   0.698   1.707   9.210
  154   1HB   GLN  18          HB2       GLN  18  -0.949   4.147   8.511
  155   2HB   GLN  18          HB1       GLN  18   0.114   4.068   9.916
  156   1HG   GLN  18          HG2       GLN  18   2.030   3.579   8.444
  157   2HG   GLN  18          HG1       GLN  18   0.966   3.652   7.040
  158   1HE2  GLN  18          HE21      GLN  18   3.264   5.460   7.626
  159   2HE2  GLN  18          HE22      GLN  18   2.615   7.025   7.717
  160    H    ASN  19           HN       ASN  19  -2.786   2.506   8.985
  161    HA   ASN  19           HA       ASN  19  -3.095   1.967  11.874
  162   1HB   ASN  19          HB2       ASN  19  -5.403   2.710  11.548
  163   2HB   ASN  19          HB1       ASN  19  -4.285   3.868  10.826
  164   1HD2  ASN  19          HD21      ASN  19  -4.624   4.368   8.654
  165   2HD2  ASN  19          HD22      ASN  19  -5.633   3.493   7.609
  166    H    ALA  20           HN       ALA  20  -2.690  -0.084   9.459
  167    HA   ALA  20           HA       ALA  20  -5.052  -1.769   9.723
  168   1HB   ALA  20          HB1       ALA  20  -3.598  -1.758   7.690
  169   2HB   ALA  20          HB2       ALA  20  -3.799  -3.371   8.374
  170   3HB   ALA  20          HB3       ALA  20  -2.303  -2.477   8.650
  171    HA   PRO  21           HA       PRO  21  -3.809  -3.363  13.811
  172   1HB   PRO  21          HB2       PRO  21  -5.260  -5.748  12.677
  173   2HB   PRO  21          HB1       PRO  21  -5.362  -5.044  14.304
  174   1HG   PRO  21          HG2       PRO  21  -7.251  -4.572  12.495
  175   2HG   PRO  21          HG1       PRO  21  -6.718  -3.307  13.616
  176   1HD   PRO  21          HD2       PRO  21  -6.191  -3.562  10.694
  177   2HD   PRO  21          HD1       PRO  21  -6.232  -2.103  11.707
  178    H    GLU  22           HN       GLU  22  -3.538  -5.234  10.823
  179    HA   GLU  22           HA       GLU  22  -1.005  -6.487  11.832
  180   1HB   GLU  22          HB2       GLU  22  -2.847  -8.079  11.225
  181   2HB   GLU  22          HB1       GLU  22  -2.836  -7.417   9.592
  182   1HG   GLU  22          HG2       GLU  22  -1.485  -9.436   9.614
  183   2HG   GLU  22          HG1       GLU  22  -0.413  -8.052   9.413
  184    H    LYS  23           HN       LYS  23   0.851  -6.052  10.636
  185    HA   LYS  23           HA       LYS  23   0.876  -3.811   8.889
  186   1HB   LYS  23          HB2       LYS  23   2.882  -4.629  10.100
  187   2HB   LYS  23          HB1       LYS  23   2.890  -6.079   9.104
  188   1HG   LYS  23          HG2       LYS  23   4.518  -4.536   8.201
  189   2HG   LYS  23          HG1       LYS  23   3.166  -4.612   7.077
  190   1HD   LYS  23          HD2       LYS  23   2.348  -2.492   7.725
  191   2HD   LYS  23          HD1       LYS  23   3.262  -2.499   9.232
  192   1HE   LYS  23          HE2       LYS  23   4.642  -2.525   6.547
  193   2HE   LYS  23          HE1       LYS  23   4.147  -1.017   7.318
  194   1HZ   LYS  23          HZ1       LYS  23   6.362  -2.695   7.914
  195   2HZ   LYS  23          HZ2       LYS  23   5.389  -2.473   9.289
  196   3HZ   LYS  23          HZ3       LYS  23   6.023  -1.128   8.467
  197    H    LYS  24           HN       LYS  24   0.744  -7.299   8.228
  198    HA   LYS  24           HA       LYS  24   0.712  -6.868   5.319
  199   1HB   LYS  24          HB2       LYS  24   0.214  -9.341   7.013
  200   2HB   LYS  24          HB1       LYS  24   0.297  -9.337   5.250
  201   1HG   LYS  24          HG2       LYS  24   2.599  -8.449   5.358
  202   2HG   LYS  24          HG1       LYS  24   2.519  -8.458   7.120
  203   1HD   LYS  24          HD2       LYS  24   2.177 -10.902   7.095
  204   2HD   LYS  24          HD1       LYS  24   2.261 -10.895   5.335
  205   1HE   LYS  24          HE2       LYS  24   4.558  -9.954   5.469
  206   2HE   LYS  24          HE1       LYS  24   4.474 -10.053   7.228
  207   1HZ   LYS  24          HZ1       LYS  24   3.964 -12.428   5.555
  208   2HZ   LYS  24          HZ2       LYS  24   4.449 -12.352   7.182
  209   3HZ   LYS  24          HZ3       LYS  24   5.550 -11.973   5.945
  210    H    ILE  25           HN       ILE  25  -1.144  -6.495   4.162
  211    HA   ILE  25           HA       ILE  25  -3.775  -7.234   5.372
  212    HB   ILE  25           HB       ILE  25  -3.268  -4.837   5.877
  213   1HG1  ILE  25          HG12      ILE  25  -5.466  -5.074   3.810
  214   2HG1  ILE  25          HG11      ILE  25  -5.606  -5.778   5.422
  215   1HG2  ILE  25          HG21      ILE  25  -1.929  -4.532   3.734
  216   2HG2  ILE  25          HG22      ILE  25  -3.060  -3.232   4.111
  217   3HG2  ILE  25          HG23      ILE  25  -3.472  -4.431   2.885
  218   1HD1  ILE  25          HD11      ILE  25  -4.960  -2.860   4.927
  219   2HD1  ILE  25          HD12      ILE  25  -5.364  -3.618   6.467
  220   3HD1  ILE  25          HD13      ILE  25  -6.594  -3.461   5.211
  221    H    THR  26           HN       THR  26  -5.377  -7.721   3.862
  222    HA   THR  26           HA       THR  26  -4.405  -8.455   1.209
  223    HB   THR  26           HB       THR  26  -7.315  -8.586   1.964
  224    HG1  THR  26           HG1      THR  26  -5.442  -9.361   3.588
  225   1HG2  THR  26          HG21      THR  26  -7.196 -10.704   0.778
  226   2HG2  THR  26          HG22      THR  26  -5.438 -10.594   0.682
  227   3HG2  THR  26          HG23      THR  26  -6.444  -9.458  -0.219
  228    H    LEU  27           HN       LEU  27  -5.527  -7.794  -0.778
  229    HA   LEU  27           HA       LEU  27  -5.683  -4.972  -1.098
  230   1HB   LEU  27          HB2       LEU  27  -5.248  -6.625  -2.921
  231   2HB   LEU  27          HB1       LEU  27  -6.920  -7.156  -2.810
  232    HG   LEU  27           HG       LEU  27  -7.685  -4.888  -3.467
  233   1HD1  LEU  27          HD11      LEU  27  -4.729  -4.340  -3.284
  234   2HD1  LEU  27          HD12      LEU  27  -6.082  -3.358  -2.726
  235   3HD1  LEU  27          HD13      LEU  27  -5.704  -3.438  -4.442
  236   1HD2  LEU  27          HD21      LEU  27  -7.004  -5.047  -5.780
  237   2HD2  LEU  27          HD22      LEU  27  -7.142  -6.684  -5.144
  238   3HD2  LEU  27          HD23      LEU  27  -5.552  -5.948  -5.340
  239    H    ASN  28           HN       ASN  28  -8.254  -7.430  -0.897
  240    HA   ASN  28           HA       ASN  28 -10.478  -5.658  -1.052
  241   1HB   ASN  28          HB2       ASN  28 -10.166  -8.340   0.320
  242   2HB   ASN  28          HB1       ASN  28 -11.712  -7.516   0.111
  243   1HD2  ASN  28          HD21      ASN  28 -11.781  -6.612  -2.424
  244   2HD2  ASN  28          HD22      ASN  28 -11.488  -7.842  -3.556
  245    H    GLY  29           HN       GLY  29  -8.578  -6.790   1.730
  246   1HA   GLY  29          HA2       GLY  29 -10.204  -5.714   3.788
  247   2HA   GLY  29          HA1       GLY  29  -8.469  -5.986   3.927
  248    H    ILE  30           HN       ILE  30  -7.611  -4.168   1.887
  249    HA   ILE  30           HA       ILE  30  -7.496  -1.741   3.370
  250    HB   ILE  30           HB       ILE  30  -7.056  -2.199   0.403
  251   1HG1  ILE  30          HG12      ILE  30  -5.045  -1.979   2.663
  252   2HG1  ILE  30          HG11      ILE  30  -5.644  -3.520   2.047
  253   1HG2  ILE  30          HG21      ILE  30  -7.374   0.164   0.784
  254   2HG2  ILE  30          HG22      ILE  30  -5.637  -0.112   0.653
  255   3HG2  ILE  30          HG23      ILE  30  -6.376   0.116   2.238
  256   1HD1  ILE  30          HD11      ILE  30  -4.851  -2.895  -0.225
  257   2HD1  ILE  30          HD12      ILE  30  -3.531  -2.956   0.945
  258   3HD1  ILE  30          HD13      ILE  30  -4.190  -1.400   0.439
  259    H    TYR  31           HN       TYR  31  -9.580  -2.681   0.633
  260    HA   TYR  31           HA       TYR  31 -10.847  -0.146   0.323
  261   1HB   TYR  31          HB2       TYR  31 -11.687  -2.975  -0.323
  262   2HB   TYR  31          HB1       TYR  31 -12.765  -1.613  -0.635
  263    HD1  TYR  31           HD1      TYR  31 -10.212  -3.592  -2.049
  264    HD2  TYR  31           HD2      TYR  31 -11.586   0.463  -1.802
  265    HE1  TYR  31           HE1      TYR  31  -8.959  -3.043  -4.116
  266    HE2  TYR  31           HE2      TYR  31 -10.337   1.013  -3.859
  267    HH   TYR  31           HH       TYR  31  -9.443  -0.179  -5.854
  268    H    GLN  32           HN       GLN  32 -11.685  -2.898   2.426
  269    HA   GLN  32           HA       GLN  32 -14.180  -1.873   3.331
  270   1HB   GLN  32          HB2       GLN  32 -13.397  -4.183   3.772
  271   2HB   GLN  32          HB1       GLN  32 -12.177  -3.547   4.874
  272   1HG   GLN  32          HG2       GLN  32 -13.949  -2.580   6.289
  273   2HG   GLN  32          HG1       GLN  32 -15.174  -3.200   5.183
  274   1HE2  GLN  32          HE21      GLN  32 -13.247  -5.663   4.845
  275   2HE2  GLN  32          HE22      GLN  32 -13.614  -6.614   6.202
  276    H    PHE  33           HN       PHE  33 -10.876  -1.311   4.496
  277    HA   PHE  33           HA       PHE  33 -11.542   0.180   6.815
  278   1HB   PHE  33          HB2       PHE  33  -9.272  -0.636   6.370
  279   2HB   PHE  33          HB1       PHE  33  -9.131   0.475   5.006
  280    HD1  PHE  33           HD1      PHE  33  -9.270   0.191   8.678
  281    HD2  PHE  33           HD2      PHE  33  -8.905   2.877   5.346
  282    HE1  PHE  33           HE1      PHE  33  -8.544   1.996  10.213
  283    HE2  PHE  33           HE2      PHE  33  -8.181   4.685   6.882
  284    HZ   PHE  33           HZ       PHE  33  -8.001   4.245   9.316
  285    H    ILE  34           HN       ILE  34 -10.915   1.361   3.491
  286    HA   ILE  34           HA       ILE  34 -11.178   4.120   4.084
  287    HB   ILE  34           HB       ILE  34 -11.733   2.559   1.551
  288   1HG1  ILE  34          HG12      ILE  34  -9.454   4.410   2.313
  289   2HG1  ILE  34          HG11      ILE  34  -9.404   2.662   2.538
  290   1HG2  ILE  34          HG21      ILE  34 -13.005   4.570   1.290
  291   2HG2  ILE  34          HG22      ILE  34 -11.472   4.875   0.473
  292   3HG2  ILE  34          HG23      ILE  34 -11.761   5.539   2.080
  293   1HD1  ILE  34          HD11      ILE  34  -9.891   4.035  -0.118
  294   2HD1  ILE  34          HD12      ILE  34  -9.700   2.300   0.148
  295   3HD1  ILE  34          HD13      ILE  34  -8.336   3.388   0.403
  296    H    MET  35           HN       MET  35 -13.717   1.863   2.912
  297    HA   MET  35           HA       MET  35 -15.802   3.810   2.948
  298   1HB   MET  35          HB2       MET  35 -15.877   0.797   3.222
  299   2HB   MET  35          HB1       MET  35 -17.330   1.791   3.105
  300   1HG   MET  35          HG2       MET  35 -16.510   2.712   0.954
  301   2HG   MET  35          HG1       MET  35 -15.088   1.676   1.065
  302   1HE   MET  35          HE1       MET  35 -16.122  -1.767   0.254
  303   2HE   MET  35          HE2       MET  35 -15.292  -0.883   1.532
  304   3HE   MET  35          HE3       MET  35 -14.969  -0.491  -0.154
  305    H    ASP  36           HN       ASP  36 -14.624   1.613   5.476
  306    HA   ASP  36           HA       ASP  36 -16.652   2.162   7.398
  307   1HB   ASP  36          HB2       ASP  36 -13.762   1.333   7.706
  308   2HB   ASP  36          HB1       ASP  36 -14.868   1.474   9.072
  309    H    ARG  37           HN       ARG  37 -13.581   3.852   6.740
  310    HA   ARG  37           HA       ARG  37 -13.981   5.687   8.981
  311   1HB   ARG  37          HB2       ARG  37 -11.967   5.325   6.798
  312   2HB   ARG  37          HB1       ARG  37 -12.049   6.912   7.553
  313   1HG   ARG  37          HG2       ARG  37 -11.804   4.336   9.128
  314   2HG   ARG  37          HG1       ARG  37 -10.408   5.271   8.606
  315   1HD   ARG  37          HD2       ARG  37 -11.793   7.261   9.789
  316   2HD   ARG  37          HD1       ARG  37 -12.435   5.909  10.715
  317    HE   ARG  37           HE       ARG  37  -9.885   7.099  11.078
  318   1HH1  ARG  37          HH21      ARG  37 -11.311   3.977  10.729
  319   2HH1  ARG  37          HH22      ARG  37  -9.939   3.141  11.371
  320   1HH2  ARG  37          HH11      ARG  37  -8.105   6.027  11.926
  321   2HH2  ARG  37          HH12      ARG  37  -8.127   4.300  12.054
  322    H    PHE  38           HN       PHE  38 -13.640   6.417   5.486
  323    HA   PHE  38           HA       PHE  38 -15.310   8.819   5.889
  324   1HB   PHE  38          HB2       PHE  38 -13.953   7.851   3.364
  325   2HB   PHE  38          HB1       PHE  38 -14.544   9.479   3.702
  326    HD1  PHE  38           HD1      PHE  38 -13.218  11.038   4.928
  327    HD2  PHE  38           HD2      PHE  38 -12.065   6.904   4.746
  328    HE1  PHE  38           HE1      PHE  38 -11.043  11.598   5.978
  329    HE2  PHE  38           HE2      PHE  38  -9.891   7.465   5.798
  330    HZ   PHE  38           HZ       PHE  38  -9.379   9.812   6.414
  331    HA   PRO  39           HA       PRO  39 -18.683   6.193   4.303
  332   1HB   PRO  39          HB2       PRO  39 -20.776   7.770   4.965
  333   2HB   PRO  39          HB1       PRO  39 -19.856   6.875   6.190
  334   1HG   PRO  39          HG2       PRO  39 -19.679   9.755   5.428
  335   2HG   PRO  39          HG1       PRO  39 -19.645   9.015   7.038
  336   1HD   PRO  39          HD2       PRO  39 -17.380   9.818   5.661
  337   2HD   PRO  39          HD1       PRO  39 -17.381   8.562   6.919
  338    H    PHE  40           HN       PHE  40 -17.684   9.223   3.107
  339    HA   PHE  40           HA       PHE  40 -19.758   9.848   1.258
  340   1HB   PHE  40          HB2       PHE  40 -16.871  10.246   0.499
  341   2HB   PHE  40          HB1       PHE  40 -18.241  11.337   0.292
  342    HD1  PHE  40           HD1      PHE  40 -19.435  11.388   2.975
  343    HD2  PHE  40           HD2      PHE  40 -15.305  11.415   1.798
  344    HE1  PHE  40           HE1      PHE  40 -18.847  12.556   5.080
  345    HE2  PHE  40           HE2      PHE  40 -14.716  12.587   3.902
  346    HZ   PHE  40           HZ       PHE  40 -16.485  13.156   5.545
  347    H    TYR  41           HN       TYR  41 -16.983   7.679   1.010
  348    HA   TYR  41           HA       TYR  41 -17.324   7.003  -1.751
  349   1HB   TYR  41          HB2       TYR  41 -15.979   5.530   0.522
  350   2HB   TYR  41          HB1       TYR  41 -15.809   5.111  -1.189
  351    HD1  TYR  41           HD1      TYR  41 -15.081   7.626   1.391
  352    HD2  TYR  41           HD2      TYR  41 -14.629   6.573  -2.734
  353    HE1  TYR  41           HE1      TYR  41 -13.387   9.418   1.131
  354    HE2  TYR  41           HE2      TYR  41 -12.931   8.351  -3.016
  355    HH   TYR  41           HH       TYR  41 -11.451   9.693  -1.754
  356    H    ARG  42           HN       ARG  42 -18.849   5.819   1.169
  357    HA   ARG  42           HA       ARG  42 -19.771   3.300   0.216
  358   1HB   ARG  42          HB2       ARG  42 -20.989   5.261   2.177
  359   2HB   ARG  42          HB1       ARG  42 -21.639   3.648   1.890
  360   1HG   ARG  42          HG2       ARG  42 -19.474   2.655   2.538
  361   2HG   ARG  42          HG1       ARG  42 -18.823   4.269   2.830
  362   1HD   ARG  42          HD2       ARG  42 -19.608   3.196   4.933
  363   2HD   ARG  42          HD1       ARG  42 -20.509   4.665   4.564
  364    HE   ARG  42           HE       ARG  42 -21.990   2.619   3.387
  365   1HH1  ARG  42          HH21      ARG  42 -20.729   3.364   6.505
  366   2HH1  ARG  42          HH22      ARG  42 -21.999   2.553   7.359
  367   1HH2  ARG  42          HH11      ARG  42 -23.654   1.555   4.478
  368   2HH2  ARG  42          HH12      ARG  42 -23.657   1.528   6.210
  369    H    GLU  43           HN       GLU  43 -21.136   6.563  -0.112
  370    HA   GLU  43           HA       GLU  43 -23.536   5.672  -1.449
  371   1HB   GLU  43          HB2       GLU  43 -23.101   7.925  -0.251
  372   2HB   GLU  43          HB1       GLU  43 -22.305   8.415  -1.746
  373   1HG   GLU  43          HG2       GLU  43 -24.570   9.153  -1.938
  374   2HG   GLU  43          HG1       GLU  43 -24.446   7.719  -2.954
  375    H    ASN  44           HN       ASN  44 -20.346   5.798  -2.384
  376    HA   ASN  44           HA       ASN  44 -21.088   5.468  -5.254
  377   1HB   ASN  44          HB2       ASN  44 -20.307   7.844  -4.822
  378   2HB   ASN  44          HB1       ASN  44 -18.746   7.168  -4.350
  379   1HD2  ASN  44          HD21      ASN  44 -19.074   8.897  -6.647
  380   2HD2  ASN  44          HD22      ASN  44 -18.716   7.985  -8.034
  381    H    LYS  45           HN       LYS  45 -20.557   3.268  -5.257
  382    HA   LYS  45           HA       LYS  45 -17.933   2.443  -4.142
  383   1HB   LYS  45          HB2       LYS  45 -20.214   0.810  -5.261
  384   2HB   LYS  45          HB1       LYS  45 -18.750   0.156  -4.530
  385   1HG   LYS  45          HG2       LYS  45 -19.283   1.306  -2.414
  386   2HG   LYS  45          HG1       LYS  45 -20.750   1.963  -3.139
  387   1HD   LYS  45          HD2       LYS  45 -21.583  -0.338  -3.518
  388   2HD   LYS  45          HD1       LYS  45 -20.126  -0.981  -2.761
  389   1HE   LYS  45          HE2       LYS  45 -22.240   0.750  -1.448
  390   2HE   LYS  45          HE1       LYS  45 -21.892  -0.942  -1.098
  391   1HZ   LYS  45          HZ1       LYS  45 -20.865   0.465   0.540
  392   2HZ   LYS  45          HZ2       LYS  45 -20.064   1.358  -0.663
  393   3HZ   LYS  45          HZ3       LYS  45 -19.657  -0.270  -0.397
  394    H    GLN  46           HN       GLN  46 -19.446   3.042  -7.226
  395    HA   GLN  46           HA       GLN  46 -17.397   1.471  -8.665
  396   1HB   GLN  46          HB2       GLN  46 -19.585   3.269  -9.743
  397   2HB   GLN  46          HB1       GLN  46 -18.595   2.153 -10.680
  398   1HG   GLN  46          HG2       GLN  46 -20.559   0.916 -10.300
  399   2HG   GLN  46          HG1       GLN  46 -19.472   0.333  -9.041
  400   1HE2  GLN  46          HE21      GLN  46 -21.737  -0.194  -8.038
  401   2HE2  GLN  46          HE22      GLN  46 -22.441   1.021  -7.085
  402    H    GLY  47           HN       GLY  47 -15.643   2.320  -9.664
  403   1HA   GLY  47          HA2       GLY  47 -14.503   4.106 -10.871
  404   2HA   GLY  47          HA1       GLY  47 -15.387   5.285  -9.908
  405    H    TRP  48           HN       TRP  48 -14.862   5.265  -7.527
  406    HA   TRP  48           HA       TRP  48 -12.061   5.595  -7.158
  407   1HB   TRP  48          HB2       TRP  48 -12.570   6.184  -4.942
  408   2HB   TRP  48          HB1       TRP  48 -14.030   6.604  -5.831
  409    HD1  TRP  48           HD1      TRP  48 -16.212   5.143  -5.394
  410    HE1  TRP  48           HE1      TRP  48 -16.830   3.528  -3.495
  411    HE3  TRP  48           HE3      TRP  48 -11.597   4.318  -3.372
  412    HZ2  TRP  48           HZ2      TRP  48 -15.555   2.036  -1.424
  413    HZ3  TRP  48           HZ3      TRP  48 -11.329   2.784  -1.449
  414    HH2  TRP  48           HH2      TRP  48 -13.297   1.643  -0.468
  415    H    GLN  49           HN       GLN  49 -14.186   2.867  -6.386
  416    HA   GLN  49           HA       GLN  49 -12.381   1.393  -4.783
  417   1HB   GLN  49          HB2       GLN  49 -14.742   0.811  -5.003
  418   2HB   GLN  49          HB1       GLN  49 -14.505   0.400  -6.700
  419   1HG   GLN  49          HG2       GLN  49 -13.048  -1.443  -6.115
  420   2HG   GLN  49          HG1       GLN  49 -13.056  -0.969  -4.416
  421   1HE2  GLN  49          HE21      GLN  49 -13.938  -3.574  -5.239
  422   2HE2  GLN  49          HE22      GLN  49 -15.607  -3.687  -4.952
  423    H    ASN  50           HN       ASN  50 -12.889   1.118  -8.322
  424    HA   ASN  50           HA       ASN  50 -10.810  -0.851  -8.634
  425   1HB   ASN  50          HB2       ASN  50 -12.241   0.939 -10.603
  426   2HB   ASN  50          HB1       ASN  50 -11.052  -0.271 -11.088
  427   1HD2  ASN  50          HD21      ASN  50 -13.915  -0.365 -11.760
  428   2HD2  ASN  50          HD22      ASN  50 -14.540  -1.768 -11.038
  429    H    SER  51           HN       SER  51 -10.806   2.691  -9.020
  430    HA   SER  51           HA       SER  51  -8.313   2.922 -10.330
  431   1HB   SER  51          HB2       SER  51  -9.637   4.804  -8.366
  432   2HB   SER  51          HB1       SER  51  -8.259   5.227  -9.378
  433    HG   SER  51           HG       SER  51  -9.922   4.184 -11.032
  434    H    ILE  52           HN       ILE  52  -8.940   2.743  -6.809
  435    HA   ILE  52           HA       ILE  52  -6.269   3.350  -6.026
  436    HB   ILE  52           HB       ILE  52  -8.364   1.663  -4.655
  437   1HG1  ILE  52          HG12      ILE  52  -7.605   4.587  -4.592
  438   2HG1  ILE  52          HG11      ILE  52  -9.170   3.884  -4.975
  439   1HG2  ILE  52          HG21      ILE  52  -7.128   1.872  -2.623
  440   2HG2  ILE  52          HG22      ILE  52  -5.989   3.001  -3.353
  441   3HG2  ILE  52          HG23      ILE  52  -5.970   1.301  -3.816
  442   1HD1  ILE  52          HD11      ILE  52  -9.386   4.718  -2.762
  443   2HD1  ILE  52          HD12      ILE  52  -7.814   4.074  -2.289
  444   3HD1  ILE  52          HD13      ILE  52  -9.166   2.977  -2.574
  445    H    ARG  53           HN       ARG  53  -7.765   0.101  -6.535
  446    HA   ARG  53           HA       ARG  53  -5.238  -1.203  -6.030
  447   1HB   ARG  53          HB2       ARG  53  -6.289  -3.216  -6.997
  448   2HB   ARG  53          HB1       ARG  53  -7.316  -2.455  -5.786
  449   1HG   ARG  53          HG2       ARG  53  -8.546  -1.309  -7.644
  450   2HG   ARG  53          HG1       ARG  53  -7.603  -2.263  -8.794
  451   1HD   ARG  53          HD2       ARG  53  -8.420  -4.340  -7.739
  452   2HD   ARG  53          HD1       ARG  53  -9.367  -3.389  -6.597
  453    HE   ARG  53           HE       ARG  53 -10.256  -2.503  -9.062
  454   1HH1  ARG  53          HH21      ARG  53  -9.816  -5.566  -7.544
  455   2HH1  ARG  53          HH22      ARG  53 -11.144  -6.314  -8.365
  456   1HH2  ARG  53          HH11      ARG  53 -11.995  -3.463 -10.145
  457   2HH2  ARG  53          HH12      ARG  53 -12.377  -5.124  -9.837
  458    H    HIS  54           HN       HIS  54  -6.717   0.209  -8.876
  459    HA   HIS  54           HA       HIS  54  -4.875  -1.006 -10.758
  460   1HB   HIS  54          HB2       HIS  54  -7.167   0.367 -11.108
  461   2HB   HIS  54          HB1       HIS  54  -6.047   1.712 -11.299
  462    HD1  HIS  54           HD1      HIS  54  -5.496   2.051 -13.710
  463    HD2  HIS  54           HD2      HIS  54  -6.015  -1.988 -12.819
  464    HE1  HIS  54           HE1      HIS  54  -5.103   0.784 -15.868
  465    H    ASN  55           HN       ASN  55  -4.944   1.899  -8.774
  466    HA   ASN  55           HA       ASN  55  -2.604   3.190  -9.774
  467   1HB   ASN  55          HB2       ASN  55  -3.923   3.203  -7.043
  468   2HB   ASN  55          HB1       ASN  55  -2.523   4.201  -7.433
  469   1HD2  ASN  55          HD21      ASN  55  -3.198   4.889 -10.135
  470   2HD2  ASN  55          HD22      ASN  55  -4.587   5.863 -10.104
  471    H    LEU  56           HN       LEU  56  -3.051   0.600  -7.398
  472    HA   LEU  56           HA       LEU  56  -0.421   0.554  -6.338
  473   1HB   LEU  56          HB2       LEU  56  -2.413  -1.680  -6.783
  474   2HB   LEU  56          HB1       LEU  56  -0.904  -1.897  -5.902
  475    HG   LEU  56           HG       LEU  56  -3.064   0.106  -5.177
  476   1HD1  LEU  56          HD11      LEU  56  -2.316  -2.379  -3.632
  477   2HD1  LEU  56          HD12      LEU  56  -3.553  -2.422  -4.889
  478   3HD1  LEU  56          HD13      LEU  56  -3.765  -1.387  -3.478
  479   1HD2  LEU  56          HD21      LEU  56  -1.193   1.041  -4.194
  480   2HD2  LEU  56          HD22      LEU  56  -0.318  -0.487  -4.129
  481   3HD2  LEU  56          HD23      LEU  56  -1.571  -0.138  -2.943
  482    H    SER  57           HN       SER  57  -1.746  -1.085  -9.219
  483    HA   SER  57           HA       SER  57   0.571  -2.611  -9.820
  484   1HB   SER  57          HB2       SER  57  -1.668  -2.870 -10.921
  485   2HB   SER  57          HB1       SER  57  -1.353  -1.386 -11.817
  486    HG   SER  57           HG       SER  57  -0.760  -3.568 -12.756
  487    H    LEU  58           HN       LEU  58  -0.344   0.669 -10.926
  488    HA   LEU  58           HA       LEU  58   2.095   1.046 -12.435
  489   1HB   LEU  58          HB2       LEU  58  -0.045   2.905 -11.401
  490   2HB   LEU  58          HB1       LEU  58   1.412   3.544 -12.162
  491    HG   LEU  58           HG       LEU  58   0.955   2.211 -14.181
  492   1HD1  LEU  58          HD11      LEU  58  -0.188   0.296 -13.382
  493   2HD1  LEU  58          HD12      LEU  58  -1.414   1.185 -14.285
  494   3HD1  LEU  58          HD13      LEU  58  -1.387   1.264 -12.524
  495   1HD2  LEU  58          HD21      LEU  58  -0.862   3.543 -14.999
  496   2HD2  LEU  58          HD22      LEU  58  -0.038   4.530 -13.790
  497   3HD2  LEU  58          HD23      LEU  58  -1.549   3.716 -13.383
  498    H    ASN  59           HN       ASN  59   1.101   1.815  -9.117
  499    HA   ASN  59           HA       ASN  59   3.557   3.260  -8.527
  500   1HB   ASN  59          HB2       ASN  59   1.392   2.085  -6.760
  501   2HB   ASN  59          HB1       ASN  59   2.754   3.020  -6.142
  502   1HD2  ASN  59          HD21      ASN  59  -0.230   3.691  -6.255
  503   2HD2  ASN  59          HD22      ASN  59  -0.295   5.194  -7.043
  504    H    GLU  60           HN       GLU  60   5.459   2.191  -8.509
  505    HA   GLU  60           HA       GLU  60   5.574  -0.673  -7.816
  506   1HB   GLU  60          HB2       GLU  60   7.675   1.314  -8.724
  507   2HB   GLU  60          HB1       GLU  60   7.999  -0.391  -8.405
  508   1HG   GLU  60          HG2       GLU  60   5.877   0.560 -10.347
  509   2HG   GLU  60          HG1       GLU  60   7.525   0.158 -10.836
  510    H    CYS  61           HN       CYS  61   5.777   2.277  -6.172
  511    HA   CYS  61           HA       CYS  61   7.846   1.793  -4.279
  512   1HB   CYS  61          HB2       CYS  61   6.728   3.437  -2.879
  513   2HB   CYS  61          HB1       CYS  61   6.624   3.965  -4.558
  514    HG   CYS  61           HG       CYS  61   4.187   2.330  -3.743
  515    H    PHE  62           HN       PHE  62   4.475   0.710  -4.391
  516    HA   PHE  62           HA       PHE  62   4.602  -0.478  -1.727
  517   1HB   PHE  62          HB2       PHE  62   2.611  -0.765  -3.997
  518   2HB   PHE  62          HB1       PHE  62   2.420  -1.523  -2.417
  519    HD1  PHE  62           HD1      PHE  62   1.855   1.450  -4.320
  520    HD2  PHE  62           HD2      PHE  62   2.583   0.021  -0.336
  521    HE1  PHE  62           HE1      PHE  62   0.927   3.556  -3.395
  522    HE2  PHE  62           HE2      PHE  62   1.655   2.126   0.590
  523    HZ   PHE  62           HZ       PHE  62   0.827   3.894  -0.940
  524    H    VAL  63           HN       VAL  63   4.813  -2.710  -1.266
  525    HA   VAL  63           HA       VAL  63   5.967  -4.373  -3.485
  526    HB   VAL  63           HB       VAL  63   6.611  -4.368  -0.523
  527   1HG1  VAL  63          HG11      VAL  63   8.456  -5.932  -1.304
  528   2HG1  VAL  63          HG12      VAL  63   7.593  -6.058  -2.837
  529   3HG1  VAL  63          HG13      VAL  63   6.830  -6.615  -1.349
  530   1HG2  VAL  63          HG21      VAL  63   8.761  -3.473  -1.222
  531   2HG2  VAL  63          HG22      VAL  63   7.491  -2.443  -1.882
  532   3HG2  VAL  63          HG23      VAL  63   8.308  -3.610  -2.921
  533    H    LYS  64           HN       LYS  64   4.981  -6.271  -3.897
  534    HA   LYS  64           HA       LYS  64   2.601  -7.049  -2.403
  535   1HB   LYS  64          HB2       LYS  64   4.124  -8.474  -4.611
  536   2HB   LYS  64          HB1       LYS  64   2.547  -8.961  -3.993
  537   1HG   LYS  64          HG2       LYS  64   1.600  -6.792  -4.684
  538   2HG   LYS  64          HG1       LYS  64   3.178  -6.303  -5.307
  539   1HD   LYS  64          HD2       LYS  64   3.155  -8.207  -6.877
  540   2HD   LYS  64          HD1       LYS  64   1.580  -8.702  -6.259
  541   1HE   LYS  64          HE2       LYS  64   0.479  -6.894  -7.243
  542   2HE   LYS  64          HE1       LYS  64   1.936  -5.900  -7.302
  543   1HZ   LYS  64          HZ1       LYS  64   1.366  -8.292  -8.966
  544   2HZ   LYS  64          HZ2       LYS  64   2.823  -7.419  -8.985
  545   3HZ   LYS  64          HZ3       LYS  64   1.381  -6.678  -9.492
  546    H    VAL  65           HN       VAL  65   2.370  -9.188  -1.376
  547    HA   VAL  65           HA       VAL  65   4.937 -10.408  -0.428
  548    HB   VAL  65           HB       VAL  65   2.540  -9.703   1.293
  549   1HG1  VAL  65          HG11      VAL  65   3.454 -11.755   2.106
  550   2HG1  VAL  65          HG12      VAL  65   4.149 -10.492   3.121
  551   3HG1  VAL  65          HG13      VAL  65   5.109 -11.212   1.827
  552   1HG2  VAL  65          HG21      VAL  65   4.040  -8.137   2.382
  553   2HG2  VAL  65          HG22      VAL  65   4.068  -7.804   0.649
  554   3HG2  VAL  65          HG23      VAL  65   5.397  -8.689   1.400
  555    HA   PRO  66           HA       PRO  66   2.094 -13.543  -2.393
  556   1HB   PRO  66          HB2       PRO  66   4.740 -14.955  -2.215
  557   2HB   PRO  66          HB1       PRO  66   3.559 -14.939  -3.541
  558   1HG   PRO  66          HG2       PRO  66   5.764 -13.483  -3.691
  559   2HG   PRO  66          HG1       PRO  66   4.218 -12.846  -4.278
  560   1HD   PRO  66          HD2       PRO  66   5.711 -12.149  -1.777
  561   2HD   PRO  66          HD1       PRO  66   4.691 -11.116  -2.803
  562    H    ARG  67           HN       ARG  67   0.955 -15.089  -1.288
  563    HA   ARG  67           HA       ARG  67   1.748 -15.698   1.489
  564   1HB   ARG  67          HB2       ARG  67  -0.471 -16.693   1.671
  565   2HB   ARG  67          HB1       ARG  67  -0.615 -15.122   0.885
  566   1HG   ARG  67          HG2       ARG  67  -0.518 -16.338  -1.339
  567   2HG   ARG  67          HG1       ARG  67  -0.656 -17.848  -0.438
  568   1HD   ARG  67          HD2       ARG  67  -2.771 -17.008   0.581
  569   2HD   ARG  67          HD1       ARG  67  -2.646 -15.560  -0.414
  570    HE   ARG  67           HE       ARG  67  -2.515 -17.650  -2.242
  571   1HH1  ARG  67          HH21      ARG  67  -4.629 -16.651   0.291
  572   2HH1  ARG  67          HH22      ARG  67  -6.048 -17.311  -0.452
  573   1HH2  ARG  67          HH11      ARG  67  -4.357 -18.517  -3.228
  574   2HH2  ARG  67          HH12      ARG  67  -5.894 -18.366  -2.444
  575    H    ASP  68           HN       ASP  68   2.118 -17.874   2.235
  576    HA   ASP  68           HA       ASP  68   3.535 -19.562   0.415
  577   1HB   ASP  68          HB2       ASP  68   2.338 -20.101   3.140
  578   2HB   ASP  68          HB1       ASP  68   3.288 -21.298   2.261
  579    H    ASP  69           HN       ASP  69   2.871 -21.316  -0.800
  580    HA   ASP  69           HA       ASP  69   0.119 -21.477  -1.579
  581   1HB   ASP  69          HB2       ASP  69   2.457 -23.350  -2.020
  582   2HB   ASP  69          HB1       ASP  69   0.870 -23.593  -2.749
  583    H    LYS  70           HN       LYS  70   2.082 -23.479   0.624
  584    HA   LYS  70           HA       LYS  70   0.084 -25.477   1.045
  585   1HB   LYS  70          HB2       LYS  70   2.391 -24.548   2.766
  586   2HB   LYS  70          HB1       LYS  70   1.368 -25.926   3.185
  587   1HG   LYS  70          HG2       LYS  70   1.912 -26.992   1.031
  588   2HG   LYS  70          HG1       LYS  70   2.936 -25.626   0.605
  589   1HD   LYS  70          HD2       LYS  70   3.368 -27.288   3.098
  590   2HD   LYS  70          HD1       LYS  70   4.141 -27.663   1.561
  591   1HE   LYS  70          HE2       LYS  70   4.907 -25.138   1.652
  592   2HE   LYS  70          HE1       LYS  70   4.586 -25.311   3.377
  593   1HZ   LYS  70          HZ1       LYS  70   6.536 -26.308   3.562
  594   2HZ   LYS  70          HZ2       LYS  70   6.779 -26.254   1.881
  595   3HZ   LYS  70          HZ3       LYS  70   5.974 -27.575   2.584
  596    H    LYS  71           HN       LYS  71   0.693 -22.393   2.734
  597    HA   LYS  71           HA       LYS  71  -1.560 -22.906   4.556
  598   1HB   LYS  71          HB2       LYS  71   0.341 -21.760   5.495
  599   2HB   LYS  71          HB1       LYS  71   0.328 -20.570   4.195
  600   1HG   LYS  71          HG2       LYS  71  -1.701 -19.604   4.954
  601   2HG   LYS  71          HG1       LYS  71  -2.028 -20.957   6.037
  602   1HD   LYS  71          HD2       LYS  71  -0.003 -20.348   7.357
  603   2HD   LYS  71          HD1       LYS  71   0.227 -18.947   6.310
  604   1HE   LYS  71          HE2       LYS  71  -2.096 -18.195   6.944
  605   2HE   LYS  71          HE1       LYS  71  -2.129 -19.497   8.134
  606   1HZ   LYS  71          HZ1       LYS  71  -1.352 -17.182   8.868
  607   2HZ   LYS  71          HZ2       LYS  71   0.100 -17.570   8.076
  608   3HZ   LYS  71          HZ3       LYS  71  -0.449 -18.528   9.367
  609    HA   PRO  72           HA       PRO  72  -4.039 -20.849   1.335
  610   1HB   PRO  72          HB2       PRO  72  -6.517 -21.410   2.313
  611   2HB   PRO  72          HB1       PRO  72  -5.528 -22.617   1.470
  612   1HG   PRO  72          HG2       PRO  72  -6.009 -22.274   4.388
  613   2HG   PRO  72          HG1       PRO  72  -5.842 -23.760   3.441
  614   1HD   PRO  72          HD2       PRO  72  -3.814 -22.650   4.989
  615   2HD   PRO  72          HD1       PRO  72  -3.541 -23.769   3.635
  616    H    GLY  73           HN       GLY  73  -3.747 -18.664   1.599
  617   1HA   GLY  73          HA2       GLY  73  -4.904 -17.312   3.992
  618   2HA   GLY  73          HA1       GLY  73  -3.724 -16.609   2.886
  619    H    LYS  74           HN       LYS  74  -5.217 -14.768   2.754
  620    HA   LYS  74           HA       LYS  74  -7.672 -15.278   1.125
  621   1HB   LYS  74          HB2       LYS  74  -6.816 -12.807   2.664
  622   2HB   LYS  74          HB1       LYS  74  -8.341 -13.002   1.805
  623   1HG   LYS  74          HG2       LYS  74  -7.447 -14.829   4.053
  624   2HG   LYS  74          HG1       LYS  74  -8.470 -13.416   4.299
  625   1HD   LYS  74          HD2       LYS  74 -10.014 -14.458   2.499
  626   2HD   LYS  74          HD1       LYS  74  -9.103 -15.944   2.770
  627   1HE   LYS  74          HE2       LYS  74  -9.626 -15.780   5.201
  628   2HE   LYS  74          HE1       LYS  74 -10.637 -14.377   4.858
  629   1HZ   LYS  74          HZ1       LYS  74 -11.968 -15.757   3.375
  630   2HZ   LYS  74          HZ2       LYS  74 -11.954 -16.389   4.952
  631   3HZ   LYS  74          HZ3       LYS  74 -11.004 -17.105   3.739
  632    H    GLY  75           HN       GLY  75  -4.721 -15.064   0.270
  633   1HA   GLY  75          HA2       GLY  75  -4.305 -14.510  -2.130
  634   2HA   GLY  75          HA1       GLY  75  -5.151 -12.988  -1.861
  635    H    SER  76           HN       SER  76  -3.071 -12.113  -2.751
  636    HA   SER  76           HA       SER  76  -0.681 -12.282  -1.085
  637   1HB   SER  76          HB2       SER  76  -0.472 -11.943  -3.505
  638   2HB   SER  76          HB1       SER  76  -1.398 -10.448  -3.395
  639    HG   SER  76           HG       SER  76   1.164 -11.037  -2.341
  640    H    TYR  77           HN       TYR  77   0.117 -10.666   0.288
  641    HA   TYR  77           HA       TYR  77  -1.888  -8.634   1.176
  642   1HB   TYR  77          HB2       TYR  77   0.610  -9.349   2.700
  643   2HB   TYR  77          HB1       TYR  77  -0.936  -8.761   3.312
  644    HD1  TYR  77           HD1      TYR  77  -2.950 -10.458   2.178
  645    HD2  TYR  77           HD2      TYR  77   1.001 -11.514   3.488
  646    HE1  TYR  77           HE1      TYR  77  -3.695 -12.792   2.541
  647    HE2  TYR  77           HE2      TYR  77   0.258 -13.851   3.849
  648    HH   TYR  77           HH       TYR  77  -2.387 -15.155   2.564
  649    H    TRP  78           HN       TRP  78  -0.978  -6.495   1.799
  650    HA   TRP  78           HA       TRP  78   1.347  -5.724   0.056
  651   1HB   TRP  78          HB2       TRP  78  -1.125  -4.148   0.838
  652   2HB   TRP  78          HB1       TRP  78   0.230  -3.504  -0.092
  653    HD1  TRP  78           HD1      TRP  78  -2.569  -6.121  -0.308
  654    HE1  TRP  78           HE1      TRP  78  -2.971  -6.689  -2.790
  655    HE3  TRP  78           HE3      TRP  78   1.242  -3.488  -2.443
  656    HZ2  TRP  78           HZ2      TRP  78  -1.815  -6.105  -5.347
  657    HZ3  TRP  78           HZ3      TRP  78   1.565  -3.498  -4.902
  658    HH2  TRP  78           HH2      TRP  78   0.041  -4.799  -6.352
  659    H    THR  79           HN       THR  79   2.956  -4.509   0.994
  660    HA   THR  79           HA       THR  79   2.556  -3.439   3.743
  661    HB   THR  79           HB       THR  79   3.478  -5.741   3.988
  662    HG1  THR  79           HG1      THR  79   4.357  -3.545   5.028
  663   1HG2  THR  79          HG21      THR  79   5.567  -6.365   3.038
  664   2HG2  THR  79          HG22      THR  79   5.929  -4.707   2.560
  665   3HG2  THR  79          HG23      THR  79   4.668  -5.610   1.722
  666    H    LEU  80           HN       LEU  80   4.298  -1.912   4.335
  667    HA   LEU  80           HA       LEU  80   5.120  -0.311   2.038
  668   1HB   LEU  80          HB2       LEU  80   5.720  -0.057   5.000
  669   2HB   LEU  80          HB1       LEU  80   6.210   1.126   3.791
  670    HG   LEU  80           HG       LEU  80   3.338   0.279   4.256
  671   1HD1  LEU  80          HD11      LEU  80   3.113   2.474   5.411
  672   2HD1  LEU  80          HD12      LEU  80   4.857   2.694   5.281
  673   3HD1  LEU  80          HD13      LEU  80   4.207   1.378   6.258
  674   1HD2  LEU  80          HD21      LEU  80   3.072   2.635   3.096
  675   2HD2  LEU  80          HD22      LEU  80   3.392   1.215   2.109
  676   3HD2  LEU  80          HD23      LEU  80   4.704   2.323   2.508
  677    H    ASP  81           HN       ASP  81   7.412   0.316   1.694
  678    HA   ASP  81           HA       ASP  81   9.107  -1.952   1.406
  679   1HB   ASP  81          HB2       ASP  81  10.044   0.926   1.554
  680   2HB   ASP  81          HB1       ASP  81  10.765  -0.393   0.632
  681    HA   PRO  82           HA       PRO  82  11.042  -2.534   5.391
  682   1HB   PRO  82          HB2       PRO  82  13.685  -2.035   4.047
  683   2HB   PRO  82          HB1       PRO  82  13.198  -3.368   5.114
  684   1HG   PRO  82          HG2       PRO  82  13.373  -3.722   2.494
  685   2HG   PRO  82          HG1       PRO  82  12.068  -4.474   3.427
  686   1HD   PRO  82          HD2       PRO  82  11.945  -2.124   1.582
  687   2HD   PRO  82          HD1       PRO  82  10.717  -3.363   1.925
  688    H    ASP  83           HN       ASP  83  13.822  -1.173   5.736
  689    HA   ASP  83           HA       ASP  83  12.918   1.113   7.180
  690   1HB   ASP  83          HB2       ASP  83  15.634   0.388   6.043
  691   2HB   ASP  83          HB1       ASP  83  15.368   1.805   7.059
  692    H    SER  84           HN       SER  84  14.400   0.833   3.952
  693    HA   SER  84           HA       SER  84  12.817   2.872   2.771
  694   1HB   SER  84          HB2       SER  84  13.857   4.559   4.027
  695   2HB   SER  84          HB1       SER  84  15.419   3.746   4.004
  696    HG   SER  84           HG       SER  84  15.780   4.468   2.009
  697    H    TYR  85           HN       TYR  85  13.690   0.333   2.025
  698    HA   TYR  85           HA       TYR  85  16.022   0.324   0.385
  699   1HB   TYR  85          HB2       TYR  85  14.320  -1.606   1.202
  700   2HB   TYR  85          HB1       TYR  85  13.679  -1.371  -0.420
  701    HD1  TYR  85           HD1      TYR  85  14.889  -2.137  -2.354
  702    HD2  TYR  85           HD2      TYR  85  16.736  -2.171   1.527
  703    HE1  TYR  85           HE1      TYR  85  16.773  -3.472  -3.262
  704    HE2  TYR  85           HE2      TYR  85  18.617  -3.510   0.617
  705    HH   TYR  85           HH       TYR  85  18.975  -4.087  -2.809
  706    H    ASN  86           HN       ASN  86  12.640   1.141  -0.303
  707    HA   ASN  86           HA       ASN  86  13.546   2.442  -2.844
  708   1HB   ASN  86          HB2       ASN  86  12.416   0.200  -3.233
  709   2HB   ASN  86          HB1       ASN  86  10.953   0.916  -2.555
  710   1HD2  ASN  86          HD21      ASN  86  13.450   2.254  -4.792
  711   2HD2  ASN  86          HD22      ASN  86  12.340   2.700  -5.997
  712    H    MET  87           HN       MET  87  12.842   3.428  -0.081
  713    HA   MET  87           HA       MET  87  10.268   4.756  -0.335
  714   1HB   MET  87          HB2       MET  87  12.577   4.944   1.589
  715   2HB   MET  87          HB1       MET  87  11.322   6.182   1.619
  716   1HG   MET  87          HG2       MET  87  10.710   3.220   1.758
  717   2HG   MET  87          HG1       MET  87  10.940   4.225   3.191
  718   1HE   MET  87          HE1       MET  87   7.050   3.313   2.137
  719   2HE   MET  87          HE2       MET  87   8.434   2.677   3.023
  720   3HE   MET  87          HE3       MET  87   8.406   2.590   1.263
  721    H    PHE  88           HN       PHE  88  12.629   5.111  -2.306
  722    HA   PHE  88           HA       PHE  88  13.020   8.042  -2.211
  723   1HB   PHE  88          HB2       PHE  88  14.033   5.852  -4.041
  724   2HB   PHE  88          HB1       PHE  88  14.344   7.563  -4.338
  725    HD1  PHE  88           HD1      PHE  88  14.893   4.764  -1.967
  726    HD2  PHE  88           HD2      PHE  88  15.922   8.800  -3.016
  727    HE1  PHE  88           HE1      PHE  88  16.780   4.702  -0.357
  728    HE2  PHE  88           HE2      PHE  88  17.810   8.737  -1.409
  729    HZ   PHE  88           HZ       PHE  88  18.238   6.688  -0.079
  730    H    GLU  89           HN       GLU  89  10.315   7.041  -2.584
  731    HA   GLU  89           HA       GLU  89   9.595   7.141  -5.377
  732   1HB   GLU  89          HB2       GLU  89   7.265   7.503  -4.477
  733   2HB   GLU  89          HB1       GLU  89   8.074   6.076  -3.833
  734   1HG   GLU  89          HG2       GLU  89   8.698   7.315  -1.809
  735   2HG   GLU  89          HG1       GLU  89   7.951   8.776  -2.455
  736    H    ASN  90           HN       ASN  90   8.035   8.918  -6.170
  737    HA   ASN  90           HA       ASN  90   9.423  11.423  -6.097
  738   1HB   ASN  90          HB2       ASN  90   7.515  12.281  -7.411
  739   2HB   ASN  90          HB1       ASN  90   8.047  10.715  -8.027
  740   1HD2  ASN  90          HD21      ASN  90   5.593  10.958  -8.827
  741   2HD2  ASN  90          HD22      ASN  90   4.437  10.254  -7.802
  742    H    GLY  91           HN       GLY  91   7.670  10.057  -3.723
  743   1HA   GLY  91          HA2       GLY  91   6.292  12.515  -2.813
  744   2HA   GLY  91          HA1       GLY  91   6.195  10.927  -2.049
  745    H    SER  92           HN       SER  92   6.787  11.657   0.011
  746    HA   SER  92           HA       SER  92   9.604  11.770   0.564
  747   1HB   SER  92          HB2       SER  92   8.074  14.371   0.512
  748   2HB   SER  92          HB1       SER  92   9.475  14.162   1.559
  749    HG   SER  92           HG       SER  92  10.752  14.098  -0.142
  750    H    PHE  93           HN       PHE  93   9.673  10.751   2.513
  751    HA   PHE  93           HA       PHE  93   7.318  10.766   4.269
  752   1HB   PHE  93          HB2       PHE  93   8.641   8.699   3.992
  753   2HB   PHE  93          HB1       PHE  93  10.054   9.514   4.663
  754    HD1  PHE  93           HD1      PHE  93  10.220  10.023   7.030
  755    HD2  PHE  93           HD2      PHE  93   6.685   8.190   5.415
  756    HE1  PHE  93           HE1      PHE  93   9.440   9.504   9.325
  757    HE2  PHE  93           HE2      PHE  93   5.908   7.669   7.711
  758    HZ   PHE  93           HZ       PHE  93   7.285   8.325   9.666
  759    H    LEU  94           HN       LEU  94   7.052  12.108   5.995
  760    HA   LEU  94           HA       LEU  94   8.930  14.254   6.458
  761   1HB   LEU  94          HB2       LEU  94   6.479  14.479   6.809
  762   2HB   LEU  94          HB1       LEU  94   6.580  13.339   8.147
  763    HG   LEU  94           HG       LEU  94   8.149  14.880   9.312
  764   1HD1  LEU  94          HD11      LEU  94   7.750  16.451   6.778
  765   2HD1  LEU  94          HD12      LEU  94   9.225  16.182   7.705
  766   3HD1  LEU  94          HD13      LEU  94   8.017  17.320   8.288
  767   1HD2  LEU  94          HD21      LEU  94   6.427  16.656   9.783
  768   2HD2  LEU  94          HD22      LEU  94   5.793  15.012   9.860
  769   3HD2  LEU  94          HD23      LEU  94   5.475  16.013   8.444
  Start of MODEL    7
    1   1H    MET   1          HT1       MET   1 -22.896  16.116   2.635
    2   2H    MET   1          HT2       MET   1 -24.002  16.704   1.488
    3   3H    MET   1          HT3       MET   1 -23.963  17.366   3.052
    4    HA   MET   1           HA       MET   1 -22.589  18.247   0.811
    5   1HB   MET   1          HB2       MET   1 -22.385  18.907   3.763
    6   2HB   MET   1          HB1       MET   1 -21.668  19.885   2.481
    7   1HG   MET   1          HG2       MET   1 -23.898  20.190   1.465
    8   2HG   MET   1          HG1       MET   1 -24.613  19.217   2.749
    9   1HE   MET   1          HE1       MET   1 -22.743  22.196   1.640
   10   2HE   MET   1          HE2       MET   1 -21.714  22.151   3.069
   11   3HE   MET   1          HE3       MET   1 -22.908  23.434   2.891
   12    H    LEU   2           HN       LEU   2 -21.726  15.526   1.895
   13    HA   LEU   2           HA       LEU   2 -19.016  15.815   2.856
   14   1HB   LEU   2          HB2       LEU   2 -20.184  13.451   1.363
   15   2HB   LEU   2          HB1       LEU   2 -18.830  13.441   2.492
   16    HG   LEU   2           HG       LEU   2 -21.697  14.132   3.199
   17   1HD1  LEU   2          HD11      LEU   2 -19.992  11.674   3.685
   18   2HD1  LEU   2          HD12      LEU   2 -21.496  11.764   2.769
   19   3HD1  LEU   2          HD13      LEU   2 -21.515  11.986   4.518
   20   1HD2  LEU   2          HD21      LEU   2 -19.110  14.063   4.762
   21   2HD2  LEU   2          HD22      LEU   2 -20.663  13.840   5.567
   22   3HD2  LEU   2          HD23      LEU   2 -20.326  15.339   4.706
   23    H    VAL   3           HN       VAL   3 -17.099  15.779   1.695
   24    HA   VAL   3           HA       VAL   3 -17.285  15.766  -1.298
   25    HB   VAL   3           HB       VAL   3 -15.609  17.570  -1.362
   26   1HG1  VAL   3          HG11      VAL   3 -17.941  18.244  -1.439
   27   2HG1  VAL   3          HG12      VAL   3 -17.061  19.398  -0.438
   28   3HG1  VAL   3          HG13      VAL   3 -18.064  18.160   0.317
   29   1HG2  VAL   3          HG21      VAL   3 -15.859  17.359   1.646
   30   2HG2  VAL   3          HG22      VAL   3 -15.223  18.802   0.855
   31   3HG2  VAL   3          HG23      VAL   3 -14.394  17.256   0.668
   32    H    LYS   4           HN       LYS   4 -15.204  15.149  -2.315
   33    HA   LYS   4           HA       LYS   4 -14.078  12.835  -1.179
   34   1HB   LYS   4          HB2       LYS   4 -12.720  14.709  -3.134
   35   2HB   LYS   4          HB1       LYS   4 -12.370  12.994  -2.904
   36   1HG   LYS   4          HG2       LYS   4 -14.849  12.587  -3.470
   37   2HG   LYS   4          HG1       LYS   4 -14.867  14.251  -4.050
   38   1HD   LYS   4          HD2       LYS   4 -13.033  13.740  -5.610
   39   2HD   LYS   4          HD1       LYS   4 -12.991  12.076  -5.021
   40   1HE   LYS   4          HE2       LYS   4 -15.420  11.874  -5.692
   41   2HE   LYS   4          HE1       LYS   4 -15.268  13.447  -6.474
   42   1HZ   LYS   4          HZ1       LYS   4 -13.814  10.949  -7.123
   43   2HZ   LYS   4          HZ2       LYS   4 -13.346  12.470  -7.721
   44   3HZ   LYS   4          HZ3       LYS   4 -14.869  11.828  -8.119
   45    HA   PRO   5           HA       PRO   5 -11.842  14.796   2.274
   46   1HB   PRO   5          HB2       PRO   5 -10.284  12.259   1.800
   47   2HB   PRO   5          HB1       PRO   5 -10.731  13.019   3.345
   48   1HG   PRO   5          HG2       PRO   5 -12.131  10.984   2.435
   49   2HG   PRO   5          HG1       PRO   5 -12.959  12.378   3.155
   50   1HD   PRO   5          HD2       PRO   5 -12.780  11.579   0.282
   51   2HD   PRO   5          HD1       PRO   5 -14.072  12.464   1.125
   52    HA   PRO   6           HA       PRO   6  -8.382  16.584   0.078
   53   1HB   PRO   6          HB2       PRO   6  -6.914  17.605   2.118
   54   2HB   PRO   6          HB1       PRO   6  -8.511  18.257   1.697
   55   1HG   PRO   6          HG2       PRO   6  -7.777  16.328   3.863
   56   2HG   PRO   6          HG1       PRO   6  -8.835  17.750   3.940
   57   1HD   PRO   6          HD2       PRO   6  -9.811  15.206   3.671
   58   2HD   PRO   6          HD1       PRO   6 -10.635  16.628   2.991
   59    H    TYR   7           HN       TYR   7  -8.175  13.669   0.847
   60    HA   TYR   7           HA       TYR   7  -5.206  13.457   1.233
   61   1HB   TYR   7          HB2       TYR   7  -7.335  11.326   1.605
   62   2HB   TYR   7          HB1       TYR   7  -5.624  11.183   2.003
   63    HD1  TYR   7           HD1      TYR   7  -8.742  11.704   3.429
   64    HD2  TYR   7           HD2      TYR   7  -4.763  13.324   3.508
   65    HE1  TYR   7           HE1      TYR   7  -9.186  12.675   5.660
   66    HE2  TYR   7           HE2      TYR   7  -5.207  14.293   5.744
   67    HH   TYR   7           HH       TYR   7  -7.112  13.487   7.752
   68    H    SER   8           HN       SER   8  -4.030  12.604  -0.435
   69    HA   SER   8           HA       SER   8  -5.242  12.224  -3.015
   70   1HB   SER   8          HB2       SER   8  -2.839  12.861  -2.653
   71   2HB   SER   8          HB1       SER   8  -2.538  11.232  -2.054
   72    HG   SER   8           HG       SER   8  -3.525  11.949  -4.622
   73    H    TYR   9           HN       TYR   9  -5.238  10.105  -4.213
   74    HA   TYR   9           HA       TYR   9  -6.559   8.069  -2.719
   75   1HB   TYR   9          HB2       TYR   9  -5.184   8.070  -5.414
   76   2HB   TYR   9          HB1       TYR   9  -5.919   6.608  -4.759
   77    HD1  TYR   9           HD1      TYR   9  -8.376   6.612  -4.164
   78    HD2  TYR   9           HD2      TYR   9  -6.519   9.815  -6.340
   79    HE1  TYR   9           HE1      TYR   9 -10.604   7.389  -4.918
   80    HE2  TYR   9           HE2      TYR   9  -8.749  10.595  -7.094
   81    HH   TYR   9           HH       TYR   9 -11.672   9.388  -5.738
   82    H    ILE  10           HN       ILE  10  -3.164   8.477  -3.675
   83    HA   ILE  10           HA       ILE  10  -2.231   5.961  -2.676
   84    HB   ILE  10           HB       ILE  10  -0.840   8.636  -3.001
   85   1HG1  ILE  10          HG12      ILE  10  -0.647   6.095  -4.645
   86   2HG1  ILE  10          HG11      ILE  10  -1.736   7.425  -5.040
   87   1HG2  ILE  10          HG21      ILE  10   0.450   7.434  -1.386
   88   2HG2  ILE  10          HG22      ILE  10   1.252   7.162  -2.932
   89   3HG2  ILE  10          HG23      ILE  10   0.227   5.907  -2.239
   90   1HD1  ILE  10          HD11      ILE  10   1.287   7.487  -4.932
   91   2HD1  ILE  10          HD12      ILE  10   0.303   8.948  -5.014
   92   3HD1  ILE  10          HD13      ILE  10   0.253   7.776  -6.330
   93    H    ALA  11           HN       ALA  11  -2.601   9.155  -1.148
   94    HA   ALA  11           HA       ALA  11  -1.413   8.495   1.357
   95   1HB   ALA  11          HB1       ALA  11  -2.656  10.411   2.247
   96   2HB   ALA  11          HB2       ALA  11  -3.721  10.404   0.840
   97   3HB   ALA  11          HB3       ALA  11  -2.015  10.812   0.654
   98    H    LEU  12           HN       LEU  12  -4.801   8.223   0.249
   99    HA   LEU  12           HA       LEU  12  -5.859   7.257   2.717
  100   1HB   LEU  12          HB2       LEU  12  -6.687   6.742  -0.153
  101   2HB   LEU  12          HB1       LEU  12  -7.626   6.193   1.232
  102    HG   LEU  12           HG       LEU  12  -6.850   9.088   0.766
  103   1HD1  LEU  12          HD11      LEU  12  -9.407   7.605   0.087
  104   2HD1  LEU  12          HD12      LEU  12  -8.294   8.365  -1.051
  105   3HD1  LEU  12          HD13      LEU  12  -9.237   9.360   0.058
  106   1HD2  LEU  12          HD21      LEU  12  -8.561   7.630   2.779
  107   2HD2  LEU  12          HD22      LEU  12  -8.966   9.286   2.340
  108   3HD2  LEU  12          HD23      LEU  12  -7.394   8.925   3.041
  109    H    ILE  13           HN       ILE  13  -4.356   5.581  -0.027
  110    HA   ILE  13           HA       ILE  13  -4.711   2.932   1.078
  111    HB   ILE  13           HB       ILE  13  -2.692   3.968  -0.931
  112   1HG1  ILE  13          HG12      ILE  13  -5.299   2.491  -1.402
  113   2HG1  ILE  13          HG11      ILE  13  -5.157   4.243  -1.491
  114   1HG2  ILE  13          HG21      ILE  13  -2.647   1.548  -1.628
  115   2HG2  ILE  13          HG22      ILE  13  -3.569   1.169  -0.174
  116   3HG2  ILE  13          HG23      ILE  13  -1.947   1.849  -0.039
  117   1HD1  ILE  13          HD11      ILE  13  -4.868   3.585  -3.727
  118   2HD1  ILE  13          HD12      ILE  13  -3.934   2.158  -3.286
  119   3HD1  ILE  13          HD13      ILE  13  -3.205   3.759  -3.169
  120    H    THR  14           HN       THR  14  -2.053   5.302   1.138
  121    HA   THR  14           HA       THR  14  -0.135   3.675   2.459
  122    HB   THR  14           HB       THR  14  -0.536   6.670   2.666
  123    HG1  THR  14           HG1      THR  14   1.172   6.570   1.046
  124   1HG2  THR  14          HG21      THR  14   1.946   6.616   3.144
  125   2HG2  THR  14          HG22      THR  14   1.802   4.867   3.324
  126   3HG2  THR  14          HG23      THR  14   0.936   5.940   4.423
  127    H    MET  15           HN       MET  15  -2.716   5.737   3.775
  128    HA   MET  15           HA       MET  15  -1.949   5.351   6.532
  129   1HB   MET  15          HB2       MET  15  -4.548   6.217   5.247
  130   2HB   MET  15          HB1       MET  15  -4.308   6.158   6.992
  131   1HG   MET  15          HG2       MET  15  -2.287   7.652   6.667
  132   2HG   MET  15          HG1       MET  15  -2.790   7.847   4.988
  133   1HE   MET  15          HE1       MET  15  -4.773   8.750   4.152
  134   2HE   MET  15          HE2       MET  15  -5.955   9.767   4.971
  135   3HE   MET  15          HE3       MET  15  -6.049   8.015   5.133
  136    H    ALA  16           HN       ALA  16  -4.164   3.675   4.346
  137    HA   ALA  16           HA       ALA  16  -5.456   2.027   6.260
  138   1HB   ALA  16          HB1       ALA  16  -4.806   1.680   3.334
  139   2HB   ALA  16          HB2       ALA  16  -6.365   2.042   4.075
  140   3HB   ALA  16          HB3       ALA  16  -5.667   0.430   4.233
  141    H    ILE  17           HN       ILE  17  -2.468   1.423   4.383
  142    HA   ILE  17           HA       ILE  17  -1.952  -1.195   5.378
  143    HB   ILE  17           HB       ILE  17   0.076   0.951   4.666
  144   1HG1  ILE  17          HG12      ILE  17  -1.110  -1.176   2.865
  145   2HG1  ILE  17          HG11      ILE  17  -1.718   0.478   2.931
  146   1HG2  ILE  17          HG21      ILE  17   1.069  -0.985   5.787
  147   2HG2  ILE  17          HG22      ILE  17   1.473  -1.034   4.071
  148   3HG2  ILE  17          HG23      ILE  17   0.205  -2.082   4.710
  149   1HD1  ILE  17          HD11      ILE  17  -0.101   0.278   1.103
  150   2HD1  ILE  17          HD12      ILE  17   1.109  -0.356   2.219
  151   3HD1  ILE  17          HD13      ILE  17   0.558   1.313   2.371
  152    H    GLN  18           HN       GLN  18  -0.784   1.959   6.488
  153    HA   GLN  18           HA       GLN  18   0.624   0.982   8.793
  154   1HB   GLN  18          HB2       GLN  18  -0.519   3.704   8.103
  155   2HB   GLN  18          HB1       GLN  18   0.498   3.400   9.514
  156   1HG   GLN  18          HG2       GLN  18   2.343   2.704   8.135
  157   2HG   GLN  18          HG1       GLN  18   1.334   2.705   6.689
  158   1HE2  GLN  18          HE21      GLN  18   3.793   4.327   7.168
  159   2HE2  GLN  18          HE22      GLN  18   3.311   5.948   7.023
  160    H    ASN  19           HN       ASN  19  -2.673   2.176   8.299
  161    HA   ASN  19           HA       ASN  19  -3.359   2.047  11.126
  162   1HB   ASN  19          HB2       ASN  19  -5.029   2.325   8.612
  163   2HB   ASN  19          HB1       ASN  19  -5.708   2.357  10.241
  164   1HD2  ASN  19          HD21      ASN  19  -2.732   3.682  10.681
  165   2HD2  ASN  19          HD22      ASN  19  -3.091   5.321  10.427
  166    H    ALA  20           HN       ALA  20  -2.699  -0.348   8.970
  167    HA   ALA  20           HA       ALA  20  -4.913  -2.147   9.564
  168   1HB   ALA  20          HB1       ALA  20  -2.223  -3.084   8.573
  169   2HB   ALA  20          HB2       ALA  20  -3.267  -2.137   7.514
  170   3HB   ALA  20          HB3       ALA  20  -3.831  -3.679   8.156
  171    HA   PRO  21           HA       PRO  21  -3.847  -3.783  13.550
  172   1HB   PRO  21          HB2       PRO  21  -3.535  -6.394  12.079
  173   2HB   PRO  21          HB1       PRO  21  -4.337  -6.070  13.630
  174   1HG   PRO  21          HG2       PRO  21  -5.740  -6.341  11.377
  175   2HG   PRO  21          HG1       PRO  21  -6.211  -5.178  12.628
  176   1HD   PRO  21          HD2       PRO  21  -5.066  -4.654   9.938
  177   2HD   PRO  21          HD1       PRO  21  -6.001  -3.574  10.996
  178    H    GLU  22           HN       GLU  22  -1.926  -5.923  11.430
  179    HA   GLU  22           HA       GLU  22   0.478  -5.281  13.027
  180   1HB   GLU  22          HB2       GLU  22  -0.022  -7.281  10.803
  181   2HB   GLU  22          HB1       GLU  22   1.503  -7.116  11.676
  182   1HG   GLU  22          HG2       GLU  22   0.353  -7.598  13.799
  183   2HG   GLU  22          HG1       GLU  22  -1.180  -7.749  12.940
  184    H    LYS  23           HN       LYS  23   0.344  -5.902   9.531
  185    HA   LYS  23           HA       LYS  23   1.104  -3.187   8.815
  186   1HB   LYS  23          HB2       LYS  23   3.225  -4.031   9.809
  187   2HB   LYS  23          HB1       LYS  23   3.203  -5.378   8.678
  188   1HG   LYS  23          HG2       LYS  23   4.695  -3.733   7.774
  189   2HG   LYS  23          HG1       LYS  23   3.235  -3.678   6.795
  190   1HD   LYS  23          HD2       LYS  23   2.496  -1.660   7.795
  191   2HD   LYS  23          HD1       LYS  23   3.602  -1.832   9.159
  192   1HE   LYS  23          HE2       LYS  23   5.520  -1.559   7.577
  193   2HE   LYS  23          HE1       LYS  23   4.363  -1.264   6.279
  194   1HZ   LYS  23          HZ1       LYS  23   5.037   0.410   8.591
  195   2HZ   LYS  23          HZ2       LYS  23   3.462   0.493   7.960
  196   3HZ   LYS  23          HZ3       LYS  23   4.796   0.853   6.972
  197    H    LYS  24           HN       LYS  24   0.894  -6.612   7.963
  198    HA   LYS  24           HA       LYS  24   0.726  -6.002   5.079
  199   1HB   LYS  24          HB2       LYS  24   0.430  -8.618   6.592
  200   2HB   LYS  24          HB1       LYS  24   0.491  -8.457   4.837
  201   1HG   LYS  24          HG2       LYS  24   2.745  -7.465   5.001
  202   2HG   LYS  24          HG1       LYS  24   2.688  -7.630   6.757
  203   1HD   LYS  24          HD2       LYS  24   2.459 -10.072   6.533
  204   2HD   LYS  24          HD1       LYS  24   2.501  -9.919   4.778
  205   1HE   LYS  24          HE2       LYS  24   4.720 -10.525   5.521
  206   2HE   LYS  24          HE1       LYS  24   4.761  -8.844   4.993
  207   1HZ   LYS  24          HZ1       LYS  24   5.639  -9.737   7.375
  208   2HZ   LYS  24          HZ2       LYS  24   4.081  -9.186   7.770
  209   3HZ   LYS  24          HZ3       LYS  24   5.200  -8.131   7.046
  210    H    ILE  25           HN       ILE  25  -1.177  -5.988   3.902
  211    HA   ILE  25           HA       ILE  25  -3.698  -6.841   5.241
  212    HB   ILE  25           HB       ILE  25  -3.373  -4.382   5.612
  213   1HG1  ILE  25          HG12      ILE  25  -5.656  -4.962   3.711
  214   2HG1  ILE  25          HG11      ILE  25  -5.626  -5.538   5.378
  215   1HG2  ILE  25          HG21      ILE  25  -2.168  -3.918   3.494
  216   2HG2  ILE  25          HG22      ILE  25  -3.566  -2.865   3.702
  217   3HG2  ILE  25          HG23      ILE  25  -3.650  -4.230   2.593
  218   1HD1  ILE  25          HD11      ILE  25  -5.419  -3.228   6.190
  219   2HD1  ILE  25          HD12      ILE  25  -6.860  -3.404   5.190
  220   3HD1  ILE  25          HD13      ILE  25  -5.417  -2.635   4.529
  221    H    THR  26           HN       THR  26  -5.412  -7.310   3.736
  222    HA   THR  26           HA       THR  26  -4.406  -8.232   1.128
  223    HB   THR  26           HB       THR  26  -6.635  -9.276   0.922
  224    HG1  THR  26           HG1      THR  26  -8.216  -8.535   2.065
  225   1HG2  THR  26          HG21      THR  26  -4.870 -10.434   2.209
  226   2HG2  THR  26          HG22      THR  26  -6.471 -10.774   2.866
  227   3HG2  THR  26          HG23      THR  26  -5.413  -9.619   3.676
  228    H    LEU  27           HN       LEU  27  -5.770  -7.811  -0.847
  229    HA   LEU  27           HA       LEU  27  -6.015  -5.024  -1.397
  230   1HB   LEU  27          HB2       LEU  27  -5.768  -7.015  -3.020
  231   2HB   LEU  27          HB1       LEU  27  -7.500  -7.249  -2.826
  232    HG   LEU  27           HG       LEU  27  -7.893  -4.947  -3.679
  233   1HD1  LEU  27          HD11      LEU  27  -6.041  -3.624  -3.228
  234   2HD1  LEU  27          HD12      LEU  27  -5.718  -4.021  -4.911
  235   3HD1  LEU  27          HD13      LEU  27  -4.892  -4.901  -3.626
  236   1HD2  LEU  27          HD21      LEU  27  -8.064  -6.562  -5.365
  237   2HD2  LEU  27          HD22      LEU  27  -6.347  -6.958  -5.307
  238   3HD2  LEU  27          HD23      LEU  27  -6.878  -5.446  -6.036
  239    H    ASN  28           HN       ASN  28  -8.488  -7.506  -0.840
  240    HA   ASN  28           HA       ASN  28 -10.770  -5.807  -0.799
  241   1HB   ASN  28          HB2       ASN  28 -10.216  -8.477   0.499
  242   2HB   ASN  28          HB1       ASN  28 -11.794  -7.688   0.566
  243   1HD2  ASN  28          HD21      ASN  28 -11.094 -10.225  -0.860
  244   2HD2  ASN  28          HD22      ASN  28 -11.473  -9.954  -2.493
  245    H    GLY  29           HN       GLY  29  -8.577  -6.822   1.811
  246   1HA   GLY  29          HA2       GLY  29 -10.053  -5.769   3.990
  247   2HA   GLY  29          HA1       GLY  29  -8.303  -5.971   3.976
  248    H    ILE  30           HN       ILE  30  -7.705  -4.163   1.842
  249    HA   ILE  30           HA       ILE  30  -7.543  -1.708   3.266
  250    HB   ILE  30           HB       ILE  30  -7.294  -2.307   0.307
  251   1HG1  ILE  30          HG12      ILE  30  -5.182  -1.694   2.392
  252   2HG1  ILE  30          HG11      ILE  30  -5.674  -3.331   1.957
  253   1HG2  ILE  30          HG21      ILE  30  -7.777   0.022   0.406
  254   2HG2  ILE  30          HG22      ILE  30  -6.018  -0.071   0.343
  255   3HG2  ILE  30          HG23      ILE  30  -6.830   0.235   1.878
  256   1HD1  ILE  30          HD11      ILE  30  -4.534  -1.259   0.058
  257   2HD1  ILE  30          HD12      ILE  30  -5.058  -2.880  -0.399
  258   3HD1  ILE  30          HD13      ILE  30  -3.678  -2.670   0.679
  259    H    TYR  31           HN       TYR  31  -9.797  -2.729   0.698
  260    HA   TYR  31           HA       TYR  31 -11.133  -0.249   0.409
  261   1HB   TYR  31          HB2       TYR  31 -11.987  -3.104  -0.033
  262   2HB   TYR  31          HB1       TYR  31 -13.101  -1.771  -0.327
  263    HD1  TYR  31           HD1      TYR  31 -10.661  -3.805  -1.836
  264    HD2  TYR  31           HD2      TYR  31 -12.000   0.261  -1.682
  265    HE1  TYR  31           HE1      TYR  31  -9.573  -3.368  -4.014
  266    HE2  TYR  31           HE2      TYR  31 -10.913   0.704  -3.856
  267    HH   TYR  31           HH       TYR  31  -9.706  -1.824  -5.841
  268    H    GLN  32           HN       GLN  32 -12.000  -2.962   2.587
  269    HA   GLN  32           HA       GLN  32 -14.371  -1.763   3.582
  270   1HB   GLN  32          HB2       GLN  32 -12.419  -3.682   4.863
  271   2HB   GLN  32          HB1       GLN  32 -13.952  -3.227   5.609
  272   1HG   GLN  32          HG2       GLN  32 -15.176  -4.064   3.659
  273   2HG   GLN  32          HG1       GLN  32 -13.657  -4.457   2.852
  274   1HE2  GLN  32          HE21      GLN  32 -15.324  -6.599   3.173
  275   2HE2  GLN  32          HE22      GLN  32 -14.800  -7.604   4.437
  276    H    PHE  33           HN       PHE  33 -11.009  -1.415   4.641
  277    HA   PHE  33           HA       PHE  33 -11.489   0.094   6.997
  278   1HB   PHE  33          HB2       PHE  33  -9.316  -0.889   6.410
  279   2HB   PHE  33          HB1       PHE  33  -9.172   0.220   5.049
  280    HD1  PHE  33           HD1      PHE  33  -8.534   2.512   5.360
  281    HD2  PHE  33           HD2      PHE  33  -9.236  -0.033   8.748
  282    HE1  PHE  33           HE1      PHE  33  -7.493   4.204   6.844
  283    HE2  PHE  33           HE2      PHE  33  -8.199   1.660  10.234
  284    HZ   PHE  33           HZ       PHE  33  -7.325   3.777   9.281
  285    H    ILE  34           HN       ILE  34 -11.161   1.161   3.607
  286    HA   ILE  34           HA       ILE  34 -11.190   3.969   4.180
  287    HB   ILE  34           HB       ILE  34 -11.906   2.401   1.697
  288   1HG1  ILE  34          HG12      ILE  34  -9.528   4.177   2.307
  289   2HG1  ILE  34          HG11      ILE  34  -9.528   2.437   2.598
  290   1HG2  ILE  34          HG21      ILE  34 -13.099   4.442   1.417
  291   2HG2  ILE  34          HG22      ILE  34 -11.568   4.706   0.585
  292   3HG2  ILE  34          HG23      ILE  34 -11.825   5.384   2.192
  293   1HD1  ILE  34          HD11      ILE  34  -9.945   3.826  -0.062
  294   2HD1  ILE  34          HD12      ILE  34 -10.124   2.088   0.189
  295   3HD1  ILE  34          HD13      ILE  34  -8.550   2.857   0.413
  296    H    MET  35           HN       MET  35 -13.901   1.808   3.177
  297    HA   MET  35           HA       MET  35 -15.861   3.870   3.134
  298   1HB   MET  35          HB2       MET  35 -16.094   0.899   3.657
  299   2HB   MET  35          HB1       MET  35 -17.503   1.952   3.621
  300   1HG   MET  35          HG2       MET  35 -17.454   1.272   1.406
  301   2HG   MET  35          HG1       MET  35 -16.449   2.710   1.280
  302   1HE   MET  35          HE1       MET  35 -16.769  -0.135  -0.379
  303   2HE   MET  35          HE2       MET  35 -16.614  -1.173   1.037
  304   3HE   MET  35          HE3       MET  35 -15.386  -1.227  -0.226
  305    H    ASP  36           HN       ASP  36 -14.754   1.838   5.842
  306    HA   ASP  36           HA       ASP  36 -16.723   2.830   7.693
  307   1HB   ASP  36          HB2       ASP  36 -14.013   1.547   8.106
  308   2HB   ASP  36          HB1       ASP  36 -15.103   1.956   9.433
  309    H    ARG  37           HN       ARG  37 -13.406   3.873   6.919
  310    HA   ARG  37           HA       ARG  37 -13.264   5.834   9.013
  311   1HB   ARG  37          HB2       ARG  37 -11.809   5.577   6.370
  312   2HB   ARG  37          HB1       ARG  37 -11.416   6.807   7.568
  313   1HG   ARG  37          HG2       ARG  37 -11.524   3.904   8.372
  314   2HG   ARG  37          HG1       ARG  37 -10.097   4.543   7.568
  315   1HD   ARG  37          HD2       ARG  37 -11.212   6.011   9.946
  316   2HD   ARG  37          HD1       ARG  37 -10.223   4.576  10.192
  317    HE   ARG  37           HE       ARG  37  -8.724   6.088   8.438
  318   1HH1  ARG  37          HH21      ARG  37 -10.325   6.642  11.438
  319   2HH1  ARG  37          HH22      ARG  37  -9.164   7.798  12.000
  320   1HH2  ARG  37          HH11      ARG  37  -7.192   7.592   9.155
  321   2HH2  ARG  37          HH12      ARG  37  -7.389   8.335  10.707
  322    H    PHE  38           HN       PHE  38 -14.316   6.028   5.620
  323    HA   PHE  38           HA       PHE  38 -15.494   8.711   6.243
  324   1HB   PHE  38          HB2       PHE  38 -14.238   7.866   3.611
  325   2HB   PHE  38          HB1       PHE  38 -14.991   9.422   3.952
  326    HD1  PHE  38           HD1      PHE  38 -13.857  11.114   5.238
  327    HD2  PHE  38           HD2      PHE  38 -12.128   7.215   4.737
  328    HE1  PHE  38           HE1      PHE  38 -11.703  11.956   6.132
  329    HE2  PHE  38           HE2      PHE  38  -9.973   8.055   5.634
  330    HZ   PHE  38           HZ       PHE  38  -9.761  10.425   6.330
  331    HA   PRO  39           HA       PRO  39 -19.009   6.270   4.724
  332   1HB   PRO  39          HB2       PRO  39 -21.000   8.054   5.221
  333   2HB   PRO  39          HB1       PRO  39 -20.209   7.139   6.520
  334   1HG   PRO  39          HG2       PRO  39 -19.753   9.957   5.648
  335   2HG   PRO  39          HG1       PRO  39 -19.844   9.289   7.286
  336   1HD   PRO  39          HD2       PRO  39 -17.469   9.845   6.007
  337   2HD   PRO  39          HD1       PRO  39 -17.631   8.603   7.270
  338    H    PHE  40           HN       PHE  40 -17.679   9.077   3.474
  339    HA   PHE  40           HA       PHE  40 -19.520   9.905   1.481
  340   1HB   PHE  40          HB2       PHE  40 -17.665  11.317   1.910
  341   2HB   PHE  40          HB1       PHE  40 -16.511  10.003   1.696
  342    HD1  PHE  40           HD1      PHE  40 -15.418   9.781  -0.364
  343    HD2  PHE  40           HD2      PHE  40 -19.178  11.854  -0.191
  344    HE1  PHE  40           HE1      PHE  40 -15.226  10.331  -2.772
  345    HE2  PHE  40           HE2      PHE  40 -18.982  12.407  -2.599
  346    HZ   PHE  40           HZ       PHE  40 -17.007  11.645  -3.891
  347    H    TYR  41           HN       TYR  41 -16.930   7.442   1.307
  348    HA   TYR  41           HA       TYR  41 -17.379   6.856  -1.465
  349   1HB   TYR  41          HB2       TYR  41 -16.060   5.248   0.729
  350   2HB   TYR  41          HB1       TYR  41 -16.051   4.783  -0.976
  351    HD1  TYR  41           HD1      TYR  41 -14.833   6.096  -2.638
  352    HD2  TYR  41           HD2      TYR  41 -14.890   7.238   1.493
  353    HE1  TYR  41           HE1      TYR  41 -12.995   7.698  -3.068
  354    HE2  TYR  41           HE2      TYR  41 -13.059   8.848   1.085
  355    HH   TYR  41           HH       TYR  41 -11.097   8.970  -0.789
  356    H    ARG  42           HN       ARG  42 -19.014   5.793   1.424
  357    HA   ARG  42           HA       ARG  42 -20.097   3.347   0.455
  358   1HB   ARG  42          HB2       ARG  42 -21.231   5.408   2.368
  359   2HB   ARG  42          HB1       ARG  42 -21.992   3.847   2.064
  360   1HG   ARG  42          HG2       ARG  42 -19.953   2.693   2.794
  361   2HG   ARG  42          HG1       ARG  42 -19.161   4.241   3.077
  362   1HD   ARG  42          HD2       ARG  42 -20.847   4.821   4.761
  363   2HD   ARG  42          HD1       ARG  42 -21.697   3.311   4.465
  364    HE   ARG  42           HE       ARG  42 -19.398   3.726   6.172
  365   1HH1  ARG  42          HH21      ARG  42 -20.746   1.474   3.933
  366   2HH1  ARG  42          HH22      ARG  42 -19.749   0.161   4.467
  367   1HH2  ARG  42          HH11      ARG  42 -18.103   2.035   6.867
  368   2HH2  ARG  42          HH12      ARG  42 -18.254   0.479   6.123
  369    H    GLU  43           HN       GLU  43 -21.203   6.708   0.062
  370    HA   GLU  43           HA       GLU  43 -23.672   6.114  -1.215
  371   1HB   GLU  43          HB2       GLU  43 -21.845   8.508  -1.428
  372   2HB   GLU  43          HB1       GLU  43 -23.438   8.441  -2.180
  373   1HG   GLU  43          HG2       GLU  43 -24.500   8.107  -0.015
  374   2HG   GLU  43          HG1       GLU  43 -22.927   8.020   0.779
  375    H    ASN  44           HN       ASN  44 -20.455   6.554  -2.519
  376    HA   ASN  44           HA       ASN  44 -21.438   5.618  -5.203
  377   1HB   ASN  44          HB2       ASN  44 -19.122   7.429  -4.467
  378   2HB   ASN  44          HB1       ASN  44 -19.361   6.754  -6.079
  379   1HD2  ASN  44          HD21      ASN  44 -19.488   9.623  -5.390
  380   2HD2  ASN  44          HD22      ASN  44 -21.063  10.139  -5.758
  381    H    LYS  45           HN       LYS  45 -20.933   3.492  -5.410
  382    HA   LYS  45           HA       LYS  45 -18.513   2.429  -4.058
  383   1HB   LYS  45          HB2       LYS  45 -20.818   1.078  -5.493
  384   2HB   LYS  45          HB1       LYS  45 -19.463   0.217  -4.765
  385   1HG   LYS  45          HG2       LYS  45 -20.012   1.200  -2.568
  386   2HG   LYS  45          HG1       LYS  45 -21.369   2.061  -3.294
  387   1HD   LYS  45          HD2       LYS  45 -22.395  -0.090  -3.935
  388   2HD   LYS  45          HD1       LYS  45 -21.041  -0.954  -3.206
  389   1HE   LYS  45          HE2       LYS  45 -21.584   0.046  -1.013
  390   2HE   LYS  45          HE1       LYS  45 -22.946   0.898  -1.741
  391   1HZ   LYS  45          HZ1       LYS  45 -23.953  -0.973  -0.925
  392   2HZ   LYS  45          HZ2       LYS  45 -22.611  -1.974  -1.221
  393   3HZ   LYS  45          HZ3       LYS  45 -23.603  -1.476  -2.507
  394    H    GLN  46           HN       GLN  46 -19.985   1.835  -7.270
  395    HA   GLN  46           HA       GLN  46 -17.516   0.978  -8.440
  396   1HB   GLN  46          HB2       GLN  46 -20.073   2.031  -9.675
  397   2HB   GLN  46          HB1       GLN  46 -18.732   1.383 -10.619
  398   1HG   GLN  46          HG2       GLN  46 -18.925  -0.772  -9.495
  399   2HG   GLN  46          HG1       GLN  46 -20.185  -0.138  -8.434
  400   1HE2  GLN  46          HE21      GLN  46 -22.214   0.693  -9.615
  401   2HE2  GLN  46          HE22      GLN  46 -22.690  -0.121 -11.027
  402    H    GLY  47           HN       GLY  47 -16.015   2.101  -9.698
  403   1HA   GLY  47          HA2       GLY  47 -15.442   4.109 -11.034
  404   2HA   GLY  47          HA1       GLY  47 -16.326   5.082  -9.865
  405    H    TRP  48           HN       TRP  48 -15.405   4.617  -7.472
  406    HA   TRP  48           HA       TRP  48 -12.598   5.431  -7.634
  407   1HB   TRP  48          HB2       TRP  48 -12.751   5.884  -5.296
  408   2HB   TRP  48          HB1       TRP  48 -14.262   6.415  -6.021
  409    HD1  TRP  48           HD1      TRP  48 -16.438   4.809  -5.616
  410    HE1  TRP  48           HE1      TRP  48 -16.985   3.253  -3.645
  411    HE3  TRP  48           HE3      TRP  48 -11.783   4.288  -3.584
  412    HZ2  TRP  48           HZ2      TRP  48 -15.639   1.959  -1.475
  413    HZ3  TRP  48           HZ3      TRP  48 -11.446   2.889  -1.572
  414    HH2  TRP  48           HH2      TRP  48 -13.356   1.728  -0.518
  415    H    GLN  49           HN       GLN  49 -14.208   2.452  -7.345
  416    HA   GLN  49           HA       GLN  49 -12.334   1.058  -5.657
  417   1HB   GLN  49          HB2       GLN  49 -14.297   0.123  -7.765
  418   2HB   GLN  49          HB1       GLN  49 -13.354  -0.982  -6.766
  419   1HG   GLN  49          HG2       GLN  49 -14.362  -0.149  -4.748
  420   2HG   GLN  49          HG1       GLN  49 -15.137   1.180  -5.615
  421   1HE2  GLN  49          HE21      GLN  49 -16.562  -0.890  -4.067
  422   2HE2  GLN  49          HE22      GLN  49 -17.553  -1.720  -5.167
  423    H    ASN  50           HN       ASN  50 -12.580   1.442  -9.188
  424    HA   ASN  50           HA       ASN  50 -10.386  -0.323  -9.788
  425   1HB   ASN  50          HB2       ASN  50 -11.752   1.862 -11.374
  426   2HB   ASN  50          HB1       ASN  50 -10.459   0.861 -12.039
  427   1HD2  ASN  50          HD21      ASN  50 -13.378   0.913 -12.812
  428   2HD2  ASN  50          HD22      ASN  50 -13.923  -0.681 -12.601
  429    H    SER  51           HN       SER  51 -10.562   3.198  -9.286
  430    HA   SER  51           HA       SER  51  -7.948   3.831 -10.188
  431   1HB   SER  51          HB2       SER  51  -9.720   5.497  -9.598
  432   2HB   SER  51          HB1       SER  51  -9.442   5.135  -7.897
  433    HG   SER  51           HG       SER  51  -7.984   6.646  -8.103
  434    H    ILE  52           HN       ILE  52  -9.042   2.770  -6.967
  435    HA   ILE  52           HA       ILE  52  -6.570   3.110  -5.612
  436    HB   ILE  52           HB       ILE  52  -8.803   1.118  -5.209
  437   1HG1  ILE  52          HG12      ILE  52  -9.340   3.565  -4.977
  438   2HG1  ILE  52          HG11      ILE  52  -9.628   2.616  -3.528
  439   1HG2  ILE  52          HG21      ILE  52  -6.985   0.127  -4.093
  440   2HG2  ILE  52          HG22      ILE  52  -7.825   1.028  -2.830
  441   3HG2  ILE  52          HG23      ILE  52  -6.354   1.683  -3.552
  442   1HD1  ILE  52          HD11      ILE  52  -7.331   3.394  -2.712
  443   2HD1  ILE  52          HD12      ILE  52  -8.573   4.630  -2.817
  444   3HD1  ILE  52          HD13      ILE  52  -7.339   4.526  -4.061
  445    H    ARG  53           HN       ARG  53  -7.832   0.168  -7.230
  446    HA   ARG  53           HA       ARG  53  -5.525  -1.437  -6.702
  447   1HB   ARG  53          HB2       ARG  53  -7.279  -1.701  -9.154
  448   2HB   ARG  53          HB1       ARG  53  -6.436  -2.980  -8.274
  449   1HG   ARG  53          HG2       ARG  53  -7.858  -2.319  -6.247
  450   2HG   ARG  53          HG1       ARG  53  -8.817  -1.366  -7.379
  451   1HD   ARG  53          HD2       ARG  53  -9.128  -3.474  -8.741
  452   2HD   ARG  53          HD1       ARG  53  -8.408  -4.357  -7.380
  453    HE   ARG  53           HE       ARG  53 -10.391  -2.951  -6.148
  454   1HH1  ARG  53          HH21      ARG  53 -10.255  -4.872  -9.010
  455   2HH1  ARG  53          HH22      ARG  53 -11.865  -5.486  -8.832
  456   1HH2  ARG  53          HH11      ARG  53 -12.486  -3.747  -5.898
  457   2HH2  ARG  53          HH12      ARG  53 -13.127  -4.851  -7.069
  458    H    HIS  54           HN       HIS  54  -6.326   0.727  -9.399
  459    HA   HIS  54           HA       HIS  54  -4.120   0.074 -11.075
  460   1HB   HIS  54          HB2       HIS  54  -6.058   1.493 -11.756
  461   2HB   HIS  54          HB1       HIS  54  -5.453   2.776 -10.709
  462    HD1  HIS  54           HD1      HIS  54  -3.365   0.563 -12.980
  463    HD2  HIS  54           HD2      HIS  54  -4.520   4.554 -12.646
  464    HE1  HIS  54           HE1      HIS  54  -2.082   1.831 -14.759
  465    H    ASN  55           HN       ASN  55  -4.425   2.357  -8.368
  466    HA   ASN  55           HA       ASN  55  -1.783   3.468  -8.627
  467   1HB   ASN  55          HB2       ASN  55  -3.702   3.260  -6.295
  468   2HB   ASN  55          HB1       ASN  55  -2.141   4.073  -6.173
  469   1HD2  ASN  55          HD21      ASN  55  -1.914   6.147  -7.172
  470   2HD2  ASN  55          HD22      ASN  55  -3.202   6.949  -7.934
  471    H    LEU  56           HN       LEU  56  -3.090   0.701  -6.804
  472    HA   LEU  56           HA       LEU  56  -0.715   0.097  -5.366
  473   1HB   LEU  56          HB2       LEU  56  -2.966  -1.678  -6.316
  474   2HB   LEU  56          HB1       LEU  56  -1.655  -2.265  -5.298
  475    HG   LEU  56           HG       LEU  56  -3.430   0.092  -4.584
  476   1HD1  LEU  56          HD11      LEU  56  -4.338  -1.617  -2.870
  477   2HD1  LEU  56          HD12      LEU  56  -3.637  -2.848  -3.920
  478   3HD1  LEU  56          HD13      LEU  56  -4.891  -1.772  -4.535
  479   1HD2  LEU  56          HD21      LEU  56  -1.517   0.355  -3.267
  480   2HD2  LEU  56          HD22      LEU  56  -1.181  -1.374  -3.219
  481   3HD2  LEU  56          HD23      LEU  56  -2.471  -0.700  -2.230
  482    H    SER  57           HN       SER  57  -1.739  -0.892  -8.623
  483    HA   SER  57           HA       SER  57   0.512  -2.659  -9.022
  484   1HB   SER  57          HB2       SER  57  -1.646  -2.705 -10.335
  485   2HB   SER  57          HB1       SER  57  -1.104  -1.246 -11.157
  486    HG   SER  57           HG       SER  57   0.709  -3.340 -11.013
  487    H    LEU  58           HN       LEU  58  -0.075   0.755  -9.842
  488    HA   LEU  58           HA       LEU  58   2.335   1.093 -11.359
  489   1HB   LEU  58          HB2       LEU  58   0.520   3.043  -9.948
  490   2HB   LEU  58          HB1       LEU  58   1.912   3.562 -10.893
  491    HG   LEU  58           HG       LEU  58  -0.282   1.779 -11.982
  492   1HD1  LEU  58          HD11      LEU  58  -1.397   3.813 -11.530
  493   2HD1  LEU  58          HD12      LEU  58  -0.902   3.975 -13.214
  494   3HD1  LEU  58          HD13      LEU  58   0.016   4.784 -11.946
  495   1HD2  LEU  58          HD21      LEU  58   2.169   3.098 -13.126
  496   2HD2  LEU  58          HD22      LEU  58   0.754   2.923 -14.158
  497   3HD2  LEU  58          HD23      LEU  58   1.503   1.499 -13.453
  498    H    ASN  59           HN       ASN  59   1.650   1.663  -7.898
  499    HA   ASN  59           HA       ASN  59   4.110   2.976  -7.333
  500   1HB   ASN  59          HB2       ASN  59   2.457   1.203  -5.514
  501   2HB   ASN  59          HB1       ASN  59   3.696   2.344  -4.987
  502   1HD2  ASN  59          HD21      ASN  59   3.160   4.560  -6.634
  503   2HD2  ASN  59          HD22      ASN  59   1.608   5.157  -6.295
  504    H    GLU  60           HN       GLU  60   6.115   2.201  -7.566
  505    HA   GLU  60           HA       GLU  60   6.622  -0.689  -7.742
  506   1HB   GLU  60          HB2       GLU  60   8.411   1.746  -7.968
  507   2HB   GLU  60          HB1       GLU  60   8.996   0.090  -8.126
  508   1HG   GLU  60          HG2       GLU  60   7.426  -0.292  -9.991
  509   2HG   GLU  60          HG1       GLU  60   6.843   1.367  -9.838
  510    H    CYS  61           HN       CYS  61   7.131   1.941  -5.455
  511    HA   CYS  61           HA       CYS  61   8.974   0.557  -3.736
  512   1HB   CYS  61          HB2       CYS  61   8.169   2.225  -2.007
  513   2HB   CYS  61          HB1       CYS  61   8.753   2.947  -3.506
  514    HG   CYS  61           HG       CYS  61   6.504   4.088  -3.251
  515    H    PHE  62           HN       PHE  62   5.751  -0.022  -4.460
  516    HA   PHE  62           HA       PHE  62   5.058  -1.173  -1.818
  517   1HB   PHE  62          HB2       PHE  62   3.619  -0.661  -4.411
  518   2HB   PHE  62          HB1       PHE  62   2.972  -1.876  -3.312
  519    HD1  PHE  62           HD1      PHE  62   4.782   1.229  -2.286
  520    HD2  PHE  62           HD2      PHE  62   0.988  -0.761  -2.609
  521    HE1  PHE  62           HE1      PHE  62   3.735   3.008  -0.927
  522    HE2  PHE  62           HE2      PHE  62  -0.057   1.022  -1.242
  523    HZ   PHE  62           HZ       PHE  62   1.315   2.908  -0.401
  524    H    VAL  63           HN       VAL  63   5.102  -3.391  -1.424
  525    HA   VAL  63           HA       VAL  63   6.033  -5.159  -3.671
  526    HB   VAL  63           HB       VAL  63   6.753  -5.376  -0.738
  527   1HG1  VAL  63          HG11      VAL  63   8.454  -6.969  -1.617
  528   2HG1  VAL  63          HG12      VAL  63   7.757  -6.787  -3.227
  529   3HG1  VAL  63          HG13      VAL  63   6.805  -7.510  -1.930
  530   1HG2  VAL  63          HG21      VAL  63   8.971  -4.551  -1.429
  531   2HG2  VAL  63          HG22      VAL  63   7.726  -3.351  -1.777
  532   3HG2  VAL  63          HG23      VAL  63   8.386  -4.342  -3.079
  533    H    LYS  64           HN       LYS  64   4.777  -6.913  -4.036
  534    HA   LYS  64           HA       LYS  64   2.406  -7.393  -2.407
  535   1HB   LYS  64          HB2       LYS  64   3.603  -9.014  -4.680
  536   2HB   LYS  64          HB1       LYS  64   1.987  -9.229  -4.007
  537   1HG   LYS  64          HG2       LYS  64   1.397  -6.928  -4.670
  538   2HG   LYS  64          HG1       LYS  64   3.013  -6.709  -5.348
  539   1HD   LYS  64          HD2       LYS  64   2.613  -8.574  -6.912
  540   2HD   LYS  64          HD1       LYS  64   0.999  -8.795  -6.238
  541   1HE   LYS  64          HE2       LYS  64   0.235  -6.730  -7.093
  542   2HE   LYS  64          HE1       LYS  64   1.873  -6.141  -7.380
  543   1HZ   LYS  64          HZ1       LYS  64   0.990  -6.791  -9.459
  544   2HZ   LYS  64          HZ2       LYS  64   0.428  -8.273  -8.847
  545   3HZ   LYS  64          HZ3       LYS  64   2.096  -7.999  -9.017
  546    H    VAL  65           HN       VAL  65   2.038  -9.251  -1.073
  547    HA   VAL  65           HA       VAL  65   4.376 -11.044  -0.553
  548    HB   VAL  65           HB       VAL  65   2.766  -9.729   1.648
  549   1HG1  VAL  65          HG11      VAL  65   3.789 -11.821   2.313
  550   2HG1  VAL  65          HG12      VAL  65   4.725 -10.501   3.013
  551   3HG1  VAL  65          HG13      VAL  65   5.326 -11.348   1.586
  552   1HG2  VAL  65          HG21      VAL  65   5.394  -8.941   0.377
  553   2HG2  VAL  65          HG22      VAL  65   4.926  -8.418   1.995
  554   3HG2  VAL  65          HG23      VAL  65   3.956  -7.944   0.601
  555    HA   PRO  66           HA       PRO  66   0.097 -13.044  -1.376
  556   1HB   PRO  66          HB2       PRO  66   2.245 -15.062  -1.986
  557   2HB   PRO  66          HB1       PRO  66   0.668 -14.834  -2.769
  558   1HG   PRO  66          HG2       PRO  66   2.899 -13.867  -3.865
  559   2HG   PRO  66          HG1       PRO  66   1.368 -12.980  -3.955
  560   1HD   PRO  66          HD2       PRO  66   3.798 -12.338  -2.383
  561   2HD   PRO  66          HD1       PRO  66   2.468 -11.267  -2.875
  562    H    ARG  67           HN       ARG  67  -0.794 -14.980  -0.312
  563    HA   ARG  67           HA       ARG  67  -0.164 -15.151   2.457
  564   1HB   ARG  67          HB2       ARG  67  -1.556 -17.210   0.714
  565   2HB   ARG  67          HB1       ARG  67  -1.625 -17.130   2.473
  566   1HG   ARG  67          HG2       ARG  67  -2.659 -14.896   2.320
  567   2HG   ARG  67          HG1       ARG  67  -2.629 -15.001   0.561
  568   1HD   ARG  67          HD2       ARG  67  -4.831 -15.668   1.268
  569   2HD   ARG  67          HD1       ARG  67  -3.984 -17.139   0.789
  570    HE   ARG  67           HE       ARG  67  -3.472 -16.972   3.492
  571   1HH1  ARG  67          HH21      ARG  67  -6.269 -16.861   1.480
  572   2HH1  ARG  67          HH22      ARG  67  -7.315 -17.561   2.670
  573   1HH2  ARG  67          HH11      ARG  67  -4.822 -17.881   5.058
  574   2HH2  ARG  67          HH12      ARG  67  -6.496 -18.139   4.698
  575    H    ASP  68           HN       ASP  68   0.161 -17.721   3.219
  576    HA   ASP  68           HA       ASP  68   2.938 -18.272   2.465
  577   1HB   ASP  68          HB2       ASP  68   1.874 -18.556   4.812
  578   2HB   ASP  68          HB1       ASP  68   1.203 -20.059   4.177
  579    H    ASP  69           HN       ASP  69   3.535 -20.586   1.869
  580    HA   ASP  69           HA       ASP  69   1.934 -21.392  -0.439
  581   1HB   ASP  69          HB2       ASP  69   4.474 -22.480   0.798
  582   2HB   ASP  69          HB1       ASP  69   3.712 -23.203  -0.619
  583    H    LYS  70           HN       LYS  70   1.979 -22.208   2.883
  584    HA   LYS  70           HA       LYS  70   1.272 -24.965   2.787
  585   1HB   LYS  70          HB2       LYS  70   0.481 -22.786   4.743
  586   2HB   LYS  70          HB1       LYS  70   0.161 -24.498   5.006
  587   1HG   LYS  70          HG2       LYS  70   2.957 -23.536   4.415
  588   2HG   LYS  70          HG1       LYS  70   2.310 -23.460   6.050
  589   1HD   LYS  70          HD2       LYS  70   1.809 -25.905   5.923
  590   2HD   LYS  70          HD1       LYS  70   2.588 -25.955   4.343
  591   1HE   LYS  70          HE2       LYS  70   4.178 -26.634   6.078
  592   2HE   LYS  70          HE1       LYS  70   4.681 -25.106   5.356
  593   1HZ   LYS  70          HZ1       LYS  70   4.523 -24.112   7.312
  594   2HZ   LYS  70          HZ2       LYS  70   4.219 -25.622   8.030
  595   3HZ   LYS  70          HZ3       LYS  70   2.926 -24.642   7.525
  596    H    LYS  71           HN       LYS  71  -0.725 -22.034   2.545
  597    HA   LYS  71           HA       LYS  71  -3.168 -23.638   2.256
  598   1HB   LYS  71          HB2       LYS  71  -2.661 -20.657   2.045
  599   2HB   LYS  71          HB1       LYS  71  -4.249 -21.399   1.893
  600   1HG   LYS  71          HG2       LYS  71  -4.310 -20.936   4.157
  601   2HG   LYS  71          HG1       LYS  71  -3.542 -22.514   4.238
  602   1HD   LYS  71          HD2       LYS  71  -2.091 -21.260   5.556
  603   2HD   LYS  71          HD1       LYS  71  -1.308 -21.102   3.985
  604   1HE   LYS  71          HE2       LYS  71  -2.596 -18.958   3.648
  605   2HE   LYS  71          HE1       LYS  71  -3.154 -19.100   5.314
  606   1HZ   LYS  71          HZ1       LYS  71  -1.190 -18.447   6.100
  607   2HZ   LYS  71          HZ2       LYS  71  -0.864 -17.896   4.526
  608   3HZ   LYS  71          HZ3       LYS  71  -0.314 -19.423   5.025
  609    HA   PRO  72           HA       PRO  72  -3.128 -24.166  -2.196
  610   1HB   PRO  72          HB2       PRO  72  -5.850 -22.889  -2.118
  611   2HB   PRO  72          HB1       PRO  72  -5.327 -24.375  -2.939
  612   1HG   PRO  72          HG2       PRO  72  -6.690 -24.494  -0.677
  613   2HG   PRO  72          HG1       PRO  72  -5.345 -25.609  -0.983
  614   1HD   PRO  72          HD2       PRO  72  -5.443 -23.239   0.845
  615   2HD   PRO  72          HD1       PRO  72  -4.543 -24.765   1.002
  616    H    GLY  73           HN       GLY  73  -5.077 -22.155  -3.601
  617   1HA   GLY  73          HA2       GLY  73  -3.172 -20.424  -4.717
  618   2HA   GLY  73          HA1       GLY  73  -4.899 -20.060  -4.664
  619    H    LYS  74           HN       LYS  74  -3.497 -17.844  -4.419
  620    HA   LYS  74           HA       LYS  74  -3.556 -17.217  -1.486
  621   1HB   LYS  74          HB2       LYS  74  -1.477 -16.179  -3.433
  622   2HB   LYS  74          HB1       LYS  74  -1.534 -15.914  -1.688
  623   1HG   LYS  74          HG2       LYS  74  -1.232 -18.336  -1.310
  624   2HG   LYS  74          HG1       LYS  74  -1.176 -18.597  -3.053
  625   1HD   LYS  74          HD2       LYS  74   0.810 -17.143  -3.214
  626   2HD   LYS  74          HD1       LYS  74   0.758 -16.876  -1.472
  627   1HE   LYS  74          HE2       LYS  74   2.370 -18.695  -2.355
  628   2HE   LYS  74          HE1       LYS  74   1.336 -19.114  -0.993
  629   1HZ   LYS  74          HZ1       LYS  74   1.256 -20.859  -2.607
  630   2HZ   LYS  74          HZ2       LYS  74   0.860 -19.769  -3.849
  631   3HZ   LYS  74          HZ3       LYS  74  -0.247 -20.073  -2.596
  632    H    GLY  75           HN       GLY  75  -4.042 -14.985  -1.037
  633   1HA   GLY  75          HA2       GLY  75  -5.698 -13.714  -3.120
  634   2HA   GLY  75          HA1       GLY  75  -5.534 -13.168  -1.447
  635    H    SER  76           HN       SER  76  -4.520 -11.206  -1.353
  636    HA   SER  76           HA       SER  76  -1.967 -10.861  -2.763
  637   1HB   SER  76          HB2       SER  76  -2.839  -8.603  -3.709
  638   2HB   SER  76          HB1       SER  76  -3.281 -10.082  -4.557
  639    HG   SER  76           HG       SER  76  -4.861  -8.859  -2.542
  640    H    TYR  77           HN       TYR  77  -0.912 -10.436  -0.861
  641    HA   TYR  77           HA       TYR  77  -2.031  -8.605   1.142
  642   1HB   TYR  77          HB2       TYR  77   0.599 -10.051   0.884
  643   2HB   TYR  77          HB1       TYR  77   0.258  -8.954   2.208
  644    HD1  TYR  77           HD1      TYR  77  -2.625 -10.908   0.980
  645    HD2  TYR  77           HD2      TYR  77   0.710 -10.899   3.697
  646    HE1  TYR  77           HE1      TYR  77  -3.662 -12.726   2.265
  647    HE2  TYR  77           HE2      TYR  77  -0.349 -12.722   4.988
  648    HH   TYR  77           HH       TYR  77  -3.616 -13.713   4.419
  649    H    TRP  78           HN       TRP  78  -0.810  -6.611   1.799
  650    HA   TRP  78           HA       TRP  78   0.980  -5.514  -0.315
  651   1HB   TRP  78          HB2       TRP  78  -1.610  -4.270   0.632
  652   2HB   TRP  78          HB1       TRP  78  -0.352  -3.352  -0.199
  653    HD1  TRP  78           HD1      TRP  78  -2.998  -6.015  -0.766
  654    HE1  TRP  78           HE1      TRP  78  -3.190  -6.488  -3.294
  655    HE3  TRP  78           HE3      TRP  78   0.999  -3.337  -2.469
  656    HZ2  TRP  78           HZ2      TRP  78  -1.819  -5.820  -5.721
  657    HZ3  TRP  78           HZ3      TRP  78   1.534  -3.273  -4.887
  658    HH2  TRP  78           HH2      TRP  78   0.129  -4.497  -6.512
  659    H    THR  79           HN       THR  79   2.651  -4.429   0.512
  660    HA   THR  79           HA       THR  79   2.458  -2.997   3.069
  661    HB   THR  79           HB       THR  79   2.979  -5.363   3.724
  662    HG1  THR  79           HG1      THR  79   4.556  -4.738   5.105
  663   1HG2  THR  79          HG21      THR  79   5.592  -4.893   2.266
  664   2HG2  THR  79          HG22      THR  79   4.268  -5.852   1.606
  665   3HG2  THR  79          HG23      THR  79   5.073  -6.362   3.090
  666    H    LEU  80           HN       LEU  80   4.240  -1.496   3.309
  667    HA   LEU  80           HA       LEU  80   5.322  -0.498   0.874
  668   1HB   LEU  80          HB2       LEU  80   6.353  -0.098   3.694
  669   2HB   LEU  80          HB1       LEU  80   6.770   0.903   2.305
  670    HG   LEU  80           HG       LEU  80   3.936   0.509   3.306
  671   1HD1  LEU  80          HD11      LEU  80   5.967   2.681   3.883
  672   2HD1  LEU  80          HD12      LEU  80   5.152   1.637   5.048
  673   3HD1  LEU  80          HD13      LEU  80   4.238   2.868   4.178
  674   1HD2  LEU  80          HD21      LEU  80   5.242   2.252   1.210
  675   2HD2  LEU  80          HD22      LEU  80   3.729   2.744   1.970
  676   3HD2  LEU  80          HD23      LEU  80   3.807   1.238   1.063
  677    H    ASP  81           HN       ASP  81   6.648  -2.599   3.312
  678    HA   ASP  81           HA       ASP  81   8.573  -3.701   1.391
  679   1HB   ASP  81          HB2       ASP  81  10.556  -3.182   2.668
  680   2HB   ASP  81          HB1       ASP  81   9.673  -1.672   2.479
  681    HA   PRO  82           HA       PRO  82   7.831  -7.236   3.972
  682   1HB   PRO  82          HB2       PRO  82  10.540  -8.297   4.033
  683   2HB   PRO  82          HB1       PRO  82   9.195  -8.793   2.997
  684   1HG   PRO  82          HG2       PRO  82  11.451  -7.529   2.087
  685   2HG   PRO  82          HG1       PRO  82   9.884  -7.482   1.264
  686   1HD   PRO  82          HD2       PRO  82  11.140  -5.415   3.050
  687   2HD   PRO  82          HD1       PRO  82  10.219  -5.194   1.541
  688    H    ASP  83           HN       ASP  83   8.582  -8.497   6.022
  689    HA   ASP  83           HA       ASP  83   9.271  -6.505   8.084
  690   1HB   ASP  83          HB2       ASP  83   8.517  -9.440   8.238
  691   2HB   ASP  83          HB1       ASP  83   8.915  -8.457   9.647
  692    H    SER  84           HN       SER  84  11.432  -6.442   6.760
  693    HA   SER  84           HA       SER  84  13.348  -8.476   6.831
  694   1HB   SER  84          HB2       SER  84  13.895  -6.515   5.627
  695   2HB   SER  84          HB1       SER  84  13.570  -5.474   7.007
  696    HG   SER  84           HG       SER  84  15.850  -5.952   6.503
  697    H    TYR  85           HN       TYR  85  12.231  -6.405   9.431
  698    HA   TYR  85           HA       TYR  85  14.361  -6.932  11.280
  699   1HB   TYR  85          HB2       TYR  85  12.577  -5.142  11.505
  700   2HB   TYR  85          HB1       TYR  85  11.455  -6.419  11.974
  701    HD1  TYR  85           HD1      TYR  85  11.690  -7.593  14.101
  702    HD2  TYR  85           HD2      TYR  85  14.459  -4.521  12.941
  703    HE1  TYR  85           HE1      TYR  85  12.566  -7.505  16.421
  704    HE2  TYR  85           HE2      TYR  85  15.333  -4.432  15.259
  705    HH   TYR  85           HH       TYR  85  14.457  -5.000  17.576
  706    H    ASN  86           HN       ASN  86  11.728  -8.832  10.120
  707    HA   ASN  86           HA       ASN  86  11.708 -10.689  12.385
  708   1HB   ASN  86          HB2       ASN  86   9.685 -10.176  10.995
  709   2HB   ASN  86          HB1       ASN  86  10.471 -10.995   9.643
  710   1HD2  ASN  86          HD21      ASN  86   9.329 -11.556  13.007
  711   2HD2  ASN  86          HD22      ASN  86   9.077 -13.223  12.807
  712    H    MET  87           HN       MET  87  13.836 -10.227   9.917
  713    HA   MET  87           HA       MET  87  14.264 -12.956   9.063
  714   1HB   MET  87          HB2       MET  87  15.793 -10.387   8.834
  715   2HB   MET  87          HB1       MET  87  16.623 -11.894   8.454
  716   1HG   MET  87          HG2       MET  87  14.697 -12.423   6.876
  717   2HG   MET  87          HG1       MET  87  14.136 -10.771   7.139
  718   1HE   MET  87          HE1       MET  87  17.256  -9.273   7.375
  719   2HE   MET  87          HE2       MET  87  15.569  -8.856   7.106
  720   3HE   MET  87          HE3       MET  87  16.763  -8.501   5.862
  721    H    PHE  88           HN       PHE  88  15.984 -14.364   9.679
  722    HA   PHE  88           HA       PHE  88  16.370 -14.644  12.475
  723   1HB   PHE  88          HB2       PHE  88  17.918 -15.777  10.131
  724   2HB   PHE  88          HB1       PHE  88  18.156 -16.292  11.800
  725    HD1  PHE  88           HD1      PHE  88  15.815 -16.240   8.952
  726    HD2  PHE  88           HD2      PHE  88  16.474 -17.601  12.973
  727    HE1  PHE  88           HE1      PHE  88  13.886 -17.784   8.745
  728    HE2  PHE  88           HE2      PHE  88  14.542 -19.144  12.766
  729    HZ   PHE  88           HZ       PHE  88  13.247 -19.235  10.653
  730    H    GLU  89           HN       GLU  89  18.569 -13.282  10.001
  731    HA   GLU  89           HA       GLU  89  20.762 -12.867  11.790
  732   1HB   GLU  89          HB2       GLU  89  19.982 -11.468   9.222
  733   2HB   GLU  89          HB1       GLU  89  21.488 -11.143  10.083
  734   1HG   GLU  89          HG2       GLU  89  22.100 -13.531   9.911
  735   2HG   GLU  89          HG1       GLU  89  20.602 -13.848   9.034
  736    H    ASN  90           HN       ASN  90  21.313 -11.107  13.085
  737    HA   ASN  90           HA       ASN  90  19.523  -8.746  13.153
  738   1HB   ASN  90          HB2       ASN  90  18.494 -10.390  14.699
  739   2HB   ASN  90          HB1       ASN  90  20.015 -10.490  15.586
  740   1HD2  ASN  90          HD21      ASN  90  18.881  -9.608  17.515
  741   2HD2  ASN  90          HD22      ASN  90  18.535  -7.949  17.613
  742    H    GLY  91           HN       GLY  91  20.458  -6.956  14.295
  743   1HA   GLY  91          HA2       GLY  91  22.205  -5.745  15.353
  744   2HA   GLY  91          HA1       GLY  91  23.157  -7.227  15.427
  745    H    SER  92           HN       SER  92  23.472  -8.040  12.906
  746    HA   SER  92           HA       SER  92  23.986  -5.899  11.022
  747   1HB   SER  92          HB2       SER  92  25.858  -5.567  12.653
  748   2HB   SER  92          HB1       SER  92  26.391  -7.213  12.326
  749    HG   SER  92           HG       SER  92  26.799  -4.955  10.908
  750    H    PHE  93           HN       PHE  93  23.657  -6.888   9.109
  751    HA   PHE  93           HA       PHE  93  24.291  -9.810   8.852
  752   1HB   PHE  93          HB2       PHE  93  22.632  -9.670   6.930
  753   2HB   PHE  93          HB1       PHE  93  21.944  -9.432   8.537
  754    HD1  PHE  93           HD1      PHE  93  21.634  -7.045   9.386
  755    HD2  PHE  93           HD2      PHE  93  22.463  -7.973   5.275
  756    HE1  PHE  93           HE1      PHE  93  20.802  -4.808   8.715
  757    HE2  PHE  93           HE2      PHE  93  21.632  -5.734   4.603
  758    HZ   PHE  93           HZ       PHE  93  20.802  -4.152   6.323
  759    H    LEU  94           HN       LEU  94  26.454  -9.596   8.145
  760    HA   LEU  94           HA       LEU  94  27.061  -7.829   5.866
  761   1HB   LEU  94          HB2       LEU  94  28.667  -9.700   7.605
  762   2HB   LEU  94          HB1       LEU  94  29.340  -9.110   6.088
  763    HG   LEU  94           HG       LEU  94  28.852  -6.761   6.866
  764   1HD1  LEU  94          HD11      LEU  94  27.159  -7.056   8.508
  765   2HD1  LEU  94          HD12      LEU  94  28.595  -6.600   9.422
  766   3HD1  LEU  94          HD13      LEU  94  28.088  -8.287   9.362
  767   1HD2  LEU  94          HD21      LEU  94  30.810  -6.628   8.248
  768   2HD2  LEU  94          HD22      LEU  94  31.084  -7.958   7.124
  769   3HD2  LEU  94          HD23      LEU  94  30.617  -8.294   8.791
  Start of MODEL    8
    1   1H    MET   1          HT1       MET   1 -23.968  16.382   4.874
    2   2H    MET   1          HT2       MET   1 -25.268  16.190   3.796
    3   3H    MET   1          HT3       MET   1 -24.898  17.727   4.421
    4    HA   MET   1           HA       MET   1 -24.085  16.827   2.025
    5   1HB   MET   1          HB2       MET   1 -22.798  18.823   3.909
    6   2HB   MET   1          HB1       MET   1 -22.385  18.685   2.199
    7   1HG   MET   1          HG2       MET   1 -24.727  19.123   1.587
    8   2HG   MET   1          HG1       MET   1 -25.156  19.259   3.292
    9   1HE   MET   1          HE1       MET   1 -25.464  22.913   2.206
   10   2HE   MET   1          HE2       MET   1 -26.242  21.453   2.811
   11   3HE   MET   1          HE3       MET   1 -25.763  21.549   1.118
   12    H    LEU   2           HN       LEU   2 -22.678  15.294   1.356
   13    HA   LEU   2           HA       LEU   2 -20.484  14.436   3.203
   14   1HB   LEU   2          HB2       LEU   2 -21.541  13.014   0.747
   15   2HB   LEU   2          HB1       LEU   2 -20.461  12.360   1.976
   16    HG   LEU   2           HG       LEU   2 -23.356  13.175   2.351
   17   1HD1  LEU   2          HD11      LEU   2 -21.914  10.513   2.488
   18   2HD1  LEU   2          HD12      LEU   2 -23.101  11.009   1.283
   19   3HD1  LEU   2          HD13      LEU   2 -23.596  10.758   2.957
   20   1HD2  LEU   2          HD21      LEU   2 -22.362  13.772   4.402
   21   2HD2  LEU   2          HD22      LEU   2 -21.190  12.455   4.326
   22   3HD2  LEU   2          HD23      LEU   2 -22.881  12.112   4.690
   23    H    VAL   3           HN       VAL   3 -18.372  14.554   2.547
   24    HA   VAL   3           HA       VAL   3 -17.763  15.364  -0.254
   25    HB   VAL   3           HB       VAL   3 -16.198  17.131   0.692
   26   1HG1  VAL   3          HG11      VAL   3 -18.436  17.616  -0.341
   27   2HG1  VAL   3          HG12      VAL   3 -17.968  18.791   0.888
   28   3HG1  VAL   3          HG13      VAL   3 -19.149  17.537   1.269
   29   1HG2  VAL   3          HG21      VAL   3 -16.248  16.201   3.021
   30   2HG2  VAL   3          HG22      VAL   3 -17.922  16.737   3.159
   31   3HG2  VAL   3          HG23      VAL   3 -16.630  17.921   2.956
   32    H    LYS   4           HN       LYS   4 -15.639  14.792  -0.902
   33    HA   LYS   4           HA       LYS   4 -14.466  12.569   0.519
   34   1HB   LYS   4          HB2       LYS   4 -13.130  14.206  -1.649
   35   2HB   LYS   4          HB1       LYS   4 -12.858  12.508  -1.260
   36   1HG   LYS   4          HG2       LYS   4 -15.416  13.692  -2.380
   37   2HG   LYS   4          HG1       LYS   4 -14.255  12.706  -3.266
   38   1HD   LYS   4          HD2       LYS   4 -14.663  10.922  -1.435
   39   2HD   LYS   4          HD1       LYS   4 -16.089  11.873  -1.018
   40   1HE   LYS   4          HE2       LYS   4 -16.863  11.699  -3.378
   41   2HE   LYS   4          HE1       LYS   4 -15.471  10.675  -3.735
   42   1HZ   LYS   4          HZ1       LYS   4 -16.492   8.927  -2.866
   43   2HZ   LYS   4          HZ2       LYS   4 -17.910   9.858  -2.773
   44   3HZ   LYS   4          HZ3       LYS   4 -16.868   9.757  -1.436
   45    HA   PRO   5           HA       PRO   5 -11.746  14.985   3.118
   46   1HB   PRO   5          HB2       PRO   5  -9.901  13.172   3.828
   47   2HB   PRO   5          HB1       PRO   5 -11.594  12.998   4.332
   48   1HG   PRO   5          HG2       PRO   5 -10.171  11.686   2.050
   49   2HG   PRO   5          HG1       PRO   5 -11.231  10.957   3.272
   50   1HD   PRO   5          HD2       PRO   5 -12.127  11.641   0.778
   51   2HD   PRO   5          HD1       PRO   5 -13.170  11.682   2.217
   52    HA   PRO   6           HA       PRO   6  -8.421  16.459   0.575
   53   1HB   PRO   6          HB2       PRO   6  -6.701  17.530   2.395
   54   2HB   PRO   6          HB1       PRO   6  -8.295  18.234   2.059
   55   1HG   PRO   6          HG2       PRO   6  -7.461  16.443   4.304
   56   2HG   PRO   6          HG1       PRO   6  -8.458  17.909   4.350
   57   1HD   PRO   6          HD2       PRO   6  -9.542  15.400   4.374
   58   2HD   PRO   6          HD1       PRO   6 -10.372  16.792   3.644
   59    H    TYR   7           HN       TYR   7  -8.133  13.549   1.569
   60    HA   TYR   7           HA       TYR   7  -5.152  13.344   1.641
   61   1HB   TYR   7          HB2       TYR   7  -7.241  11.172   1.998
   62   2HB   TYR   7          HB1       TYR   7  -5.510  11.013   2.273
   63    HD1  TYR   7           HD1      TYR   7  -8.505  11.350   3.942
   64    HD2  TYR   7           HD2      TYR   7  -4.575  13.087   3.864
   65    HE1  TYR   7           HE1      TYR   7  -8.817  12.159   6.261
   66    HE2  TYR   7           HE2      TYR   7  -4.883  13.885   6.187
   67    HH   TYR   7           HH       TYR   7  -7.924  13.273   7.954
   68    H    SER   8           HN       SER   8  -4.059  12.455  -0.100
   69    HA   SER   8           HA       SER   8  -5.531  12.190  -2.607
   70   1HB   SER   8          HB2       SER   8  -2.627  11.774  -1.850
   71   2HB   SER   8          HB1       SER   8  -3.233  11.525  -3.485
   72    HG   SER   8           HG       SER   8  -3.264  13.604  -3.738
   73    H    TYR   9           HN       TYR   9  -5.214  10.142  -3.966
   74    HA   TYR   9           HA       TYR   9  -6.232   7.868  -2.578
   75   1HB   TYR   9          HB2       TYR   9  -4.809   8.066  -5.250
   76   2HB   TYR   9          HB1       TYR   9  -5.628   6.614  -4.670
   77    HD1  TYR   9           HD1      TYR   9  -8.092   6.624  -4.288
   78    HD2  TYR   9           HD2      TYR   9  -6.049   9.971  -6.047
   79    HE1  TYR   9           HE1      TYR   9 -10.257   7.523  -5.089
   80    HE2  TYR   9           HE2      TYR   9  -8.219  10.870  -6.848
   81    HH   TYR   9           HH       TYR   9 -11.232   9.049  -6.419
   82    H    ILE  10           HN       ILE  10  -2.951   8.824  -3.484
   83    HA   ILE  10           HA       ILE  10  -1.607   6.415  -2.750
   84    HB   ILE  10           HB       ILE  10  -0.594   9.267  -2.510
   85   1HG1  ILE  10          HG12      ILE  10  -1.405   8.924  -4.766
   86   2HG1  ILE  10          HG11      ILE  10   0.353   8.837  -4.797
   87   1HG2  ILE  10          HG21      ILE  10   0.906   7.763  -1.400
   88   2HG2  ILE  10          HG22      ILE  10   1.616   8.107  -2.978
   89   3HG2  ILE  10          HG23      ILE  10   0.779   6.580  -2.702
   90   1HD1  ILE  10          HD11      ILE  10  -1.653   6.616  -5.077
   91   2HD1  ILE  10          HD12      ILE  10  -0.029   6.258  -4.492
   92   3HD1  ILE  10          HD13      ILE  10  -0.254   6.982  -6.083
   93    H    ALA  11           HN       ALA  11  -2.340   9.349  -0.849
   94    HA   ALA  11           HA       ALA  11  -1.112   8.433   1.570
   95   1HB   ALA  11          HB1       ALA  11  -3.464  10.334   1.340
   96   2HB   ALA  11          HB2       ALA  11  -1.790  10.813   1.057
   97   3HB   ALA  11          HB3       ALA  11  -2.287  10.248   2.651
   98    H    LEU  12           HN       LEU  12  -4.483   8.152   0.404
   99    HA   LEU  12           HA       LEU  12  -5.535   7.027   2.804
  100   1HB   LEU  12          HB2       LEU  12  -6.326   6.573  -0.089
  101   2HB   LEU  12          HB1       LEU  12  -7.271   6.008   1.285
  102    HG   LEU  12           HG       LEU  12  -6.506   8.909   0.842
  103   1HD1  LEU  12          HD11      LEU  12  -8.993   7.364   0.085
  104   2HD1  LEU  12          HD12      LEU  12  -7.944   8.308  -0.975
  105   3HD1  LEU  12          HD13      LEU  12  -8.963   9.123   0.214
  106   1HD2  LEU  12          HD21      LEU  12  -8.612   9.095   2.423
  107   2HD2  LEU  12          HD22      LEU  12  -7.039   8.727   3.117
  108   3HD2  LEU  12          HD23      LEU  12  -8.208   7.433   2.849
  109    H    ILE  13           HN       ILE  13  -3.908   5.535   0.027
  110    HA   ILE  13           HA       ILE  13  -4.220   2.819   0.929
  111    HB   ILE  13           HB       ILE  13  -2.076   4.111  -0.792
  112   1HG1  ILE  13          HG12      ILE  13  -4.411   2.377  -1.632
  113   2HG1  ILE  13          HG11      ILE  13  -4.504   4.138  -1.583
  114   1HG2  ILE  13          HG21      ILE  13  -1.806   1.671  -1.573
  115   2HG2  ILE  13          HG22      ILE  13  -2.664   1.229  -0.098
  116   3HG2  ILE  13          HG23      ILE  13  -1.126   2.086   0.000
  117   1HD1  ILE  13          HD11      ILE  13  -3.887   3.260  -3.844
  118   2HD1  ILE  13          HD12      ILE  13  -2.418   2.580  -3.140
  119   3HD1  ILE  13          HD13      ILE  13  -2.660   4.327  -3.161
  120    H    THR  14           HN       THR  14  -1.663   5.255   1.350
  121    HA   THR  14           HA       THR  14   0.059   3.584   2.912
  122    HB   THR  14           HB       THR  14  -0.155   6.599   2.824
  123    HG1  THR  14           HG1      THR  14   1.270   6.458   1.199
  124   1HG2  THR  14          HG21      THR  14   1.119   6.095   4.750
  125   2HG2  THR  14          HG22      THR  14   2.324   6.342   3.487
  126   3HG2  THR  14          HG23      THR  14   1.888   4.706   3.981
  127    H    MET  15           HN       MET  15  -2.507   5.893   3.844
  128    HA   MET  15           HA       MET  15  -1.986   5.713   6.672
  129   1HB   MET  15          HB2       MET  15  -4.507   6.424   5.140
  130   2HB   MET  15          HB1       MET  15  -4.377   6.515   6.894
  131   1HG   MET  15          HG2       MET  15  -2.510   8.114   6.679
  132   2HG   MET  15          HG1       MET  15  -2.637   8.028   4.923
  133   1HE   MET  15          HE1       MET  15  -2.418  10.425   5.759
  134   2HE   MET  15          HE2       MET  15  -3.756  11.466   6.238
  135   3HE   MET  15          HE3       MET  15  -3.583  10.987   4.552
  136    H    ALA  16           HN       ALA  16  -4.086   3.913   4.463
  137    HA   ALA  16           HA       ALA  16  -5.474   2.365   6.392
  138   1HB   ALA  16          HB1       ALA  16  -5.905   0.813   4.537
  139   2HB   ALA  16          HB2       ALA  16  -4.613   1.565   3.599
  140   3HB   ALA  16          HB3       ALA  16  -6.068   2.482   3.987
  141    H    ILE  17           HN       ILE  17  -2.475   1.572   4.600
  142    HA   ILE  17           HA       ILE  17  -2.020  -0.956   5.825
  143    HB   ILE  17           HB       ILE  17   0.017   1.062   4.822
  144   1HG1  ILE  17          HG12      ILE  17  -1.189  -1.302   3.369
  145   2HG1  ILE  17          HG11      ILE  17  -1.835   0.334   3.235
  146   1HG2  ILE  17          HG21      ILE  17   1.282  -1.162   4.381
  147   2HG2  ILE  17          HG22      ILE  17   0.144  -1.877   5.522
  148   3HG2  ILE  17          HG23      ILE  17   1.214  -0.577   6.043
  149   1HD1  ILE  17          HD11      ILE  17  -0.189  -0.264   1.417
  150   2HD1  ILE  17          HD12      ILE  17   1.054  -0.378   2.661
  151   3HD1  ILE  17          HD13      ILE  17   0.258   1.166   2.350
  152    H    GLN  18           HN       GLN  18  -0.734   2.253   6.644
  153    HA   GLN  18           HA       GLN  18   0.709   1.404   8.972
  154   1HB   GLN  18          HB2       GLN  18  -0.421   4.119   8.241
  155   2HB   GLN  18          HB1       GLN  18   0.706   3.831   9.568
  156   1HG   GLN  18          HG2       GLN  18   2.355   2.920   7.976
  157   2HG   GLN  18          HG1       GLN  18   1.230   3.210   6.648
  158   1HE2  GLN  18          HE21      GLN  18   3.308   4.599   6.025
  159   2HE2  GLN  18          HE22      GLN  18   3.281   6.215   6.543
  160    H    ASN  19           HN       ASN  19  -2.596   2.671   8.574
  161    HA   ASN  19           HA       ASN  19  -3.076   2.612  11.463
  162   1HB   ASN  19          HB2       ASN  19  -4.895   3.099   9.091
  163   2HB   ASN  19          HB1       ASN  19  -5.439   3.155  10.768
  164   1HD2  ASN  19          HD21      ASN  19  -4.058   5.040   8.278
  165   2HD2  ASN  19          HD22      ASN  19  -3.541   6.348   9.229
  166    H    ALA  20           HN       ALA  20  -2.787   0.199   9.254
  167    HA   ALA  20           HA       ALA  20  -5.107  -1.405   9.989
  168   1HB   ALA  20          HB1       ALA  20  -2.493  -2.173   8.636
  169   2HB   ALA  20          HB2       ALA  20  -3.986  -1.718   7.811
  170   3HB   ALA  20          HB3       ALA  20  -3.918  -3.207   8.751
  171    HA   PRO  21           HA       PRO  21  -3.450  -3.004  13.801
  172   1HB   PRO  21          HB2       PRO  21  -4.378  -5.629  13.709
  173   2HB   PRO  21          HB1       PRO  21  -5.358  -4.238  14.208
  174   1HG   PRO  21          HG2       PRO  21  -5.260  -5.630  11.572
  175   2HG   PRO  21          HG1       PRO  21  -6.653  -4.973  12.448
  176   1HD   PRO  21          HD2       PRO  21  -5.549  -3.662  10.352
  177   2HD   PRO  21          HD1       PRO  21  -6.242  -2.785  11.735
  178    H    GLU  22           HN       GLU  22  -3.008  -4.792  10.823
  179    HA   GLU  22           HA       GLU  22  -0.286  -5.660  11.741
  180   1HB   GLU  22          HB2       GLU  22  -2.186  -7.109   9.860
  181   2HB   GLU  22          HB1       GLU  22  -0.548  -7.626  10.261
  182   1HG   GLU  22          HG2       GLU  22  -2.727  -7.226  12.326
  183   2HG   GLU  22          HG1       GLU  22  -2.346  -8.786  11.596
  184    H    LYS  23           HN       LYS  23   1.364  -5.164  10.265
  185    HA   LYS  23           HA       LYS  23   0.878  -3.120   8.342
  186   1HB   LYS  23          HB2       LYS  23   3.117  -3.701   9.415
  187   2HB   LYS  23          HB1       LYS  23   3.215  -5.056   8.294
  188   1HG   LYS  23          HG2       LYS  23   4.366  -3.427   7.091
  189   2HG   LYS  23          HG1       LYS  23   2.737  -3.201   6.468
  190   1HD   LYS  23          HD2       LYS  23   3.301  -1.005   6.992
  191   2HD   LYS  23          HD1       LYS  23   2.530  -1.496   8.496
  192   1HE   LYS  23          HE2       LYS  23   4.860  -2.157   9.312
  193   2HE   LYS  23          HE1       LYS  23   5.487  -1.311   7.899
  194   1HZ   LYS  23          HZ1       LYS  23   5.481   0.345   9.461
  195   2HZ   LYS  23          HZ2       LYS  23   4.087  -0.230  10.243
  196   3HZ   LYS  23          HZ3       LYS  23   3.956   0.583   8.757
  197    H    LYS  24           HN       LYS  24   1.112  -6.644   8.023
  198    HA   LYS  24           HA       LYS  24   0.784  -6.569   5.118
  199   1HB   LYS  24          HB2       LYS  24   0.564  -8.828   7.141
  200   2HB   LYS  24          HB1       LYS  24   0.498  -9.062   5.393
  201   1HG   LYS  24          HG2       LYS  24   2.742  -8.058   5.174
  202   2HG   LYS  24          HG1       LYS  24   2.814  -7.843   6.923
  203   1HD   LYS  24          HD2       LYS  24   2.603 -10.281   7.235
  204   2HD   LYS  24          HD1       LYS  24   2.533 -10.498   5.487
  205   1HE   LYS  24          HE2       LYS  24   4.822 -10.876   6.470
  206   2HE   LYS  24          HE1       LYS  24   4.775  -9.632   5.221
  207   1HZ   LYS  24          HZ1       LYS  24   4.792  -7.936   6.849
  208   2HZ   LYS  24          HZ2       LYS  24   6.026  -9.023   7.276
  209   3HZ   LYS  24          HZ3       LYS  24   4.548  -9.037   8.116
  210    H    ILE  25           HN       ILE  25  -1.156  -6.133   4.189
  211    HA   ILE  25           HA       ILE  25  -3.663  -7.051   5.530
  212    HB   ILE  25           HB       ILE  25  -3.244  -4.658   6.105
  213   1HG1  ILE  25          HG12      ILE  25  -5.533  -4.947   4.146
  214   2HG1  ILE  25          HG11      ILE  25  -5.557  -5.660   5.759
  215   1HG2  ILE  25          HG21      ILE  25  -3.639  -4.123   3.158
  216   2HG2  ILE  25          HG22      ILE  25  -2.039  -4.224   3.892
  217   3HG2  ILE  25          HG23      ILE  25  -3.171  -2.975   4.412
  218   1HD1  ILE  25          HD11      ILE  25  -6.653  -3.387   5.608
  219   2HD1  ILE  25          HD12      ILE  25  -5.062  -2.717   5.244
  220   3HD1  ILE  25          HD13      ILE  25  -5.358  -3.494   6.799
  221    H    THR  26           HN       THR  26  -5.371  -7.484   4.079
  222    HA   THR  26           HA       THR  26  -4.523  -8.149   1.366
  223    HB   THR  26           HB       THR  26  -6.822  -9.037   1.136
  224    HG1  THR  26           HG1      THR  26  -8.196  -8.850   2.947
  225   1HG2  THR  26          HG21      THR  26  -6.712 -10.619   3.128
  226   2HG2  THR  26          HG22      THR  26  -5.311  -9.694   3.669
  227   3HG2  THR  26          HG23      THR  26  -5.265 -10.546   2.124
  228    H    LEU  27           HN       LEU  27  -5.713  -7.455  -0.550
  229    HA   LEU  27           HA       LEU  27  -6.025  -4.606  -0.713
  230   1HB   LEU  27          HB2       LEU  27  -5.335  -6.007  -2.624
  231   2HB   LEU  27          HB1       LEU  27  -6.894  -6.819  -2.603
  232    HG   LEU  27           HG       LEU  27  -8.039  -4.811  -3.291
  233   1HD1  LEU  27          HD11      LEU  27  -5.395  -3.489  -2.681
  234   2HD1  LEU  27          HD12      LEU  27  -7.007  -3.042  -2.116
  235   3HD1  LEU  27          HD13      LEU  27  -6.547  -2.740  -3.789
  236   1HD2  LEU  27          HD21      LEU  27  -5.446  -5.114  -4.829
  237   2HD2  LEU  27          HD22      LEU  27  -6.928  -4.393  -5.451
  238   3HD2  LEU  27          HD23      LEU  27  -6.886  -6.107  -5.049
  239    H    ASN  28           HN       ASN  28  -8.289  -7.307  -0.491
  240    HA   ASN  28           HA       ASN  28 -10.699  -5.779  -0.767
  241   1HB   ASN  28          HB2       ASN  28 -10.118  -8.432   0.565
  242   2HB   ASN  28          HB1       ASN  28 -11.745  -7.767   0.401
  243   1HD2  ASN  28          HD21      ASN  28 -10.749 -10.224  -0.904
  244   2HD2  ASN  28          HD22      ASN  28 -10.861  -9.961  -2.578
  245    H    GLY  29           HN       GLY  29  -8.751  -6.728   2.040
  246   1HA   GLY  29          HA2       GLY  29 -10.524  -5.769   4.056
  247   2HA   GLY  29          HA1       GLY  29  -8.785  -5.973   4.258
  248    H    ILE  30           HN       ILE  30  -7.969  -4.117   2.211
  249    HA   ILE  30           HA       ILE  30  -7.938  -1.705   3.715
  250    HB   ILE  30           HB       ILE  30  -7.431  -2.188   0.766
  251   1HG1  ILE  30          HG12      ILE  30  -5.498  -1.656   3.040
  252   2HG1  ILE  30          HG11      ILE  30  -5.933  -3.277   2.498
  253   1HG2  ILE  30          HG21      ILE  30  -7.939   0.133   0.929
  254   2HG2  ILE  30          HG22      ILE  30  -6.180   0.049   0.996
  255   3HG2  ILE  30          HG23      ILE  30  -7.108   0.285   2.477
  256   1HD1  ILE  30          HD11      ILE  30  -5.198  -2.608   0.177
  257   2HD1  ILE  30          HD12      ILE  30  -3.892  -2.650   1.361
  258   3HD1  ILE  30          HD13      ILE  30  -4.587  -1.107   0.869
  259    H    TYR  31           HN       TYR  31 -10.012  -2.667   0.958
  260    HA   TYR  31           HA       TYR  31 -11.313  -0.156   0.699
  261   1HB   TYR  31          HB2       TYR  31 -12.279  -2.962   0.115
  262   2HB   TYR  31          HB1       TYR  31 -13.262  -1.542  -0.222
  263    HD1  TYR  31           HD1      TYR  31 -11.670   0.453  -1.389
  264    HD2  TYR  31           HD2      TYR  31 -11.203  -3.798  -1.778
  265    HE1  TYR  31           HE1      TYR  31 -10.456   0.778  -3.507
  266    HE2  TYR  31           HE2      TYR  31  -9.997  -3.467  -3.912
  267    HH   TYR  31           HH       TYR  31  -9.994  -0.506  -5.563
  268    H    GLN  32           HN       GLN  32 -12.006  -2.897   2.837
  269    HA   GLN  32           HA       GLN  32 -14.474  -1.924   3.870
  270   1HB   GLN  32          HB2       GLN  32 -13.609  -4.198   4.319
  271   2HB   GLN  32          HB1       GLN  32 -12.310  -3.512   5.293
  272   1HG   GLN  32          HG2       GLN  32 -13.976  -2.551   6.844
  273   2HG   GLN  32          HG1       GLN  32 -15.277  -3.238   5.871
  274   1HE2  GLN  32          HE21      GLN  32 -15.173  -4.058   8.511
  275   2HE2  GLN  32          HE22      GLN  32 -14.598  -5.650   8.621
  276    H    PHE  33           HN       PHE  33 -11.113  -1.289   4.845
  277    HA   PHE  33           HA       PHE  33 -11.697   0.285   7.143
  278   1HB   PHE  33          HB2       PHE  33  -9.439  -0.544   6.641
  279   2HB   PHE  33          HB1       PHE  33  -9.351   0.522   5.238
  280    HD1  PHE  33           HD1      PHE  33  -9.351   0.348   8.914
  281    HD2  PHE  33           HD2      PHE  33  -9.141   2.947   5.500
  282    HE1  PHE  33           HE1      PHE  33  -8.583   2.201  10.371
  283    HE2  PHE  33           HE2      PHE  33  -8.372   4.800   6.957
  284    HZ   PHE  33           HZ       PHE  33  -8.091   4.427   9.392
  285    H    ILE  34           HN       ILE  34 -11.167   1.318   3.750
  286    HA   ILE  34           HA       ILE  34 -11.511   4.099   4.261
  287    HB   ILE  34           HB       ILE  34 -11.824   2.406   1.781
  288   1HG1  ILE  34          HG12      ILE  34  -9.913   4.036   1.095
  289   2HG1  ILE  34          HG11      ILE  34  -9.816   4.428   2.807
  290   1HG2  ILE  34          HG21      ILE  34 -11.930   4.714   0.586
  291   2HG2  ILE  34          HG22      ILE  34 -12.494   5.324   2.142
  292   3HG2  ILE  34          HG23      ILE  34 -13.412   4.078   1.298
  293   1HD1  ILE  34          HD11      ILE  34  -9.411   2.071   3.345
  294   2HD1  ILE  34          HD12      ILE  34  -8.235   2.631   2.159
  295   3HD1  ILE  34          HD13      ILE  34  -9.598   1.636   1.647
  296    H    MET  35           HN       MET  35 -13.940   1.693   3.149
  297    HA   MET  35           HA       MET  35 -16.088   3.552   3.054
  298   1HB   MET  35          HB2       MET  35 -16.045   0.567   3.532
  299   2HB   MET  35          HB1       MET  35 -17.547   1.487   3.429
  300   1HG   MET  35          HG2       MET  35 -16.895   2.309   1.197
  301   2HG   MET  35          HG1       MET  35 -15.395   1.390   1.293
  302   1HE   MET  35          HE1       MET  35 -15.090  -0.933   1.263
  303   2HE   MET  35          HE2       MET  35 -15.452  -0.647  -0.437
  304   3HE   MET  35          HE3       MET  35 -16.133  -2.053   0.377
  305    H    ASP  36           HN       ASP  36 -14.851   1.608   5.776
  306    HA   ASP  36           HA       ASP  36 -16.940   2.490   7.583
  307   1HB   ASP  36          HB2       ASP  36 -14.202   1.281   8.060
  308   2HB   ASP  36          HB1       ASP  36 -15.334   1.654   9.361
  309    H    ARG  37           HN       ARG  37 -13.496   3.416   7.212
  310    HA   ARG  37           HA       ARG  37 -13.545   5.515   9.128
  311   1HB   ARG  37          HB2       ARG  37 -11.466   4.559   8.146
  312   2HB   ARG  37          HB1       ARG  37 -11.869   5.307   6.606
  313   1HG   ARG  37          HG2       ARG  37 -10.302   6.770   7.650
  314   2HG   ARG  37          HG1       ARG  37 -11.867   7.549   7.835
  315   1HD   ARG  37          HD2       ARG  37 -12.029   6.869  10.133
  316   2HD   ARG  37          HD1       ARG  37 -10.654   5.774   9.970
  317    HE   ARG  37           HE       ARG  37  -9.612   8.258   9.327
  318   1HH1  ARG  37          HH21      ARG  37 -11.420   6.900  11.930
  319   2HH1  ARG  37          HH22      ARG  37 -10.740   7.953  13.126
  320   1HH2  ARG  37          HH11      ARG  37  -8.714   9.639  10.873
  321   2HH2  ARG  37          HH12      ARG  37  -9.207   9.504  12.527
  322    H    PHE  38           HN       PHE  38 -13.993   5.644   5.586
  323    HA   PHE  38           HA       PHE  38 -15.316   8.317   5.920
  324   1HB   PHE  38          HB2       PHE  38 -13.978   7.265   3.415
  325   2HB   PHE  38          HB1       PHE  38 -14.541   8.905   3.728
  326    HD1  PHE  38           HD1      PHE  38 -13.414  10.272   5.548
  327    HD2  PHE  38           HD2      PHE  38 -11.826   6.544   4.122
  328    HE1  PHE  38           HE1      PHE  38 -11.201  10.846   6.512
  329    HE2  PHE  38           HE2      PHE  38  -9.616   7.115   5.089
  330    HZ   PHE  38           HZ       PHE  38  -9.303   9.264   6.284
  331    HA   PRO  39           HA       PRO  39 -18.630   5.607   4.300
  332   1HB   PRO  39          HB2       PRO  39 -20.763   7.033   5.123
  333   2HB   PRO  39          HB1       PRO  39 -19.767   6.118   6.271
  334   1HG   PRO  39          HG2       PRO  39 -19.750   9.042   5.674
  335   2HG   PRO  39          HG1       PRO  39 -19.635   8.215   7.237
  336   1HD   PRO  39          HD2       PRO  39 -17.450   9.202   5.837
  337   2HD   PRO  39          HD1       PRO  39 -17.351   7.896   7.039
  338    H    PHE  40           HN       PHE  40 -17.740   8.742   3.355
  339    HA   PHE  40           HA       PHE  40 -19.851   9.487   1.593
  340   1HB   PHE  40          HB2       PHE  40 -17.004  10.044   0.816
  341   2HB   PHE  40          HB1       PHE  40 -18.396  11.123   0.813
  342    HD1  PHE  40           HD1      PHE  40 -19.482  10.908   3.503
  343    HD2  PHE  40           HD2      PHE  40 -15.379  10.955   2.226
  344    HE1  PHE  40           HE1      PHE  40 -18.805  11.799   5.714
  345    HE2  PHE  40           HE2      PHE  40 -14.705  11.854   4.436
  346    HZ   PHE  40           HZ       PHE  40 -16.417  12.270   6.183
  347    H    TYR  41           HN       TYR  41 -17.017   7.434   1.110
  348    HA   TYR  41           HA       TYR  41 -17.302   7.033  -1.695
  349   1HB   TYR  41          HB2       TYR  41 -16.066   5.301   0.457
  350   2HB   TYR  41          HB1       TYR  41 -15.900   4.992  -1.274
  351    HD1  TYR  41           HD1      TYR  41 -14.486   6.346  -2.658
  352    HD2  TYR  41           HD2      TYR  41 -15.176   7.401   1.438
  353    HE1  TYR  41           HE1      TYR  41 -12.665   8.016  -2.801
  354    HE2  TYR  41           HE2      TYR  41 -13.362   9.086   1.321
  355    HH   TYR  41           HH       TYR  41 -11.373   9.426  -1.618
  356    H    ARG  42           HN       ARG  42 -19.150   5.780   0.942
  357    HA   ARG  42           HA       ARG  42 -19.963   3.276  -0.136
  358   1HB   ARG  42          HB2       ARG  42 -21.463   5.292   1.566
  359   2HB   ARG  42          HB1       ARG  42 -22.063   3.671   1.216
  360   1HG   ARG  42          HG2       ARG  42 -20.143   2.662   2.298
  361   2HG   ARG  42          HG1       ARG  42 -19.382   4.240   2.509
  362   1HD   ARG  42          HD2       ARG  42 -20.398   3.642   4.615
  363   2HD   ARG  42          HD1       ARG  42 -21.379   4.920   3.897
  364    HE   ARG  42           HE       ARG  42 -22.601   2.610   3.009
  365   1HH1  ARG  42          HH21      ARG  42 -21.580   3.869   6.054
  366   2HH1  ARG  42          HH22      ARG  42 -22.835   3.081   6.951
  367   1HH2  ARG  42          HH11      ARG  42 -24.244   1.573   4.164
  368   2HH2  ARG  42          HH12      ARG  42 -24.341   1.780   5.882
  369    H    GLU  43           HN       GLU  43 -21.258   6.563  -0.599
  370    HA   GLU  43           HA       GLU  43 -23.413   5.811  -2.312
  371   1HB   GLU  43          HB2       GLU  43 -23.184   8.042  -1.212
  372   2HB   GLU  43          HB1       GLU  43 -21.862   8.410  -2.320
  373   1HG   GLU  43          HG2       GLU  43 -23.335   8.228  -4.235
  374   2HG   GLU  43          HG1       GLU  43 -24.662   7.672  -3.212
  375    H    ASN  44           HN       ASN  44 -20.111   6.774  -2.986
  376    HA   ASN  44           HA       ASN  44 -20.457   6.027  -5.862
  377   1HB   ASN  44          HB2       ASN  44 -19.434   8.263  -5.293
  378   2HB   ASN  44          HB1       ASN  44 -18.091   7.391  -4.547
  379   1HD2  ASN  44          HD21      ASN  44 -16.389   7.650  -6.024
  380   2HD2  ASN  44          HD22      ASN  44 -16.489   7.266  -7.675
  381    H    LYS  45           HN       LYS  45 -20.237   3.776  -5.833
  382    HA   LYS  45           HA       LYS  45 -17.934   2.593  -4.374
  383   1HB   LYS  45          HB2       LYS  45 -20.179   1.299  -5.957
  384   2HB   LYS  45          HB1       LYS  45 -18.975   0.443  -4.995
  385   1HG   LYS  45          HG2       LYS  45 -19.755   1.615  -2.967
  386   2HG   LYS  45          HG1       LYS  45 -20.963   2.469  -3.927
  387   1HD   LYS  45          HD2       LYS  45 -21.999   0.318  -4.548
  388   2HD   LYS  45          HD1       LYS  45 -20.796  -0.542  -3.588
  389   1HE   LYS  45          HE2       LYS  45 -22.639   1.563  -2.431
  390   2HE   LYS  45          HE1       LYS  45 -23.009  -0.161  -2.414
  391   1HZ   LYS  45          HZ1       LYS  45 -20.721  -0.405  -1.353
  392   2HZ   LYS  45          HZ2       LYS  45 -21.972   0.219  -0.389
  393   3HZ   LYS  45          HZ3       LYS  45 -20.808   1.262  -1.056
  394    H    GLN  46           HN       GLN  46 -19.218   2.883  -7.684
  395    HA   GLN  46           HA       GLN  46 -16.866   1.551  -8.819
  396   1HB   GLN  46          HB2       GLN  46 -19.244   2.984 -10.015
  397   2HB   GLN  46          HB1       GLN  46 -17.913   2.387 -11.006
  398   1HG   GLN  46          HG2       GLN  46 -18.276   0.113 -10.175
  399   2HG   GLN  46          HG1       GLN  46 -19.558   0.685  -9.108
  400   1HE2  GLN  46          HE21      GLN  46 -18.922   1.626 -12.523
  401   2HE2  GLN  46          HE22      GLN  46 -20.425   1.094 -13.108
  402    H    GLY  47           HN       GLY  47 -15.245   2.597 -10.048
  403   1HA   GLY  47          HA2       GLY  47 -14.229   4.572 -11.041
  404   2HA   GLY  47          HA1       GLY  47 -15.152   5.580  -9.931
  405    H    TRP  48           HN       TRP  48 -14.573   5.255  -7.549
  406    HA   TRP  48           HA       TRP  48 -11.733   5.607  -7.268
  407   1HB   TRP  48          HB2       TRP  48 -12.143   6.114  -5.020
  408   2HB   TRP  48          HB1       TRP  48 -13.609   6.624  -5.845
  409    HD1  TRP  48           HD1      TRP  48 -15.784   4.989  -5.587
  410    HE1  TRP  48           HE1      TRP  48 -16.442   3.432  -3.646
  411    HE3  TRP  48           HE3      TRP  48 -11.271   4.549  -3.228
  412    HZ2  TRP  48           HZ2      TRP  48 -15.227   2.170  -1.387
  413    HZ3  TRP  48           HZ3      TRP  48 -11.053   3.171  -1.183
  414    HH2  TRP  48           HH2      TRP  48 -13.024   1.981  -0.258
  415    H    GLN  49           HN       GLN  49 -13.889   2.873  -6.535
  416    HA   GLN  49           HA       GLN  49 -11.985   1.298  -5.143
  417   1HB   GLN  49          HB2       GLN  49 -14.318   0.489  -6.885
  418   2HB   GLN  49          HB1       GLN  49 -13.368  -0.664  -5.950
  419   1HG   GLN  49          HG2       GLN  49 -13.899   0.574  -3.879
  420   2HG   GLN  49          HG1       GLN  49 -14.850   1.722  -4.819
  421   1HE2  GLN  49          HE21      GLN  49 -15.601  -0.824  -6.554
  422   2HE2  GLN  49          HE22      GLN  49 -16.877  -1.502  -5.663
  423    H    ASN  50           HN       ASN  50 -12.639   1.523  -8.629
  424    HA   ASN  50           HA       ASN  50 -10.758  -0.531  -9.364
  425   1HB   ASN  50          HB2       ASN  50 -12.007   1.751 -10.917
  426   2HB   ASN  50          HB1       ASN  50 -10.953   0.545 -11.655
  427   1HD2  ASN  50          HD21      ASN  50 -11.778  -1.821 -10.428
  428   2HD2  ASN  50          HD22      ASN  50 -13.413  -2.118 -10.778
  429    H    SER  51           HN       SER  51 -10.493   3.008  -9.102
  430    HA   SER  51           HA       SER  51  -7.946   3.297 -10.301
  431   1HB   SER  51          HB2       SER  51  -7.804   5.418  -9.076
  432   2HB   SER  51          HB1       SER  51  -9.425   5.191  -9.727
  433    HG   SER  51           HG       SER  51  -8.632   5.467  -7.175
  434    H    ILE  52           HN       ILE  52  -8.760   2.541  -6.905
  435    HA   ILE  52           HA       ILE  52  -6.117   2.780  -5.882
  436    HB   ILE  52           HB       ILE  52  -8.336   0.898  -5.044
  437   1HG1  ILE  52          HG12      ILE  52  -9.013   3.239  -4.917
  438   2HG1  ILE  52          HG11      ILE  52  -8.768   2.604  -3.295
  439   1HG2  ILE  52          HG21      ILE  52  -5.729   1.659  -3.728
  440   2HG2  ILE  52          HG22      ILE  52  -6.332   0.044  -4.097
  441   3HG2  ILE  52          HG23      ILE  52  -7.087   0.997  -2.818
  442   1HD1  ILE  52          HD11      ILE  52  -6.321   3.575  -3.624
  443   2HD1  ILE  52          HD12      ILE  52  -7.647   4.629  -3.147
  444   3HD1  ILE  52          HD13      ILE  52  -7.122   4.584  -4.828
  445    H    ARG  53           HN       ARG  53  -7.778  -0.139  -7.136
  446    HA   ARG  53           HA       ARG  53  -5.559  -1.894  -6.803
  447   1HB   ARG  53          HB2       ARG  53  -7.519  -2.122  -9.100
  448   2HB   ARG  53          HB1       ARG  53  -6.752  -3.416  -8.173
  449   1HG   ARG  53          HG2       ARG  53  -7.982  -2.465  -6.134
  450   2HG   ARG  53          HG1       ARG  53  -8.930  -1.528  -7.284
  451   1HD   ARG  53          HD2       ARG  53  -9.043  -4.423  -6.667
  452   2HD   ARG  53          HD1       ARG  53 -10.299  -3.356  -7.298
  453    HE   ARG  53           HE       ARG  53  -8.555  -3.653  -9.432
  454   1HH1  ARG  53          HH21      ARG  53 -10.283  -5.721  -7.281
  455   2HH1  ARG  53          HH22      ARG  53 -10.452  -7.003  -8.434
  456   1HH2  ARG  53          HH11      ARG  53  -8.766  -5.319 -10.953
  457   2HH2  ARG  53          HH12      ARG  53  -9.594  -6.775 -10.511
  458    H    HIS  54           HN       HIS  54  -6.579  -0.020  -9.677
  459    HA   HIS  54           HA       HIS  54  -4.391  -0.799 -11.330
  460   1HB   HIS  54          HB2       HIS  54  -6.058   1.735 -11.273
  461   2HB   HIS  54          HB1       HIS  54  -4.858   1.398 -12.522
  462    HD1  HIS  54           HD1      HIS  54  -8.131   0.091 -11.144
  463    HD2  HIS  54           HD2      HIS  54  -5.665  -0.478 -14.455
  464    HE1  HIS  54           HE1      HIS  54  -9.427  -1.365 -12.760
  465    H    ASN  55           HN       ASN  55  -4.787   1.808  -8.969
  466    HA   ASN  55           HA       ASN  55  -2.279   3.097  -9.422
  467   1HB   ASN  55          HB2       ASN  55  -4.132   4.056  -8.052
  468   2HB   ASN  55          HB1       ASN  55  -3.809   2.842  -6.814
  469   1HD2  ASN  55          HD21      ASN  55  -2.118   5.448  -8.645
  470   2HD2  ASN  55          HD22      ASN  55  -1.076   5.868  -7.373
  471    H    LEU  56           HN       LEU  56  -3.216   0.375  -7.324
  472    HA   LEU  56           HA       LEU  56  -0.679   0.114  -6.040
  473   1HB   LEU  56          HB2       LEU  56  -2.881  -1.885  -6.541
  474   2HB   LEU  56          HB1       LEU  56  -1.442  -2.266  -5.600
  475    HG   LEU  56           HG       LEU  56  -3.287   0.061  -4.986
  476   1HD1  LEU  56          HD11      LEU  56  -4.124  -1.380  -3.131
  477   2HD1  LEU  56          HD12      LEU  56  -3.196  -2.725  -3.797
  478   3HD1  LEU  56          HD13      LEU  56  -4.521  -2.024  -4.722
  479   1HD2  LEU  56          HD21      LEU  56  -0.832  -1.106  -3.701
  480   2HD2  LEU  56          HD22      LEU  56  -2.079  -0.430  -2.658
  481   3HD2  LEU  56          HD23      LEU  56  -1.312   0.581  -3.875
  482    H    SER  57           HN       SER  57  -1.963  -1.333  -9.021
  483    HA   SER  57           HA       SER  57   0.323  -3.034  -9.460
  484   1HB   SER  57          HB2       SER  57  -1.736  -1.939 -11.396
  485   2HB   SER  57          HB1       SER  57  -0.552  -3.180 -11.794
  486    HG   SER  57           HG       SER  57  -1.463  -4.325  -9.911
  487    H    LEU  58           HN       LEU  58  -0.572   0.169 -10.775
  488    HA   LEU  58           HA       LEU  58   1.784   0.442 -12.387
  489   1HB   LEU  58          HB2       LEU  58  -0.091   2.492 -11.193
  490   2HB   LEU  58          HB1       LEU  58   1.200   2.901 -12.318
  491    HG   LEU  58           HG       LEU  58  -0.866   0.799 -12.992
  492   1HD1  LEU  58          HD11      LEU  58  -2.025   2.936 -12.430
  493   2HD1  LEU  58          HD12      LEU  58  -2.169   2.519 -14.137
  494   3HD1  LEU  58          HD13      LEU  58  -1.026   3.762 -13.626
  495   1HD2  LEU  58          HD21      LEU  58   0.988   0.750 -14.503
  496   2HD2  LEU  58          HD22      LEU  58   1.073   2.510 -14.576
  497   3HD2  LEU  58          HD23      LEU  58  -0.268   1.659 -15.336
  498    H    ASN  59           HN       ASN  59   1.048   1.446  -9.050
  499    HA   ASN  59           HA       ASN  59   3.601   2.801  -8.727
  500   1HB   ASN  59          HB2       ASN  59   1.437   1.917  -6.812
  501   2HB   ASN  59          HB1       ASN  59   2.939   2.644  -6.241
  502   1HD2  ASN  59          HD21      ASN  59  -0.063   3.291  -7.994
  503   2HD2  ASN  59          HD22      ASN  59   0.127   4.977  -8.059
  504    H    GLU  60           HN       GLU  60   5.495   1.744  -8.586
  505    HA   GLU  60           HA       GLU  60   5.566  -1.100  -7.787
  506   1HB   GLU  60          HB2       GLU  60   7.744   0.768  -8.771
  507   2HB   GLU  60          HB1       GLU  60   7.929  -0.967  -8.507
  508   1HG   GLU  60          HG2       GLU  60   6.164  -1.411 -10.173
  509   2HG   GLU  60          HG1       GLU  60   5.980   0.322 -10.447
  510    H    CYS  61           HN       CYS  61   5.646   1.821  -6.225
  511    HA   CYS  61           HA       CYS  61   7.817   1.588  -4.398
  512   1HB   CYS  61          HB2       CYS  61   5.094   2.883  -4.157
  513   2HB   CYS  61          HB1       CYS  61   6.309   2.989  -2.883
  514    HG   CYS  61           HG       CYS  61   7.809   3.879  -5.169
  515    H    PHE  62           HN       PHE  62   4.519   0.275  -4.286
  516    HA   PHE  62           HA       PHE  62   4.921  -0.906  -1.643
  517   1HB   PHE  62          HB2       PHE  62   2.766  -1.488  -3.700
  518   2HB   PHE  62          HB1       PHE  62   2.714  -1.869  -1.978
  519    HD1  PHE  62           HD1      PHE  62   2.716   0.009  -0.287
  520    HD2  PHE  62           HD2      PHE  62   2.231   0.692  -4.502
  521    HE1  PHE  62           HE1      PHE  62   1.832   2.275   0.181
  522    HE2  PHE  62           HE2      PHE  62   1.347   2.959  -4.032
  523    HZ   PHE  62           HZ       PHE  62   1.147   3.752  -1.690
  524    H    VAL  63           HN       VAL  63   5.075  -3.198  -1.241
  525    HA   VAL  63           HA       VAL  63   6.243  -4.751  -3.531
  526    HB   VAL  63           HB       VAL  63   6.642  -5.300  -0.584
  527   1HG1  VAL  63          HG11      VAL  63   7.088  -7.101  -2.264
  528   2HG1  VAL  63          HG12      VAL  63   8.531  -6.607  -1.383
  529   3HG1  VAL  63          HG13      VAL  63   8.268  -6.041  -3.032
  530   1HG2  VAL  63          HG21      VAL  63   7.484  -3.050  -0.996
  531   2HG2  VAL  63          HG22      VAL  63   8.324  -3.593  -2.450
  532   3HG2  VAL  63          HG23      VAL  63   8.851  -4.154  -0.862
  533    H    LYS  64           HN       LYS  64   5.071  -6.514  -4.176
  534    HA   LYS  64           HA       LYS  64   2.596  -7.228  -2.856
  535   1HB   LYS  64          HB2       LYS  64   4.233  -8.683  -4.964
  536   2HB   LYS  64          HB1       LYS  64   2.623  -9.174  -4.440
  537   1HG   LYS  64          HG2       LYS  64   1.714  -7.002  -5.172
  538   2HG   LYS  64          HG1       LYS  64   3.325  -6.505  -5.698
  539   1HD   LYS  64          HD2       LYS  64   3.402  -8.400  -7.276
  540   2HD   LYS  64          HD1       LYS  64   1.793  -8.902  -6.758
  541   1HE   LYS  64          HE2       LYS  64   1.820  -7.548  -8.885
  542   2HE   LYS  64          HE1       LYS  64   0.809  -6.872  -7.610
  543   1HZ   LYS  64          HZ1       LYS  64   2.532  -5.399  -8.892
  544   2HZ   LYS  64          HZ2       LYS  64   3.617  -6.046  -7.757
  545   3HZ   LYS  64          HZ3       LYS  64   2.259  -5.170  -7.233
  546    H    VAL  65           HN       VAL  65   2.198  -9.064  -1.522
  547    HA   VAL  65           HA       VAL  65   4.578 -10.678  -0.689
  548    HB   VAL  65           HB       VAL  65   2.580  -9.512   1.263
  549   1HG1  VAL  65          HG11      VAL  65   3.791 -11.636   1.861
  550   2HG1  VAL  65          HG12      VAL  65   4.150 -10.287   2.937
  551   3HG1  VAL  65          HG13      VAL  65   5.310 -10.757   1.694
  552   1HG2  VAL  65          HG21      VAL  65   3.931  -7.720   0.198
  553   2HG2  VAL  65          HG22      VAL  65   5.402  -8.586   0.641
  554   3HG2  VAL  65          HG23      VAL  65   4.350  -7.933   1.897
  555    HA   PRO  66           HA       PRO  66   0.850 -13.265  -1.872
  556   1HB   PRO  66          HB2       PRO  66   3.202 -15.083  -2.309
  557   2HB   PRO  66          HB1       PRO  66   1.752 -14.861  -3.309
  558   1HG   PRO  66          HG2       PRO  66   4.073 -13.797  -4.034
  559   2HG   PRO  66          HG1       PRO  66   2.554 -12.912  -4.269
  560   1HD   PRO  66          HD2       PRO  66   4.690 -12.473  -2.214
  561   2HD   PRO  66          HD1       PRO  66   3.639 -11.285  -3.018
  562    H    ARG  67           HN       ARG  67   0.129 -15.291  -0.823
  563    HA   ARG  67           HA       ARG  67   1.077 -15.465   1.957
  564   1HB   ARG  67          HB2       ARG  67  -1.050 -17.065   0.502
  565   2HB   ARG  67          HB1       ARG  67  -0.757 -17.073   2.241
  566   1HG   ARG  67          HG2       ARG  67  -1.280 -14.674   2.345
  567   2HG   ARG  67          HG1       ARG  67  -1.585 -14.662   0.607
  568   1HD   ARG  67          HD2       ARG  67  -3.723 -14.898   1.713
  569   2HD   ARG  67          HD1       ARG  67  -3.318 -16.457   0.990
  570    HE   ARG  67           HE       ARG  67  -2.297 -16.637   3.558
  571   1HH1  ARG  67          HH21      ARG  67  -5.327 -15.834   2.123
  572   2HH1  ARG  67          HH22      ARG  67  -6.266 -16.455   3.441
  573   1HH2  ARG  67          HH11      ARG  67  -3.506 -17.456   5.285
  574   2HH2  ARG  67          HH12      ARG  67  -5.235 -17.369   5.232
  575    H    ASP  68           HN       ASP  68   1.517 -17.711   2.868
  576    HA   ASP  68           HA       ASP  68   3.551 -19.008   1.229
  577   1HB   ASP  68          HB2       ASP  68   3.883 -20.457   3.184
  578   2HB   ASP  68          HB1       ASP  68   3.812 -18.765   3.680
  579    H    ASP  69           HN       ASP  69   3.514 -21.438   0.976
  580    HA   ASP  69           HA       ASP  69   1.254 -22.257  -0.537
  581   1HB   ASP  69          HB2       ASP  69   3.510 -23.838   0.713
  582   2HB   ASP  69          HB1       ASP  69   2.304 -24.553  -0.357
  583    H    LYS  70           HN       LYS  70   2.075 -22.846   2.877
  584    HA   LYS  70           HA       LYS  70   0.138 -24.864   3.378
  585   1HB   LYS  70          HB2       LYS  70   1.273 -22.714   5.185
  586   2HB   LYS  70          HB1       LYS  70   0.230 -24.016   5.759
  587   1HG   LYS  70          HG2       LYS  70   1.818 -25.695   4.980
  588   2HG   LYS  70          HG1       LYS  70   2.827 -24.444   4.261
  589   1HD   LYS  70          HD2       LYS  70   3.783 -25.098   6.407
  590   2HD   LYS  70          HD1       LYS  70   3.174 -23.449   6.516
  591   1HE   LYS  70          HE2       LYS  70   2.613 -25.091   8.446
  592   2HE   LYS  70          HE1       LYS  70   1.311 -24.094   7.808
  593   1HZ   LYS  70          HZ1       LYS  70   0.358 -25.860   6.737
  594   2HZ   LYS  70          HZ2       LYS  70   0.996 -26.643   8.104
  595   3HZ   LYS  70          HZ3       LYS  70   1.810 -26.729   6.615
  596    H    LYS  71           HN       LYS  71  -0.184 -21.310   3.463
  597    HA   LYS  71           HA       LYS  71  -3.014 -21.524   4.225
  598   1HB   LYS  71          HB2       LYS  71  -1.321 -19.148   3.387
  599   2HB   LYS  71          HB1       LYS  71  -2.981 -19.030   3.957
  600   1HG   LYS  71          HG2       LYS  71  -0.841 -20.394   5.601
  601   2HG   LYS  71          HG1       LYS  71  -1.094 -18.652   5.685
  602   1HD   LYS  71          HD2       LYS  71  -3.560 -19.187   6.173
  603   2HD   LYS  71          HD1       LYS  71  -3.034 -20.852   6.426
  604   1HE   LYS  71          HE2       LYS  71  -2.992 -19.844   8.580
  605   2HE   LYS  71          HE1       LYS  71  -1.308 -19.903   8.059
  606   1HZ   LYS  71          HZ1       LYS  71  -2.992 -17.535   7.530
  607   2HZ   LYS  71          HZ2       LYS  71  -1.297 -17.648   7.569
  608   3HZ   LYS  71          HZ3       LYS  71  -2.190 -17.725   9.012
  609    HA   PRO  72           HA       PRO  72  -4.582 -21.892   0.097
  610   1HB   PRO  72          HB2       PRO  72  -6.838 -20.253   0.235
  611   2HB   PRO  72          HB1       PRO  72  -6.768 -21.927   0.812
  612   1HG   PRO  72          HG2       PRO  72  -6.516 -19.389   2.354
  613   2HG   PRO  72          HG1       PRO  72  -7.340 -20.897   2.791
  614   1HD   PRO  72          HD2       PRO  72  -4.927 -20.264   3.824
  615   2HD   PRO  72          HD1       PRO  72  -5.359 -21.947   3.450
  616    H    GLY  73           HN       GLY  73  -4.280 -20.842  -1.859
  617   1HA   GLY  73          HA2       GLY  73  -2.855 -18.334  -1.839
  618   2HA   GLY  73          HA1       GLY  73  -3.378 -19.205  -3.277
  619    H    LYS  74           HN       LYS  74  -4.497 -16.970  -0.753
  620    HA   LYS  74           HA       LYS  74  -6.683 -16.073  -2.612
  621   1HB   LYS  74          HB2       LYS  74  -6.488 -15.952   0.406
  622   2HB   LYS  74          HB1       LYS  74  -7.707 -15.083  -0.526
  623   1HG   LYS  74          HG2       LYS  74  -8.500 -17.211  -1.484
  624   2HG   LYS  74          HG1       LYS  74  -7.282 -18.087  -0.553
  625   1HD   LYS  74          HD2       LYS  74  -8.276 -17.239   1.542
  626   2HD   LYS  74          HD1       LYS  74  -9.494 -16.368   0.608
  627   1HE   LYS  74          HE2       LYS  74  -9.104 -19.356   0.365
  628   2HE   LYS  74          HE1       LYS  74 -10.212 -18.641   1.537
  629   1HZ   LYS  74          HZ1       LYS  74 -11.065 -19.289  -0.803
  630   2HZ   LYS  74          HZ2       LYS  74 -10.351 -17.824  -1.284
  631   3HZ   LYS  74          HZ3       LYS  74 -11.573 -17.829  -0.104
  632    H    GLY  75           HN       GLY  75  -6.537 -14.071  -3.387
  633   1HA   GLY  75          HA2       GLY  75  -5.432 -12.048  -3.935
  634   2HA   GLY  75          HA1       GLY  75  -5.890 -11.687  -2.274
  635    H    SER  76           HN       SER  76  -4.015 -10.390  -1.998
  636    HA   SER  76           HA       SER  76  -1.639 -11.917  -1.181
  637   1HB   SER  76          HB2       SER  76  -1.251 -11.462  -3.612
  638   2HB   SER  76          HB1       SER  76  -1.430  -9.740  -3.289
  639    HG   SER  76           HG       SER  76   0.771 -10.540  -3.279
  640    H    TYR  77           HN       TYR  77  -0.580 -10.796   0.509
  641    HA   TYR  77           HA       TYR  77  -1.979  -8.430   1.515
  642   1HB   TYR  77          HB2       TYR  77   0.647  -9.504   2.560
  643   2HB   TYR  77          HB1       TYR  77  -0.559  -8.555   3.419
  644    HD1  TYR  77           HD1      TYR  77   0.779 -11.552   3.688
  645    HD2  TYR  77           HD2      TYR  77  -3.095  -9.950   2.745
  646    HE1  TYR  77           HE1      TYR  77  -0.281 -13.644   4.480
  647    HE2  TYR  77           HE2      TYR  77  -4.150 -12.042   3.535
  648    HH   TYR  77           HH       TYR  77  -3.751 -13.920   4.838
  649    H    TRP  78           HN       TRP  78  -0.950  -6.349   1.834
  650    HA   TRP  78           HA       TRP  78   1.244  -5.803  -0.145
  651   1HB   TRP  78          HB2       TRP  78  -1.179  -4.158   0.617
  652   2HB   TRP  78          HB1       TRP  78   0.176  -3.518  -0.315
  653    HD1  TRP  78           HD1      TRP  78  -2.607  -6.162  -0.515
  654    HE1  TRP  78           HE1      TRP  78  -2.951  -6.788  -2.992
  655    HE3  TRP  78           HE3      TRP  78   1.226  -3.538  -2.624
  656    HZ2  TRP  78           HZ2      TRP  78  -1.747  -6.248  -5.541
  657    HZ3  TRP  78           HZ3      TRP  78   1.604  -3.603  -5.071
  658    HH2  TRP  78           HH2      TRP  78   0.119  -4.946  -6.530
  659    H    THR  79           HN       THR  79   2.929  -4.579   0.504
  660    HA   THR  79           HA       THR  79   2.882  -3.283   3.191
  661    HB   THR  79           HB       THR  79   3.878  -5.579   3.387
  662    HG1  THR  79           HG1      THR  79   5.708  -4.846   4.455
  663   1HG2  THR  79          HG21      THR  79   6.079  -4.494   1.621
  664   2HG2  THR  79          HG22      THR  79   4.784  -5.520   1.008
  665   3HG2  THR  79          HG23      THR  79   5.895  -6.140   2.230
  666    H    LEU  80           HN       LEU  80   4.733  -1.714   3.399
  667    HA   LEU  80           HA       LEU  80   5.301  -0.474   0.751
  668   1HB   LEU  80          HB2       LEU  80   5.865   0.720   3.470
  669   2HB   LEU  80          HB1       LEU  80   5.752   1.549   1.924
  670    HG   LEU  80           HG       LEU  80   3.264   0.374   2.045
  671   1HD1  LEU  80          HD11      LEU  80   3.557  -0.492   4.301
  672   2HD1  LEU  80          HD12      LEU  80   2.412   0.850   4.351
  673   3HD1  LEU  80          HD13      LEU  80   4.074   1.093   4.879
  674   1HD2  LEU  80          HD21      LEU  80   3.716   2.735   1.526
  675   2HD2  LEU  80          HD22      LEU  80   4.061   3.053   3.227
  676   3HD2  LEU  80          HD23      LEU  80   2.431   2.599   2.727
  677    H    ASP  81           HN       ASP  81   6.823  -2.793   2.263
  678    HA   ASP  81           HA       ASP  81   9.504  -1.717   1.575
  679   1HB   ASP  81          HB2       ASP  81   8.717  -2.778   4.292
  680   2HB   ASP  81          HB1       ASP  81  10.392  -2.597   3.780
  681    HA   PRO  82           HA       PRO  82  10.047  -5.933   0.216
  682   1HB   PRO  82          HB2       PRO  82  12.758  -6.104   0.081
  683   2HB   PRO  82          HB1       PRO  82  11.823  -5.084  -1.029
  684   1HG   PRO  82          HG2       PRO  82  13.305  -4.305   1.448
  685   2HG   PRO  82          HG1       PRO  82  13.286  -3.518  -0.140
  686   1HD   PRO  82          HD2       PRO  82  11.766  -2.630   1.943
  687   2HD   PRO  82          HD1       PRO  82  11.252  -2.469   0.250
  688    H    ASP  83           HN       ASP  83  12.333  -7.571   1.005
  689    HA   ASP  83           HA       ASP  83  11.329  -8.507   3.588
  690   1HB   ASP  83          HB2       ASP  83  12.135 -10.040   1.721
  691   2HB   ASP  83          HB1       ASP  83  13.772  -9.498   2.091
  692    H    SER  84           HN       SER  84  11.941  -6.336   4.545
  693    HA   SER  84           HA       SER  84  14.627  -5.499   4.885
  694   1HB   SER  84          HB2       SER  84  13.740  -3.967   6.406
  695   2HB   SER  84          HB1       SER  84  12.310  -4.397   5.476
  696    HG   SER  84           HG       SER  84  12.000  -4.495   7.767
  697    H    TYR  85           HN       TYR  85  15.823  -7.462   5.265
  698    HA   TYR  85           HA       TYR  85  15.261  -9.048   7.659
  699   1HB   TYR  85          HB2       TYR  85  16.178  -9.987   5.499
  700   2HB   TYR  85          HB1       TYR  85  17.702  -9.182   5.877
  701    HD1  TYR  85           HD1      TYR  85  19.162 -10.010   7.601
  702    HD2  TYR  85           HD2      TYR  85  15.286 -11.749   6.999
  703    HE1  TYR  85           HE1      TYR  85  19.765 -11.870   9.127
  704    HE2  TYR  85           HE2      TYR  85  15.887 -13.616   8.523
  705    HH   TYR  85           HH       TYR  85  17.864 -14.713   9.397
  706    H    ASN  86           HN       ASN  86  17.722  -6.653   6.688
  707    HA   ASN  86           HA       ASN  86  18.453  -6.377   9.575
  708   1HB   ASN  86          HB2       ASN  86  20.319  -6.847   7.250
  709   2HB   ASN  86          HB1       ASN  86  20.871  -6.075   8.736
  710   1HD2  ASN  86          HD21      ASN  86  21.710  -8.736   7.734
  711   2HD2  ASN  86          HD22      ASN  86  21.250  -9.858   8.921
  712    H    MET  87           HN       MET  87  16.837  -4.755   7.675
  713    HA   MET  87           HA       MET  87  18.209  -2.507   6.696
  714   1HB   MET  87          HB2       MET  87  16.095  -1.285   6.916
  715   2HB   MET  87          HB1       MET  87  15.802  -2.911   6.311
  716   1HG   MET  87          HG2       MET  87  15.504  -2.067   9.210
  717   2HG   MET  87          HG1       MET  87  14.177  -2.234   8.072
  718   1HE   MET  87          HE1       MET  87  15.817  -4.137  10.971
  719   2HE   MET  87          HE2       MET  87  14.345  -5.099  10.879
  720   3HE   MET  87          HE3       MET  87  14.255  -3.347  10.725
  721    H    PHE  88           HN       PHE  88  19.006  -0.630   7.644
  722    HA   PHE  88           HA       PHE  88  19.888  -0.749  10.339
  723   1HB   PHE  88          HB2       PHE  88  19.539   1.642   8.508
  724   2HB   PHE  88          HB1       PHE  88  20.395   1.688  10.049
  725    HD1  PHE  88           HD1      PHE  88  20.456   0.418   6.593
  726    HD2  PHE  88           HD2      PHE  88  22.531   0.537  10.353
  727    HE1  PHE  88           HE1      PHE  88  22.496  -0.464   5.495
  728    HE2  PHE  88           HE2      PHE  88  24.573  -0.344   9.254
  729    HZ   PHE  88           HZ       PHE  88  24.555  -0.845   6.825
  730    H    GLU  89           HN       GLU  89  18.368   2.273   9.932
  731    HA   GLU  89           HA       GLU  89  16.362   1.548  12.028
  732   1HB   GLU  89          HB2       GLU  89  16.279   3.973  12.498
  733   2HB   GLU  89          HB1       GLU  89  17.908   3.327  12.671
  734   1HG   GLU  89          HG2       GLU  89  16.975   4.591  10.082
  735   2HG   GLU  89          HG1       GLU  89  17.654   5.549  11.391
  736    H    ASN  90           HN       ASN  90  16.185   1.290   8.975
  737    HA   ASN  90           HA       ASN  90  13.955   3.143   8.369
  738   1HB   ASN  90          HB2       ASN  90  15.244   0.959   6.701
  739   2HB   ASN  90          HB1       ASN  90  14.053   2.124   6.121
  740   1HD2  ASN  90          HD21      ASN  90  17.244   1.607   5.876
  741   2HD2  ASN  90          HD22      ASN  90  17.831   3.199   5.890
  742    H    GLY  91           HN       GLY  91  13.655   1.057  10.458
  743   1HA   GLY  91          HA2       GLY  91  11.151  -0.115   9.434
  744   2HA   GLY  91          HA1       GLY  91  12.385  -1.273   9.931
  745    H    SER  92           HN       SER  92  12.296  -1.889  12.034
  746    HA   SER  92           HA       SER  92  11.418   0.044  14.101
  747   1HB   SER  92          HB2       SER  92   9.698  -1.371  14.972
  748   2HB   SER  92          HB1       SER  92   9.399  -1.266  13.239
  749    HG   SER  92           HG       SER  92  10.997  -3.305  14.370
  750    H    PHE  93           HN       PHE  93  12.996  -0.075  15.588
  751    HA   PHE  93           HA       PHE  93  14.566  -2.582  15.895
  752   1HB   PHE  93          HB2       PHE  93  16.001  -1.105  17.367
  753   2HB   PHE  93          HB1       PHE  93  15.890  -0.576  15.687
  754    HD1  PHE  93           HD1      PHE  93  15.002   0.181  19.159
  755    HD2  PHE  93           HD2      PHE  93  14.452   1.336  15.058
  756    HE1  PHE  93           HE1      PHE  93  14.082   2.365  19.895
  757    HE2  PHE  93           HE2      PHE  93  13.534   3.518  15.795
  758    HZ   PHE  93           HZ       PHE  93  13.348   4.032  18.213
  759    H    LEU  94           HN       LEU  94  13.799  -4.003  17.382
  760    HA   LEU  94           HA       LEU  94  11.884  -3.283  19.411
  761   1HB   LEU  94          HB2       LEU  94  13.625  -5.752  19.141
  762   2HB   LEU  94          HB1       LEU  94  12.276  -5.593  20.260
  763    HG   LEU  94           HG       LEU  94  12.009  -5.264  17.259
  764   1HD1  LEU  94          HD11      LEU  94  11.106  -7.537  17.233
  765   2HD1  LEU  94          HD12      LEU  94  11.366  -7.685  18.971
  766   3HD1  LEU  94          HD13      LEU  94  12.745  -7.557  17.882
  767   1HD2  LEU  94          HD21      LEU  94   9.558  -5.859  17.973
  768   2HD2  LEU  94          HD22      LEU  94  10.140  -4.221  18.244
  769   3HD2  LEU  94          HD23      LEU  94  10.081  -5.368  19.583
  Start of MODEL    9
    1   1H    MET   1          HT1       MET   1 -23.963  16.499   2.863
    2   2H    MET   1          HT2       MET   1 -24.952  17.799   3.326
    3   3H    MET   1          HT3       MET   1 -24.541  16.599   4.454
    4    HA   MET   1           HA       MET   1 -22.915  18.804   3.399
    5   1HB   MET   1          HB2       MET   1 -23.362  17.503   6.097
    6   2HB   MET   1          HB1       MET   1 -22.184  18.787   5.819
    7   1HG   MET   1          HG2       MET   1 -23.989  20.263   5.001
    8   2HG   MET   1          HG1       MET   1 -25.162  18.978   5.289
    9   1HE   MET   1          HE1       MET   1 -22.819  21.554   8.165
   10   2HE   MET   1          HE2       MET   1 -22.413  21.042   6.531
   11   3HE   MET   1          HE3       MET   1 -22.040  19.991   7.892
   12    H    LEU   2           HN       LEU   2 -22.696  15.861   2.597
   13    HA   LEU   2           HA       LEU   2 -20.234  14.906   3.804
   14   1HB   LEU   2          HB2       LEU   2 -21.498  14.084   1.173
   15   2HB   LEU   2          HB1       LEU   2 -20.309  13.170   2.103
   16    HG   LEU   2           HG       LEU   2 -23.105  13.889   3.030
   17   1HD1  LEU   2          HD11      LEU   2 -23.086  12.159   1.295
   18   2HD1  LEU   2          HD12      LEU   2 -23.493  11.448   2.857
   19   3HD1  LEU   2          HD13      LEU   2 -21.871  11.249   2.192
   20   1HD2  LEU   2          HD21      LEU   2 -20.753  12.556   4.368
   21   2HD2  LEU   2          HD22      LEU   2 -22.394  12.107   4.828
   22   3HD2  LEU   2          HD23      LEU   2 -21.854  13.772   5.012
   23    H    VAL   3           HN       VAL   3 -18.156  15.114   3.049
   24    HA   VAL   3           HA       VAL   3 -17.684  16.564   0.486
   25    HB   VAL   3           HB       VAL   3 -15.958  17.965   1.636
   26   1HG1  VAL   3          HG11      VAL   3 -17.519  19.562   2.529
   27   2HG1  VAL   3          HG12      VAL   3 -18.698  18.300   2.882
   28   3HG1  VAL   3          HG13      VAL   3 -18.336  18.726   1.209
   29   1HG2  VAL   3          HG21      VAL   3 -15.453  16.696   3.593
   30   2HG2  VAL   3          HG22      VAL   3 -17.148  16.615   4.072
   31   3HG2  VAL   3          HG23      VAL   3 -16.276  18.143   4.174
   32    H    LYS   4           HN       LYS   4 -15.738  15.900  -0.533
   33    HA   LYS   4           HA       LYS   4 -14.701  13.349   0.317
   34   1HB   LYS   4          HB2       LYS   4 -13.134  13.582  -1.556
   35   2HB   LYS   4          HB1       LYS   4 -14.751  14.073  -2.060
   36   1HG   LYS   4          HG2       LYS   4 -14.017  16.469  -1.415
   37   2HG   LYS   4          HG1       LYS   4 -12.377  15.824  -1.408
   38   1HD   LYS   4          HD2       LYS   4 -12.514  15.211  -3.724
   39   2HD   LYS   4          HD1       LYS   4 -14.248  15.522  -3.771
   40   1HE   LYS   4          HE2       LYS   4 -12.768  17.348  -4.766
   41   2HE   LYS   4          HE1       LYS   4 -13.938  17.875  -3.556
   42   1HZ   LYS   4          HZ1       LYS   4 -12.305  18.112  -1.955
   43   2HZ   LYS   4          HZ2       LYS   4 -11.521  18.665  -3.358
   44   3HZ   LYS   4          HZ3       LYS   4 -11.204  17.105  -2.762
   45    HA   PRO   5           HA       PRO   5 -11.567  15.004   3.023
   46   1HB   PRO   5          HB2       PRO   5 -10.002  12.888   3.425
   47   2HB   PRO   5          HB1       PRO   5 -11.700  12.860   3.929
   48   1HG   PRO   5          HG2       PRO   5 -10.462  11.732   1.450
   49   2HG   PRO   5          HG1       PRO   5 -11.595  10.964   2.578
   50   1HD   PRO   5          HD2       PRO   5 -12.401  12.145   0.226
   51   2HD   PRO   5          HD1       PRO   5 -13.435  12.042   1.670
   52    HA   PRO   6           HA       PRO   6  -8.534  16.692   0.059
   53   1HB   PRO   6          HB2       PRO   6  -7.047  17.004   2.657
   54   2HB   PRO   6          HB1       PRO   6  -7.205  18.150   1.310
   55   1HG   PRO   6          HG2       PRO   6  -8.676  18.426   3.497
   56   2HG   PRO   6          HG1       PRO   6  -9.363  18.741   1.893
   57   1HD   PRO   6          HD2       PRO   6  -9.866  16.446   3.730
   58   2HD   PRO   6          HD1       PRO   6 -10.921  17.148   2.483
   59    H    TYR   7           HN       TYR   7  -8.019  13.932   2.101
   60    HA   TYR   7           HA       TYR   7  -5.255  13.449   1.544
   61   1HB   TYR   7          HB2       TYR   7  -7.349  11.281   1.814
   62   2HB   TYR   7          HB1       TYR   7  -5.636  11.169   2.193
   63    HD1  TYR   7           HD1      TYR   7  -8.575  11.066   3.774
   64    HD2  TYR   7           HD2      TYR   7  -5.050  13.524   3.807
   65    HE1  TYR   7           HE1      TYR   7  -9.081  11.749   6.086
   66    HE2  TYR   7           HE2      TYR   7  -5.557  14.210   6.130
   67    HH   TYR   7           HH       TYR   7  -7.899  14.331   7.543
   68    H    SER   8           HN       SER   8  -4.232  12.480  -0.180
   69    HA   SER   8           HA       SER   8  -5.726  12.335  -2.699
   70   1HB   SER   8          HB2       SER   8  -3.328  13.142  -2.525
   71   2HB   SER   8          HB1       SER   8  -2.866  11.484  -2.152
   72    HG   SER   8           HG       SER   8  -2.728  12.047  -4.407
   73    H    TYR   9           HN       TYR   9  -5.452  10.234  -4.044
   74    HA   TYR   9           HA       TYR   9  -6.601   8.058  -2.610
   75   1HB   TYR   9          HB2       TYR   9  -5.173   8.144  -5.280
   76   2HB   TYR   9          HB1       TYR   9  -5.997   6.709  -4.664
   77    HD1  TYR   9           HD1      TYR   9  -8.441   6.711  -4.307
   78    HD2  TYR   9           HD2      TYR   9  -6.415  10.072  -6.052
   79    HE1  TYR   9           HE1      TYR   9 -10.611   7.608  -5.099
   80    HE2  TYR   9           HE2      TYR   9  -8.586  10.970  -6.845
   81    HH   TYR   9           HH       TYR   9 -10.780  10.672  -6.923
   82    H    ILE  10           HN       ILE  10  -3.247   8.746  -3.537
   83    HA   ILE  10           HA       ILE  10  -2.122   6.265  -2.671
   84    HB   ILE  10           HB       ILE  10  -0.880   9.036  -2.659
   85   1HG1  ILE  10          HG12      ILE  10  -1.677   8.497  -4.887
   86   2HG1  ILE  10          HG11      ILE  10   0.073   8.313  -4.861
   87   1HG2  ILE  10          HG21      ILE  10   0.323   6.259  -2.564
   88   2HG2  ILE  10          HG22      ILE  10   0.455   7.522  -1.339
   89   3HG2  ILE  10          HG23      ILE  10   1.255   7.719  -2.899
   90   1HD1  ILE  10          HD11      ILE  10  -0.583   6.364  -5.957
   91   2HD1  ILE  10          HD12      ILE  10  -2.052   6.195  -4.999
   92   3HD1  ILE  10          HD13      ILE  10  -0.487   5.798  -4.291
   93    H    ALA  11           HN       ALA  11  -2.751   9.310  -0.939
   94    HA   ALA  11           HA       ALA  11  -1.529   8.484   1.530
   95   1HB   ALA  11          HB1       ALA  11  -3.696  10.530   0.959
   96   2HB   ALA  11          HB2       ALA  11  -1.967  10.839   1.114
   97   3HB   ALA  11          HB3       ALA  11  -2.904  10.340   2.522
   98    H    LEU  12           HN       LEU  12  -4.898   8.290   0.344
   99    HA   LEU  12           HA       LEU  12  -6.028   7.291   2.762
  100   1HB   LEU  12          HB2       LEU  12  -6.792   6.832  -0.133
  101   2HB   LEU  12          HB1       LEU  12  -7.766   6.265   1.221
  102    HG   LEU  12           HG       LEU  12  -6.936   9.156   0.835
  103   1HD1  LEU  12          HD11      LEU  12  -8.379   8.380  -1.018
  104   2HD1  LEU  12          HD12      LEU  12  -9.215   9.542   0.011
  105   3HD1  LEU  12          HD13      LEU  12  -9.572   7.821   0.154
  106   1HD2  LEU  12          HD21      LEU  12  -9.131   9.286   2.372
  107   2HD2  LEU  12          HD22      LEU  12  -7.531   9.051   3.068
  108   3HD2  LEU  12          HD23      LEU  12  -8.603   7.672   2.842
  109    H    ILE  13           HN       ILE  13  -4.437   5.640   0.058
  110    HA   ILE  13           HA       ILE  13  -4.892   2.964   1.043
  111    HB   ILE  13           HB       ILE  13  -2.774   4.094  -0.813
  112   1HG1  ILE  13          HG12      ILE  13  -5.257   2.478  -1.452
  113   2HG1  ILE  13          HG11      ILE  13  -5.221   4.240  -1.489
  114   1HG2  ILE  13          HG21      ILE  13  -1.868   2.047  -0.051
  115   2HG2  ILE  13          HG22      ILE  13  -2.698   1.609  -1.544
  116   3HG2  ILE  13          HG23      ILE  13  -3.450   1.269   0.014
  117   1HD1  ILE  13          HD11      ILE  13  -3.353   4.137  -3.134
  118   2HD1  ILE  13          HD12      ILE  13  -4.819   3.365  -3.739
  119   3HD1  ILE  13          HD13      ILE  13  -3.486   2.378  -3.141
  120    H    THR  14           HN       THR  14  -2.273   5.318   1.412
  121    HA   THR  14           HA       THR  14  -0.448   3.641   2.822
  122    HB   THR  14           HB       THR  14  -0.840   6.635   3.005
  123    HG1  THR  14           HG1      THR  14   0.198   6.705   1.192
  124   1HG2  THR  14          HG21      THR  14   1.694   6.443   3.552
  125   2HG2  THR  14          HG22      THR  14   1.319   4.772   3.974
  126   3HG2  THR  14          HG23      THR  14   0.531   6.098   4.832
  127    H    MET  15           HN       MET  15  -3.080   5.725   3.964
  128    HA   MET  15           HA       MET  15  -2.520   5.452   6.760
  129   1HB   MET  15          HB2       MET  15  -5.069   6.075   5.251
  130   2HB   MET  15          HB1       MET  15  -4.951   6.128   7.010
  131   1HG   MET  15          HG2       MET  15  -3.130   7.777   6.848
  132   2HG   MET  15          HG1       MET  15  -3.229   7.724   5.090
  133   1HE   MET  15          HE1       MET  15  -3.477  10.190   4.884
  134   2HE   MET  15          HE2       MET  15  -3.363  10.413   6.627
  135   3HE   MET  15          HE3       MET  15  -4.654  11.203   5.727
  136    H    ALA  16           HN       ALA  16  -4.552   3.570   4.544
  137    HA   ALA  16           HA       ALA  16  -5.772   1.887   6.483
  138   1HB   ALA  16          HB1       ALA  16  -5.805   0.236   4.462
  139   2HB   ALA  16          HB2       ALA  16  -5.079   1.574   3.568
  140   3HB   ALA  16          HB3       ALA  16  -6.667   1.767   4.308
  141    H    ILE  17           HN       ILE  17  -2.769   1.412   4.599
  142    HA   ILE  17           HA       ILE  17  -2.057  -1.106   5.732
  143    HB   ILE  17           HB       ILE  17  -0.192   1.103   4.792
  144   1HG1  ILE  17          HG12      ILE  17  -1.326  -1.211   3.196
  145   2HG1  ILE  17          HG11      ILE  17  -2.019   0.412   3.169
  146   1HG2  ILE  17          HG21      ILE  17   0.097  -1.885   5.188
  147   2HG2  ILE  17          HG22      ILE  17   1.055  -0.601   5.927
  148   3HG2  ILE  17          HG23      ILE  17   1.221  -0.945   4.205
  149   1HD1  ILE  17          HD11      ILE  17   0.888  -0.160   2.535
  150   2HD1  ILE  17          HD12      ILE  17   0.017   1.355   2.294
  151   3HD1  ILE  17          HD13      ILE  17  -0.369  -0.052   1.303
  152    H    GLN  18           HN       GLN  18  -1.048   2.188   6.601
  153    HA   GLN  18           HA       GLN  18   0.577   1.507   8.829
  154   1HB   GLN  18          HB2       GLN  18  -1.031   3.996   8.216
  155   2HB   GLN  18          HB1       GLN  18   0.091   3.879   9.572
  156   1HG   GLN  18          HG2       GLN  18   1.945   3.433   8.077
  157   2HG   GLN  18          HG1       GLN  18   0.856   3.347   6.691
  158   1HE2  GLN  18          HE21      GLN  18   3.135   5.290   7.319
  159   2HE2  GLN  18          HE22      GLN  18   2.428   6.829   7.181
  160    H    ASN  19           HN       ASN  19  -2.899   2.184   8.629
  161    HA   ASN  19           HA       ASN  19  -3.258   1.882  11.522
  162   1HB   ASN  19          HB2       ASN  19  -5.190   2.179   9.209
  163   2HB   ASN  19          HB1       ASN  19  -5.708   2.024  10.888
  164   1HD2  ASN  19          HD21      ASN  19  -4.669   4.271   8.518
  165   2HD2  ASN  19          HD22      ASN  19  -4.411   5.594   9.552
  166    H    ALA  20           HN       ALA  20  -2.655  -0.287   9.119
  167    HA   ALA  20           HA       ALA  20  -4.609  -2.332   9.807
  168   1HB   ALA  20          HB1       ALA  20  -1.958  -2.770   8.413
  169   2HB   ALA  20          HB2       ALA  20  -3.359  -2.090   7.583
  170   3HB   ALA  20          HB3       ALA  20  -3.439  -3.718   8.259
  171    HA   PRO  21           HA       PRO  21  -2.545  -3.470  13.697
  172   1HB   PRO  21          HB2       PRO  21  -3.560  -6.172  12.836
  173   2HB   PRO  21          HB1       PRO  21  -3.630  -5.404  14.436
  174   1HG   PRO  21          HG2       PRO  21  -5.767  -5.479  12.839
  175   2HG   PRO  21          HG1       PRO  21  -5.428  -4.078  13.870
  176   1HD   PRO  21          HD2       PRO  21  -5.190  -4.323  10.912
  177   2HD   PRO  21          HD1       PRO  21  -5.433  -2.871  11.907
  178    H    GLU  22           HN       GLU  22  -2.343  -5.668  10.905
  179    HA   GLU  22           HA       GLU  22   0.548  -6.163  11.507
  180   1HB   GLU  22          HB2       GLU  22  -1.278  -7.652   9.591
  181   2HB   GLU  22          HB1       GLU  22   0.333  -8.139  10.116
  182   1HG   GLU  22          HG2       GLU  22  -2.128  -7.905  11.872
  183   2HG   GLU  22          HG1       GLU  22  -1.346  -9.402  11.366
  184    H    LYS  23           HN       LYS  23   2.073  -5.582   9.920
  185    HA   LYS  23           HA       LYS  23   1.393  -3.460   8.151
  186   1HB   LYS  23          HB2       LYS  23   3.768  -5.343   8.004
  187   2HB   LYS  23          HB1       LYS  23   3.642  -3.791   7.183
  188   1HG   LYS  23          HG2       LYS  23   3.442  -4.103  10.189
  189   2HG   LYS  23          HG1       LYS  23   4.948  -3.737   9.351
  190   1HD   LYS  23          HD2       LYS  23   3.663  -1.751   8.300
  191   2HD   LYS  23          HD1       LYS  23   2.459  -2.035   9.557
  192   1HE   LYS  23          HE2       LYS  23   4.009  -0.376  10.382
  193   2HE   LYS  23          HE1       LYS  23   4.294  -1.875  11.264
  194   1HZ   LYS  23          HZ1       LYS  23   5.810  -1.430   8.805
  195   2HZ   LYS  23          HZ2       LYS  23   6.271  -2.221  10.237
  196   3HZ   LYS  23          HZ3       LYS  23   6.249  -0.523  10.169
  197    H    LYS  24           HN       LYS  24   1.635  -6.963   7.575
  198    HA   LYS  24           HA       LYS  24   1.145  -6.634   4.710
  199   1HB   LYS  24          HB2       LYS  24   0.883  -9.101   6.464
  200   2HB   LYS  24          HB1       LYS  24   0.882  -9.089   4.701
  201   1HG   LYS  24          HG2       LYS  24   3.165  -8.151   4.705
  202   2HG   LYS  24          HG1       LYS  24   3.167  -8.170   6.468
  203   1HD   LYS  24          HD2       LYS  24   2.824 -10.630   6.427
  204   2HD   LYS  24          HD1       LYS  24   2.894 -10.593   4.665
  205   1HE   LYS  24          HE2       LYS  24   5.096 -11.174   5.374
  206   2HE   LYS  24          HE1       LYS  24   5.183  -9.471   4.926
  207   1HZ   LYS  24          HZ1       LYS  24   6.115 -10.322   7.206
  208   2HZ   LYS  24          HZ2       LYS  24   4.496 -10.149   7.690
  209   3HZ   LYS  24          HZ3       LYS  24   5.351  -8.812   7.086
  210    H    ILE  25           HN       ILE  25  -0.857  -6.350   3.814
  211    HA   ILE  25           HA       ILE  25  -3.269  -7.223   5.347
  212    HB   ILE  25           HB       ILE  25  -2.886  -4.802   5.793
  213   1HG1  ILE  25          HG12      ILE  25  -5.239  -5.224   3.932
  214   2HG1  ILE  25          HG11      ILE  25  -5.188  -5.865   5.575
  215   1HG2  ILE  25          HG21      ILE  25  -2.963  -3.193   4.002
  216   2HG2  ILE  25          HG22      ILE  25  -3.348  -4.443   2.819
  217   3HG2  ILE  25          HG23      ILE  25  -1.751  -4.396   3.564
  218   1HD1  ILE  25          HD11      ILE  25  -6.341  -3.615   5.333
  219   2HD1  ILE  25          HD12      ILE  25  -4.762  -2.937   4.936
  220   3HD1  ILE  25          HD13      ILE  25  -5.037  -3.665   6.520
  221    H    THR  26           HN       THR  26  -5.087  -7.660   4.004
  222    HA   THR  26           HA       THR  26  -4.345  -8.464   1.290
  223    HB   THR  26           HB       THR  26  -6.618  -9.418   1.216
  224    HG1  THR  26           HG1      THR  26  -8.029  -9.032   2.841
  225   1HG2  THR  26          HG21      THR  26  -5.427  -9.964   3.939
  226   2HG2  THR  26          HG22      THR  26  -4.641 -10.506   2.455
  227   3HG2  THR  26          HG23      THR  26  -6.255 -11.093   2.866
  228    H    LEU  27           HN       LEU  27  -5.534  -7.793  -0.602
  229    HA   LEU  27           HA       LEU  27  -5.758  -4.984  -0.928
  230   1HB   LEU  27          HB2       LEU  27  -5.360  -6.664  -2.735
  231   2HB   LEU  27          HB1       LEU  27  -7.034  -7.183  -2.580
  232    HG   LEU  27           HG       LEU  27  -7.762  -4.857  -3.134
  233   1HD1  LEU  27          HD11      LEU  27  -5.589  -3.725  -4.425
  234   2HD1  LEU  27          HD12      LEU  27  -4.838  -4.407  -2.991
  235   3HD1  LEU  27          HD13      LEU  27  -6.167  -3.263  -2.829
  236   1HD2  LEU  27          HD21      LEU  27  -5.933  -6.140  -5.184
  237   2HD2  LEU  27          HD22      LEU  27  -7.306  -5.084  -5.521
  238   3HD2  LEU  27          HD23      LEU  27  -7.572  -6.682  -4.823
  239    H    ASN  28           HN       ASN  28  -8.314  -7.448  -0.613
  240    HA   ASN  28           HA       ASN  28 -10.536  -5.691  -0.781
  241   1HB   ASN  28          HB2       ASN  28 -10.224  -8.314   0.701
  242   2HB   ASN  28          HB1       ASN  28 -11.767  -7.496   0.446
  243   1HD2  ASN  28          HD21      ASN  28 -10.172 -10.032  -0.767
  244   2HD2  ASN  28          HD22      ASN  28 -10.578  -9.916  -2.413
  245    H    GLY  29           HN       GLY  29  -8.605  -6.698   2.029
  246   1HA   GLY  29          HA2       GLY  29 -10.217  -5.562   4.056
  247   2HA   GLY  29          HA1       GLY  29  -8.471  -5.770   4.178
  248    H    ILE  30           HN       ILE  30  -7.726  -4.038   2.023
  249    HA   ILE  30           HA       ILE  30  -7.615  -1.541   3.368
  250    HB   ILE  30           HB       ILE  30  -7.238  -2.196   0.434
  251   1HG1  ILE  30          HG12      ILE  30  -5.198  -1.667   2.613
  252   2HG1  ILE  30          HG11      ILE  30  -5.733  -3.287   2.164
  253   1HG2  ILE  30          HG21      ILE  30  -7.640   0.159   0.538
  254   2HG2  ILE  30          HG22      ILE  30  -5.885  -0.016   0.520
  255   3HG2  ILE  30          HG23      ILE  30  -6.722   0.322   2.035
  256   1HD1  ILE  30          HD11      ILE  30  -5.012  -2.858  -0.171
  257   2HD1  ILE  30          HD12      ILE  30  -3.668  -2.724   0.964
  258   3HD1  ILE  30          HD13      ILE  30  -4.425  -1.267   0.317
  259    H    TYR  31           HN       TYR  31  -9.789  -2.604   0.728
  260    HA   TYR  31           HA       TYR  31 -11.047  -0.085   0.325
  261   1HB   TYR  31          HB2       TYR  31 -11.975  -2.928  -0.064
  262   2HB   TYR  31          HB1       TYR  31 -13.051  -1.574  -0.404
  263    HD1  TYR  31           HD1      TYR  31 -12.244   0.245  -2.007
  264    HD2  TYR  31           HD2      TYR  31 -10.317  -3.567  -1.633
  265    HE1  TYR  31           HE1      TYR  31 -11.164   0.573  -4.210
  266    HE2  TYR  31           HE2      TYR  31  -9.245  -3.242  -3.843
  267    HH   TYR  31           HH       TYR  31 -10.095  -1.565  -6.062
  268    H    GLN  32           HN       GLN  32 -11.857  -2.680   2.622
  269    HA   GLN  32           HA       GLN  32 -14.272  -1.552   3.609
  270   1HB   GLN  32          HB2       GLN  32 -13.525  -3.856   4.113
  271   2HB   GLN  32          HB1       GLN  32 -12.223  -3.211   5.110
  272   1HG   GLN  32          HG2       GLN  32 -13.877  -2.133   6.591
  273   2HG   GLN  32          HG1       GLN  32 -15.186  -2.760   5.589
  274   1HE2  GLN  32          HE21      GLN  32 -15.984  -4.010   7.460
  275   2HE2  GLN  32          HE22      GLN  32 -15.191  -5.432   7.947
  276    H    PHE  33           HN       PHE  33 -10.910  -0.998   4.569
  277    HA   PHE  33           HA       PHE  33 -11.386   0.523   6.908
  278   1HB   PHE  33          HB2       PHE  33  -9.189  -0.399   6.076
  279   2HB   PHE  33          HB1       PHE  33  -9.138   0.930   4.921
  280    HD1  PHE  33           HD1      PHE  33  -8.994   0.004   8.481
  281    HD2  PHE  33           HD2      PHE  33  -8.718   3.220   5.646
  282    HE1  PHE  33           HE1      PHE  33  -7.999   1.453  10.227
  283    HE2  PHE  33           HE2      PHE  33  -7.722   4.672   7.398
  284    HZ   PHE  33           HZ       PHE  33  -7.364   3.786   9.686
  285    H    ILE  34           HN       ILE  34 -10.926   1.701   3.548
  286    HA   ILE  34           HA       ILE  34 -11.229   4.468   4.138
  287    HB   ILE  34           HB       ILE  34 -11.871   2.895   1.627
  288   1HG1  ILE  34          HG12      ILE  34  -9.516   4.692   2.263
  289   2HG1  ILE  34          HG11      ILE  34  -9.493   2.950   2.540
  290   1HG2  ILE  34          HG21      ILE  34 -11.768   5.874   2.159
  291   2HG2  ILE  34          HG22      ILE  34 -13.090   4.950   1.446
  292   3HG2  ILE  34          HG23      ILE  34 -11.596   5.191   0.542
  293   1HD1  ILE  34          HD11      ILE  34 -10.213   4.135  -0.145
  294   2HD1  ILE  34          HD12      ILE  34  -9.753   2.472   0.225
  295   3HD1  ILE  34          HD13      ILE  34  -8.548   3.757   0.297
  296    H    MET  35           HN       MET  35 -13.733   2.129   3.037
  297    HA   MET  35           HA       MET  35 -15.887   3.984   3.066
  298   1HB   MET  35          HB2       MET  35 -15.793   0.987   3.417
  299   2HB   MET  35          HB1       MET  35 -17.314   1.880   3.434
  300   1HG   MET  35          HG2       MET  35 -16.736   2.844   1.208
  301   2HG   MET  35          HG1       MET  35 -15.277   1.855   1.188
  302   1HE   MET  35          HE1       MET  35 -15.231  -0.388  -0.011
  303   2HE   MET  35          HE2       MET  35 -16.286  -1.650   0.619
  304   3HE   MET  35          HE3       MET  35 -15.343  -0.663   1.733
  305    H    ASP  36           HN       ASP  36 -14.592   1.937   5.687
  306    HA   ASP  36           HA       ASP  36 -16.633   2.490   7.590
  307   1HB   ASP  36          HB2       ASP  36 -13.711   1.788   7.887
  308   2HB   ASP  36          HB1       ASP  36 -14.753   2.030   9.287
  309    H    ARG  37           HN       ARG  37 -13.571   4.249   6.973
  310    HA   ARG  37           HA       ARG  37 -14.022   6.154   9.077
  311   1HB   ARG  37          HB2       ARG  37 -12.242   6.120   6.646
  312   2HB   ARG  37          HB1       ARG  37 -12.344   7.556   7.662
  313   1HG   ARG  37          HG2       ARG  37 -11.727   6.197   9.632
  314   2HG   ARG  37          HG1       ARG  37 -11.592   4.774   8.602
  315   1HD   ARG  37          HD2       ARG  37  -9.793   5.747   7.348
  316   2HD   ARG  37          HD1       ARG  37 -10.016   7.314   8.108
  317    HE   ARG  37           HE       ARG  37  -8.420   5.117   9.081
  318   1HH1  ARG  37          HH21      ARG  37 -10.604   7.555  10.188
  319   2HH1  ARG  37          HH22      ARG  37 -10.073   7.448  11.832
  320   1HH2  ARG  37          HH11      ARG  37  -7.725   4.988  11.206
  321   2HH2  ARG  37          HH12      ARG  37  -8.451   6.003  12.409
  322    H    PHE  38           HN       PHE  38 -14.596   6.401   5.542
  323    HA   PHE  38           HA       PHE  38 -16.380   8.742   6.129
  324   1HB   PHE  38          HB2       PHE  38 -14.702   8.230   3.657
  325   2HB   PHE  38          HB1       PHE  38 -15.743   9.625   3.932
  326    HD1  PHE  38           HD1      PHE  38 -12.468   8.278   4.378
  327    HD2  PHE  38           HD2      PHE  38 -15.304  11.011   6.095
  328    HE1  PHE  38           HE1      PHE  38 -10.633   9.403   5.614
  329    HE2  PHE  38           HE2      PHE  38 -13.472  12.136   7.329
  330    HZ   PHE  38           HZ       PHE  38 -11.139  11.333   7.091
  331    HA   PRO  39           HA       PRO  39 -19.313   5.950   4.064
  332   1HB   PRO  39          HB2       PRO  39 -21.585   7.344   4.481
  333   2HB   PRO  39          HB1       PRO  39 -20.757   6.519   5.817
  334   1HG   PRO  39          HG2       PRO  39 -20.695   9.407   5.057
  335   2HG   PRO  39          HG1       PRO  39 -20.840   8.674   6.664
  336   1HD   PRO  39          HD2       PRO  39 -18.462   9.632   5.639
  337   2HD   PRO  39          HD1       PRO  39 -18.555   8.348   6.863
  338    H    PHE  40           HN       PHE  40 -18.282   9.001   3.183
  339    HA   PHE  40           HA       PHE  40 -20.018   9.775   1.070
  340   1HB   PHE  40          HB2       PHE  40 -18.403  11.352   1.810
  341   2HB   PHE  40          HB1       PHE  40 -17.082  10.201   1.639
  342    HD1  PHE  40           HD1      PHE  40 -15.843  10.072  -0.368
  343    HD2  PHE  40           HD2      PHE  40 -19.616  12.133  -0.315
  344    HE1  PHE  40           HE1      PHE  40 -15.432  10.892  -2.674
  345    HE2  PHE  40           HE2      PHE  40 -19.201  12.955  -2.618
  346    HZ   PHE  40           HZ       PHE  40 -17.109  12.335  -3.797
  347    H    TYR  41           HN       TYR  41 -17.225   7.589   1.129
  348    HA   TYR  41           HA       TYR  41 -17.200   7.101  -1.714
  349   1HB   TYR  41          HB2       TYR  41 -16.081   5.575   0.649
  350   2HB   TYR  41          HB1       TYR  41 -15.798   5.106  -1.032
  351    HD1  TYR  41           HD1      TYR  41 -14.363   6.409  -2.472
  352    HD2  TYR  41           HD2      TYR  41 -15.280   7.739   1.491
  353    HE1  TYR  41           HE1      TYR  41 -12.608   8.138  -2.666
  354    HE2  TYR  41           HE2      TYR  41 -13.529   9.476   1.325
  355    HH   TYR  41           HH       TYR  41 -12.066  10.331  -1.626
  356    H    ARG  42           HN       ARG  42 -18.914   5.652   0.997
  357    HA   ARG  42           HA       ARG  42 -19.738   3.247  -0.269
  358   1HB   ARG  42          HB2       ARG  42 -21.095   4.962   1.829
  359   2HB   ARG  42          HB1       ARG  42 -21.703   3.383   1.331
  360   1HG   ARG  42          HG2       ARG  42 -19.576   2.338   1.982
  361   2HG   ARG  42          HG1       ARG  42 -18.931   3.911   2.447
  362   1HD   ARG  42          HD2       ARG  42 -19.711   2.812   4.454
  363   2HD   ARG  42          HD1       ARG  42 -20.827   4.126   4.087
  364    HE   ARG  42           HE       ARG  42 -21.976   1.949   2.834
  365   1HH1  ARG  42          HH21      ARG  42 -20.772   2.656   5.988
  366   2HH1  ARG  42          HH22      ARG  42 -21.894   1.614   6.797
  367   1HH2  ARG  42          HH11      ARG  42 -23.452   0.581   3.876
  368   2HH2  ARG  42          HH12      ARG  42 -23.412   0.442   5.601
  369    H    GLU  43           HN       GLU  43 -21.129   6.519  -0.326
  370    HA   GLU  43           HA       GLU  43 -23.490   5.857  -1.782
  371   1HB   GLU  43          HB2       GLU  43 -21.902   8.421  -1.596
  372   2HB   GLU  43          HB1       GLU  43 -23.449   8.302  -2.434
  373   1HG   GLU  43          HG2       GLU  43 -24.522   7.523  -0.357
  374   2HG   GLU  43          HG1       GLU  43 -22.976   7.638   0.488
  375    H    ASN  44           HN       ASN  44 -20.277   6.767  -2.817
  376    HA   ASN  44           HA       ASN  44 -21.030   6.197  -5.668
  377   1HB   ASN  44          HB2       ASN  44 -18.731   7.803  -4.508
  378   2HB   ASN  44          HB1       ASN  44 -18.969   7.488  -6.227
  379   1HD2  ASN  44          HD21      ASN  44 -19.065  10.132  -4.799
  380   2HD2  ASN  44          HD22      ASN  44 -20.606  10.766  -5.125
  381    H    LYS  45           HN       LYS  45 -20.630   3.983  -5.847
  382    HA   LYS  45           HA       LYS  45 -18.169   2.855  -4.666
  383   1HB   LYS  45          HB2       LYS  45 -20.438   1.623  -6.247
  384   2HB   LYS  45          HB1       LYS  45 -19.048   0.715  -5.649
  385   1HG   LYS  45          HG2       LYS  45 -19.588   1.403  -3.341
  386   2HG   LYS  45          HG1       LYS  45 -20.980   2.309  -3.938
  387   1HD   LYS  45          HD2       LYS  45 -21.959   0.232  -4.829
  388   2HD   LYS  45          HD1       LYS  45 -20.572  -0.683  -4.235
  389   1HE   LYS  45          HE2       LYS  45 -22.466   0.934  -2.506
  390   2HE   LYS  45          HE1       LYS  45 -22.490  -0.821  -2.670
  391   1HZ   LYS  45          HZ1       LYS  45 -20.621   0.885  -1.240
  392   2HZ   LYS  45          HZ2       LYS  45 -19.941  -0.434  -2.067
  393   3HZ   LYS  45          HZ3       LYS  45 -21.138  -0.692  -0.889
  394    H    GLN  46           HN       GLN  46 -19.523   3.476  -7.903
  395    HA   GLN  46           HA       GLN  46 -17.178   2.358  -9.231
  396   1HB   GLN  46          HB2       GLN  46 -19.525   3.984 -10.226
  397   2HB   GLN  46          HB1       GLN  46 -18.223   3.431 -11.281
  398   1HG   GLN  46          HG2       GLN  46 -18.692   1.109 -10.713
  399   2HG   GLN  46          HG1       GLN  46 -19.912   1.609  -9.542
  400   1HE2  GLN  46          HE21      GLN  46 -20.492  -0.081 -11.846
  401   2HE2  GLN  46          HE22      GLN  46 -21.550   0.786 -12.854
  402    H    GLY  47           HN       GLY  47 -15.456   3.459 -10.106
  403   1HA   GLY  47          HA2       GLY  47 -14.431   5.537 -10.935
  404   2HA   GLY  47          HA1       GLY  47 -15.327   6.424  -9.705
  405    H    TRP  48           HN       TRP  48 -14.820   5.347  -7.366
  406    HA   TRP  48           HA       TRP  48 -11.898   5.657  -7.071
  407   1HB   TRP  48          HB2       TRP  48 -12.311   6.043  -4.788
  408   2HB   TRP  48          HB1       TRP  48 -13.695   6.769  -5.596
  409    HD1  TRP  48           HD1      TRP  48 -16.031   5.373  -5.502
  410    HE1  TRP  48           HE1      TRP  48 -16.891   3.688  -3.752
  411    HE3  TRP  48           HE3      TRP  48 -11.657   4.246  -3.144
  412    HZ2  TRP  48           HZ2      TRP  48 -15.856   2.071  -1.623
  413    HZ3  TRP  48           HZ3      TRP  48 -11.614   2.630  -1.266
  414    HH2  TRP  48           HH2      TRP  48 -13.704   1.544  -0.502
  415    H    GLN  49           HN       GLN  49 -14.102   3.088  -7.379
  416    HA   GLN  49           HA       GLN  49 -12.861   1.190  -5.614
  417   1HB   GLN  49          HB2       GLN  49 -15.149   0.917  -6.464
  418   2HB   GLN  49          HB1       GLN  49 -14.527   0.735  -8.103
  419   1HG   GLN  49          HG2       GLN  49 -13.318  -1.296  -7.445
  420   2HG   GLN  49          HG1       GLN  49 -13.866  -1.098  -5.779
  421   1HE2  GLN  49          HE21      GLN  49 -15.348  -2.820  -5.535
  422   2HE2  GLN  49          HE22      GLN  49 -16.679  -3.077  -6.554
  423    H    ASN  50           HN       ASN  50 -12.675   1.444  -9.179
  424    HA   ASN  50           HA       ASN  50 -10.596  -0.529  -9.412
  425   1HB   ASN  50          HB2       ASN  50 -11.626   1.596 -11.297
  426   2HB   ASN  50          HB1       ASN  50 -10.398   0.419 -11.756
  427   1HD2  ASN  50          HD21      ASN  50 -13.154   0.605 -12.855
  428   2HD2  ASN  50          HD22      ASN  50 -13.906  -0.874 -12.498
  429    H    SER  51           HN       SER  51 -10.467   3.030  -9.295
  430    HA   SER  51           HA       SER  51  -7.760   3.320 -10.069
  431   1HB   SER  51          HB2       SER  51  -9.463   4.980  -8.200
  432   2HB   SER  51          HB1       SER  51  -7.864   5.471  -8.756
  433    HG   SER  51           HG       SER  51  -9.223   4.676 -10.871
  434    H    ILE  52           HN       ILE  52  -9.117   2.708  -6.833
  435    HA   ILE  52           HA       ILE  52  -6.809   3.099  -5.288
  436    HB   ILE  52           HB       ILE  52  -9.040   1.085  -5.031
  437   1HG1  ILE  52          HG12      ILE  52  -9.360   3.685  -4.875
  438   2HG1  ILE  52          HG11      ILE  52 -10.117   2.639  -3.678
  439   1HG2  ILE  52          HG21      ILE  52  -7.361   0.102  -3.717
  440   2HG2  ILE  52          HG22      ILE  52  -8.266   1.074  -2.556
  441   3HG2  ILE  52          HG23      ILE  52  -6.728   1.661  -3.191
  442   1HD1  ILE  52          HD11      ILE  52  -8.742   4.772  -2.929
  443   2HD1  ILE  52          HD12      ILE  52  -7.364   3.686  -3.115
  444   3HD1  ILE  52          HD13      ILE  52  -8.663   3.278  -1.996
  445    H    ARG  53           HN       ARG  53  -7.891  -0.184  -6.245
  446    HA   ARG  53           HA       ARG  53  -5.299  -1.285  -5.700
  447   1HB   ARG  53          HB2       ARG  53  -6.208  -3.366  -6.652
  448   2HB   ARG  53          HB1       ARG  53  -7.307  -2.622  -5.491
  449   1HG   ARG  53          HG2       ARG  53  -8.493  -1.546  -7.454
  450   2HG   ARG  53          HG1       ARG  53  -7.507  -2.561  -8.508
  451   1HD   ARG  53          HD2       ARG  53  -9.127  -3.764  -6.252
  452   2HD   ARG  53          HD1       ARG  53  -9.836  -3.465  -7.843
  453    HE   ARG  53           HE       ARG  53  -7.551  -4.862  -8.456
  454   1HH1  ARG  53          HH21      ARG  53 -10.148  -5.283  -6.226
  455   2HH1  ARG  53          HH22      ARG  53 -10.113  -7.014  -6.308
  456   1HH2  ARG  53          HH11      ARG  53  -7.496  -7.119  -8.577
  457   2HH2  ARG  53          HH12      ARG  53  -8.617  -8.052  -7.641
  458    H    HIS  54           HN       HIS  54  -6.747  -0.148  -8.746
  459    HA   HIS  54           HA       HIS  54  -4.820  -1.385 -10.463
  460   1HB   HIS  54          HB2       HIS  54  -6.383   1.198 -10.701
  461   2HB   HIS  54          HB1       HIS  54  -5.279   0.651 -11.961
  462    HD1  HIS  54           HD1      HIS  54  -7.951   0.745 -13.039
  463    HD2  HIS  54           HD2      HIS  54  -6.790  -2.537 -10.741
  464    HE1  HIS  54           HE1      HIS  54  -9.530  -1.142 -13.630
  465    H    ASN  55           HN       ASN  55  -4.788   1.628  -8.612
  466    HA   ASN  55           HA       ASN  55  -2.304   2.642  -9.560
  467   1HB   ASN  55          HB2       ASN  55  -3.889   3.951  -8.183
  468   2HB   ASN  55          HB1       ASN  55  -3.548   2.906  -6.804
  469   1HD2  ASN  55          HD21      ASN  55  -1.741   4.933  -9.186
  470   2HD2  ASN  55          HD22      ASN  55  -0.601   5.494  -8.061
  471    H    LEU  56           HN       LEU  56  -3.053   0.344  -6.927
  472    HA   LEU  56           HA       LEU  56  -0.382   0.111  -5.937
  473   1HB   LEU  56          HB2       LEU  56  -2.700  -1.827  -5.936
  474   2HB   LEU  56          HB1       LEU  56  -1.165  -2.199  -5.163
  475    HG   LEU  56           HG       LEU  56  -2.816   0.266  -4.520
  476   1HD1  LEU  56          HD11      LEU  56  -3.920  -1.981  -3.972
  477   2HD1  LEU  56          HD12      LEU  56  -3.685  -0.886  -2.613
  478   3HD1  LEU  56          HD13      LEU  56  -2.591  -2.247  -2.847
  479   1HD2  LEU  56          HD21      LEU  56  -0.266  -0.940  -3.459
  480   2HD2  LEU  56          HD22      LEU  56  -1.322  -0.087  -2.340
  481   3HD2  LEU  56          HD23      LEU  56  -0.670   0.752  -3.740
  482    H    SER  57           HN       SER  57  -2.096  -1.612  -8.529
  483    HA   SER  57           HA       SER  57  -0.038  -3.526  -9.040
  484   1HB   SER  57          HB2       SER  57  -2.196  -2.375 -10.821
  485   2HB   SER  57          HB1       SER  57  -1.136  -3.694 -11.314
  486    HG   SER  57           HG       SER  57  -2.839  -4.702 -10.416
  487    H    LEU  58           HN       LEU  58  -0.704  -0.390 -10.667
  488    HA   LEU  58           HA       LEU  58   1.628  -0.602 -12.356
  489   1HB   LEU  58          HB2       LEU  58  -0.180   1.692 -11.597
  490   2HB   LEU  58          HB1       LEU  58   1.257   1.957 -12.578
  491    HG   LEU  58           HG       LEU  58   0.355   0.106 -14.122
  492   1HD1  LEU  58          HD11      LEU  58  -2.109   0.695 -12.459
  493   2HD1  LEU  58          HD12      LEU  58  -1.317  -0.869 -12.657
  494   3HD1  LEU  58          HD13      LEU  58  -2.146  -0.121 -14.020
  495   1HD2  LEU  58          HD21      LEU  58   0.309   2.488 -14.710
  496   2HD2  LEU  58          HD22      LEU  58  -1.190   2.696 -13.802
  497   3HD2  LEU  58          HD23      LEU  58  -1.171   1.695 -15.255
  498    H    ASN  59           HN       ASN  59   1.021   0.991  -9.238
  499    HA   ASN  59           HA       ASN  59   3.592   2.275  -9.131
  500   1HB   ASN  59          HB2       ASN  59   1.568   1.563  -7.003
  501   2HB   ASN  59          HB1       ASN  59   3.064   2.427  -6.643
  502   1HD2  ASN  59          HD21      ASN  59   0.433   3.615  -6.330
  503   2HD2  ASN  59          HD22      ASN  59   0.316   4.896  -7.439
  504    H    GLU  60           HN       GLU  60   5.511   1.349  -8.845
  505    HA   GLU  60           HA       GLU  60   5.697  -1.442  -7.878
  506   1HB   GLU  60          HB2       GLU  60   7.812   0.469  -8.928
  507   2HB   GLU  60          HB1       GLU  60   8.050  -1.247  -8.592
  508   1HG   GLU  60          HG2       GLU  60   6.324  -1.818 -10.260
  509   2HG   GLU  60          HG1       GLU  60   6.082  -0.104 -10.599
  510    H    CYS  61           HN       CYS  61   5.629   1.593  -6.539
  511    HA   CYS  61           HA       CYS  61   7.758   1.589  -4.651
  512   1HB   CYS  61          HB2       CYS  61   4.974   2.774  -4.520
  513   2HB   CYS  61          HB1       CYS  61   6.211   3.068  -3.298
  514    HG   CYS  61           HG       CYS  61   7.639   4.317  -5.043
  515    H    PHE  62           HN       PHE  62   4.508   0.156  -4.514
  516    HA   PHE  62           HA       PHE  62   4.857  -0.778  -1.772
  517   1HB   PHE  62          HB2       PHE  62   2.855  -1.583  -3.907
  518   2HB   PHE  62          HB1       PHE  62   2.767  -2.031  -2.204
  519    HD1  PHE  62           HD1      PHE  62   2.285  -0.362  -0.475
  520    HD2  PHE  62           HD2      PHE  62   2.407   0.701  -4.634
  521    HE1  PHE  62           HE1      PHE  62   1.159   1.788   0.042
  522    HE2  PHE  62           HE2      PHE  62   1.282   2.850  -4.119
  523    HZ   PHE  62           HZ       PHE  62   0.660   3.395  -1.781
  524    H    VAL  63           HN       VAL  63   5.237  -2.968  -1.141
  525    HA   VAL  63           HA       VAL  63   6.596  -4.641  -3.228
  526    HB   VAL  63           HB       VAL  63   6.938  -4.731  -0.218
  527   1HG1  VAL  63          HG11      VAL  63   8.917  -6.070  -0.753
  528   2HG1  VAL  63          HG12      VAL  63   8.597  -5.889  -2.478
  529   3HG1  VAL  63          HG13      VAL  63   7.486  -6.814  -1.468
  530   1HG2  VAL  63          HG21      VAL  63   9.095  -3.573  -0.652
  531   2HG2  VAL  63          HG22      VAL  63   7.712  -2.571  -1.099
  532   3HG2  VAL  63          HG23      VAL  63   8.642  -3.399  -2.349
  533    H    LYS  64           HN       LYS  64   5.696  -6.580  -3.696
  534    HA   LYS  64           HA       LYS  64   3.293  -7.460  -2.193
  535   1HB   LYS  64          HB2       LYS  64   4.642  -8.623  -4.666
  536   2HB   LYS  64          HB1       LYS  64   3.056  -9.075  -4.042
  537   1HG   LYS  64          HG2       LYS  64   2.228  -6.799  -4.438
  538   2HG   LYS  64          HG1       LYS  64   3.816  -6.316  -5.040
  539   1HD   LYS  64          HD2       LYS  64   3.652  -7.997  -6.838
  540   2HD   LYS  64          HD1       LYS  64   2.069  -8.490  -6.243
  541   1HE   LYS  64          HE2       LYS  64   1.026  -6.685  -7.197
  542   2HE   LYS  64          HE1       LYS  64   2.332  -5.577  -6.775
  543   1HZ   LYS  64          HZ1       LYS  64   3.655  -6.632  -8.570
  544   2HZ   LYS  64          HZ2       LYS  64   2.280  -5.800  -9.120
  545   3HZ   LYS  64          HZ3       LYS  64   2.272  -7.496  -9.035
  546    H    VAL  65           HN       VAL  65   3.598  -8.923  -0.505
  547    HA   VAL  65           HA       VAL  65   6.117 -10.519  -0.465
  548    HB   VAL  65           HB       VAL  65   4.237 -10.520   1.868
  549   1HG1  VAL  65          HG11      VAL  65   7.240 -10.246   1.579
  550   2HG1  VAL  65          HG12      VAL  65   6.369 -11.729   1.968
  551   3HG1  VAL  65          HG13      VAL  65   6.367 -10.381   3.104
  552   1HG2  VAL  65          HG21      VAL  65   5.214  -8.334   2.620
  553   2HG2  VAL  65          HG22      VAL  65   4.123  -8.188   1.241
  554   3HG2  VAL  65          HG23      VAL  65   5.871  -8.123   0.995
  555    HA   PRO  66           HA       PRO  66   3.394 -13.990  -1.522
  556   1HB   PRO  66          HB2       PRO  66   5.241 -15.973  -1.643
  557   2HB   PRO  66          HB1       PRO  66   5.131 -14.714  -2.891
  558   1HG   PRO  66          HG2       PRO  66   7.029 -14.934  -0.596
  559   2HG   PRO  66          HG1       PRO  66   7.343 -14.453  -2.271
  560   1HD   PRO  66          HD2       PRO  66   7.034 -12.649  -0.206
  561   2HD   PRO  66          HD1       PRO  66   6.678 -12.265  -1.904
  562    H    ARG  67           HN       ARG  67   2.443 -15.787  -0.393
  563    HA   ARG  67           HA       ARG  67   2.888 -15.757   2.501
  564   1HB   ARG  67          HB2       ARG  67   1.088 -17.533   0.828
  565   2HB   ARG  67          HB1       ARG  67   1.066 -17.400   2.586
  566   1HG   ARG  67          HG2       ARG  67   0.773 -14.789   2.000
  567   2HG   ARG  67          HG1       ARG  67   0.098 -15.459   0.519
  568   1HD   ARG  67          HD2       ARG  67  -0.806 -16.069   3.347
  569   2HD   ARG  67          HD1       ARG  67  -1.704 -15.166   2.124
  570    HE   ARG  67           HE       ARG  67  -1.261 -17.604   0.912
  571   1HH1  ARG  67          HH21      ARG  67  -2.519 -16.541   3.943
  572   2HH1  ARG  67          HH22      ARG  67  -3.611 -17.876   4.108
  573   1HH2  ARG  67          HH11      ARG  67  -2.676 -19.353   1.111
  574   2HH2  ARG  67          HH12      ARG  67  -3.703 -19.466   2.504
  575    H    ASP  68           HN       ASP  68   3.530 -17.616   3.739
  576    HA   ASP  68           HA       ASP  68   5.540 -19.277   2.404
  577   1HB   ASP  68          HB2       ASP  68   4.560 -19.101   5.262
  578   2HB   ASP  68          HB1       ASP  68   5.789 -20.255   4.739
  579    H    ASP  69           HN       ASP  69   5.498 -21.692   2.748
  580    HA   ASP  69           HA       ASP  69   3.137 -22.837   1.654
  581   1HB   ASP  69          HB2       ASP  69   5.436 -24.108   3.172
  582   2HB   ASP  69          HB1       ASP  69   4.181 -25.026   2.339
  583    H    LYS  70           HN       LYS  70   4.271 -22.616   5.017
  584    HA   LYS  70           HA       LYS  70   2.417 -24.271   6.298
  585   1HB   LYS  70          HB2       LYS  70   3.450 -21.562   7.192
  586   2HB   LYS  70          HB1       LYS  70   2.628 -22.714   8.246
  587   1HG   LYS  70          HG2       LYS  70   4.376 -24.411   7.680
  588   2HG   LYS  70          HG1       LYS  70   5.235 -23.172   6.766
  589   1HD   LYS  70          HD2       LYS  70   4.513 -22.885   9.696
  590   2HD   LYS  70          HD1       LYS  70   6.064 -23.508   9.137
  591   1HE   LYS  70          HE2       LYS  70   6.225 -21.326   7.754
  592   2HE   LYS  70          HE1       LYS  70   4.920 -20.737   8.784
  593   1HZ   LYS  70          HZ1       LYS  70   6.303 -20.472  10.482
  594   2HZ   LYS  70          HZ2       LYS  70   7.575 -20.678   9.375
  595   3HZ   LYS  70          HZ3       LYS  70   7.006 -22.002  10.275
  596    H    LYS  71           HN       LYS  71   1.819 -21.468   4.458
  597    HA   LYS  71           HA       LYS  71  -1.024 -21.362   5.421
  598   1HB   LYS  71          HB2       LYS  71   0.728 -19.098   4.422
  599   2HB   LYS  71          HB1       LYS  71  -0.992 -18.958   4.782
  600   1HG   LYS  71          HG2       LYS  71  -0.535 -19.662   7.124
  601   2HG   LYS  71          HG1       LYS  71   1.190 -19.710   6.751
  602   1HD   LYS  71          HD2       LYS  71   1.249 -17.353   6.306
  603   2HD   LYS  71          HD1       LYS  71  -0.511 -17.241   6.343
  604   1HE   LYS  71          HE2       LYS  71   0.571 -16.419   8.445
  605   2HE   LYS  71          HE1       LYS  71  -0.544 -17.756   8.718
  606   1HZ   LYS  71          HZ1       LYS  71   1.272 -19.276   8.828
  607   2HZ   LYS  71          HZ2       LYS  71   1.608 -17.989   9.884
  608   3HZ   LYS  71          HZ3       LYS  71   2.385 -18.079   8.375
  609    HA   PRO  72           HA       PRO  72  -0.797 -22.357   0.891
  610   1HB   PRO  72          HB2       PRO  72  -2.550 -24.440   0.876
  611   2HB   PRO  72          HB1       PRO  72  -0.844 -24.634   1.318
  612   1HG   PRO  72          HG2       PRO  72  -3.242 -24.453   3.077
  613   2HG   PRO  72          HG1       PRO  72  -1.801 -25.472   3.237
  614   1HD   PRO  72          HD2       PRO  72  -2.205 -23.126   4.650
  615   2HD   PRO  72          HD1       PRO  72  -0.602 -23.820   4.325
  616    H    GLY  73           HN       GLY  73  -2.080 -21.306  -0.554
  617   1HA   GLY  73          HA2       GLY  73  -4.644 -21.196  -1.167
  618   2HA   GLY  73          HA1       GLY  73  -4.738 -20.321   0.365
  619    H    LYS  74           HN       LYS  74  -4.066 -18.185   0.433
  620    HA   LYS  74           HA       LYS  74  -3.818 -16.786  -2.091
  621   1HB   LYS  74          HB2       LYS  74  -3.447 -15.884   0.777
  622   2HB   LYS  74          HB1       LYS  74  -3.397 -14.792  -0.606
  623   1HG   LYS  74          HG2       LYS  74  -5.689 -15.472  -1.223
  624   2HG   LYS  74          HG1       LYS  74  -5.739 -16.561   0.166
  625   1HD   LYS  74          HD2       LYS  74  -5.405 -14.640   1.683
  626   2HD   LYS  74          HD1       LYS  74  -5.355 -13.556   0.296
  627   1HE   LYS  74          HE2       LYS  74  -7.639 -13.974  -0.244
  628   2HE   LYS  74          HE1       LYS  74  -7.715 -15.365   0.838
  629   1HZ   LYS  74          HZ1       LYS  74  -8.563 -13.888   2.271
  630   2HZ   LYS  74          HZ2       LYS  74  -7.940 -12.546   1.435
  631   3HZ   LYS  74          HZ3       LYS  74  -6.950 -13.416   2.508
  632    H    GLY  75           HN       GLY  75  -1.957 -15.517  -2.765
  633   1HA   GLY  75          HA2       GLY  75   0.664 -16.329  -1.576
  634   2HA   GLY  75          HA1       GLY  75   0.402 -16.494  -3.311
  635    H    SER  76           HN       SER  76  -0.769 -13.855  -1.229
  636    HA   SER  76           HA       SER  76   1.284 -12.018  -2.251
  637   1HB   SER  76          HB2       SER  76  -0.245 -10.555  -3.432
  638   2HB   SER  76          HB1       SER  76  -0.399 -12.175  -4.104
  639    HG   SER  76           HG       SER  76  -2.447 -11.792  -3.685
  640    H    TYR  77           HN       TYR  77   1.269 -10.006  -1.173
  641    HA   TYR  77           HA       TYR  77  -0.772  -9.432   0.864
  642   1HB   TYR  77          HB2       TYR  77   1.960 -10.449   1.489
  643   2HB   TYR  77          HB1       TYR  77   1.440  -9.068   2.439
  644    HD1  TYR  77           HD1      TYR  77   1.674 -12.467   2.611
  645    HD2  TYR  77           HD2      TYR  77  -1.303  -9.391   3.082
  646    HE1  TYR  77           HE1      TYR  77   0.365 -13.955   4.096
  647    HE2  TYR  77           HE2      TYR  77  -2.610 -10.889   4.550
  648    HH   TYR  77           HH       TYR  77  -2.721 -12.869   5.530
  649    H    TRP  78           HN       TRP  78  -0.132  -7.226   1.926
  650    HA   TRP  78           HA       TRP  78   1.506  -5.578   0.031
  651   1HB   TRP  78          HB2       TRP  78  -1.253  -4.935   1.122
  652   2HB   TRP  78          HB1       TRP  78  -0.228  -3.785   0.254
  653    HD1  TRP  78           HD1      TRP  78  -2.458  -6.790  -0.257
  654    HE1  TRP  78           HE1      TRP  78  -2.685  -7.271  -2.780
  655    HE3  TRP  78           HE3      TRP  78   1.046  -3.568  -2.082
  656    HZ2  TRP  78           HZ2      TRP  78  -1.515  -6.404  -5.251
  657    HZ3  TRP  78           HZ3      TRP  78   1.467  -3.405  -4.515
  658    HH2  TRP  78           HH2      TRP  78   0.188  -4.812  -6.102
  659    H    THR  79           HN       THR  79   3.032  -4.469   1.129
  660    HA   THR  79           HA       THR  79   2.433  -3.351   3.790
  661    HB   THR  79           HB       THR  79   3.232  -5.601   4.355
  662    HG1  THR  79           HG1      THR  79   5.521  -4.331   4.987
  663   1HG2  THR  79          HG21      THR  79   4.505  -6.066   2.306
  664   2HG2  THR  79          HG22      THR  79   5.517  -6.296   3.732
  665   3HG2  THR  79          HG23      THR  79   5.691  -4.841   2.754
  666    H    LEU  80           HN       LEU  80   3.949  -1.703   4.397
  667    HA   LEU  80           HA       LEU  80   5.230  -0.409   2.112
  668   1HB   LEU  80          HB2       LEU  80   5.118   0.279   5.062
  669   2HB   LEU  80          HB1       LEU  80   5.934   1.282   3.866
  670    HG   LEU  80           HG       LEU  80   3.015   0.482   3.682
  671   1HD1  LEU  80          HD11      LEU  80   3.361   1.845   5.681
  672   2HD1  LEU  80          HD12      LEU  80   2.553   2.807   4.444
  673   3HD1  LEU  80          HD13      LEU  80   4.277   3.027   4.746
  674   1HD2  LEU  80          HD21      LEU  80   4.845   2.277   2.092
  675   2HD2  LEU  80          HD22      LEU  80   3.133   2.674   2.201
  676   3HD2  LEU  80          HD23      LEU  80   3.633   1.133   1.521
  677    H    ASP  81           HN       ASP  81   7.557   0.275   2.244
  678    HA   ASP  81           HA       ASP  81   9.295  -1.906   2.445
  679   1HB   ASP  81          HB2       ASP  81  10.438   0.780   3.114
  680   2HB   ASP  81          HB1       ASP  81  10.976  -0.402   1.921
  681    HA   PRO  82           HA       PRO  82  10.328  -2.570   6.677
  682   1HB   PRO  82          HB2       PRO  82  13.124  -1.550   6.450
  683   2HB   PRO  82          HB1       PRO  82  12.548  -3.164   6.907
  684   1HG   PRO  82          HG2       PRO  82  13.667  -2.735   4.535
  685   2HG   PRO  82          HG1       PRO  82  12.286  -3.835   4.707
  686   1HD   PRO  82          HD2       PRO  82  12.321  -1.000   3.698
  687   2HD   PRO  82          HD1       PRO  82  11.440  -2.409   3.056
  688    H    ASP  83           HN       ASP  83  12.410  -1.041   8.228
  689    HA   ASP  83           HA       ASP  83  10.658   1.160   9.048
  690   1HB   ASP  83          HB2       ASP  83  13.350   0.183  10.032
  691   2HB   ASP  83          HB1       ASP  83  12.523   1.581  10.719
  692    H    SER  84           HN       SER  84  11.174   1.847   6.558
  693    HA   SER  84           HA       SER  84  13.655   3.369   6.283
  694   1HB   SER  84          HB2       SER  84  12.811   3.988   4.105
  695   2HB   SER  84          HB1       SER  84  12.442   2.285   4.355
  696    HG   SER  84           HG       SER  84  10.534   3.066   3.754
  697    H    TYR  85           HN       TYR  85  13.448   4.808   8.128
  698    HA   TYR  85           HA       TYR  85  11.188   6.719   8.125
  699   1HB   TYR  85          HB2       TYR  85  13.204   5.778  10.049
  700   2HB   TYR  85          HB1       TYR  85  13.018   7.526  10.097
  701    HD1  TYR  85           HD1      TYR  85  10.492   8.365  10.015
  702    HD2  TYR  85           HD2      TYR  85  11.754   4.486  11.361
  703    HE1  TYR  85           HE1      TYR  85   8.384   8.125  11.304
  704    HE2  TYR  85           HE2      TYR  85   9.647   4.246  12.648
  705    HH   TYR  85           HH       TYR  85   6.976   6.234  12.191
  706    H    ASN  86           HN       ASN  86  14.629   7.424   8.707
  707    HA   ASN  86           HA       ASN  86  14.371   9.780   6.913
  708   1HB   ASN  86          HB2       ASN  86  16.579   8.987   8.837
  709   2HB   ASN  86          HB1       ASN  86  16.496  10.507   7.942
  710   1HD2  ASN  86          HD21      ASN  86  16.046   9.475  10.982
  711   2HD2  ASN  86          HD22      ASN  86  14.729  10.434  11.458
  712    H    MET  87           HN       MET  87  15.065   6.679   6.481
  713    HA   MET  87           HA       MET  87  17.596   6.592   5.180
  714   1HB   MET  87          HB2       MET  87  15.067   4.975   4.765
  715   2HB   MET  87          HB1       MET  87  16.601   4.594   3.984
  716   1HG   MET  87          HG2       MET  87  16.520   3.249   5.960
  717   2HG   MET  87          HG1       MET  87  17.633   4.568   6.319
  718   1HE   MET  87          HE1       MET  87  17.263   3.464   8.550
  719   2HE   MET  87          HE2       MET  87  16.210   4.217   9.746
  720   3HE   MET  87          HE3       MET  87  17.454   5.177   8.947
  721    H    PHE  88           HN       PHE  88  18.206   7.042   3.078
  722    HA   PHE  88           HA       PHE  88  16.180   8.385   1.325
  723   1HB   PHE  88          HB2       PHE  88  19.190   8.761   1.485
  724   2HB   PHE  88          HB1       PHE  88  18.117   9.587   0.354
  725    HD1  PHE  88           HD1      PHE  88  16.557  11.310   1.116
  726    HD2  PHE  88           HD2      PHE  88  19.154   9.285   3.875
  727    HE1  PHE  88           HE1      PHE  88  16.055  13.017   2.843
  728    HE2  PHE  88           HE2      PHE  88  18.653  10.995   5.600
  729    HZ   PHE  88           HZ       PHE  88  17.104  12.861   5.084
  730    H    GLU  89           HN       GLU  89  15.550   6.825  -0.077
  731    HA   GLU  89           HA       GLU  89  17.184   4.641  -0.940
  732   1HB   GLU  89          HB2       GLU  89  14.677   5.860  -2.120
  733   2HB   GLU  89          HB1       GLU  89  15.429   4.394  -2.754
  734   1HG   GLU  89          HG2       GLU  89  15.199   3.318  -0.546
  735   2HG   GLU  89          HG1       GLU  89  14.443   4.780   0.089
  736    H    ASN  90           HN       ASN  90  16.908   7.889  -1.931
  737    HA   ASN  90           HA       ASN  90  18.454   7.402  -4.440
  738   1HB   ASN  90          HB2       ASN  90  16.380   8.914  -4.399
  739   2HB   ASN  90          HB1       ASN  90  17.357  10.050  -3.469
  740   1HD2  ASN  90          HD21      ASN  90  16.504  10.943  -5.951
  741   2HD2  ASN  90          HD22      ASN  90  17.793  10.955  -7.053
  742    H    GLY  91           HN       GLY  91  19.358   7.375  -1.494
  743   1HA   GLY  91          HA2       GLY  91  21.875   8.815  -1.979
  744   2HA   GLY  91          HA1       GLY  91  20.919   9.422  -0.624
  745    H    SER  92           HN       SER  92  21.917   8.662   1.205
  746    HA   SER  92           HA       SER  92  22.869   5.840   1.259
  747   1HB   SER  92          HB2       SER  92  23.371   7.964   3.348
  748   2HB   SER  92          HB1       SER  92  24.268   6.474   3.071
  749    HG   SER  92           HG       SER  92  24.082   8.191   0.914
  750    H    PHE  93           HN       PHE  93  22.761   5.602   4.064
  751    HA   PHE  93           HA       PHE  93  19.814   5.294   4.476
  752   1HB   PHE  93          HB2       PHE  93  20.401   3.540   6.078
  753   2HB   PHE  93          HB1       PHE  93  21.154   3.219   4.517
  754    HD1  PHE  93           HD1      PHE  93  23.584   3.908   4.166
  755    HD2  PHE  93           HD2      PHE  93  21.718   3.811   8.034
  756    HE1  PHE  93           HE1      PHE  93  25.818   3.855   5.243
  757    HE2  PHE  93           HE2      PHE  93  23.952   3.762   9.111
  758    HZ   PHE  93           HZ       PHE  93  26.003   3.784   7.716
  759    H    LEU  94           HN       LEU  94  22.660   6.864   5.758
  760    HA   LEU  94           HA       LEU  94  20.957   8.315   7.666
  761   1HB   LEU  94          HB2       LEU  94  21.888   6.083   8.707
  762   2HB   LEU  94          HB1       LEU  94  23.403   6.968   8.800
  763    HG   LEU  94           HG       LEU  94  21.968   8.834   9.948
  764   1HD1  LEU  94          HD11      LEU  94  20.184   6.401  10.221
  765   2HD1  LEU  94          HD12      LEU  94  19.748   7.991   9.590
  766   3HD1  LEU  94          HD13      LEU  94  20.098   7.789  11.303
  767   1HD2  LEU  94          HD21      LEU  94  22.332   7.785  12.142
  768   2HD2  LEU  94          HD22      LEU  94  23.707   7.485  11.078
  769   3HD2  LEU  94          HD23      LEU  94  22.520   6.213  11.366
  Start of MODEL   10
    1   1H    MET   1          HT1       MET   1 -25.387  18.450   2.222
    2   2H    MET   1          HT2       MET   1 -24.032  19.404   2.594
    3   3H    MET   1          HT3       MET   1 -24.194  17.853   3.269
    4    HA   MET   1           HA       MET   1 -24.288  17.160   0.744
    5   1HB   MET   1          HB2       MET   1 -22.788  18.542  -0.587
    6   2HB   MET   1          HB1       MET   1 -24.096  19.551   0.030
    7   1HG   MET   1          HG2       MET   1 -22.586  20.224   1.930
    8   2HG   MET   1          HG1       MET   1 -21.278  19.353   1.133
    9   1HE   MET   1          HE1       MET   1 -19.715  21.710   0.853
   10   2HE   MET   1          HE2       MET   1 -20.987  22.011   2.033
   11   3HE   MET   1          HE3       MET   1 -20.664  23.200   0.773
   12    H    LEU   2           HN       LEU   2 -22.695  15.613   0.481
   13    HA   LEU   2           HA       LEU   2 -20.614  15.469   2.612
   14   1HB   LEU   2          HB2       LEU   2 -21.539  13.390   0.606
   15   2HB   LEU   2          HB1       LEU   2 -20.386  13.114   1.908
   16    HG   LEU   2           HG       LEU   2 -23.244  14.041   2.332
   17   1HD1  LEU   2          HD11      LEU   2 -22.982  11.710   1.354
   18   2HD1  LEU   2          HD12      LEU   2 -23.792  11.778   2.918
   19   3HD1  LEU   2          HD13      LEU   2 -22.106  11.277   2.822
   20   1HD2  LEU   2          HD21      LEU   2 -20.952  13.302   4.154
   21   2HD2  LEU   2          HD22      LEU   2 -22.615  13.077   4.693
   22   3HD2  LEU   2          HD23      LEU   2 -22.046  14.682   4.250
   23    H    VAL   3           HN       VAL   3 -18.431  15.452   2.104
   24    HA   VAL   3           HA       VAL   3 -17.669  15.674  -0.789
   25    HB   VAL   3           HB       VAL   3 -15.954  17.359  -0.072
   26   1HG1  VAL   3          HG11      VAL   3 -17.541  19.221   0.104
   27   2HG1  VAL   3          HG12      VAL   3 -18.826  18.104   0.566
   28   3HG1  VAL   3          HG13      VAL   3 -18.138  18.034  -1.056
   29   1HG2  VAL   3          HG21      VAL   3 -17.563  17.368   2.503
   30   2HG2  VAL   3          HG22      VAL   3 -16.195  18.413   2.121
   31   3HG2  VAL   3          HG23      VAL   3 -15.947  16.682   2.339
   32    H    LYS   4           HN       LYS   4 -15.459  15.007  -1.230
   33    HA   LYS   4           HA       LYS   4 -14.637  12.755   0.436
   34   1HB   LYS   4          HB2       LYS   4 -13.655  13.980  -2.139
   35   2HB   LYS   4          HB1       LYS   4 -12.670  12.781  -1.305
   36   1HG   LYS   4          HG2       LYS   4 -14.139  11.743  -3.011
   37   2HG   LYS   4          HG1       LYS   4 -14.514  11.169  -1.387
   38   1HD   LYS   4          HD2       LYS   4 -16.451  12.551  -1.239
   39   2HD   LYS   4          HD1       LYS   4 -15.981  13.487  -2.658
   40   1HE   LYS   4          HE2       LYS   4 -16.456  11.694  -4.137
   41   2HE   LYS   4          HE1       LYS   4 -16.505  10.516  -2.826
   42   1HZ   LYS   4          HZ1       LYS   4 -18.492  12.576  -3.536
   43   2HZ   LYS   4          HZ2       LYS   4 -18.427  11.945  -1.959
   44   3HZ   LYS   4          HZ3       LYS   4 -18.723  10.916  -3.278
   45    HA   PRO   5           HA       PRO   5 -11.717  15.022   2.878
   46   1HB   PRO   5          HB2       PRO   5  -9.880  13.120   3.496
   47   2HB   PRO   5          HB1       PRO   5 -11.523  13.105   4.162
   48   1HG   PRO   5          HG2       PRO   5 -10.416  11.560   1.857
   49   2HG   PRO   5          HG1       PRO   5 -11.461  11.007   3.179
   50   1HD   PRO   5          HD2       PRO   5 -12.444  11.627   0.711
   51   2HD   PRO   5          HD1       PRO   5 -13.385  11.873   2.199
   52    HA   PRO   6           HA       PRO   6  -8.431  16.387   0.230
   53   1HB   PRO   6          HB2       PRO   6  -6.643  17.433   1.992
   54   2HB   PRO   6          HB1       PRO   6  -8.236  18.163   1.709
   55   1HG   PRO   6          HG2       PRO   6  -7.362  16.352   3.923
   56   2HG   PRO   6          HG1       PRO   6  -8.323  17.841   4.004
   57   1HD   PRO   6          HD2       PRO   6  -9.467  15.358   4.063
   58   2HD   PRO   6          HD1       PRO   6 -10.283  16.773   3.358
   59    H    TYR   7           HN       TYR   7  -8.127  13.474   1.435
   60    HA   TYR   7           HA       TYR   7  -5.157  13.267   1.355
   61   1HB   TYR   7          HB2       TYR   7  -7.195  11.070   1.810
   62   2HB   TYR   7          HB1       TYR   7  -5.461  10.989   2.110
   63    HD1  TYR   7           HD1      TYR   7  -8.487  11.283   3.735
   64    HD2  TYR   7           HD2      TYR   7  -4.627  13.167   3.609
   65    HE1  TYR   7           HE1      TYR   7  -8.849  12.168   6.020
   66    HE2  TYR   7           HE2      TYR   7  -4.985  14.048   5.896
   67    HH   TYR   7           HH       TYR   7  -6.336  14.118   7.647
   68    H    SER   8           HN       SER   8  -4.096  12.335  -0.364
   69    HA   SER   8           HA       SER   8  -5.550  12.012  -2.860
   70   1HB   SER   8          HB2       SER   8  -3.371  11.421  -3.805
   71   2HB   SER   8          HB1       SER   8  -3.190  12.821  -2.753
   72    HG   SER   8           HG       SER   8  -1.853  11.670  -1.631
   73    H    TYR   9           HN       TYR   9  -5.358   9.910  -4.133
   74    HA   TYR   9           HA       TYR   9  -6.514   7.762  -2.666
   75   1HB   TYR   9          HB2       TYR   9  -5.118   7.813  -5.355
   76   2HB   TYR   9          HB1       TYR   9  -5.940   6.388  -4.718
   77    HD1  TYR   9           HD1      TYR   9  -6.359   9.750  -6.112
   78    HD2  TYR   9           HD2      TYR   9  -8.384   6.398  -4.348
   79    HE1  TYR   9           HE1      TYR   9  -8.533  10.658  -6.884
   80    HE2  TYR   9           HE2      TYR   9 -10.558   7.304  -5.122
   81    HH   TYR   9           HH       TYR   9 -10.987   9.340  -7.418
   82    H    ILE  10           HN       ILE  10  -3.162   8.388  -3.652
   83    HA   ILE  10           HA       ILE  10  -2.124   5.882  -2.685
   84    HB   ILE  10           HB       ILE  10  -0.783   8.558  -3.168
   85   1HG1  ILE  10          HG12      ILE  10  -0.732   6.001  -4.796
   86   2HG1  ILE  10          HG11      ILE  10  -1.851   7.326  -5.112
   87   1HG2  ILE  10          HG21      ILE  10   1.303   7.082  -3.253
   88   2HG2  ILE  10          HG22      ILE  10   0.334   5.833  -2.473
   89   3HG2  ILE  10          HG23      ILE  10   0.628   7.363  -1.649
   90   1HD1  ILE  10          HD11      ILE  10   1.176   7.444  -5.200
   91   2HD1  ILE  10          HD12      ILE  10   0.130   8.858  -5.332
   92   3HD1  ILE  10          HD13      ILE  10   0.070   7.599  -6.565
   93    H    ALA  11           HN       ALA  11  -2.495   9.099  -1.195
   94    HA   ALA  11           HA       ALA  11  -1.106   8.483   1.233
   95   1HB   ALA  11          HB1       ALA  11  -1.740  10.797   0.598
   96   2HB   ALA  11          HB2       ALA  11  -2.366  10.387   2.195
   97   3HB   ALA  11          HB3       ALA  11  -3.444  10.384   0.800
   98    H    LEU  12           HN       LEU  12  -4.529   8.101   0.307
   99    HA   LEU  12           HA       LEU  12  -5.458   7.198   2.852
  100   1HB   LEU  12          HB2       LEU  12  -6.386   6.546   0.044
  101   2HB   LEU  12          HB1       LEU  12  -7.254   6.042   1.491
  102    HG   LEU  12           HG       LEU  12  -6.565   8.924   0.849
  103   1HD1  LEU  12          HD11      LEU  12  -8.160   7.796  -0.782
  104   2HD1  LEU  12          HD12      LEU  12  -8.804   9.209   0.051
  105   3HD1  LEU  12          HD13      LEU  12  -9.267   7.591   0.575
  106   1HD2  LEU  12          HD21      LEU  12  -6.971   8.919   3.139
  107   2HD2  LEU  12          HD22      LEU  12  -8.061   7.536   3.061
  108   3HD2  LEU  12          HD23      LEU  12  -8.613   9.126   2.544
  109    H    ILE  13           HN       ILE  13  -3.999   5.494   0.113
  110    HA   ILE  13           HA       ILE  13  -4.277   2.862   1.262
  111    HB   ILE  13           HB       ILE  13  -2.396   3.952  -0.848
  112   1HG1  ILE  13          HG12      ILE  13  -4.869   2.220  -1.131
  113   2HG1  ILE  13          HG11      ILE  13  -4.886   3.976  -1.301
  114   1HG2  ILE  13          HG21      ILE  13  -1.356   1.983   0.002
  115   2HG2  ILE  13          HG22      ILE  13  -2.220   1.470  -1.445
  116   3HG2  ILE  13          HG23      ILE  13  -2.899   1.141   0.148
  117   1HD1  ILE  13          HD11      ILE  13  -3.254   3.832  -3.134
  118   2HD1  ILE  13          HD12      ILE  13  -4.676   2.854  -3.501
  119   3HD1  ILE  13          HD13      ILE  13  -3.191   2.078  -2.953
  120    H    THR  14           HN       THR  14  -1.637   5.265   1.236
  121    HA   THR  14           HA       THR  14   0.250   3.601   2.600
  122    HB   THR  14           HB       THR  14   0.045   6.616   2.563
  123    HG1  THR  14           HG1      THR  14   0.476   4.956   0.630
  124   1HG2  THR  14          HG21      THR  14   1.504   5.852   4.363
  125   2HG2  THR  14          HG22      THR  14   2.484   6.504   3.052
  126   3HG2  THR  14          HG23      THR  14   2.335   4.759   3.255
  127    H    MET  15           HN       MET  15  -2.157   5.938   3.784
  128    HA   MET  15           HA       MET  15  -1.382   5.673   6.555
  129   1HB   MET  15          HB2       MET  15  -3.913   6.675   5.236
  130   2HB   MET  15          HB1       MET  15  -3.681   6.675   6.982
  131   1HG   MET  15          HG2       MET  15  -1.513   7.979   6.544
  132   2HG   MET  15          HG1       MET  15  -2.100   8.192   4.895
  133   1HE   MET  15          HE1       MET  15  -5.160  10.335   5.095
  134   2HE   MET  15          HE2       MET  15  -4.620   8.773   4.488
  135   3HE   MET  15          HE3       MET  15  -3.629  10.205   4.222
  136    H    ALA  16           HN       ALA  16  -3.644   3.981   4.469
  137    HA   ALA  16           HA       ALA  16  -5.121   2.588   6.450
  138   1HB   ALA  16          HB1       ALA  16  -5.968   2.408   4.270
  139   2HB   ALA  16          HB2       ALA  16  -5.269   0.810   4.528
  140   3HB   ALA  16          HB3       ALA  16  -4.390   2.018   3.589
  141    H    ILE  17           HN       ILE  17  -2.122   1.659   4.762
  142    HA   ILE  17           HA       ILE  17  -1.784  -0.877   6.020
  143    HB   ILE  17           HB       ILE  17   0.359   1.053   5.072
  144   1HG1  ILE  17          HG12      ILE  17  -0.949  -1.200   3.531
  145   2HG1  ILE  17          HG11      ILE  17  -1.494   0.473   3.421
  146   1HG2  ILE  17          HG21      ILE  17   1.378  -0.711   6.320
  147   2HG2  ILE  17          HG22      ILE  17   1.534  -1.179   4.627
  148   3HG2  ILE  17          HG23      ILE  17   0.293  -1.919   5.633
  149   1HD1  ILE  17          HD11      ILE  17   1.369  -0.366   2.917
  150   2HD1  ILE  17          HD12      ILE  17   0.635   1.203   2.576
  151   3HD1  ILE  17          HD13      ILE  17   0.169  -0.215   1.634
  152    H    GLN  18           HN       GLN  18  -0.548   2.333   6.864
  153    HA   GLN  18           HA       GLN  18   0.996   1.557   9.125
  154   1HB   GLN  18          HB2       GLN  18  -0.372   4.175   8.469
  155   2HB   GLN  18          HB1       GLN  18   0.795   3.969   9.776
  156   1HG   GLN  18          HG2       GLN  18   2.489   3.214   8.168
  157   2HG   GLN  18          HG1       GLN  18   1.323   3.373   6.854
  158   1HE2  GLN  18          HE21      GLN  18   2.655   5.048   5.810
  159   2HE2  GLN  18          HE22      GLN  18   2.732   6.619   6.446
  160    H    ASN  19           HN       ASN  19  -2.415   2.669   8.997
  161    HA   ASN  19           HA       ASN  19  -2.618   2.291  11.924
  162   1HB   ASN  19          HB2       ASN  19  -4.795   3.286  11.748
  163   2HB   ASN  19          HB1       ASN  19  -3.713   4.224  10.717
  164   1HD2  ASN  19          HD21      ASN  19  -3.853   1.610   8.908
  165   2HD2  ASN  19          HD22      ASN  19  -5.273   1.868   8.015
  166    H    ALA  20           HN       ALA  20  -2.496   0.126   9.576
  167    HA   ALA  20           HA       ALA  20  -4.942  -1.387  10.022
  168   1HB   ALA  20          HB1       ALA  20  -3.696  -1.636   7.922
  169   2HB   ALA  20          HB2       ALA  20  -3.706  -3.182   8.770
  170   3HB   ALA  20          HB3       ALA  20  -2.263  -2.170   8.806
  171    HA   PRO  21           HA       PRO  21  -3.801  -3.405  13.826
  172   1HB   PRO  21          HB2       PRO  21  -4.670  -6.017  13.307
  173   2HB   PRO  21          HB1       PRO  21  -5.709  -4.698  13.874
  174   1HG   PRO  21          HG2       PRO  21  -5.312  -5.731  11.105
  175   2HG   PRO  21          HG1       PRO  21  -6.799  -5.188  11.903
  176   1HD   PRO  21          HD2       PRO  21  -5.527  -3.616  10.131
  177   2HD   PRO  21          HD1       PRO  21  -6.308  -2.920  11.570
  178    H    GLU  22           HN       GLU  22  -2.828  -4.666  10.751
  179    HA   GLU  22           HA       GLU  22  -0.245  -5.576  11.915
  180   1HB   GLU  22          HB2       GLU  22  -1.805  -7.560  11.555
  181   2HB   GLU  22          HB1       GLU  22  -1.763  -7.177   9.834
  182   1HG   GLU  22          HG2       GLU  22   0.643  -7.486   9.766
  183   2HG   GLU  22          HG1       GLU  22   0.704  -7.699  11.516
  184    H    LYS  23           HN       LYS  23   1.497  -5.240  10.446
  185    HA   LYS  23           HA       LYS  23   1.142  -3.138   8.557
  186   1HB   LYS  23          HB2       LYS  23   3.368  -5.201   8.713
  187   2HB   LYS  23          HB1       LYS  23   3.447  -3.695   7.803
  188   1HG   LYS  23          HG2       LYS  23   2.947  -3.816  10.791
  189   2HG   LYS  23          HG1       LYS  23   4.548  -3.617  10.085
  190   1HD   LYS  23          HD2       LYS  23   3.530  -1.600   8.819
  191   2HD   LYS  23          HD1       LYS  23   2.201  -1.717   9.972
  192   1HE   LYS  23          HE2       LYS  23   5.117  -1.443  10.744
  193   2HE   LYS  23          HE1       LYS  23   3.957  -0.116  10.710
  194   1HZ   LYS  23          HZ1       LYS  23   3.441  -0.692  12.775
  195   2HZ   LYS  23          HZ2       LYS  23   4.331  -2.138  12.684
  196   3HZ   LYS  23          HZ3       LYS  23   2.720  -2.091  12.143
  197    H    LYS  24           HN       LYS  24   1.233  -6.674   8.128
  198    HA   LYS  24           HA       LYS  24   0.945  -6.422   5.225
  199   1HB   LYS  24          HB2       LYS  24   0.664  -8.791   7.092
  200   2HB   LYS  24          HB1       LYS  24   0.462  -8.898   5.346
  201   1HG   LYS  24          HG2       LYS  24   2.757  -8.025   5.039
  202   2HG   LYS  24          HG1       LYS  24   2.961  -7.978   6.789
  203   1HD   LYS  24          HD2       LYS  24   2.556 -10.407   6.902
  204   2HD   LYS  24          HD1       LYS  24   2.352 -10.454   5.149
  205   1HE   LYS  24          HE2       LYS  24   4.863  -9.667   6.661
  206   2HE   LYS  24          HE1       LYS  24   4.634 -11.117   5.681
  207   1HZ   LYS  24          HZ1       LYS  24   5.148  -8.388   4.856
  208   2HZ   LYS  24          HZ2       LYS  24   3.969  -9.202   3.946
  209   3HZ   LYS  24          HZ3       LYS  24   5.534  -9.847   4.082
  210    H    ILE  25           HN       ILE  25  -0.945  -6.188   4.153
  211    HA   ILE  25           HA       ILE  25  -3.478  -7.100   5.380
  212    HB   ILE  25           HB       ILE  25  -3.240  -4.754   6.140
  213   1HG1  ILE  25          HG12      ILE  25  -5.295  -4.976   3.922
  214   2HG1  ILE  25          HG11      ILE  25  -5.467  -5.769   5.488
  215   1HG2  ILE  25          HG21      ILE  25  -3.343  -3.972   3.222
  216   2HG2  ILE  25          HG22      ILE  25  -1.820  -4.125   4.099
  217   3HG2  ILE  25          HG23      ILE  25  -3.019  -2.940   4.616
  218   1HD1  ILE  25          HD11      ILE  25  -5.058  -2.787   5.134
  219   2HD1  ILE  25          HD12      ILE  25  -5.418  -3.634   6.640
  220   3HD1  ILE  25          HD13      ILE  25  -6.632  -3.549   5.362
  221    H    THR  26           HN       THR  26  -5.001  -7.654   3.805
  222    HA   THR  26           HA       THR  26  -3.951  -7.949   1.094
  223    HB   THR  26           HB       THR  26  -6.174  -9.040   0.668
  224    HG1  THR  26           HG1      THR  26  -7.690  -8.911   2.123
  225   1HG2  THR  26          HG21      THR  26  -4.935 -10.084   3.217
  226   2HG2  THR  26          HG22      THR  26  -4.107 -10.201   1.663
  227   3HG2  THR  26          HG23      THR  26  -5.658 -11.006   1.898
  228    H    LEU  27           HN       LEU  27  -5.246  -7.258  -0.804
  229    HA   LEU  27           HA       LEU  27  -5.711  -4.462  -0.803
  230   1HB   LEU  27          HB2       LEU  27  -5.143  -5.775  -2.810
  231   2HB   LEU  27          HB1       LEU  27  -6.689  -6.603  -2.723
  232    HG   LEU  27           HG       LEU  27  -7.897  -4.611  -3.277
  233   1HD1  LEU  27          HD11      LEU  27  -6.523  -2.457  -3.712
  234   2HD1  LEU  27          HD12      LEU  27  -5.280  -3.216  -2.718
  235   3HD1  LEU  27          HD13      LEU  27  -6.873  -2.880  -2.038
  236   1HD2  LEU  27          HD21      LEU  27  -5.388  -4.964  -4.931
  237   2HD2  LEU  27          HD22      LEU  27  -6.695  -3.894  -5.414
  238   3HD2  LEU  27          HD23      LEU  27  -6.994  -5.622  -5.237
  239    H    ASN  28           HN       ASN  28  -7.936  -7.200  -0.537
  240    HA   ASN  28           HA       ASN  28 -10.389  -5.761  -0.607
  241   1HB   ASN  28          HB2       ASN  28  -9.632  -8.306   0.845
  242   2HB   ASN  28          HB1       ASN  28 -11.287  -7.721   0.667
  243   1HD2  ASN  28          HD21      ASN  28  -8.891  -9.628  -0.823
  244   2HD2  ASN  28          HD22      ASN  28  -9.589  -9.732  -2.367
  245    H    GLY  29           HN       GLY  29  -8.209  -6.522   2.096
  246   1HA   GLY  29          HA2       GLY  29  -9.854  -5.569   4.207
  247   2HA   GLY  29          HA1       GLY  29  -8.093  -5.635   4.260
  248    H    ILE  30           HN       ILE  30  -7.557  -3.844   2.113
  249    HA   ILE  30           HA       ILE  30  -7.614  -1.357   3.483
  250    HB   ILE  30           HB       ILE  30  -7.248  -1.926   0.530
  251   1HG1  ILE  30          HG12      ILE  30  -5.201  -1.376   2.699
  252   2HG1  ILE  30          HG11      ILE  30  -5.656  -2.999   2.180
  253   1HG2  ILE  30          HG21      ILE  30  -6.921   0.573   2.196
  254   2HG2  ILE  30          HG22      ILE  30  -7.728   0.384   0.640
  255   3HG2  ILE  30          HG23      ILE  30  -5.969   0.332   0.731
  256   1HD1  ILE  30          HD11      ILE  30  -4.381  -0.830   0.496
  257   2HD1  ILE  30          HD12      ILE  30  -5.041  -2.319  -0.178
  258   3HD1  ILE  30          HD13      ILE  30  -3.681  -2.384   0.944
  259    H    TYR  31           HN       TYR  31  -9.781  -2.622   0.943
  260    HA   TYR  31           HA       TYR  31 -11.243  -0.216   0.544
  261   1HB   TYR  31          HB2       TYR  31 -11.934  -3.127   0.215
  262   2HB   TYR  31          HB1       TYR  31 -13.166  -1.898  -0.037
  263    HD1  TYR  31           HD1      TYR  31 -12.235   0.204  -1.484
  264    HD2  TYR  31           HD2      TYR  31 -10.767  -3.817  -1.699
  265    HE1  TYR  31           HE1      TYR  31 -11.364   0.645  -3.750
  266    HE2  TYR  31           HE2      TYR  31  -9.889  -3.377  -3.972
  267    HH   TYR  31           HH       TYR  31 -10.743  -1.386  -5.905
  268    H    GLN  32           HN       GLN  32 -11.705  -2.793   2.953
  269    HA   GLN  32           HA       GLN  32 -14.177  -1.852   3.993
  270   1HB   GLN  32          HB2       GLN  32 -11.865  -3.289   5.305
  271   2HB   GLN  32          HB1       GLN  32 -13.402  -2.999   6.119
  272   1HG   GLN  32          HG2       GLN  32 -13.191  -4.401   3.446
  273   2HG   GLN  32          HG1       GLN  32 -13.185  -5.265   4.985
  274   1HE2  GLN  32          HE21      GLN  32 -15.123  -4.388   6.509
  275   2HE2  GLN  32          HE22      GLN  32 -16.627  -4.274   5.728
  276    H    PHE  33           HN       PHE  33 -10.840  -0.937   4.781
  277    HA   PHE  33           HA       PHE  33 -11.394   0.729   7.006
  278   1HB   PHE  33          HB2       PHE  33  -9.134   0.031   6.421
  279   2HB   PHE  33          HB1       PHE  33  -9.215   0.946   4.916
  280    HD1  PHE  33           HD1      PHE  33  -8.648   3.242   4.865
  281    HD2  PHE  33           HD2      PHE  33  -9.394   1.310   8.629
  282    HE1  PHE  33           HE1      PHE  33  -7.862   5.268   6.060
  283    HE2  PHE  33           HE2      PHE  33  -8.608   3.335   9.823
  284    HZ   PHE  33           HZ       PHE  33  -7.839   5.314   8.539
  285    H    ILE  34           HN       ILE  34 -11.074   1.673   3.562
  286    HA   ILE  34           HA       ILE  34 -11.537   4.435   3.970
  287    HB   ILE  34           HB       ILE  34 -12.054   2.686   1.559
  288   1HG1  ILE  34          HG12      ILE  34  -9.841   4.669   2.166
  289   2HG1  ILE  34          HG11      ILE  34  -9.711   2.942   2.493
  290   1HG2  ILE  34          HG21      ILE  34 -13.402   4.604   1.175
  291   2HG2  ILE  34          HG22      ILE  34 -11.880   4.974   0.367
  292   3HG2  ILE  34          HG23      ILE  34 -12.236   5.680   1.943
  293   1HD1  ILE  34          HD11      ILE  34 -10.345   4.089  -0.237
  294   2HD1  ILE  34          HD12      ILE  34  -9.970   2.409   0.151
  295   3HD1  ILE  34          HD13      ILE  34  -8.721   3.648   0.290
  296    H    MET  35           HN       MET  35 -13.964   1.944   3.040
  297    HA   MET  35           HA       MET  35 -16.143   3.760   2.927
  298   1HB   MET  35          HB2       MET  35 -16.017   0.797   3.491
  299   2HB   MET  35          HB1       MET  35 -17.546   1.671   3.402
  300   1HG   MET  35          HG2       MET  35 -16.976   2.448   1.130
  301   2HG   MET  35          HG1       MET  35 -15.446   1.579   1.214
  302   1HE   MET  35          HE1       MET  35 -15.178  -0.751   1.712
  303   2HE   MET  35          HE2       MET  35 -15.316  -0.786  -0.045
  304   3HE   MET  35          HE3       MET  35 -16.134  -2.011   0.921
  305    H    ASP  36           HN       ASP  36 -14.853   1.940   5.706
  306    HA   ASP  36           HA       ASP  36 -16.957   2.695   7.511
  307   1HB   ASP  36          HB2       ASP  36 -14.088   1.851   7.976
  308   2HB   ASP  36          HB1       ASP  36 -15.239   2.121   9.284
  309    H    ARG  37           HN       ARG  37 -13.699   4.077   7.009
  310    HA   ARG  37           HA       ARG  37 -14.056   6.174   8.939
  311   1HB   ARG  37          HB2       ARG  37 -12.110   5.730   6.686
  312   2HB   ARG  37          HB1       ARG  37 -12.037   7.171   7.694
  313   1HG   ARG  37          HG2       ARG  37 -12.240   4.560   9.144
  314   2HG   ARG  37          HG1       ARG  37 -10.726   4.861   8.306
  315   1HD   ARG  37          HD2       ARG  37 -11.071   5.688  10.805
  316   2HD   ARG  37          HD1       ARG  37 -10.170   6.669   9.653
  317    HE   ARG  37           HE       ARG  37 -12.782   7.547   9.365
  318   1HH1  ARG  37          HH21      ARG  37 -10.579   7.080  11.975
  319   2HH1  ARG  37          HH22      ARG  37 -11.204   8.395  12.913
  320   1HH2  ARG  37          HH11      ARG  37 -13.609   9.269  10.571
  321   2HH2  ARG  37          HH12      ARG  37 -12.918   9.637  12.116
  322    H    PHE  38           HN       PHE  38 -14.496   6.124   5.395
  323    HA   PHE  38           HA       PHE  38 -15.767   8.842   5.627
  324   1HB   PHE  38          HB2       PHE  38 -14.278   7.817   3.202
  325   2HB   PHE  38          HB1       PHE  38 -14.821   9.459   3.528
  326    HD1  PHE  38           HD1      PHE  38 -12.239   6.957   4.118
  327    HD2  PHE  38           HD2      PHE  38 -13.697  10.816   5.318
  328    HE1  PHE  38           HE1      PHE  38 -10.058   7.450   5.190
  329    HE2  PHE  38           HE2      PHE  38 -11.512  11.308   6.388
  330    HZ   PHE  38           HZ       PHE  38  -9.696   9.622   6.327
  331    HA   PRO  39           HA       PRO  39 -18.949   5.710   4.216
  332   1HB   PRO  39          HB2       PRO  39 -20.554   8.049   5.204
  333   2HB   PRO  39          HB1       PRO  39 -20.848   6.311   5.419
  334   1HG   PRO  39          HG2       PRO  39 -19.850   7.756   7.398
  335   2HG   PRO  39          HG1       PRO  39 -19.249   6.116   7.086
  336   1HD   PRO  39          HD2       PRO  39 -17.941   8.745   6.487
  337   2HD   PRO  39          HD1       PRO  39 -17.199   7.199   6.956
  338    H    PHE  40           HN       PHE  40 -18.029   8.855   3.158
  339    HA   PHE  40           HA       PHE  40 -20.128   9.448   1.327
  340   1HB   PHE  40          HB2       PHE  40 -17.293  10.019   0.514
  341   2HB   PHE  40          HB1       PHE  40 -18.713  11.055   0.423
  342    HD1  PHE  40           HD1      PHE  40 -19.796  11.120   3.092
  343    HD2  PHE  40           HD2      PHE  40 -15.680  11.031   1.855
  344    HE1  PHE  40           HE1      PHE  40 -19.136  12.241   5.203
  345    HE2  PHE  40           HE2      PHE  40 -15.025  12.154   3.961
  346    HZ   PHE  40           HZ       PHE  40 -16.749  12.757   5.639
  347    H    TYR  41           HN       TYR  41 -17.295   7.376   1.058
  348    HA   TYR  41           HA       TYR  41 -17.555   6.812  -1.742
  349   1HB   TYR  41          HB2       TYR  41 -16.161   5.376   0.525
  350   2HB   TYR  41          HB1       TYR  41 -16.037   4.866  -1.161
  351    HD1  TYR  41           HD1      TYR  41 -14.759   6.141  -2.767
  352    HD2  TYR  41           HD2      TYR  41 -15.351   7.609   1.209
  353    HE1  TYR  41           HE1      TYR  41 -13.056   7.891  -3.168
  354    HE2  TYR  41           HE2      TYR  41 -13.645   9.360   0.839
  355    HH   TYR  41           HH       TYR  41 -11.737   9.441  -2.152
  356    H    ARG  42           HN       ARG  42 -19.087   5.394   1.108
  357    HA   ARG  42           HA       ARG  42 -19.886   2.924  -0.067
  358   1HB   ARG  42          HB2       ARG  42 -21.152   4.684   2.039
  359   2HB   ARG  42          HB1       ARG  42 -21.924   3.190   1.511
  360   1HG   ARG  42          HG2       ARG  42 -20.003   1.885   2.192
  361   2HG   ARG  42          HG1       ARG  42 -19.079   3.342   2.540
  362   1HD   ARG  42          HD2       ARG  42 -20.358   3.860   4.438
  363   2HD   ARG  42          HD1       ARG  42 -21.715   2.867   3.933
  364    HE   ARG  42           HE       ARG  42 -19.451   2.070   5.548
  365   1HH1  ARG  42          HH21      ARG  42 -21.495   0.940   3.005
  366   2HH1  ARG  42          HH22      ARG  42 -21.130  -0.730   3.292
  367   1HH2  ARG  42          HH11      ARG  42 -18.980  -0.089   5.927
  368   2HH2  ARG  42          HH12      ARG  42 -19.711  -1.310   4.941
  369    H    GLU  43           HN       GLU  43 -21.319   6.174  -0.206
  370    HA   GLU  43           HA       GLU  43 -23.621   5.373  -1.729
  371   1HB   GLU  43          HB2       GLU  43 -22.242   8.046  -1.410
  372   2HB   GLU  43          HB1       GLU  43 -23.738   7.833  -2.322
  373   1HG   GLU  43          HG2       GLU  43 -24.834   6.904  -0.314
  374   2HG   GLU  43          HG1       GLU  43 -23.341   7.119   0.599
  375    H    ASN  44           HN       ASN  44 -20.425   6.504  -2.576
  376    HA   ASN  44           HA       ASN  44 -20.993   6.088  -5.480
  377   1HB   ASN  44          HB2       ASN  44 -18.682   7.394  -4.019
  378   2HB   ASN  44          HB1       ASN  44 -18.690   7.109  -5.758
  379   1HD2  ASN  44          HD21      ASN  44 -18.701   9.742  -4.351
  380   2HD2  ASN  44          HD22      ASN  44 -20.102  10.541  -4.880
  381    H    LYS  45           HN       LYS  45 -20.813   3.859  -5.802
  382    HA   LYS  45           HA       LYS  45 -18.548   2.404  -4.579
  383   1HB   LYS  45          HB2       LYS  45 -20.818   1.473  -6.363
  384   2HB   LYS  45          HB1       LYS  45 -19.591   0.418  -5.666
  385   1HG   LYS  45          HG2       LYS  45 -20.283   1.090  -3.400
  386   2HG   LYS  45          HG1       LYS  45 -21.515   2.150  -4.087
  387   1HD   LYS  45          HD2       LYS  45 -22.590   0.208  -5.165
  388   2HD   LYS  45          HD1       LYS  45 -21.364  -0.855  -4.476
  389   1HE   LYS  45          HE2       LYS  45 -22.076   0.026  -2.189
  390   2HE   LYS  45          HE1       LYS  45 -23.460   0.753  -3.005
  391   1HZ   LYS  45          HZ1       LYS  45 -22.933  -2.045  -3.595
  392   2HZ   LYS  45          HZ2       LYS  45 -24.412  -1.240  -3.373
  393   3HZ   LYS  45          HZ3       LYS  45 -23.486  -1.707  -2.028
  394    H    GLN  46           HN       GLN  46 -19.825   2.046  -7.866
  395    HA   GLN  46           HA       GLN  46 -17.311   1.387  -9.001
  396   1HB   GLN  46          HB2       GLN  46 -19.819   2.521 -10.263
  397   2HB   GLN  46          HB1       GLN  46 -18.437   1.941 -11.192
  398   1HG   GLN  46          HG2       GLN  46 -19.907   0.257  -9.148
  399   2HG   GLN  46          HG1       GLN  46 -20.264   0.225 -10.875
  400   1HE2  GLN  46          HE21      GLN  46 -18.762  -1.651  -8.738
  401   2HE2  GLN  46          HE22      GLN  46 -17.428  -2.190  -9.638
  402    H    GLY  47           HN       GLY  47 -15.717   2.595  -9.956
  403   1HA   GLY  47          HA2       GLY  47 -15.096   4.718 -11.135
  404   2HA   GLY  47          HA1       GLY  47 -16.008   5.584  -9.901
  405    H    TRP  48           HN       TRP  48 -15.208   4.681  -7.541
  406    HA   TRP  48           HA       TRP  48 -12.346   5.417  -7.495
  407   1HB   TRP  48          HB2       TRP  48 -12.626   5.773  -5.152
  408   2HB   TRP  48          HB1       TRP  48 -14.054   6.433  -5.938
  409    HD1  TRP  48           HD1      TRP  48 -16.320   4.880  -5.823
  410    HE1  TRP  48           HE1      TRP  48 -17.107   3.284  -3.971
  411    HE3  TRP  48           HE3      TRP  48 -11.904   4.126  -3.362
  412    HZ2  TRP  48           HZ2      TRP  48 -16.025   1.875  -1.734
  413    HZ3  TRP  48           HZ3      TRP  48 -11.818   2.654  -1.372
  414    HH2  TRP  48           HH2      TRP  48 -13.872   1.528  -0.553
  415    H    GLN  49           HN       GLN  49 -14.139   2.528  -7.524
  416    HA   GLN  49           HA       GLN  49 -12.509   0.964  -5.743
  417   1HB   GLN  49          HB2       GLN  49 -14.270   0.197  -8.078
  418   2HB   GLN  49          HB1       GLN  49 -13.452  -0.988  -7.060
  419   1HG   GLN  49          HG2       GLN  49 -14.588  -0.066  -5.072
  420   2HG   GLN  49          HG1       GLN  49 -15.411   1.116  -6.090
  421   1HE2  GLN  49          HE21      GLN  49 -17.566   0.295  -5.830
  422   2HE2  GLN  49          HE22      GLN  49 -18.035  -1.242  -6.374
  423    H    ASN  50           HN       ASN  50 -12.488   1.143  -9.324
  424    HA   ASN  50           HA       ASN  50 -10.159  -0.493  -9.617
  425   1HB   ASN  50          HB2       ASN  50 -11.277   1.631 -11.471
  426   2HB   ASN  50          HB1       ASN  50 -10.082   0.415 -11.920
  427   1HD2  ASN  50          HD21      ASN  50 -11.029  -1.922 -10.831
  428   2HD2  ASN  50          HD22      ASN  50 -12.582  -2.279 -11.412
  429    H    SER  51           HN       SER  51 -10.529   3.015  -9.203
  430    HA   SER  51           HA       SER  51  -7.897   3.775  -9.948
  431   1HB   SER  51          HB2       SER  51  -8.288   5.792  -8.650
  432   2HB   SER  51          HB1       SER  51  -9.791   5.345  -9.452
  433    HG   SER  51           HG       SER  51  -9.331   5.651  -6.859
  434    H    ILE  52           HN       ILE  52  -9.162   2.657  -6.812
  435    HA   ILE  52           HA       ILE  52  -6.778   3.048  -5.310
  436    HB   ILE  52           HB       ILE  52  -9.013   1.021  -5.050
  437   1HG1  ILE  52          HG12      ILE  52  -9.345   3.605  -4.767
  438   2HG1  ILE  52          HG11      ILE  52 -10.018   2.521  -3.560
  439   1HG2  ILE  52          HG21      ILE  52  -8.126   0.888  -2.629
  440   2HG2  ILE  52          HG22      ILE  52  -6.626   1.543  -3.284
  441   3HG2  ILE  52          HG23      ILE  52  -7.245   0.000  -3.872
  442   1HD1  ILE  52          HD11      ILE  52  -8.444   3.095  -1.959
  443   2HD1  ILE  52          HD12      ILE  52  -8.626   4.626  -2.814
  444   3HD1  ILE  52          HD13      ILE  52  -7.242   3.588  -3.147
  445    H    ARG  53           HN       ARG  53  -7.923   0.135  -7.032
  446    HA   ARG  53           HA       ARG  53  -5.496  -1.354  -6.483
  447   1HB   ARG  53          HB2       ARG  53  -7.277  -2.034  -8.813
  448   2HB   ARG  53          HB1       ARG  53  -6.506  -3.106  -7.642
  449   1HG   ARG  53          HG2       ARG  53  -8.056  -2.087  -5.888
  450   2HG   ARG  53          HG1       ARG  53  -8.910  -1.335  -7.231
  451   1HD   ARG  53          HD2       ARG  53  -9.207  -3.612  -8.241
  452   2HD   ARG  53          HD1       ARG  53  -8.553  -4.299  -6.747
  453    HE   ARG  53           HE       ARG  53 -10.594  -2.644  -5.877
  454   1HH1  ARG  53          HH21      ARG  53 -10.251  -5.212  -8.150
  455   2HH1  ARG  53          HH22      ARG  53 -11.886  -5.759  -7.977
  456   1HH2  ARG  53          HH11      ARG  53 -12.725  -3.346  -5.633
  457   2HH2  ARG  53          HH12      ARG  53 -13.285  -4.706  -6.547
  458    H    HIS  54           HN       HIS  54  -6.668   0.560  -9.234
  459    HA   HIS  54           HA       HIS  54  -4.611  -0.121 -11.076
  460   1HB   HIS  54          HB2       HIS  54  -6.642   1.154 -11.702
  461   2HB   HIS  54          HB1       HIS  54  -6.064   2.528 -10.759
  462    HD1  HIS  54           HD1      HIS  54  -4.399   0.281 -13.368
  463    HD2  HIS  54           HD2      HIS  54  -4.952   4.327 -12.525
  464    HE1  HIS  54           HE1      HIS  54  -3.186   1.563 -15.184
  465    H    ASN  55           HN       ASN  55  -4.760   2.335  -8.522
  466    HA   ASN  55           HA       ASN  55  -2.236   3.567  -9.111
  467   1HB   ASN  55          HB2       ASN  55  -3.851   3.360  -6.554
  468   2HB   ASN  55          HB1       ASN  55  -2.379   4.323  -6.694
  469   1HD2  ASN  55          HD21      ASN  55  -5.032   5.449  -6.188
  470   2HD2  ASN  55          HD22      ASN  55  -5.414   6.438  -7.514
  471    H    LEU  56           HN       LEU  56  -3.154   0.842  -7.011
  472    HA   LEU  56           HA       LEU  56  -0.632   0.483  -5.772
  473   1HB   LEU  56          HB2       LEU  56  -2.894  -1.409  -6.359
  474   2HB   LEU  56          HB1       LEU  56  -1.423  -1.977  -5.574
  475    HG   LEU  56           HG       LEU  56  -3.074   0.363  -4.575
  476   1HD1  LEU  56          HD11      LEU  56  -4.401  -1.692  -4.463
  477   2HD1  LEU  56          HD12      LEU  56  -3.895  -1.216  -2.844
  478   3HD1  LEU  56          HD13      LEU  56  -3.067  -2.533  -3.674
  479   1HD2  LEU  56          HD21      LEU  56  -0.559  -0.991  -3.684
  480   2HD2  LEU  56          HD22      LEU  56  -1.703  -0.566  -2.417
  481   3HD2  LEU  56          HD23      LEU  56  -1.073   0.682  -3.485
  482    H    SER  57           HN       SER  57  -1.877  -1.031  -8.773
  483    HA   SER  57           HA       SER  57   0.453  -2.626  -9.219
  484   1HB   SER  57          HB2       SER  57  -0.422  -3.039 -11.390
  485   2HB   SER  57          HB1       SER  57  -1.830  -2.819 -10.354
  486    HG   SER  57           HG       SER  57  -1.546  -0.490 -11.043
  487    H    LEU  58           HN       LEU  58  -0.358   0.674 -10.298
  488    HA   LEU  58           HA       LEU  58   1.970   0.977 -11.962
  489   1HB   LEU  58          HB2       LEU  58   0.187   2.980 -10.566
  490   2HB   LEU  58          HB1       LEU  58   1.529   3.466 -11.596
  491    HG   LEU  58           HG       LEU  58  -0.602   1.558 -12.580
  492   1HD1  LEU  58          HD11      LEU  58  -1.548   3.694 -13.695
  493   2HD1  LEU  58          HD12      LEU  58  -0.652   4.576 -12.460
  494   3HD1  LEU  58          HD13      LEU  58  -1.913   3.437 -11.989
  495   1HD2  LEU  58          HD21      LEU  58   1.274   1.601 -14.053
  496   2HD2  LEU  58          HD22      LEU  58   1.482   3.342 -13.871
  497   3HD2  LEU  58          HD23      LEU  58   0.116   2.708 -14.782
  498    H    ASN  59           HN       ASN  59   1.336   1.596  -8.543
  499    HA   ASN  59           HA       ASN  59   3.965   2.794  -8.110
  500   1HB   ASN  59          HB2       ASN  59   1.738   1.884  -6.281
  501   2HB   ASN  59          HB1       ASN  59   3.264   2.522  -5.662
  502   1HD2  ASN  59          HD21      ASN  59   0.275   3.596  -5.972
  503   2HD2  ASN  59          HD22      ASN  59   0.526   5.181  -6.527
  504    H    GLU  60           HN       GLU  60   5.714   1.499  -8.276
  505    HA   GLU  60           HA       GLU  60   5.554  -1.357  -7.536
  506   1HB   GLU  60          HB2       GLU  60   7.796   0.326  -8.693
  507   2HB   GLU  60          HB1       GLU  60   7.884  -1.414  -8.419
  508   1HG   GLU  60          HG2       GLU  60   6.004  -1.783  -9.940
  509   2HG   GLU  60          HG1       GLU  60   5.821  -0.043 -10.173
  510    H    CYS  61           HN       CYS  61   6.239   1.572  -6.015
  511    HA   CYS  61           HA       CYS  61   8.432   0.890  -4.320
  512   1HB   CYS  61          HB2       CYS  61   6.036   2.692  -3.860
  513   2HB   CYS  61          HB1       CYS  61   7.387   2.571  -2.733
  514    HG   CYS  61           HG       CYS  61   7.560   4.494  -4.765
  515    H    PHE  62           HN       PHE  62   4.944   0.311  -4.074
  516    HA   PHE  62           HA       PHE  62   5.191  -1.052  -1.492
  517   1HB   PHE  62          HB2       PHE  62   2.871  -1.258  -3.429
  518   2HB   PHE  62          HB1       PHE  62   2.843  -1.453  -1.679
  519    HD1  PHE  62           HD1      PHE  62   3.805   0.675  -0.337
  520    HD2  PHE  62           HD2      PHE  62   2.125   0.776  -4.287
  521    HE1  PHE  62           HE1      PHE  62   3.317   3.092  -0.070
  522    HE2  PHE  62           HE2      PHE  62   1.639   3.192  -4.022
  523    HZ   PHE  62           HZ       PHE  62   2.235   4.350  -1.913
  524    H    VAL  63           HN       VAL  63   5.764  -3.185  -1.292
  525    HA   VAL  63           HA       VAL  63   5.927  -4.844  -3.778
  526    HB   VAL  63           HB       VAL  63   7.124  -5.409  -1.052
  527   1HG1  VAL  63          HG11      VAL  63   6.819  -7.284  -2.742
  528   2HG1  VAL  63          HG12      VAL  63   8.485  -7.001  -2.238
  529   3HG1  VAL  63          HG13      VAL  63   7.923  -6.406  -3.800
  530   1HG2  VAL  63          HG21      VAL  63   8.096  -3.335  -1.781
  531   2HG2  VAL  63          HG22      VAL  63   8.235  -3.912  -3.442
  532   3HG2  VAL  63          HG23      VAL  63   9.262  -4.597  -2.183
  533    H    LYS  64           HN       LYS  64   4.434  -6.445  -4.039
  534    HA   LYS  64           HA       LYS  64   2.661  -7.078  -1.737
  535   1HB   LYS  64          HB2       LYS  64   1.364  -8.317  -3.616
  536   2HB   LYS  64          HB1       LYS  64   1.346  -6.556  -3.603
  537   1HG   LYS  64          HG2       LYS  64   3.035  -6.446  -5.315
  538   2HG   LYS  64          HG1       LYS  64   3.323  -8.183  -5.219
  539   1HD   LYS  64          HD2       LYS  64   1.269  -8.715  -6.231
  540   2HD   LYS  64          HD1       LYS  64   0.571  -7.138  -5.874
  541   1HE   LYS  64          HE2       LYS  64   1.094  -7.250  -8.244
  542   2HE   LYS  64          HE1       LYS  64   2.191  -6.108  -7.471
  543   1HZ   LYS  64          HZ1       LYS  64   2.978  -8.126  -9.042
  544   2HZ   LYS  64          HZ2       LYS  64   3.108  -8.850  -7.510
  545   3HZ   LYS  64          HZ3       LYS  64   3.954  -7.417  -7.849
  546    H    VAL  65           HN       VAL  65   3.141  -8.792  -0.564
  547    HA   VAL  65           HA       VAL  65   4.906 -10.900  -1.596
  548    HB   VAL  65           HB       VAL  65   4.152 -11.811   0.866
  549   1HG1  VAL  65          HG11      VAL  65   6.146  -9.583   0.356
  550   2HG1  VAL  65          HG12      VAL  65   6.459 -11.309   0.179
  551   3HG1  VAL  65          HG13      VAL  65   6.121 -10.633   1.773
  552   1HG2  VAL  65          HG21      VAL  65   2.600  -9.689   0.912
  553   2HG2  VAL  65          HG22      VAL  65   4.088  -8.824   1.278
  554   3HG2  VAL  65          HG23      VAL  65   3.527 -10.108   2.349
  555    HA   PRO  66           HA       PRO  66   1.477 -13.498  -2.762
  556   1HB   PRO  66          HB2       PRO  66   2.629 -15.966  -2.707
  557   2HB   PRO  66          HB1       PRO  66   3.083 -14.746  -3.912
  558   1HG   PRO  66          HG2       PRO  66   4.468 -15.486  -1.367
  559   2HG   PRO  66          HG1       PRO  66   5.156 -15.208  -2.978
  560   1HD   PRO  66          HD2       PRO  66   5.192 -13.297  -1.019
  561   2HD   PRO  66          HD1       PRO  66   5.108 -12.897  -2.751
  562    H    ARG  67           HN       ARG  67   1.125 -16.202  -1.765
  563    HA   ARG  67           HA       ARG  67   0.199 -15.569   1.009
  564   1HB   ARG  67          HB2       ARG  67  -0.695 -17.713  -0.935
  565   2HB   ARG  67          HB1       ARG  67  -1.381 -17.421   0.665
  566   1HG   ARG  67          HG2       ARG  67  -2.007 -15.136  -0.009
  567   2HG   ARG  67          HG1       ARG  67  -1.325 -15.419  -1.612
  568   1HD   ARG  67          HD2       ARG  67  -3.605 -16.980  -0.365
  569   2HD   ARG  67          HD1       ARG  67  -3.762 -15.761  -1.630
  570    HE   ARG  67           HE       ARG  67  -1.943 -17.585  -2.665
  571   1HH1  ARG  67          HH21      ARG  67  -5.138 -17.645  -1.375
  572   2HH1  ARG  67          HH22      ARG  67  -5.624 -19.033  -2.290
  573   1HH2  ARG  67          HH11      ARG  67  -2.550 -19.399  -3.857
  574   2HH2  ARG  67          HH12      ARG  67  -4.154 -20.031  -3.694
  575    H    ASP  68           HN       ASP  68   0.689 -16.964   2.696
  576    HA   ASP  68           HA       ASP  68   3.084 -18.641   2.296
  577   1HB   ASP  68          HB2       ASP  68   2.705 -16.950   4.211
  578   2HB   ASP  68          HB1       ASP  68   1.641 -18.172   4.907
  579    H    ASP  69           HN       ASP  69   2.867 -20.596   4.137
  580    HA   ASP  69           HA       ASP  69   1.321 -22.613   2.865
  581   1HB   ASP  69          HB2       ASP  69   2.552 -22.434   5.624
  582   2HB   ASP  69          HB1       ASP  69   1.745 -23.889   5.040
  583    H    LYS  70           HN       LYS  70   0.624 -20.602   5.707
  584    HA   LYS  70           HA       LYS  70  -1.933 -21.930   6.193
  585   1HB   LYS  70          HB2       LYS  70  -0.641 -19.446   7.345
  586   2HB   LYS  70          HB1       LYS  70  -2.229 -20.031   7.846
  587   1HG   LYS  70          HG2       LYS  70  -1.230 -22.198   8.483
  588   2HG   LYS  70          HG1       LYS  70   0.357 -21.608   7.989
  589   1HD   LYS  70          HD2       LYS  70   0.226 -19.812   9.668
  590   2HD   LYS  70          HD1       LYS  70  -1.368 -20.385  10.162
  591   1HE   LYS  70          HE2       LYS  70   0.449 -21.215  11.657
  592   2HE   LYS  70          HE1       LYS  70  -0.429 -22.523  10.864
  593   1HZ   LYS  70          HZ1       LYS  70   1.356 -23.112   9.672
  594   2HZ   LYS  70          HZ2       LYS  70   2.234 -22.276  10.862
  595   3HZ   LYS  70          HZ3       LYS  70   1.848 -21.513   9.395
  596    H    LYS  71           HN       LYS  71  -2.144 -21.302   3.663
  597    HA   LYS  71           HA       LYS  71  -3.187 -18.613   3.207
  598   1HB   LYS  71          HB2       LYS  71  -3.889 -19.742   0.961
  599   2HB   LYS  71          HB1       LYS  71  -2.180 -19.500   1.303
  600   1HG   LYS  71          HG2       LYS  71  -1.874 -21.782   1.949
  601   2HG   LYS  71          HG1       LYS  71  -3.608 -22.075   1.991
  602   1HD   LYS  71          HD2       LYS  71  -2.973 -23.028  -0.056
  603   2HD   LYS  71          HD1       LYS  71  -3.558 -21.442  -0.539
  604   1HE   LYS  71          HE2       LYS  71  -0.636 -22.036   0.020
  605   2HE   LYS  71          HE1       LYS  71  -1.357 -22.128  -1.584
  606   1HZ   LYS  71          HZ1       LYS  71  -1.038 -19.962  -1.764
  607   2HZ   LYS  71          HZ2       LYS  71  -0.495 -19.849  -0.158
  608   3HZ   LYS  71          HZ3       LYS  71  -2.151 -19.707  -0.509
  609    HA   PRO  72           HA       PRO  72  -7.275 -20.189   4.476
  610   1HB   PRO  72          HB2       PRO  72  -8.448 -17.875   5.136
  611   2HB   PRO  72          HB1       PRO  72  -7.134 -18.538   6.129
  612   1HG   PRO  72          HG2       PRO  72  -7.045 -16.356   4.096
  613   2HG   PRO  72          HG1       PRO  72  -6.252 -16.448   5.677
  614   1HD   PRO  72          HD2       PRO  72  -5.010 -17.051   3.242
  615   2HD   PRO  72          HD1       PRO  72  -4.452 -17.604   4.835
  616    H    GLY  73           HN       GLY  73  -6.417 -18.752   1.697
  617   1HA   GLY  73          HA2       GLY  73  -7.622 -18.883  -0.375
  618   2HA   GLY  73          HA1       GLY  73  -9.123 -19.055   0.532
  619    H    LYS  74           HN       LYS  74  -6.541 -16.624   0.000
  620    HA   LYS  74           HA       LYS  74  -8.664 -14.565  -0.381
  621   1HB   LYS  74          HB2       LYS  74  -6.337 -14.371   1.553
  622   2HB   LYS  74          HB1       LYS  74  -7.310 -12.990   1.043
  623   1HG   LYS  74          HG2       LYS  74  -9.339 -14.091   1.895
  624   2HG   LYS  74          HG1       LYS  74  -8.380 -15.479   2.406
  625   1HD   LYS  74          HD2       LYS  74  -7.076 -14.017   3.913
  626   2HD   LYS  74          HD1       LYS  74  -8.050 -12.635   3.409
  627   1HE   LYS  74          HE2       LYS  74  -9.093 -15.131   4.779
  628   2HE   LYS  74          HE1       LYS  74  -8.888 -13.551   5.534
  629   1HZ   LYS  74          HZ1       LYS  74 -10.742 -14.279   3.339
  630   2HZ   LYS  74          HZ2       LYS  74 -10.421 -12.673   3.791
  631   3HZ   LYS  74          HZ3       LYS  74 -11.143 -13.741   4.896
  632    H    GLY  75           HN       GLY  75  -7.413 -12.410  -1.060
  633   1HA   GLY  75          HA2       GLY  75  -5.989 -13.075  -3.484
  634   2HA   GLY  75          HA1       GLY  75  -6.252 -11.447  -2.863
  635    H    SER  76           HN       SER  76  -3.977 -11.127  -3.602
  636    HA   SER  76           HA       SER  76  -1.825 -12.487  -2.156
  637   1HB   SER  76          HB2       SER  76  -1.897 -10.112  -4.033
  638   2HB   SER  76          HB1       SER  76  -0.413 -10.709  -3.297
  639    HG   SER  76           HG       SER  76  -0.781 -11.657  -5.339
  640    H    TYR  77           HN       TYR  77  -0.303 -11.294  -0.760
  641    HA   TYR  77           HA       TYR  77  -1.743  -9.448   1.058
  642   1HB   TYR  77          HB2       TYR  77   0.799 -11.067   1.214
  643   2HB   TYR  77          HB1       TYR  77   0.488  -9.781   2.381
  644    HD1  TYR  77           HD1      TYR  77  -0.774 -12.994   1.013
  645    HD2  TYR  77           HD2      TYR  77  -1.139 -10.050   4.118
  646    HE1  TYR  77           HE1      TYR  77  -2.238 -14.530   2.297
  647    HE2  TYR  77           HE2      TYR  77  -2.612 -11.582   5.398
  648    HH   TYR  77           HH       TYR  77  -4.107 -14.203   4.102
  649    H    TRP  78           HN       TRP  78  -1.249  -7.295   1.237
  650    HA   TRP  78           HA       TRP  78   0.925  -6.212  -0.518
  651   1HB   TRP  78          HB2       TRP  78  -1.719  -5.101   0.410
  652   2HB   TRP  78          HB1       TRP  78  -0.439  -4.025  -0.148
  653    HD1  TRP  78           HD1      TRP  78  -2.915  -6.633  -1.374
  654    HE1  TRP  78           HE1      TRP  78  -2.914  -6.641  -3.952
  655    HE3  TRP  78           HE3      TRP  78   1.066  -3.565  -2.260
  656    HZ2  TRP  78           HZ2      TRP  78  -1.412  -5.494  -6.112
  657    HZ3  TRP  78           HZ3      TRP  78   1.760  -3.040  -4.577
  658    HH2  TRP  78           HH2      TRP  78   0.528  -3.996  -6.502
  659    H    THR  79           HN       THR  79   2.590  -5.111   0.420
  660    HA   THR  79           HA       THR  79   2.292  -3.970   3.123
  661    HB   THR  79           HB       THR  79   2.901  -6.395   3.426
  662    HG1  THR  79           HG1      THR  79   3.755  -4.330   4.633
  663   1HG2  THR  79          HG21      THR  79   5.017  -7.218   2.733
  664   2HG2  THR  79          HG22      THR  79   5.597  -5.604   2.325
  665   3HG2  THR  79          HG23      THR  79   4.371  -6.379   1.322
  666    H    LEU  80           HN       LEU  80   4.285  -2.748   3.753
  667    HA   LEU  80           HA       LEU  80   5.360  -1.297   1.453
  668   1HB   LEU  80          HB2       LEU  80   6.175  -1.109   4.374
  669   2HB   LEU  80          HB1       LEU  80   6.476   0.089   3.116
  670    HG   LEU  80           HG       LEU  80   3.746  -0.768   4.111
  671   1HD1  LEU  80          HD11      LEU  80   4.900   0.586   5.771
  672   2HD1  LEU  80          HD12      LEU  80   3.663   1.572   4.992
  673   3HD1  LEU  80          HD13      LEU  80   5.357   1.764   4.540
  674   1HD2  LEU  80          HD21      LEU  80   3.114   1.366   2.756
  675   2HD2  LEU  80          HD22      LEU  80   3.431  -0.116   1.859
  676   3HD2  LEU  80          HD23      LEU  80   4.670   1.136   1.956
  677    H    ASP  81           HN       ASP  81   7.859  -0.982   1.374
  678    HA   ASP  81           HA       ASP  81   9.140  -3.331   0.690
  679   1HB   ASP  81          HB2       ASP  81  11.309  -2.112   1.198
  680   2HB   ASP  81          HB1       ASP  81  10.182  -1.235   0.164
  681    HA   PRO  82           HA       PRO  82   9.694  -5.272   4.699
  682   1HB   PRO  82          HB2       PRO  82  11.201  -7.391   4.035
  683   2HB   PRO  82          HB1       PRO  82   9.551  -7.219   3.397
  684   1HG   PRO  82          HG2       PRO  82  12.154  -6.549   2.077
  685   2HG   PRO  82          HG1       PRO  82  10.776  -7.460   1.428
  686   1HD   PRO  82          HD2       PRO  82  11.174  -4.793   0.906
  687   2HD   PRO  82          HD1       PRO  82   9.561  -5.545   0.952
  688    H    ASP  83           HN       ASP  83  11.905  -6.613   5.625
  689    HA   ASP  83           HA       ASP  83  13.839  -4.419   6.087
  690   1HB   ASP  83          HB2       ASP  83  13.465  -7.155   7.344
  691   2HB   ASP  83          HB1       ASP  83  14.781  -6.061   7.772
  692    H    SER  84           HN       SER  84  14.459  -4.689   3.740
  693    HA   SER  84           HA       SER  84  15.703  -7.018   2.719
  694   1HB   SER  84          HB2       SER  84  15.075  -5.185   1.263
  695   2HB   SER  84          HB1       SER  84  16.184  -4.097   2.091
  696    HG   SER  84           HG       SER  84  16.712  -5.580   0.024
  697    H    TYR  85           HN       TYR  85  16.998  -4.345   4.637
  698    HA   TYR  85           HA       TYR  85  19.760  -4.970   4.402
  699   1HB   TYR  85          HB2       TYR  85  18.939  -2.878   5.424
  700   2HB   TYR  85          HB1       TYR  85  18.290  -3.797   6.783
  701    HD1  TYR  85           HD1      TYR  85  21.273  -2.372   5.265
  702    HD2  TYR  85           HD2      TYR  85  19.845  -5.074   8.284
  703    HE1  TYR  85           HE1      TYR  85  23.500  -2.331   6.355
  704    HE2  TYR  85           HE2      TYR  85  22.072  -5.029   9.376
  705    HH   TYR  85           HH       TYR  85  24.377  -4.546   8.830
  706    H    ASN  86           HN       ASN  86  17.280  -6.227   6.615
  707    HA   ASN  86           HA       ASN  86  19.110  -7.743   8.226
  708   1HB   ASN  86          HB2       ASN  86  16.135  -8.072   7.760
  709   2HB   ASN  86          HB1       ASN  86  17.051  -8.941   8.991
  710   1HD2  ASN  86          HD21      ASN  86  18.739  -6.250   9.146
  711   2HD2  ASN  86          HD22      ASN  86  17.800  -5.301  10.194
  712    H    MET  87           HN       MET  87  18.163  -8.169   5.058
  713    HA   MET  87           HA       MET  87  18.100 -11.094   5.089
  714   1HB   MET  87          HB2       MET  87  18.321  -9.145   2.780
  715   2HB   MET  87          HB1       MET  87  18.117 -10.886   2.613
  716   1HG   MET  87          HG2       MET  87  16.185  -9.243   4.248
  717   2HG   MET  87          HG1       MET  87  15.988  -9.426   2.506
  718   1HE   MET  87          HE1       MET  87  13.598 -10.439   3.024
  719   2HE   MET  87          HE2       MET  87  13.576 -12.159   2.640
  720   3HE   MET  87          HE3       MET  87  14.477 -11.045   1.614
  721    H    PHE  88           HN       PHE  88  20.093 -11.749   5.962
  722    HA   PHE  88           HA       PHE  88  22.607 -10.749   4.841
  723   1HB   PHE  88          HB2       PHE  88  23.650 -12.456   6.331
  724   2HB   PHE  88          HB1       PHE  88  22.557 -11.375   7.191
  725    HD1  PHE  88           HD1      PHE  88  23.067 -14.796   5.940
  726    HD2  PHE  88           HD2      PHE  88  20.394 -12.153   8.017
  727    HE1  PHE  88           HE1      PHE  88  21.755 -16.746   6.734
  728    HE2  PHE  88           HE2      PHE  88  19.080 -14.102   8.808
  729    HZ   PHE  88           HZ       PHE  88  19.761 -16.399   8.166
  730    H    GLU  89           HN       GLU  89  20.306 -13.021   3.904
  731    HA   GLU  89           HA       GLU  89  22.063 -15.000   2.706
  732   1HB   GLU  89          HB2       GLU  89  19.145 -14.309   2.277
  733   2HB   GLU  89          HB1       GLU  89  19.955 -15.637   1.446
  734   1HG   GLU  89          HG2       GLU  89  19.907 -15.351   4.460
  735   2HG   GLU  89          HG1       GLU  89  18.727 -16.305   3.559
  736    H    ASN  90           HN       ASN  90  22.573 -15.205   0.458
  737    HA   ASN  90           HA       ASN  90  22.965 -12.664  -0.908
  738   1HB   ASN  90          HB2       ASN  90  24.600 -14.517  -1.096
  739   2HB   ASN  90          HB1       ASN  90  23.380 -15.497  -1.911
  740   1HD2  ASN  90          HD21      ASN  90  24.812 -12.191  -2.231
  741   2HD2  ASN  90          HD22      ASN  90  24.877 -12.228  -3.928
  742    H    GLY  91           HN       GLY  91  21.568 -11.729  -2.325
  743   1HA   GLY  91          HA2       GLY  91  19.834 -11.522  -3.904
  744   2HA   GLY  91          HA1       GLY  91  19.852 -13.278  -4.077
  745    H    SER  92           HN       SER  92  17.970 -10.750  -3.060
  746    HA   SER  92           HA       SER  92  16.758 -11.779  -0.679
  747   1HB   SER  92          HB2       SER  92  15.003 -10.188  -1.075
  748   2HB   SER  92          HB1       SER  92  16.495  -9.435  -1.631
  749    HG   SER  92           HG       SER  92  14.301  -9.845  -3.002
  750    H    PHE  93           HN       PHE  93  16.118 -12.304  -4.121
  751    HA   PHE  93           HA       PHE  93  14.516 -14.705  -3.394
  752   1HB   PHE  93          HB2       PHE  93  12.913 -12.835  -3.778
  753   2HB   PHE  93          HB1       PHE  93  13.587 -12.622  -5.396
  754    HD1  PHE  93           HD1      PHE  93  13.233 -14.297  -7.148
  755    HD2  PHE  93           HD2      PHE  93  11.587 -14.809  -3.213
  756    HE1  PHE  93           HE1      PHE  93  11.774 -16.115  -7.995
  757    HE2  PHE  93           HE2      PHE  93  10.127 -16.627  -4.060
  758    HZ   PHE  93           HZ       PHE  93  10.222 -17.280  -6.451
  759    H    LEU  94           HN       LEU  94  14.547 -16.317  -5.040
  760    HA   LEU  94           HA       LEU  94  16.911 -16.633  -6.508
  761   1HB   LEU  94          HB2       LEU  94  14.166 -17.721  -7.212
  762   2HB   LEU  94          HB1       LEU  94  15.703 -18.355  -7.800
  763    HG   LEU  94           HG       LEU  94  14.865 -18.227  -4.887
  764   1HD1  LEU  94          HD11      LEU  94  15.129 -20.609  -6.748
  765   2HD1  LEU  94          HD12      LEU  94  13.599 -19.875  -6.267
  766   3HD1  LEU  94          HD13      LEU  94  14.623 -20.650  -5.059
  767   1HD2  LEU  94          HD21      LEU  94  16.907 -19.906  -4.822
  768   2HD2  LEU  94          HD22      LEU  94  17.204 -18.172  -4.813
  769   3HD2  LEU  94          HD23      LEU  94  17.378 -19.087  -6.311
  Start of MODEL   11
    1   1H    MET   1          HT1       MET   1 -22.121  19.416   2.425
    2   2H    MET   1          HT2       MET   1 -23.757  19.647   2.028
    3   3H    MET   1          HT3       MET   1 -22.568  19.713   0.817
    4    HA   MET   1           HA       MET   1 -23.736  17.389   2.163
    5   1HB   MET   1          HB2       MET   1 -22.831  18.080  -0.646
    6   2HB   MET   1          HB1       MET   1 -23.431  16.488  -0.180
    7   1HG   MET   1          HG2       MET   1 -25.553  17.498   0.567
    8   2HG   MET   1          HG1       MET   1 -24.959  19.093   0.104
    9   1HE   MET   1          HE1       MET   1 -27.431  18.909  -2.552
   10   2HE   MET   1          HE2       MET   1 -27.157  19.139  -0.827
   11   3HE   MET   1          HE3       MET   1 -27.826  17.617  -1.412
   12    H    LEU   2           HN       LEU   2 -22.308  15.391   0.907
   13    HA   LEU   2           HA       LEU   2 -19.814  15.423   2.461
   14   1HB   LEU   2          HB2       LEU   2 -20.832  13.278   0.580
   15   2HB   LEU   2          HB1       LEU   2 -19.639  13.085   1.868
   16    HG   LEU   2           HG       LEU   2 -22.563  13.810   2.237
   17   1HD1  LEU   2          HD11      LEU   2 -22.839  11.612   3.118
   18   2HD1  LEU   2          HD12      LEU   2 -21.098  11.333   3.165
   19   3HD1  LEU   2          HD13      LEU   2 -21.938  11.409   1.616
   20   1HD2  LEU   2          HD21      LEU   2 -20.216  13.650   4.128
   21   2HD2  LEU   2          HD22      LEU   2 -21.850  13.326   4.708
   22   3HD2  LEU   2          HD23      LEU   2 -21.459  14.894   4.010
   23    H    VAL   3           HN       VAL   3 -17.734  15.368   1.597
   24    HA   VAL   3           HA       VAL   3 -17.464  15.765  -1.365
   25    HB   VAL   3           HB       VAL   3 -15.704  17.429  -0.913
   26   1HG1  VAL   3          HG11      VAL   3 -18.177  18.058  -1.090
   27   2HG1  VAL   3          HG12      VAL   3 -17.142  19.235  -0.284
   28   3HG1  VAL   3          HG13      VAL   3 -18.173  18.171   0.669
   29   1HG2  VAL   3          HG21      VAL   3 -16.495  16.948   1.974
   30   2HG2  VAL   3          HG22      VAL   3 -15.481  18.288   1.435
   31   3HG2  VAL   3          HG23      VAL   3 -14.920  16.628   1.247
   32    H    LYS   4           HN       LYS   4 -15.293  15.154  -2.160
   33    HA   LYS   4           HA       LYS   4 -14.369  12.713  -0.891
   34   1HB   LYS   4          HB2       LYS   4 -12.524  13.000  -2.746
   35   2HB   LYS   4          HB1       LYS   4 -14.178  12.618  -3.214
   36   1HG   LYS   4          HG2       LYS   4 -14.641  14.878  -3.814
   37   2HG   LYS   4          HG1       LYS   4 -13.177  15.466  -3.024
   38   1HD   LYS   4          HD2       LYS   4 -11.797  14.235  -4.662
   39   2HD   LYS   4          HD1       LYS   4 -13.261  13.653  -5.456
   40   1HE   LYS   4          HE2       LYS   4 -12.410  16.551  -5.176
   41   2HE   LYS   4          HE1       LYS   4 -12.389  15.598  -6.660
   42   1HZ   LYS   4          HZ1       LYS   4 -14.939  15.411  -5.520
   43   2HZ   LYS   4          HZ2       LYS   4 -14.493  16.130  -6.994
   44   3HZ   LYS   4          HZ3       LYS   4 -14.512  17.053  -5.569
   45    HA   PRO   5           HA       PRO   5 -11.683  14.907   2.056
   46   1HB   PRO   5          HB2       PRO   5 -10.211  12.294   1.793
   47   2HB   PRO   5          HB1       PRO   5 -10.593  13.222   3.262
   48   1HG   PRO   5          HG2       PRO   5 -12.011  11.077   2.591
   49   2HG   PRO   5          HG1       PRO   5 -12.790  12.504   3.296
   50   1HD   PRO   5          HD2       PRO   5 -12.882  11.518   0.481
   51   2HD   PRO   5          HD1       PRO   5 -14.074  12.483   1.381
   52    HA   PRO   6           HA       PRO   6  -8.473  16.265  -0.747
   53   1HB   PRO   6          HB2       PRO   6  -6.694  17.387   1.008
   54   2HB   PRO   6          HB1       PRO   6  -8.248  18.140   0.598
   55   1HG   PRO   6          HG2       PRO   6  -7.519  16.501   2.988
   56   2HG   PRO   6          HG1       PRO   6  -8.469  17.995   2.898
   57   1HD   PRO   6          HD2       PRO   6  -9.642  15.542   3.118
   58   2HD   PRO   6          HD1       PRO   6 -10.407  16.883   2.236
   59    H    TYR   7           HN       TYR   7  -7.919  13.868   1.652
   60    HA   TYR   7           HA       TYR   7  -5.129  13.381   1.328
   61   1HB   TYR   7          HB2       TYR   7  -7.300  11.305   1.757
   62   2HB   TYR   7          HB1       TYR   7  -5.593  11.141   2.158
   63    HD1  TYR   7           HD1      TYR   7  -8.732  11.829   3.523
   64    HD2  TYR   7           HD2      TYR   7  -4.665  13.202   3.656
   65    HE1  TYR   7           HE1      TYR   7  -9.154  12.841   5.739
   66    HE2  TYR   7           HE2      TYR   7  -5.082  14.210   5.885
   67    HH   TYR   7           HH       TYR   7  -7.254  15.099   7.125
   68    H    SER   8           HN       SER   8  -4.006  12.409  -0.344
   69    HA   SER   8           HA       SER   8  -5.354  11.970  -2.871
   70   1HB   SER   8          HB2       SER   8  -3.195  11.418  -3.734
   71   2HB   SER   8          HB1       SER   8  -2.902  12.658  -2.516
   72    HG   SER   8           HG       SER   8  -2.440   9.887  -2.422
   73    H    TYR   9           HN       TYR   9  -5.319   9.795  -3.997
   74    HA   TYR   9           HA       TYR   9  -6.541   7.781  -2.398
   75   1HB   TYR   9          HB2       TYR   9  -5.085   7.543  -5.050
   76   2HB   TYR   9          HB1       TYR   9  -6.054   6.255  -4.331
   77    HD1  TYR   9           HD1      TYR   9  -8.509   6.512  -4.077
   78    HD2  TYR   9           HD2      TYR   9  -6.111   9.502  -6.021
   79    HE1  TYR   9           HE1      TYR   9 -10.551   7.519  -5.045
   80    HE2  TYR   9           HE2      TYR   9  -8.159  10.513  -6.987
   81    HH   TYR   9           HH       TYR   9 -10.812   9.199  -7.448
   82    H    ILE  10           HN       ILE  10  -3.181   8.266  -3.412
   83    HA   ILE  10           HA       ILE  10  -2.116   5.838  -2.349
   84    HB   ILE  10           HB       ILE  10  -0.710   8.521  -2.452
   85   1HG1  ILE  10          HG12      ILE  10  -1.695   8.226  -4.626
   86   2HG1  ILE  10          HG11      ILE  10  -0.004   7.752  -4.765
   87   1HG2  ILE  10          HG21      ILE  10   1.290   7.170  -2.755
   88   2HG2  ILE  10          HG22      ILE  10   0.324   5.695  -2.811
   89   3HG2  ILE  10          HG23      ILE  10   0.439   6.616  -1.311
   90   1HD1  ILE  10          HD11      ILE  10  -0.833   5.351  -4.288
   91   2HD1  ILE  10          HD12      ILE  10  -1.179   6.031  -5.879
   92   3HD1  ILE  10          HD13      ILE  10  -2.442   5.977  -4.651
   93    H    ALA  11           HN       ALA  11  -2.535   9.066  -0.890
   94    HA   ALA  11           HA       ALA  11  -1.351   8.457   1.628
   95   1HB   ALA  11          HB1       ALA  11  -3.525  10.419   0.848
   96   2HB   ALA  11          HB2       ALA  11  -1.814  10.755   1.108
   97   3HB   ALA  11          HB3       ALA  11  -2.847  10.337   2.473
   98    H    LEU  12           HN       LEU  12  -4.757   8.203   0.566
   99    HA   LEU  12           HA       LEU  12  -5.792   7.280   3.056
  100   1HB   LEU  12          HB2       LEU  12  -6.672   6.704   0.211
  101   2HB   LEU  12          HB1       LEU  12  -7.609   6.250   1.631
  102    HG   LEU  12           HG       LEU  12  -6.739   9.093   1.027
  103   1HD1  LEU  12          HD11      LEU  12  -9.438   7.797   0.547
  104   2HD1  LEU  12          HD12      LEU  12  -8.269   8.174  -0.719
  105   3HD1  LEU  12          HD13      LEU  12  -9.008   9.475   0.216
  106   1HD2  LEU  12          HD21      LEU  12  -8.805   9.457   2.614
  107   2HD2  LEU  12          HD22      LEU  12  -7.254   9.021   3.320
  108   3HD2  LEU  12          HD23      LEU  12  -8.500   7.793   3.105
  109    H    ILE  13           HN       ILE  13  -4.319   5.557   0.330
  110    HA   ILE  13           HA       ILE  13  -4.720   2.910   1.428
  111    HB   ILE  13           HB       ILE  13  -2.708   3.968  -0.578
  112   1HG1  ILE  13          HG12      ILE  13  -5.222   2.342  -1.055
  113   2HG1  ILE  13          HG11      ILE  13  -5.214   4.101  -1.100
  114   1HG2  ILE  13          HG21      ILE  13  -2.615   1.504  -1.237
  115   2HG2  ILE  13          HG22      ILE  13  -3.428   1.158   0.289
  116   3HG2  ILE  13          HG23      ILE  13  -1.834   1.913   0.289
  117   1HD1  ILE  13          HD11      ILE  13  -3.866   2.156  -2.960
  118   2HD1  ILE  13          HD12      ILE  13  -3.228   3.792  -2.797
  119   3HD1  ILE  13          HD13      ILE  13  -4.878   3.543  -3.355
  120    H    THR  14           HN       THR  14  -2.087   5.280   1.546
  121    HA   THR  14           HA       THR  14  -0.184   3.637   2.895
  122    HB   THR  14           HB       THR  14  -0.523   6.646   3.008
  123    HG1  THR  14           HG1      THR  14  -0.208   5.958   0.918
  124   1HG2  THR  14          HG21      THR  14   1.985   6.498   3.475
  125   2HG2  THR  14          HG22      THR  14   1.724   4.783   3.791
  126   3HG2  THR  14          HG23      THR  14   0.923   5.995   4.790
  127    H    MET  15           HN       MET  15  -2.731   5.786   4.107
  128    HA   MET  15           HA       MET  15  -2.025   5.572   6.883
  129   1HB   MET  15          HB2       MET  15  -4.634   6.234   5.490
  130   2HB   MET  15          HB1       MET  15  -4.424   6.314   7.241
  131   1HG   MET  15          HG2       MET  15  -2.616   7.941   6.981
  132   2HG   MET  15          HG1       MET  15  -2.728   7.819   5.226
  133   1HE   MET  15          HE1       MET  15  -2.487  10.199   5.871
  134   2HE   MET  15          HE2       MET  15  -3.792  11.303   6.291
  135   3HE   MET  15          HE3       MET  15  -3.669  10.681   4.648
  136    H    ALA  16           HN       ALA  16  -4.155   3.695   4.775
  137    HA   ALA  16           HA       ALA  16  -5.382   2.087   6.767
  138   1HB   ALA  16          HB1       ALA  16  -6.000   2.209   4.319
  139   2HB   ALA  16          HB2       ALA  16  -5.921   0.569   4.967
  140   3HB   ALA  16          HB3       ALA  16  -4.597   1.195   3.981
  141    H    ILE  17           HN       ILE  17  -2.313   1.643   5.001
  142    HA   ILE  17           HA       ILE  17  -1.699  -0.938   6.096
  143    HB   ILE  17           HB       ILE  17   0.195   1.263   5.206
  144   1HG1  ILE  17          HG12      ILE  17  -0.854  -1.116   3.651
  145   2HG1  ILE  17          HG11      ILE  17  -1.551   0.503   3.542
  146   1HG2  ILE  17          HG21      ILE  17   1.417  -0.387   6.448
  147   2HG2  ILE  17          HG22      ILE  17   1.670  -0.769   4.745
  148   3HG2  ILE  17          HG23      ILE  17   0.521  -1.707   5.696
  149   1HD1  ILE  17          HD11      ILE  17   1.331  -0.223   2.928
  150   2HD1  ILE  17          HD12      ILE  17   0.642   1.400   2.841
  151   3HD1  ILE  17          HD13      ILE  17   0.086   0.144   1.734
  152    H    GLN  18           HN       GLN  18  -0.567   2.313   7.009
  153    HA   GLN  18           HA       GLN  18   0.839   1.477   9.360
  154   1HB   GLN  18          HB2       GLN  18  -0.391   4.143   8.604
  155   2HB   GLN  18          HB1       GLN  18   0.590   3.905  10.049
  156   1HG   GLN  18          HG2       GLN  18   2.466   3.125   8.640
  157   2HG   GLN  18          HG1       GLN  18   1.485   3.391   7.198
  158   1HE2  GLN  18          HE21      GLN  18   0.793   5.698   6.779
  159   2HE2  GLN  18          HE22      GLN  18   1.761   6.965   7.361
  160    H    ASN  19           HN       ASN  19  -2.496   2.580   8.843
  161    HA   ASN  19           HA       ASN  19  -3.210   2.602  11.638
  162   1HB   ASN  19          HB2       ASN  19  -4.867   2.440   9.107
  163   2HB   ASN  19          HB1       ASN  19  -5.571   2.565  10.719
  164   1HD2  ASN  19          HD21      ASN  19  -2.944   4.292  11.312
  165   2HD2  ASN  19          HD22      ASN  19  -3.411   5.828  10.764
  166    H    ALA  20           HN       ALA  20  -2.902   0.063   9.288
  167    HA   ALA  20           HA       ALA  20  -4.651  -1.792  10.709
  168   1HB   ALA  20          HB1       ALA  20  -3.877  -3.441   9.118
  169   2HB   ALA  20          HB2       ALA  20  -2.487  -2.444   8.687
  170   3HB   ALA  20          HB3       ALA  20  -4.114  -1.931   8.238
  171    HA   PRO  21           HA       PRO  21  -1.625  -3.010  13.749
  172   1HB   PRO  21          HB2       PRO  21  -2.384  -5.621  14.215
  173   2HB   PRO  21          HB1       PRO  21  -3.264  -4.218  14.850
  174   1HG   PRO  21          HG2       PRO  21  -3.869  -5.898  12.457
  175   2HG   PRO  21          HG1       PRO  21  -4.973  -5.236  13.675
  176   1HD   PRO  21          HD2       PRO  21  -4.671  -4.088  11.225
  177   2HD   PRO  21          HD1       PRO  21  -5.023  -3.127  12.679
  178    H    GLU  22           HN       GLU  22  -2.255  -5.469  11.252
  179    HA   GLU  22           HA       GLU  22   0.664  -6.115  11.163
  180   1HB   GLU  22          HB2       GLU  22  -1.795  -7.584  10.169
  181   2HB   GLU  22          HB1       GLU  22  -0.150  -8.074   9.758
  182   1HG   GLU  22          HG2       GLU  22   0.393  -8.356  12.123
  183   2HG   GLU  22          HG1       GLU  22  -1.206  -7.773  12.587
  184    H    LYS  23           HN       LYS  23   1.781  -5.174   9.523
  185    HA   LYS  23           HA       LYS  23   0.554  -3.468   7.615
  186   1HB   LYS  23          HB2       LYS  23   3.290  -4.765   7.602
  187   2HB   LYS  23          HB1       LYS  23   2.789  -3.501   6.475
  188   1HG   LYS  23          HG2       LYS  23   2.306  -1.997   8.369
  189   2HG   LYS  23          HG1       LYS  23   2.809  -3.254   9.498
  190   1HD   LYS  23          HD2       LYS  23   5.069  -3.244   8.486
  191   2HD   LYS  23          HD1       LYS  23   4.557  -1.960   7.388
  192   1HE   LYS  23          HE2       LYS  23   3.988  -0.564   9.405
  193   2HE   LYS  23          HE1       LYS  23   4.732  -1.811  10.406
  194   1HZ   LYS  23          HZ1       LYS  23   6.688  -0.897   9.996
  195   2HZ   LYS  23          HZ2       LYS  23   5.981   0.257   8.968
  196   3HZ   LYS  23          HZ3       LYS  23   6.506  -1.233   8.344
  197    H    LYS  24           HN       LYS  24   1.226  -6.920   7.473
  198    HA   LYS  24           HA       LYS  24   0.817  -7.047   4.577
  199   1HB   LYS  24          HB2       LYS  24   0.825  -9.242   6.680
  200   2HB   LYS  24          HB1       LYS  24   0.780  -9.514   4.936
  201   1HG   LYS  24          HG2       LYS  24   2.932  -8.333   4.692
  202   2HG   LYS  24          HG1       LYS  24   2.983  -8.064   6.435
  203   1HD   LYS  24          HD2       LYS  24   2.980 -10.500   6.818
  204   2HD   LYS  24          HD1       LYS  24   2.931 -10.776   5.077
  205   1HE   LYS  24          HE2       LYS  24   5.092  -9.678   4.799
  206   2HE   LYS  24          HE1       LYS  24   5.132  -9.263   6.513
  207   1HZ   LYS  24          HZ1       LYS  24   4.771 -12.075   5.798
  208   2HZ   LYS  24          HZ2       LYS  24   5.589 -11.387   7.118
  209   3HZ   LYS  24          HZ3       LYS  24   6.313 -11.403   5.582
  210    H    ILE  25           HN       ILE  25  -1.217  -6.008   4.332
  211    HA   ILE  25           HA       ILE  25  -3.594  -7.501   5.399
  212    HB   ILE  25           HB       ILE  25  -3.503  -5.171   6.170
  213   1HG1  ILE  25          HG12      ILE  25  -5.542  -5.421   3.938
  214   2HG1  ILE  25          HG11      ILE  25  -5.693  -6.248   5.489
  215   1HG2  ILE  25          HG21      ILE  25  -3.484  -3.321   4.584
  216   2HG2  ILE  25          HG22      ILE  25  -3.496  -4.445   3.225
  217   3HG2  ILE  25          HG23      ILE  25  -2.085  -4.350   4.280
  218   1HD1  ILE  25          HD11      ILE  25  -5.780  -4.162   6.683
  219   2HD1  ILE  25          HD12      ILE  25  -6.915  -4.032   5.339
  220   3HD1  ILE  25          HD13      ILE  25  -5.338  -3.251   5.239
  221    H    THR  26           HN       THR  26  -5.310  -7.909   3.898
  222    HA   THR  26           HA       THR  26  -4.378  -8.356   1.164
  223    HB   THR  26           HB       THR  26  -6.568  -9.400   0.824
  224    HG1  THR  26           HG1      THR  26  -7.484  -7.681   2.351
  225   1HG2  THR  26          HG21      THR  26  -6.538 -10.937   2.915
  226   2HG2  THR  26          HG22      THR  26  -5.117 -10.015   3.395
  227   3HG2  THR  26          HG23      THR  26  -5.114 -10.916   1.878
  228    H    LEU  27           HN       LEU  27  -5.564  -7.574  -0.721
  229    HA   LEU  27           HA       LEU  27  -5.920  -4.756  -0.740
  230   1HB   LEU  27          HB2       LEU  27  -5.338  -6.097  -2.726
  231   2HB   LEU  27          HB1       LEU  27  -6.916  -6.870  -2.682
  232    HG   LEU  27           HG       LEU  27  -8.029  -4.781  -3.216
  233   1HD1  LEU  27          HD11      LEU  27  -6.451  -2.771  -3.746
  234   2HD1  LEU  27          HD12      LEU  27  -5.299  -3.607  -2.705
  235   3HD1  LEU  27          HD13      LEU  27  -6.861  -3.097  -2.064
  236   1HD2  LEU  27          HD21      LEU  27  -6.767  -4.209  -5.391
  237   2HD2  LEU  27          HD22      LEU  27  -7.304  -5.873  -5.185
  238   3HD2  LEU  27          HD23      LEU  27  -5.616  -5.449  -4.910
  239    H    ASN  28           HN       ASN  28  -8.241  -7.423  -0.570
  240    HA   ASN  28           HA       ASN  28 -10.645  -5.918  -0.695
  241   1HB   ASN  28          HB2       ASN  28  -9.975  -8.510   0.709
  242   2HB   ASN  28          HB1       ASN  28 -11.613  -7.869   0.591
  243   1HD2  ASN  28          HD21      ASN  28 -10.137 -10.290  -0.728
  244   2HD2  ASN  28          HD22      ASN  28 -10.537 -10.139  -2.371
  245    H    GLY  29           HN       GLY  29  -8.578  -6.761   2.066
  246   1HA   GLY  29          HA2       GLY  29 -10.281  -5.782   4.122
  247   2HA   GLY  29          HA1       GLY  29  -8.532  -5.932   4.253
  248    H    ILE  30           HN       ILE  30  -7.816  -4.105   2.175
  249    HA   ILE  30           HA       ILE  30  -7.843  -1.663   3.625
  250    HB   ILE  30           HB       ILE  30  -7.308  -2.156   0.683
  251   1HG1  ILE  30          HG12      ILE  30  -5.393  -1.693   2.988
  252   2HG1  ILE  30          HG11      ILE  30  -5.850  -3.298   2.420
  253   1HG2  ILE  30          HG21      ILE  30  -6.046   0.048   0.926
  254   2HG2  ILE  30          HG22      ILE  30  -6.903   0.271   2.451
  255   3HG2  ILE  30          HG23      ILE  30  -7.805   0.183   0.937
  256   1HD1  ILE  30          HD11      ILE  30  -3.691  -2.309   1.444
  257   2HD1  ILE  30          HD12      ILE  30  -4.733  -1.204   0.550
  258   3HD1  ILE  30          HD13      ILE  30  -4.860  -2.943   0.288
  259    H    TYR  31           HN       TYR  31  -9.950  -2.747   0.943
  260    HA   TYR  31           HA       TYR  31 -11.255  -0.254   0.531
  261   1HB   TYR  31          HB2       TYR  31 -12.142  -3.112   0.184
  262   2HB   TYR  31          HB1       TYR  31 -13.258  -1.795  -0.131
  263    HD1  TYR  31           HD1      TYR  31 -12.033   0.228  -1.546
  264    HD2  TYR  31           HD2      TYR  31 -11.053  -3.944  -1.699
  265    HE1  TYR  31           HE1      TYR  31 -11.052   0.540  -3.787
  266    HE2  TYR  31           HE2      TYR  31 -10.070  -3.631  -3.945
  267    HH   TYR  31           HH       TYR  31 -10.686  -1.295  -5.883
  268    H    GLN  32           HN       GLN  32 -12.048  -2.901   2.778
  269    HA   GLN  32           HA       GLN  32 -14.442  -1.752   3.796
  270   1HB   GLN  32          HB2       GLN  32 -12.388  -3.570   5.073
  271   2HB   GLN  32          HB1       GLN  32 -13.920  -3.155   5.844
  272   1HG   GLN  32          HG2       GLN  32 -15.175  -4.134   4.023
  273   2HG   GLN  32          HG1       GLN  32 -13.706  -4.376   3.079
  274   1HE2  GLN  32          HE21      GLN  32 -15.435  -6.565   3.771
  275   2HE2  GLN  32          HE22      GLN  32 -14.596  -7.585   4.836
  276    H    PHE  33           HN       PHE  33 -11.066  -1.321   4.727
  277    HA   PHE  33           HA       PHE  33 -11.443   0.262   7.049
  278   1HB   PHE  33          HB2       PHE  33  -9.295  -0.747   6.313
  279   2HB   PHE  33          HB1       PHE  33  -9.220   0.420   4.996
  280    HD1  PHE  33           HD1      PHE  33  -8.785   2.794   5.431
  281    HD2  PHE  33           HD2      PHE  33  -8.942  -0.076   8.624
  282    HE1  PHE  33           HE1      PHE  33  -7.701   4.426   6.952
  283    HE2  PHE  33           HE2      PHE  33  -7.863   1.557  10.145
  284    HZ   PHE  33           HZ       PHE  33  -7.240   3.804   9.309
  285    H    ILE  34           HN       ILE  34 -10.936   1.342   3.658
  286    HA   ILE  34           HA       ILE  34 -11.115   4.128   4.224
  287    HB   ILE  34           HB       ILE  34 -11.688   2.583   1.686
  288   1HG1  ILE  34          HG12      ILE  34  -9.335   4.324   2.473
  289   2HG1  ILE  34          HG11      ILE  34  -9.361   2.575   2.697
  290   1HG2  ILE  34          HG21      ILE  34 -11.582   5.558   2.237
  291   2HG2  ILE  34          HG22      ILE  34 -12.855   4.654   1.416
  292   3HG2  ILE  34          HG23      ILE  34 -11.296   4.894   0.629
  293   1HD1  ILE  34          HD11      ILE  34  -9.699   2.249   0.289
  294   2HD1  ILE  34          HD12      ILE  34  -8.251   3.214   0.571
  295   3HD1  ILE  34          HD13      ILE  34  -9.742   3.996   0.044
  296    H    MET  35           HN       MET  35 -13.691   1.899   3.075
  297    HA   MET  35           HA       MET  35 -15.709   3.893   2.934
  298   1HB   MET  35          HB2       MET  35 -15.904   0.923   3.480
  299   2HB   MET  35          HB1       MET  35 -17.314   1.957   3.254
  300   1HG   MET  35          HG2       MET  35 -16.446   2.638   1.035
  301   2HG   MET  35          HG1       MET  35 -15.066   1.564   1.255
  302   1HE   MET  35          HE1       MET  35 -15.249  -0.587  -0.337
  303   2HE   MET  35          HE2       MET  35 -16.138  -1.837   0.531
  304   3HE   MET  35          HE3       MET  35 -15.039  -0.777   1.408
  305    H    ASP  36           HN       ASP  36 -14.655   1.883   5.678
  306    HA   ASP  36           HA       ASP  36 -16.718   2.754   7.473
  307   1HB   ASP  36          HB2       ASP  36 -13.938   1.662   7.952
  308   2HB   ASP  36          HB1       ASP  36 -15.083   1.989   9.253
  309    H    ARG  37           HN       ARG  37 -13.360   3.924   7.009
  310    HA   ARG  37           HA       ARG  37 -13.612   5.978   9.014
  311   1HB   ARG  37          HB2       ARG  37 -11.417   5.124   8.310
  312   2HB   ARG  37          HB1       ARG  37 -11.664   5.804   6.700
  313   1HG   ARG  37          HG2       ARG  37 -11.660   8.042   7.540
  314   2HG   ARG  37          HG1       ARG  37 -11.792   7.490   9.207
  315   1HD   ARG  37          HD2       ARG  37  -9.428   6.682   7.520
  316   2HD   ARG  37          HD1       ARG  37  -9.456   8.245   8.342
  317    HE   ARG  37           HE       ARG  37 -10.121   6.487  10.352
  318   1HH1  ARG  37          HH21      ARG  37  -7.632   6.658   7.972
  319   2HH1  ARG  37          HH22      ARG  37  -6.438   5.904   8.975
  320   1HH2  ARG  37          HH11      ARG  37  -8.581   5.499  11.674
  321   2HH2  ARG  37          HH12      ARG  37  -6.977   5.243  11.072
  322    H    PHE  38           HN       PHE  38 -14.037   6.010   5.478
  323    HA   PHE  38           HA       PHE  38 -15.242   8.752   5.754
  324   1HB   PHE  38          HB2       PHE  38 -13.722   7.687   3.357
  325   2HB   PHE  38          HB1       PHE  38 -14.354   9.316   3.573
  326    HD1  PHE  38           HD1      PHE  38 -13.439  10.731   5.502
  327    HD2  PHE  38           HD2      PHE  38 -11.579   7.094   4.171
  328    HE1  PHE  38           HE1      PHE  38 -11.325  11.406   6.610
  329    HE2  PHE  38           HE2      PHE  38  -9.467   7.769   5.282
  330    HZ   PHE  38           HZ       PHE  38  -9.339   9.924   6.501
  331    HA   PRO  39           HA       PRO  39 -18.474   5.628   4.357
  332   1HB   PRO  39          HB2       PRO  39 -19.992   8.005   5.407
  333   2HB   PRO  39          HB1       PRO  39 -20.361   6.275   5.569
  334   1HG   PRO  39          HG2       PRO  39 -19.289   7.602   7.589
  335   2HG   PRO  39          HG1       PRO  39 -18.751   5.954   7.209
  336   1HD   PRO  39          HD2       PRO  39 -17.345   8.550   6.719
  337   2HD   PRO  39          HD1       PRO  39 -16.663   6.949   7.081
  338    H    PHE  40           HN       PHE  40 -17.424   8.693   3.350
  339    HA   PHE  40           HA       PHE  40 -19.438   9.513   1.528
  340   1HB   PHE  40          HB2       PHE  40 -17.698  11.055   1.946
  341   2HB   PHE  40          HB1       PHE  40 -16.441   9.857   1.659
  342    HD1  PHE  40           HD1      PHE  40 -15.406   9.725  -0.450
  343    HD2  PHE  40           HD2      PHE  40 -19.210  11.697  -0.072
  344    HE1  PHE  40           HE1      PHE  40 -15.262  10.464  -2.813
  345    HE2  PHE  40           HE2      PHE  40 -19.060  12.436  -2.435
  346    HZ   PHE  40           HZ       PHE  40 -17.086  11.820  -3.805
  347    H    TYR  41           HN       TYR  41 -16.766   7.209   1.165
  348    HA   TYR  41           HA       TYR  41 -17.202   6.731  -1.634
  349   1HB   TYR  41          HB2       TYR  41 -15.769   5.130   0.489
  350   2HB   TYR  41          HB1       TYR  41 -15.749   4.732  -1.232
  351    HD1  TYR  41           HD1      TYR  41 -14.650   7.116   1.324
  352    HD2  TYR  41           HD2      TYR  41 -14.703   6.231  -2.869
  353    HE1  TYR  41           HE1      TYR  41 -12.932   8.859   0.938
  354    HE2  TYR  41           HE2      TYR  41 -12.973   7.954  -3.266
  355    HH   TYR  41           HH       TYR  41 -11.481   9.326  -2.268
  356    H    ARG  42           HN       ARG  42 -18.768   5.439   1.224
  357    HA   ARG  42           HA       ARG  42 -19.720   2.983   0.120
  358   1HB   ARG  42          HB2       ARG  42 -20.958   4.885   2.129
  359   2HB   ARG  42          HB1       ARG  42 -21.658   3.319   1.729
  360   1HG   ARG  42          HG2       ARG  42 -19.572   2.208   2.424
  361   2HG   ARG  42          HG1       ARG  42 -18.872   3.773   2.833
  362   1HD   ARG  42          HD2       ARG  42 -20.589   4.153   4.513
  363   2HD   ARG  42          HD1       ARG  42 -21.419   2.670   4.065
  364    HE   ARG  42           HE       ARG  42 -19.167   2.959   5.867
  365   1HH1  ARG  42          HH21      ARG  42 -20.464   0.892   3.430
  366   2HH1  ARG  42          HH22      ARG  42 -19.482  -0.462   3.883
  367   1HH2  ARG  42          HH11      ARG  42 -17.892   1.212   6.464
  368   2HH2  ARG  42          HH12      ARG  42 -18.033  -0.281   5.599
  369    H    GLU  43           HN       GLU  43 -20.953   6.294  -0.060
  370    HA   GLU  43           HA       GLU  43 -23.352   5.650  -1.487
  371   1HB   GLU  43          HB2       GLU  43 -22.951   7.800  -0.276
  372   2HB   GLU  43          HB1       GLU  43 -21.793   8.241  -1.531
  373   1HG   GLU  43          HG2       GLU  43 -23.565   8.077  -3.235
  374   2HG   GLU  43          HG1       GLU  43 -24.729   7.631  -1.985
  375    H    ASN  44           HN       ASN  44 -20.106   6.444  -2.484
  376    HA   ASN  44           HA       ASN  44 -20.869   6.077  -5.359
  377   1HB   ASN  44          HB2       ASN  44 -18.464   7.407  -4.084
  378   2HB   ASN  44          HB1       ASN  44 -18.689   7.206  -5.822
  379   1HD2  ASN  44          HD21      ASN  44 -21.197   7.931  -6.404
  380   2HD2  ASN  44          HD22      ASN  44 -21.587   9.475  -5.814
  381    H    LYS  45           HN       LYS  45 -20.397   4.141  -6.191
  382    HA   LYS  45           HA       LYS  45 -17.998   2.625  -5.205
  383   1HB   LYS  45          HB2       LYS  45 -20.642   1.650  -6.320
  384   2HB   LYS  45          HB1       LYS  45 -19.263   0.606  -5.994
  385   1HG   LYS  45          HG2       LYS  45 -19.333   1.257  -3.611
  386   2HG   LYS  45          HG1       LYS  45 -20.723   2.294  -3.939
  387   1HD   LYS  45          HD2       LYS  45 -22.008   0.333  -4.710
  388   2HD   LYS  45          HD1       LYS  45 -20.623  -0.707  -4.379
  389   1HE   LYS  45          HE2       LYS  45 -22.155  -0.841  -2.499
  390   2HE   LYS  45          HE1       LYS  45 -20.713   0.036  -1.984
  391   1HZ   LYS  45          HZ1       LYS  45 -22.836   1.096  -1.318
  392   2HZ   LYS  45          HZ2       LYS  45 -23.191   1.344  -2.962
  393   3HZ   LYS  45          HZ3       LYS  45 -21.842   2.099  -2.257
  394    H    GLN  46           HN       GLN  46 -18.739   4.640  -7.491
  395    HA   GLN  46           HA       GLN  46 -18.667   3.316  -9.968
  396   1HB   GLN  46          HB2       GLN  46 -17.691   6.065  -9.182
  397   2HB   GLN  46          HB1       GLN  46 -17.792   5.510 -10.855
  398   1HG   GLN  46          HG2       GLN  46 -20.176   5.153 -10.664
  399   2HG   GLN  46          HG1       GLN  46 -20.132   5.481  -8.931
  400   1HE2  GLN  46          HE21      GLN  46 -21.734   7.005 -10.844
  401   2HE2  GLN  46          HE22      GLN  46 -21.145   8.597 -10.833
  402    H    GLY  47           HN       GLY  47 -16.050   5.311 -10.317
  403   1HA   GLY  47          HA2       GLY  47 -14.309   2.997 -10.814
  404   2HA   GLY  47          HA1       GLY  47 -13.987   4.659 -11.284
  405    H    TRP  48           HN       TRP  48 -14.706   5.140  -8.151
  406    HA   TRP  48           HA       TRP  48 -11.965   5.444  -7.414
  407   1HB   TRP  48          HB2       TRP  48 -12.715   6.160  -5.324
  408   2HB   TRP  48          HB1       TRP  48 -14.135   6.458  -6.317
  409    HD1  TRP  48           HD1      TRP  48 -16.265   4.996  -5.897
  410    HE1  TRP  48           HE1      TRP  48 -16.943   3.387  -3.999
  411    HE3  TRP  48           HE3      TRP  48 -11.738   4.342  -3.621
  412    HZ2  TRP  48           HZ2      TRP  48 -15.736   2.011  -1.803
  413    HZ3  TRP  48           HZ3      TRP  48 -11.534   2.884  -1.629
  414    HH2  TRP  48           HH2      TRP  48 -13.528   1.720  -0.715
  415    H    GLN  49           HN       GLN  49 -14.265   2.825  -6.993
  416    HA   GLN  49           HA       GLN  49 -12.724   1.170  -5.272
  417   1HB   GLN  49          HB2       GLN  49 -15.091   0.739  -5.814
  418   2HB   GLN  49          HB1       GLN  49 -14.651   0.389  -7.484
  419   1HG   GLN  49          HG2       GLN  49 -13.358  -1.540  -6.808
  420   2HG   GLN  49          HG1       GLN  49 -13.560  -1.137  -5.102
  421   1HE2  GLN  49          HE21      GLN  49 -15.746  -1.579  -7.959
  422   2HE2  GLN  49          HE22      GLN  49 -16.888  -2.509  -7.116
  423    H    ASN  50           HN       ASN  50 -12.889   1.209  -8.849
  424    HA   ASN  50           HA       ASN  50 -10.842  -0.799  -9.168
  425   1HB   ASN  50          HB2       ASN  50 -11.993   1.279 -11.047
  426   2HB   ASN  50          HB1       ASN  50 -10.819   0.061 -11.551
  427   1HD2  ASN  50          HD21      ASN  50 -12.596  -1.357  -9.115
  428   2HD2  ASN  50          HD22      ASN  50 -13.784  -2.130 -10.049
  429    H    SER  51           HN       SER  51 -10.755   2.765  -9.207
  430    HA   SER  51           HA       SER  51  -8.113   3.107 -10.127
  431   1HB   SER  51          HB2       SER  51  -8.175   5.295  -9.065
  432   2HB   SER  51          HB1       SER  51  -9.747   4.949  -9.778
  433    HG   SER  51           HG       SER  51  -9.656   5.767  -7.518
  434    H    ILE  52           HN       ILE  52  -9.228   2.289  -6.857
  435    HA   ILE  52           HA       ILE  52  -6.769   2.773  -5.507
  436    HB   ILE  52           HB       ILE  52  -8.979   0.774  -5.009
  437   1HG1  ILE  52          HG12      ILE  52  -9.556   3.171  -4.777
  438   2HG1  ILE  52          HG11      ILE  52  -9.647   2.322  -3.241
  439   1HG2  ILE  52          HG21      ILE  52  -7.081  -0.201  -3.951
  440   2HG2  ILE  52          HG22      ILE  52  -7.978   0.626  -2.679
  441   3HG2  ILE  52          HG23      ILE  52  -6.524   1.362  -3.352
  442   1HD1  ILE  52          HD11      ILE  52  -8.511   4.246  -2.629
  443   2HD1  ILE  52          HD12      ILE  52  -7.672   4.376  -4.168
  444   3HD1  ILE  52          HD13      ILE  52  -7.151   3.187  -2.980
  445    H    ARG  53           HN       ARG  53  -7.959  -0.166  -7.129
  446    HA   ARG  53           HA       ARG  53  -5.545  -1.679  -6.592
  447   1HB   ARG  53          HB2       ARG  53  -7.375  -2.330  -8.897
  448   2HB   ARG  53          HB1       ARG  53  -6.587  -3.420  -7.752
  449   1HG   ARG  53          HG2       ARG  53  -8.061  -2.379  -5.956
  450   2HG   ARG  53          HG1       ARG  53  -8.957  -1.620  -7.272
  451   1HD   ARG  53          HD2       ARG  53  -9.294  -3.911  -8.257
  452   2HD   ARG  53          HD1       ARG  53  -8.616  -4.580  -6.764
  453    HE   ARG  53           HE       ARG  53 -10.625  -2.899  -5.876
  454   1HH1  ARG  53          HH21      ARG  53 -10.351  -5.466  -8.158
  455   2HH1  ARG  53          HH22      ARG  53 -11.978  -6.017  -7.938
  456   1HH2  ARG  53          HH11      ARG  53 -12.753  -3.604  -5.570
  457   2HH2  ARG  53          HH12      ARG  53 -13.338  -4.964  -6.468
  458    H    HIS  54           HN       HIS  54  -6.729   0.207  -9.353
  459    HA   HIS  54           HA       HIS  54  -4.726  -0.521 -11.222
  460   1HB   HIS  54          HB2       HIS  54  -6.832   0.813 -11.675
  461   2HB   HIS  54          HB1       HIS  54  -6.008   2.213 -10.989
  462    HD1  HIS  54           HD1      HIS  54  -4.623   3.546 -12.588
  463    HD2  HIS  54           HD2      HIS  54  -5.277  -0.329 -13.980
  464    HE1  HIS  54           HE1      HIS  54  -3.630   3.443 -14.915
  465    H    ASN  55           HN       ASN  55  -4.708   2.036  -8.728
  466    HA   ASN  55           HA       ASN  55  -2.126   3.049  -9.586
  467   1HB   ASN  55          HB2       ASN  55  -2.184   4.383  -7.530
  468   2HB   ASN  55          HB1       ASN  55  -3.737   4.469  -8.361
  469   1HD2  ASN  55          HD21      ASN  55  -5.071   4.785  -6.514
  470   2HD2  ASN  55          HD22      ASN  55  -5.222   3.639  -5.272
  471    H    LEU  56           HN       LEU  56  -3.137   0.468  -7.423
  472    HA   LEU  56           HA       LEU  56  -0.728   0.347  -5.888
  473   1HB   LEU  56          HB2       LEU  56  -2.767  -1.758  -6.590
  474   2HB   LEU  56          HB1       LEU  56  -1.354  -2.133  -5.609
  475    HG   LEU  56           HG       LEU  56  -3.380   0.028  -4.951
  476   1HD1  LEU  56          HD11      LEU  56  -4.331  -1.477  -3.363
  477   2HD1  LEU  56          HD12      LEU  56  -3.011  -2.629  -3.556
  478   3HD1  LEU  56          HD13      LEU  56  -4.183  -2.406  -4.854
  479   1HD2  LEU  56          HD21      LEU  56  -2.152  -0.462  -2.612
  480   2HD2  LEU  56          HD22      LEU  56  -1.517   0.711  -3.757
  481   3HD2  LEU  56          HD23      LEU  56  -0.827  -0.909  -3.686
  482    H    SER  57           HN       SER  57  -1.635  -1.223  -8.955
  483    HA   SER  57           HA       SER  57   0.834  -2.699  -9.171
  484   1HB   SER  57          HB2       SER  57   0.133  -3.210 -11.414
  485   2HB   SER  57          HB1       SER  57  -1.316  -3.200 -10.413
  486    HG   SER  57           HG       SER  57  -1.936  -1.870 -11.957
  487    H    LEU  58           HN       LEU  58  -0.225   0.465 -10.438
  488    HA   LEU  58           HA       LEU  58   2.188   0.906 -11.955
  489   1HB   LEU  58          HB2       LEU  58   0.142   2.833 -10.838
  490   2HB   LEU  58          HB1       LEU  58   1.463   3.319 -11.898
  491    HG   LEU  58           HG       LEU  58  -0.569   1.191 -12.609
  492   1HD1  LEU  58          HD11      LEU  58  -0.519   4.162 -13.172
  493   2HD1  LEU  58          HD12      LEU  58  -1.813   3.220 -12.430
  494   3HD1  LEU  58          HD13      LEU  58  -1.459   3.033 -14.147
  495   1HD2  LEU  58          HD21      LEU  58   1.236   0.821 -14.036
  496   2HD2  LEU  58          HD22      LEU  58   1.718   2.517 -14.049
  497   3HD2  LEU  58          HD23      LEU  58   0.316   1.989 -14.976
  498    H    ASN  59           HN       ASN  59   1.167   1.768  -8.664
  499    HA   ASN  59           HA       ASN  59   3.617   3.239  -8.108
  500   1HB   ASN  59          HB2       ASN  59   1.410   2.151  -6.342
  501   2HB   ASN  59          HB1       ASN  59   2.802   3.028  -5.703
  502   1HD2  ASN  59          HD21      ASN  59   3.136   4.996  -7.715
  503   2HD2  ASN  59          HD22      ASN  59   1.772   6.006  -7.735
  504    H    GLU  60           HN       GLU  60   5.535   2.269  -7.838
  505    HA   GLU  60           HA       GLU  60   5.666  -0.614  -7.212
  506   1HB   GLU  60          HB2       GLU  60   7.848   1.403  -7.830
  507   2HB   GLU  60          HB1       GLU  60   8.070  -0.341  -7.695
  508   1HG   GLU  60          HG2       GLU  60   6.496  -0.695  -9.560
  509   2HG   GLU  60          HG1       GLU  60   6.267   1.048  -9.704
  510    H    CYS  61           HN       CYS  61   5.541   2.254  -5.488
  511    HA   CYS  61           HA       CYS  61   7.504   1.885  -3.456
  512   1HB   CYS  61          HB2       CYS  61   4.769   3.182  -3.387
  513   2HB   CYS  61          HB1       CYS  61   5.898   3.239  -2.034
  514    HG   CYS  61           HG       CYS  61   6.405   5.351  -3.444
  515    H    PHE  62           HN       PHE  62   4.196   0.627  -3.786
  516    HA   PHE  62           HA       PHE  62   4.394  -0.806  -1.216
  517   1HB   PHE  62          HB2       PHE  62   2.259  -1.000  -3.367
  518   2HB   PHE  62          HB1       PHE  62   2.142  -1.592  -1.711
  519    HD1  PHE  62           HD1      PHE  62   2.465   0.138   0.196
  520    HD2  PHE  62           HD2      PHE  62   1.577   1.198  -3.870
  521    HE1  PHE  62           HE1      PHE  62   1.647   2.354   0.952
  522    HE2  PHE  62           HE2      PHE  62   0.762   3.414  -3.115
  523    HZ   PHE  62           HZ       PHE  62   0.798   3.993  -0.704
  524    H    VAL  63           HN       VAL  63   4.569  -3.084  -1.049
  525    HA   VAL  63           HA       VAL  63   5.501  -4.480  -3.544
  526    HB   VAL  63           HB       VAL  63   6.232  -5.099  -0.669
  527   1HG1  VAL  63          HG11      VAL  63   6.374  -6.924  -2.456
  528   2HG1  VAL  63          HG12      VAL  63   7.874  -6.565  -1.602
  529   3HG1  VAL  63          HG13      VAL  63   7.613  -5.934  -3.227
  530   1HG2  VAL  63          HG21      VAL  63   7.719  -3.523  -2.791
  531   2HG2  VAL  63          HG22      VAL  63   8.431  -4.067  -1.273
  532   3HG2  VAL  63          HG23      VAL  63   7.108  -2.901  -1.258
  533    H    LYS  64           HN       LYS  64   4.181  -6.105  -4.195
  534    HA   LYS  64           HA       LYS  64   1.979  -6.987  -2.479
  535   1HB   LYS  64          HB2       LYS  64   1.578  -6.763  -4.869
  536   2HB   LYS  64          HB1       LYS  64   2.893  -7.878  -5.232
  537   1HG   LYS  64          HG2       LYS  64   1.711  -9.745  -4.445
  538   2HG   LYS  64          HG1       LYS  64   0.619  -8.768  -3.466
  539   1HD   LYS  64          HD2       LYS  64  -0.430  -9.717  -5.555
  540   2HD   LYS  64          HD1       LYS  64  -0.534  -7.963  -5.425
  541   1HE   LYS  64          HE2       LYS  64   0.184  -8.889  -7.701
  542   2HE   LYS  64          HE1       LYS  64   1.213  -7.638  -7.010
  543   1HZ   LYS  64          HZ1       LYS  64   2.606  -9.383  -7.774
  544   2HZ   LYS  64          HZ2       LYS  64   1.679 -10.568  -6.985
  545   3HZ   LYS  64          HZ3       LYS  64   2.600  -9.463  -6.081
  546    H    VAL  65           HN       VAL  65   2.021  -8.742  -1.176
  547    HA   VAL  65           HA       VAL  65   4.413 -10.547  -1.293
  548    HB   VAL  65           HB       VAL  65   2.564 -10.009   1.040
  549   1HG1  VAL  65          HG11      VAL  65   5.346 -11.209   0.910
  550   2HG1  VAL  65          HG12      VAL  65   3.862 -12.152   1.046
  551   3HG1  VAL  65          HG13      VAL  65   4.334 -11.056   2.346
  552   1HG2  VAL  65          HG21      VAL  65   5.282  -8.820   0.394
  553   2HG2  VAL  65          HG22      VAL  65   4.370  -8.551   1.880
  554   3HG2  VAL  65          HG23      VAL  65   3.748  -7.951   0.343
  555    HA   PRO  66           HA       PRO  66   1.037 -13.342  -2.771
  556   1HB   PRO  66          HB2       PRO  66   3.410 -15.178  -2.797
  557   2HB   PRO  66          HB1       PRO  66   2.164 -14.931  -4.035
  558   1HG   PRO  66          HG2       PRO  66   4.602 -13.907  -4.316
  559   2HG   PRO  66          HG1       PRO  66   3.165 -13.016  -4.849
  560   1HD   PRO  66          HD2       PRO  66   4.879 -12.551  -2.438
  561   2HD   PRO  66          HD1       PRO  66   3.997 -11.376  -3.438
  562    H    ARG  67           HN       ARG  67   0.311 -15.525  -1.944
  563    HA   ARG  67           HA       ARG  67   0.966 -15.847   0.968
  564   1HB   ARG  67          HB2       ARG  67  -1.389 -15.163   0.316
  565   2HB   ARG  67          HB1       ARG  67  -1.548 -16.735  -0.466
  566   1HG   ARG  67          HG2       ARG  67  -1.155 -17.887   1.620
  567   2HG   ARG  67          HG1       ARG  67  -0.786 -16.375   2.447
  568   1HD   ARG  67          HD2       ARG  67  -3.160 -15.638   1.723
  569   2HD   ARG  67          HD1       ARG  67  -3.456 -17.343   1.409
  570    HE   ARG  67           HE       ARG  67  -3.525 -16.063   3.954
  571   1HH1  ARG  67          HH21      ARG  67  -2.228 -18.899   2.464
  572   2HH1  ARG  67          HH22      ARG  67  -1.959 -19.706   3.969
  573   1HH2  ARG  67          HH11      ARG  67  -3.219 -17.127   5.897
  574   2HH2  ARG  67          HH12      ARG  67  -2.541 -18.721   5.904
  575    H    ASP  68           HN       ASP  68   0.866 -18.131   1.759
  576    HA   ASP  68           HA       ASP  68   2.361 -19.886   0.023
  577   1HB   ASP  68          HB2       ASP  68   1.005 -20.293   2.695
  578   2HB   ASP  68          HB1       ASP  68   1.873 -21.589   1.872
  579    H    ASP  69           HN       ASP  69   1.674 -21.793  -1.008
  580    HA   ASP  69           HA       ASP  69  -1.087 -21.748  -1.949
  581   1HB   ASP  69          HB2       ASP  69   1.075 -23.818  -2.432
  582   2HB   ASP  69          HB1       ASP  69  -0.398 -23.597  -3.377
  583    H    LYS  70           HN       LYS  70   0.598 -23.289   0.616
  584    HA   LYS  70           HA       LYS  70  -0.839 -25.729   0.841
  585   1HB   LYS  70          HB2       LYS  70   0.344 -23.963   3.006
  586   2HB   LYS  70          HB1       LYS  70  -0.185 -25.631   3.244
  587   1HG   LYS  70          HG2       LYS  70   1.405 -26.388   1.516
  588   2HG   LYS  70          HG1       LYS  70   1.937 -24.725   1.276
  589   1HD   LYS  70          HD2       LYS  70   2.700 -24.627   3.620
  590   2HD   LYS  70          HD1       LYS  70   2.170 -26.294   3.861
  591   1HE   LYS  70          HE2       LYS  70   4.613 -26.135   3.369
  592   2HE   LYS  70          HE1       LYS  70   3.740 -27.080   2.163
  593   1HZ   LYS  70          HZ1       LYS  70   5.349 -25.369   1.291
  594   2HZ   LYS  70          HZ2       LYS  70   4.262 -24.183   1.838
  595   3HZ   LYS  70          HZ3       LYS  70   3.779 -25.300   0.654
  596    H    LYS  71           HN       LYS  71  -1.597 -22.472   2.031
  597    HA   LYS  71           HA       LYS  71  -4.358 -23.418   2.710
  598   1HB   LYS  71          HB2       LYS  71  -3.286 -22.788   4.749
  599   2HB   LYS  71          HB1       LYS  71  -2.560 -21.365   4.012
  600   1HG   LYS  71          HG2       LYS  71  -4.518 -20.139   4.095
  601   2HG   LYS  71          HG1       LYS  71  -5.551 -21.557   3.970
  602   1HD   LYS  71          HD2       LYS  71  -3.883 -21.253   6.450
  603   2HD   LYS  71          HD1       LYS  71  -5.292 -20.212   6.273
  604   1HE   LYS  71          HE2       LYS  71  -5.707 -22.413   7.476
  605   2HE   LYS  71          HE1       LYS  71  -6.775 -22.081   6.111
  606   1HZ   LYS  71          HZ1       LYS  71  -5.453 -23.490   4.722
  607   2HZ   LYS  71          HZ2       LYS  71  -5.878 -24.359   6.119
  608   3HZ   LYS  71          HZ3       LYS  71  -4.309 -23.726   5.953
  609    HA   PRO  72           HA       PRO  72  -4.629 -20.199  -0.599
  610   1HB   PRO  72          HB2       PRO  72  -6.288 -21.483  -2.290
  611   2HB   PRO  72          HB1       PRO  72  -4.563 -21.896  -2.200
  612   1HG   PRO  72          HG2       PRO  72  -6.907 -23.306  -1.007
  613   2HG   PRO  72          HG1       PRO  72  -5.466 -23.981  -1.787
  614   1HD   PRO  72          HD2       PRO  72  -5.811 -23.771   0.970
  615   2HD   PRO  72          HD1       PRO  72  -4.232 -23.913   0.166
  616    H    GLY  73           HN       GLY  73  -6.263 -18.642  -0.838
  617   1HA   GLY  73          HA2       GLY  73  -9.020 -18.910  -0.558
  618   2HA   GLY  73          HA1       GLY  73  -8.426 -18.694   1.090
  619    H    LYS  74           HN       LYS  74  -6.215 -16.976   0.382
  620    HA   LYS  74           HA       LYS  74  -7.710 -14.482  -0.384
  621   1HB   LYS  74          HB2       LYS  74  -5.184 -14.646   1.273
  622   2HB   LYS  74          HB1       LYS  74  -6.267 -13.270   1.088
  623   1HG   LYS  74          HG2       LYS  74  -8.078 -14.611   2.180
  624   2HG   LYS  74          HG1       LYS  74  -6.899 -15.888   2.476
  625   1HD   LYS  74          HD2       LYS  74  -5.484 -14.039   3.622
  626   2HD   LYS  74          HD1       LYS  74  -6.974 -13.099   3.626
  627   1HE   LYS  74          HE2       LYS  74  -8.112 -14.767   4.945
  628   2HE   LYS  74          HE1       LYS  74  -6.755 -15.885   4.794
  629   1HZ   LYS  74          HZ1       LYS  74  -5.669 -13.565   5.774
  630   2HZ   LYS  74          HZ2       LYS  74  -5.972 -14.991   6.647
  631   3HZ   LYS  74          HZ3       LYS  74  -7.123 -13.741   6.629
  632    H    GLY  75           HN       GLY  75  -6.553 -12.992  -1.762
  633   1HA   GLY  75          HA2       GLY  75  -4.878 -14.283  -3.730
  634   2HA   GLY  75          HA1       GLY  75  -5.252 -12.561  -3.674
  635    H    SER  76           HN       SER  76  -3.989 -11.253  -2.072
  636    HA   SER  76           HA       SER  76  -1.509 -12.430  -1.030
  637   1HB   SER  76          HB2       SER  76  -0.844 -12.060  -3.343
  638   2HB   SER  76          HB1       SER  76  -1.466 -10.414  -3.294
  639    HG   SER  76           HG       SER  76   0.923 -10.967  -2.847
  640    H    TYR  77           HN       TYR  77  -0.142 -10.619   0.003
  641    HA   TYR  77           HA       TYR  77  -1.988  -8.603   1.236
  642   1HB   TYR  77          HB2       TYR  77   0.715  -9.317   2.361
  643   2HB   TYR  77          HB1       TYR  77  -0.710  -8.707   3.192
  644    HD1  TYR  77           HD1      TYR  77  -2.883 -10.345   2.767
  645    HD2  TYR  77           HD2      TYR  77   1.245 -11.528   2.832
  646    HE1  TYR  77           HE1      TYR  77  -3.554 -12.664   3.342
  647    HE2  TYR  77           HE2      TYR  77   0.575 -13.847   3.394
  648    HH   TYR  77           HH       TYR  77  -1.617 -14.871   4.622
  649    H    TRP  78           HN       TRP  78  -1.064  -6.470   1.650
  650    HA   TRP  78           HA       TRP  78   1.150  -5.723  -0.242
  651   1HB   TRP  78          HB2       TRP  78  -1.357  -4.209   0.541
  652   2HB   TRP  78          HB1       TRP  78  -0.003  -3.473  -0.318
  653    HD1  TRP  78           HD1      TRP  78  -2.814  -6.024  -0.757
  654    HE1  TRP  78           HE1      TRP  78  -3.071  -6.540  -3.272
  655    HE3  TRP  78           HE3      TRP  78   1.252  -3.541  -2.591
  656    HZ2  TRP  78           HZ2      TRP  78  -1.721  -5.971  -5.741
  657    HZ3  TRP  78           HZ3      TRP  78   1.744  -3.540  -5.016
  658    HH2  TRP  78           HH2      TRP  78   0.266  -4.750  -6.593
  659    H    THR  79           HN       THR  79   2.835  -4.594   0.684
  660    HA   THR  79           HA       THR  79   2.451  -3.269   3.300
  661    HB   THR  79           HB       THR  79   3.007  -5.591   3.910
  662    HG1  THR  79           HG1      THR  79   5.057  -5.027   4.986
  663   1HG2  THR  79          HG21      THR  79   5.141  -6.574   3.244
  664   2HG2  THR  79          HG22      THR  79   5.548  -5.126   2.323
  665   3HG2  THR  79          HG23      THR  79   4.210  -6.153   1.808
  666    H    LEU  80           HN       LEU  80   4.342  -1.955   3.896
  667    HA   LEU  80           HA       LEU  80   5.528  -0.688   1.548
  668   1HB   LEU  80          HB2       LEU  80   6.073  -0.248   4.503
  669   2HB   LEU  80          HB1       LEU  80   6.567   0.825   3.196
  670    HG   LEU  80           HG       LEU  80   3.662   0.096   3.591
  671   1HD1  LEU  80          HD11      LEU  80   4.303   0.997   5.726
  672   2HD1  LEU  80          HD12      LEU  80   3.488   2.288   4.843
  673   3HD1  LEU  80          HD13      LEU  80   5.248   2.277   4.965
  674   1HD2  LEU  80          HD21      LEU  80   3.385   2.362   2.522
  675   2HD2  LEU  80          HD22      LEU  80   4.182   1.184   1.482
  676   3HD2  LEU  80          HD23      LEU  80   5.132   2.421   2.306
  677    H    ASP  81           HN       ASP  81   7.907  -0.444   1.298
  678    HA   ASP  81           HA       ASP  81   9.257  -2.990   1.659
  679   1HB   ASP  81          HB2       ASP  81  10.452  -0.349   0.788
  680   2HB   ASP  81          HB1       ASP  81  11.112  -1.959   0.497
  681    HA   PRO  82           HA       PRO  82  10.667  -1.978   5.874
  682   1HB   PRO  82          HB2       PRO  82  12.914  -3.812   5.069
  683   2HB   PRO  82          HB1       PRO  82  11.954  -3.798   6.561
  684   1HG   PRO  82          HG2       PRO  82  11.505  -5.602   4.667
  685   2HG   PRO  82          HG1       PRO  82  10.166  -4.877   5.574
  686   1HD   PRO  82          HD2       PRO  82  11.030  -4.354   2.754
  687   2HD   PRO  82          HD1       PRO  82   9.401  -4.301   3.475
  688    H    ASP  83           HN       ASP  83  13.524  -2.612   3.864
  689    HA   ASP  83           HA       ASP  83  14.220   0.221   3.663
  690   1HB   ASP  83          HB2       ASP  83  15.006  -0.575   5.992
  691   2HB   ASP  83          HB1       ASP  83  16.166  -1.582   5.125
  692    H    SER  84           HN       SER  84  13.648  -1.843   1.803
  693    HA   SER  84           HA       SER  84  15.786  -3.313   0.780
  694   1HB   SER  84          HB2       SER  84  13.576  -1.845  -0.678
  695   2HB   SER  84          HB1       SER  84  14.696  -2.937  -1.487
  696    HG   SER  84           HG       SER  84  12.581  -3.469   0.188
  697    H    TYR  85           HN       TYR  85  17.744  -2.106   1.091
  698    HA   TYR  85           HA       TYR  85  18.116   0.528  -0.022
  699   1HB   TYR  85          HB2       TYR  85  19.458  -0.663   1.850
  700   2HB   TYR  85          HB1       TYR  85  20.351  -1.426   0.536
  701    HD1  TYR  85           HD1      TYR  85  19.711   1.666   2.362
  702    HD2  TYR  85           HD2      TYR  85  21.664  -0.039  -1.065
  703    HE1  TYR  85           HE1      TYR  85  21.072   3.729   2.107
  704    HE2  TYR  85           HE2      TYR  85  23.023   2.021  -1.318
  705    HH   TYR  85           HH       TYR  85  23.523   4.006  -0.470
  706    H    ASN  86           HN       ASN  86  19.167  -2.713  -1.110
  707    HA   ASN  86           HA       ASN  86  19.104  -1.760  -3.917
  708   1HB   ASN  86          HB2       ASN  86  21.412  -1.298  -3.124
  709   2HB   ASN  86          HB1       ASN  86  21.565  -2.990  -2.646
  710   1HD2  ASN  86          HD21      ASN  86  20.586  -1.126  -5.590
  711   2HD2  ASN  86          HD22      ASN  86  21.390  -2.149  -6.680
  712    H    MET  87           HN       MET  87  17.643  -3.692  -2.207
  713    HA   MET  87           HA       MET  87  18.498  -6.345  -3.135
  714   1HB   MET  87          HB2       MET  87  16.053  -5.445  -1.584
  715   2HB   MET  87          HB1       MET  87  16.518  -7.127  -1.864
  716   1HG   MET  87          HG2       MET  87  18.669  -6.722  -0.726
  717   2HG   MET  87          HG1       MET  87  18.204  -5.046  -0.443
  718   1HE   MET  87          HE1       MET  87  19.282  -6.440   1.583
  719   2HE   MET  87          HE2       MET  87  18.263  -6.924   2.938
  720   3HE   MET  87          HE3       MET  87  18.313  -5.235   2.439
  721    H    PHE  88           HN       PHE  88  17.707  -7.394  -4.889
  722    HA   PHE  88           HA       PHE  88  15.674  -5.996  -6.553
  723   1HB   PHE  88          HB2       PHE  88  17.462  -8.362  -7.197
  724   2HB   PHE  88          HB1       PHE  88  16.430  -7.502  -8.339
  725    HD1  PHE  88           HD1      PHE  88  16.837  -4.998  -8.700
  726    HD2  PHE  88           HD2      PHE  88  19.641  -7.573  -6.706
  727    HE1  PHE  88           HE1      PHE  88  18.637  -3.336  -9.082
  728    HE2  PHE  88           HE2      PHE  88  21.440  -5.908  -7.089
  729    HZ   PHE  88           HZ       PHE  88  20.938  -3.791  -8.278
  730    H    GLU  89           HN       GLU  89  15.684  -8.280  -4.170
  731    HA   GLU  89           HA       GLU  89  13.171  -9.506  -5.201
  732   1HB   GLU  89          HB2       GLU  89  13.932 -11.715  -4.333
  733   2HB   GLU  89          HB1       GLU  89  14.916 -11.134  -5.673
  734   1HG   GLU  89          HG2       GLU  89  15.718 -10.581  -2.810
  735   2HG   GLU  89          HG1       GLU  89  16.143 -12.096  -3.599
  736    H    ASN  90           HN       ASN  90  11.840 -10.405  -3.473
  737    HA   ASN  90           HA       ASN  90  12.452  -9.290  -0.752
  738   1HB   ASN  90          HB2       ASN  90  10.668  -8.007  -1.984
  739   2HB   ASN  90          HB1       ASN  90   9.716  -9.491  -2.046
  740   1HD2  ASN  90          HD21      ASN  90   8.104  -9.306  -0.477
  741   2HD2  ASN  90          HD22      ASN  90   8.358  -8.769   1.114
  742    H    GLY  91           HN       GLY  91  12.367 -10.819   0.832
  743   1HA   GLY  91          HA2       GLY  91  10.504 -13.002   0.857
  744   2HA   GLY  91          HA1       GLY  91  12.077 -13.572   0.300
  745    H    SER  92           HN       SER  92  13.783 -13.707   1.782
  746    HA   SER  92           HA       SER  92  13.022 -13.343   4.654
  747   1HB   SER  92          HB2       SER  92  13.677 -15.622   4.064
  748   2HB   SER  92          HB1       SER  92  15.173 -15.034   3.343
  749    HG   SER  92           HG       SER  92  15.513 -14.085   5.545
  750    H    PHE  93           HN       PHE  93  13.529 -11.091   4.735
  751    HA   PHE  93           HA       PHE  93  16.381 -10.341   4.241
  752   1HB   PHE  93          HB2       PHE  93  15.497  -7.998   4.521
  753   2HB   PHE  93          HB1       PHE  93  14.794  -8.868   3.157
  754    HD1  PHE  93           HD1      PHE  93  12.484  -9.665   3.215
  755    HD2  PHE  93           HD2      PHE  93  14.191  -7.559   6.547
  756    HE1  PHE  93           HE1      PHE  93  10.220  -9.360   4.180
  757    HE2  PHE  93           HE2      PHE  93  11.928  -7.252   7.511
  758    HZ   PHE  93           HZ       PHE  93   9.941  -8.152   6.329
  759    H    LEU  94           HN       LEU  94  17.698  -9.979   5.965
  760    HA   LEU  94           HA       LEU  94  16.466  -9.893   8.702
  761   1HB   LEU  94          HB2       LEU  94  19.285 -10.661   7.880
  762   2HB   LEU  94          HB1       LEU  94  18.618 -10.736   9.510
  763    HG   LEU  94           HG       LEU  94  17.612 -12.317   7.125
  764   1HD1  LEU  94          HD11      LEU  94  19.825 -13.045   7.991
  765   2HD1  LEU  94          HD12      LEU  94  18.571 -14.249   8.288
  766   3HD1  LEU  94          HD13      LEU  94  19.123 -13.208   9.602
  767   1HD2  LEU  94          HD21      LEU  94  15.725 -12.073   8.496
  768   2HD2  LEU  94          HD22      LEU  94  16.680 -12.022   9.978
  769   3HD2  LEU  94          HD23      LEU  94  16.438 -13.551   9.135
  Start of MODEL   12
    1   1H    MET   1          HT1       MET   1 -24.102  18.831   4.435
    2   2H    MET   1          HT2       MET   1 -22.789  17.988   5.107
    3   3H    MET   1          HT3       MET   1 -24.348  17.314   5.151
    4    HA   MET   1           HA       MET   1 -24.259  16.568   3.048
    5   1HB   MET   1          HB2       MET   1 -22.616  19.053   2.509
    6   2HB   MET   1          HB1       MET   1 -22.967  17.840   1.277
    7   1HG   MET   1          HG2       MET   1 -25.393  18.164   1.666
    8   2HG   MET   1          HG1       MET   1 -25.026  19.411   2.856
    9   1HE   MET   1          HE1       MET   1 -23.736  22.366   1.047
   10   2HE   MET   1          HE2       MET   1 -22.555  21.138   1.487
   11   3HE   MET   1          HE3       MET   1 -23.931  21.448   2.544
   12    H    LEU   2           HN       LEU   2 -22.815  15.058   2.093
   13    HA   LEU   2           HA       LEU   2 -20.382  14.547   3.678
   14   1HB   LEU   2          HB2       LEU   2 -21.464  12.995   1.311
   15   2HB   LEU   2          HB1       LEU   2 -20.313  12.429   2.520
   16    HG   LEU   2           HG       LEU   2 -23.212  13.166   3.005
   17   1HD1  LEU   2          HD11      LEU   2 -22.584  10.930   1.878
   18   2HD1  LEU   2          HD12      LEU   2 -23.603  10.852   3.313
   19   3HD1  LEU   2          HD13      LEU   2 -21.883  10.489   3.435
   20   1HD2  LEU   2          HD21      LEU   2 -22.580  12.110   5.320
   21   2HD2  LEU   2          HD22      LEU   2 -22.145  13.787   5.003
   22   3HD2  LEU   2          HD23      LEU   2 -20.926  12.520   4.865
   23    H    VAL   3           HN       VAL   3 -18.280  14.608   2.858
   24    HA   VAL   3           HA       VAL   3 -17.893  15.430   0.026
   25    HB   VAL   3           HB       VAL   3 -16.255  16.853   2.100
   26   1HG1  VAL   3          HG11      VAL   3 -16.324  18.635   0.396
   27   2HG1  VAL   3          HG12      VAL   3 -17.414  17.654  -0.584
   28   3HG1  VAL   3          HG13      VAL   3 -15.760  17.113  -0.294
   29   1HG2  VAL   3          HG21      VAL   3 -18.007  18.673   2.121
   30   2HG2  VAL   3          HG22      VAL   3 -18.476  17.208   2.983
   31   3HG2  VAL   3          HG23      VAL   3 -19.119  17.529   1.372
   32    H    LYS   4           HN       LYS   4 -15.561  15.227  -0.592
   33    HA   LYS   4           HA       LYS   4 -14.457  12.765   0.593
   34   1HB   LYS   4          HB2       LYS   4 -13.824  14.404  -1.862
   35   2HB   LYS   4          HB1       LYS   4 -12.729  13.135  -1.315
   36   1HG   LYS   4          HG2       LYS   4 -14.399  12.366  -3.030
   37   2HG   LYS   4          HG1       LYS   4 -14.461  11.460  -1.519
   38   1HD   LYS   4          HD2       LYS   4 -16.415  12.617  -0.786
   39   2HD   LYS   4          HD1       LYS   4 -16.250  13.842  -2.044
   40   1HE   LYS   4          HE2       LYS   4 -16.566  11.966  -3.741
   41   2HE   LYS   4          HE1       LYS   4 -17.015  10.933  -2.384
   42   1HZ   LYS   4          HZ1       LYS   4 -18.536  13.062  -1.916
   43   2HZ   LYS   4          HZ2       LYS   4 -19.052  11.730  -2.835
   44   3HZ   LYS   4          HZ3       LYS   4 -18.469  13.125  -3.609
   45    HA   PRO   5           HA       PRO   5 -11.455  15.015   2.993
   46   1HB   PRO   5          HB2       PRO   5  -9.576  13.127   3.436
   47   2HB   PRO   5          HB1       PRO   5 -11.205  12.996   4.127
   48   1HG   PRO   5          HG2       PRO   5 -10.101  11.711   1.661
   49   2HG   PRO   5          HG1       PRO   5 -11.040  10.980   2.976
   50   1HD   PRO   5          HD2       PRO   5 -12.199  11.751   0.631
   51   2HD   PRO   5          HD1       PRO   5 -13.058  11.821   2.186
   52    HA   PRO   6           HA       PRO   6  -8.320  16.550   0.244
   53   1HB   PRO   6          HB2       PRO   6  -6.451  17.524   1.963
   54   2HB   PRO   6          HB1       PRO   6  -8.063  18.249   1.805
   55   1HG   PRO   6          HG2       PRO   6  -7.057  16.332   3.868
   56   2HG   PRO   6          HG1       PRO   6  -8.018  17.807   4.082
   57   1HD   PRO   6          HD2       PRO   6  -9.148  15.321   4.071
   58   2HD   PRO   6          HD1       PRO   6 -10.006  16.761   3.483
   59    H    TYR   7           HN       TYR   7  -7.695  13.725   1.990
   60    HA   TYR   7           HA       TYR   7  -4.847  13.492   1.505
   61   1HB   TYR   7          HB2       TYR   7  -6.829  11.227   1.842
   62   2HB   TYR   7          HB1       TYR   7  -5.099  11.186   2.166
   63    HD1  TYR   7           HD1      TYR   7  -4.353  13.311   3.773
   64    HD2  TYR   7           HD2      TYR   7  -8.161  11.321   3.751
   65    HE1  TYR   7           HE1      TYR   7  -4.777  14.089   6.088
   66    HE2  TYR   7           HE2      TYR   7  -8.587  12.107   6.059
   67    HH   TYR   7           HH       TYR   7  -6.896  14.540   7.516
   68    H    SER   8           HN       SER   8  -3.802  12.481  -0.230
   69    HA   SER   8           HA       SER   8  -5.278  12.392  -2.746
   70   1HB   SER   8          HB2       SER   8  -3.164  11.936  -3.766
   71   2HB   SER   8          HB1       SER   8  -2.817  13.054  -2.449
   72    HG   SER   8           HG       SER   8  -2.164  10.383  -2.761
   73    H    TYR   9           HN       TYR   9  -5.262  10.360  -4.118
   74    HA   TYR   9           HA       TYR   9  -6.407   8.165  -2.705
   75   1HB   TYR   9          HB2       TYR   9  -5.139   8.281  -5.456
   76   2HB   TYR   9          HB1       TYR   9  -6.016   6.882  -4.840
   77    HD1  TYR   9           HD1      TYR   9  -8.451   7.018  -4.374
   78    HD2  TYR   9           HD2      TYR   9  -6.292  10.308  -6.100
   79    HE1  TYR   9           HE1      TYR   9 -10.591   8.064  -5.049
   80    HE2  TYR   9           HE2      TYR   9  -8.435  11.356  -6.776
   81    HH   TYR   9           HH       TYR   9 -11.381  10.468  -5.543
   82    H    ILE  10           HN       ILE  10  -3.104   8.770  -3.842
   83    HA   ILE  10           HA       ILE  10  -2.030   6.208  -3.104
   84    HB   ILE  10           HB       ILE  10  -0.668   8.918  -3.242
   85   1HG1  ILE  10          HG12      ILE  10  -1.724   8.367  -5.366
   86   2HG1  ILE  10          HG11      ILE  10   0.019   8.163  -5.517
   87   1HG2  ILE  10          HG21      ILE  10   1.360   7.444  -3.717
   88   2HG2  ILE  10          HG22      ILE  10   0.391   6.091  -3.134
   89   3HG2  ILE  10          HG23      ILE  10   0.768   7.434  -2.056
   90   1HD1  ILE  10          HD11      ILE  10  -2.137   6.081  -5.443
   91   2HD1  ILE  10          HD12      ILE  10  -0.532   5.655  -4.851
   92   3HD1  ILE  10          HD13      ILE  10  -0.742   6.210  -6.510
   93    H    ALA  11           HN       ALA  11  -2.371   9.285  -1.367
   94    HA   ALA  11           HA       ALA  11  -0.935   8.486   0.985
   95   1HB   ALA  11          HB1       ALA  11  -1.493  10.847   0.460
   96   2HB   ALA  11          HB2       ALA  11  -2.072  10.391   2.062
   97   3HB   ALA  11          HB3       ALA  11  -3.202  10.493   0.711
   98    H    LEU  12           HN       LEU  12  -4.386   8.262   0.109
   99    HA   LEU  12           HA       LEU  12  -5.308   7.345   2.642
  100   1HB   LEU  12          HB2       LEU  12  -6.308   6.810  -0.162
  101   2HB   LEU  12          HB1       LEU  12  -7.171   6.288   1.283
  102    HG   LEU  12           HG       LEU  12  -6.357   9.162   0.755
  103   1HD1  LEU  12          HD11      LEU  12  -9.009   7.771   0.272
  104   2HD1  LEU  12          HD12      LEU  12  -7.938   8.437  -0.961
  105   3HD1  LEU  12          HD13      LEU  12  -8.750   9.513   0.174
  106   1HD2  LEU  12          HD21      LEU  12  -8.397   9.378   2.460
  107   2HD2  LEU  12          HD22      LEU  12  -6.766   9.077   3.043
  108   3HD2  LEU  12          HD23      LEU  12  -7.911   7.744   2.907
  109    H    ILE  13           HN       ILE  13  -3.942   5.576  -0.119
  110    HA   ILE  13           HA       ILE  13  -4.328   2.952   0.987
  111    HB   ILE  13           HB       ILE  13  -2.180   3.995  -0.889
  112   1HG1  ILE  13          HG12      ILE  13  -4.700   2.438  -1.508
  113   2HG1  ILE  13          HG11      ILE  13  -4.612   4.198  -1.603
  114   1HG2  ILE  13          HG21      ILE  13  -1.373   1.933  -0.022
  115   2HG2  ILE  13          HG22      ILE  13  -2.145   1.502  -1.548
  116   3HG2  ILE  13          HG23      ILE  13  -2.982   1.211  -0.023
  117   1HD1  ILE  13          HD11      ILE  13  -2.633   3.902  -3.172
  118   2HD1  ILE  13          HD12      ILE  13  -4.185   3.372  -3.819
  119   3HD1  ILE  13          HD13      ILE  13  -3.028   2.184  -3.219
  120    H    THR  14           HN       THR  14  -1.660   5.282   1.130
  121    HA   THR  14           HA       THR  14   0.138   3.727   2.682
  122    HB   THR  14           HB       THR  14  -0.243   6.731   2.645
  123    HG1  THR  14           HG1      THR  14   1.235   4.909   1.078
  124   1HG2  THR  14          HG21      THR  14   1.114   6.160   4.535
  125   2HG2  THR  14          HG22      THR  14   2.220   6.673   3.262
  126   3HG2  THR  14          HG23      THR  14   2.008   4.957   3.606
  127    H    MET  15           HN       MET  15  -2.502   5.894   3.628
  128    HA   MET  15           HA       MET  15  -2.002   5.752   6.458
  129   1HB   MET  15          HB2       MET  15  -4.479   6.441   4.860
  130   2HB   MET  15          HB1       MET  15  -4.404   6.550   6.619
  131   1HG   MET  15          HG2       MET  15  -2.504   8.115   6.443
  132   2HG   MET  15          HG1       MET  15  -2.577   8.010   4.685
  133   1HE   MET  15          HE1       MET  15  -3.706  11.491   6.067
  134   2HE   MET  15          HE2       MET  15  -3.240  11.011   4.438
  135   3HE   MET  15          HE3       MET  15  -2.330  10.408   5.821
  136    H    ALA  16           HN       ALA  16  -4.055   3.870   4.259
  137    HA   ALA  16           HA       ALA  16  -5.445   2.361   6.219
  138   1HB   ALA  16          HB1       ALA  16  -6.163   2.282   3.927
  139   2HB   ALA  16          HB2       ALA  16  -5.652   0.649   4.356
  140   3HB   ALA  16          HB3       ALA  16  -4.591   1.684   3.396
  141    H    ILE  17           HN       ILE  17  -2.355   1.610   4.560
  142    HA   ILE  17           HA       ILE  17  -1.932  -0.921   5.796
  143    HB   ILE  17           HB       ILE  17   0.196   1.101   5.024
  144   1HG1  ILE  17          HG12      ILE  17  -0.969  -1.093   3.295
  145   2HG1  ILE  17          HG11      ILE  17  -1.551   0.571   3.239
  146   1HG2  ILE  17          HG21      ILE  17   1.449  -1.074   4.538
  147   2HG2  ILE  17          HG22      ILE  17   0.162  -1.900   5.416
  148   3HG2  ILE  17          HG23      ILE  17   1.172  -0.713   6.242
  149   1HD1  ILE  17          HD11      ILE  17   0.570   1.399   2.528
  150   2HD1  ILE  17          HD12      ILE  17   0.260  -0.027   1.537
  151   3HD1  ILE  17          HD13      ILE  17   1.370  -0.127   2.904
  152    H    GLN  18           HN       GLN  18  -0.707   2.294   6.718
  153    HA   GLN  18           HA       GLN  18   0.517   1.378   9.164
  154   1HB   GLN  18          HB2       GLN  18  -0.290   4.127   8.190
  155   2HB   GLN  18          HB1       GLN  18   0.567   3.853   9.708
  156   1HG   GLN  18          HG2       GLN  18   2.444   2.874   8.562
  157   2HG   GLN  18          HG1       GLN  18   1.565   2.844   7.032
  158   1HE2  GLN  18          HE21      GLN  18   4.125   4.266   7.606
  159   2HE2  GLN  18          HE22      GLN  18   3.823   5.908   7.299
  160    H    ASN  19           HN       ASN  19  -2.622   2.864   8.430
  161    HA   ASN  19           HA       ASN  19  -3.468   3.176  11.146
  162   1HB   ASN  19          HB2       ASN  19  -5.041   2.812   8.582
  163   2HB   ASN  19          HB1       ASN  19  -5.786   3.161  10.141
  164   1HD2  ASN  19          HD21      ASN  19  -2.825   4.664  10.243
  165   2HD2  ASN  19          HD22      ASN  19  -3.273   6.204   9.687
  166    H    ALA  20           HN       ALA  20  -3.537   0.457   8.915
  167    HA   ALA  20           HA       ALA  20  -5.248  -1.186  10.594
  168   1HB   ALA  20          HB1       ALA  20  -4.893  -2.887   8.987
  169   2HB   ALA  20          HB2       ALA  20  -3.337  -2.215   8.489
  170   3HB   ALA  20          HB3       ALA  20  -4.838  -1.392   8.054
  171    HA   PRO  21           HA       PRO  21  -1.846  -1.989  13.545
  172   1HB   PRO  21          HB2       PRO  21  -3.570  -4.395  14.066
  173   2HB   PRO  21          HB1       PRO  21  -2.804  -3.288  15.224
  174   1HG   PRO  21          HG2       PRO  21  -5.410  -3.136  14.683
  175   2HG   PRO  21          HG1       PRO  21  -4.441  -1.684  14.981
  176   1HD   PRO  21          HD2       PRO  21  -5.551  -2.702  12.403
  177   2HD   PRO  21          HD1       PRO  21  -5.184  -1.034  12.895
  178    H    GLU  22           HN       GLU  22  -3.270  -4.333  11.336
  179    HA   GLU  22           HA       GLU  22  -0.731  -5.898  11.252
  180   1HB   GLU  22          HB2       GLU  22  -2.869  -7.138  11.528
  181   2HB   GLU  22          HB1       GLU  22  -3.452  -6.447  10.015
  182   1HG   GLU  22          HG2       GLU  22  -1.606  -7.521   8.796
  183   2HG   GLU  22          HG1       GLU  22  -0.988  -8.191  10.306
  184    H    LYS  23           HN       LYS  23   0.691  -5.100   9.753
  185    HA   LYS  23           HA       LYS  23  -0.130  -3.341   7.623
  186   1HB   LYS  23          HB2       LYS  23   2.462  -4.830   8.125
  187   2HB   LYS  23          HB1       LYS  23   2.238  -3.696   6.793
  188   1HG   LYS  23          HG2       LYS  23   1.676  -1.912   8.402
  189   2HG   LYS  23          HG1       LYS  23   1.904  -3.045   9.736
  190   1HD   LYS  23          HD2       LYS  23   4.251  -3.382   9.056
  191   2HD   LYS  23          HD1       LYS  23   4.027  -2.247   7.723
  192   1HE   LYS  23          HE2       LYS  23   3.320  -0.537   9.492
  193   2HE   LYS  23          HE1       LYS  23   3.955  -1.667  10.689
  194   1HZ   LYS  23          HZ1       LYS  23   5.669  -1.054   8.414
  195   2HZ   LYS  23          HZ2       LYS  23   6.074  -1.310  10.043
  196   3HZ   LYS  23          HZ3       LYS  23   5.444   0.187   9.548
  197    H    LYS  24           HN       LYS  24   0.331  -6.820   7.837
  198    HA   LYS  24           HA       LYS  24   0.342  -7.189   4.938
  199   1HB   LYS  24          HB2       LYS  24  -0.051  -9.136   7.235
  200   2HB   LYS  24          HB1       LYS  24   0.042  -9.615   5.538
  201   1HG   LYS  24          HG2       LYS  24   2.288  -8.605   5.371
  202   2HG   LYS  24          HG1       LYS  24   2.200  -8.130   7.067
  203   1HD   LYS  24          HD2       LYS  24   1.983 -10.494   7.727
  204   2HD   LYS  24          HD1       LYS  24   2.067 -10.980   6.035
  205   1HE   LYS  24          HE2       LYS  24   4.323 -10.271   5.831
  206   2HE   LYS  24          HE1       LYS  24   4.251  -9.336   7.325
  207   1HZ   LYS  24          HZ1       LYS  24   4.523 -12.226   6.946
  208   2HZ   LYS  24          HZ2       LYS  24   3.668 -11.681   8.309
  209   3HZ   LYS  24          HZ3       LYS  24   5.281 -11.205   8.070
  210    H    ILE  25           HN       ILE  25  -1.631  -5.807   4.667
  211    HA   ILE  25           HA       ILE  25  -4.181  -7.187   5.370
  212    HB   ILE  25           HB       ILE  25  -3.966  -4.769   5.927
  213   1HG1  ILE  25          HG12      ILE  25  -5.944  -5.112   3.664
  214   2HG1  ILE  25          HG11      ILE  25  -6.154  -5.936   5.209
  215   1HG2  ILE  25          HG21      ILE  25  -3.814  -3.111   4.175
  216   2HG2  ILE  25          HG22      ILE  25  -3.895  -4.351   2.925
  217   3HG2  ILE  25          HG23      ILE  25  -2.474  -4.238   3.962
  218   1HD1  ILE  25          HD11      ILE  25  -7.357  -3.737   5.079
  219   2HD1  ILE  25          HD12      ILE  25  -5.791  -2.941   4.924
  220   3HD1  ILE  25          HD13      ILE  25  -6.190  -3.824   6.398
  221    H    THR  26           HN       THR  26  -5.648  -7.769   3.740
  222    HA   THR  26           HA       THR  26  -4.418  -8.385   1.162
  223    HB   THR  26           HB       THR  26  -7.356  -8.747   1.732
  224    HG1  THR  26           HG1      THR  26  -5.413 -10.547   2.675
  225   1HG2  THR  26          HG21      THR  26  -5.300 -10.590   0.490
  226   2HG2  THR  26          HG22      THR  26  -6.272  -9.446  -0.435
  227   3HG2  THR  26          HG23      THR  26  -7.056 -10.762   0.440
  228    H    LEU  27           HN       LEU  27  -5.584  -7.833  -0.885
  229    HA   LEU  27           HA       LEU  27  -5.835  -5.020  -1.236
  230   1HB   LEU  27          HB2       LEU  27  -5.328  -6.688  -3.028
  231   2HB   LEU  27          HB1       LEU  27  -6.982  -7.274  -2.921
  232    HG   LEU  27           HG       LEU  27  -7.812  -5.025  -3.588
  233   1HD1  LEU  27          HD11      LEU  27  -4.868  -4.421  -3.413
  234   2HD1  LEU  27          HD12      LEU  27  -6.245  -3.438  -2.917
  235   3HD1  LEU  27          HD13      LEU  27  -5.833  -3.579  -4.621
  236   1HD2  LEU  27          HD21      LEU  27  -7.170  -6.885  -5.228
  237   2HD2  LEU  27          HD22      LEU  27  -5.687  -5.977  -5.522
  238   3HD2  LEU  27          HD23      LEU  27  -7.253  -5.257  -5.894
  239    H    ASN  28           HN       ASN  28  -8.280  -7.581  -0.990
  240    HA   ASN  28           HA       ASN  28 -10.606  -5.958  -1.197
  241   1HB   ASN  28          HB2       ASN  28 -10.091  -8.578   0.234
  242   2HB   ASN  28          HB1       ASN  28 -11.696  -7.865   0.067
  243   1HD2  ASN  28          HD21      ASN  28 -10.921 -10.407  -1.123
  244   2HD2  ASN  28          HD22      ASN  28 -11.002 -10.225  -2.808
  245    H    GLY  29           HN       GLY  29  -8.657  -6.899   1.628
  246   1HA   GLY  29          HA2       GLY  29 -10.374  -5.883   3.643
  247   2HA   GLY  29          HA1       GLY  29  -8.629  -6.059   3.814
  248    H    ILE  30           HN       ILE  30  -7.843  -4.218   1.762
  249    HA   ILE  30           HA       ILE  30  -7.875  -1.775   3.221
  250    HB   ILE  30           HB       ILE  30  -7.385  -2.261   0.266
  251   1HG1  ILE  30          HG12      ILE  30  -5.412  -1.819   2.526
  252   2HG1  ILE  30          HG11      ILE  30  -5.885  -3.420   1.955
  253   1HG2  ILE  30          HG21      ILE  30  -7.866   0.068   0.525
  254   2HG2  ILE  30          HG22      ILE  30  -6.108  -0.058   0.506
  255   3HG2  ILE  30          HG23      ILE  30  -6.960   0.158   2.034
  256   1HD1  ILE  30          HD11      ILE  30  -5.090  -2.867  -0.304
  257   2HD1  ILE  30          HD12      ILE  30  -3.793  -2.650   0.870
  258   3HD1  ILE  30          HD13      ILE  30  -4.652  -1.247   0.234
  259    H    TYR  31           HN       TYR  31  -9.847  -2.837   0.438
  260    HA   TYR  31           HA       TYR  31 -11.255  -0.395   0.092
  261   1HB   TYR  31          HB2       TYR  31 -11.945  -3.271  -0.521
  262   2HB   TYR  31          HB1       TYR  31 -13.083  -1.969  -0.870
  263    HD1  TYR  31           HD1      TYR  31 -10.479  -3.869  -2.255
  264    HD2  TYR  31           HD2      TYR  31 -11.930   0.166  -2.026
  265    HE1  TYR  31           HE1      TYR  31  -9.217  -3.294  -4.314
  266    HE2  TYR  31           HE2      TYR  31 -10.667   0.738  -4.063
  267    HH   TYR  31           HH       TYR  31  -9.247  -1.638  -6.086
  268    H    GLN  32           HN       GLN  32 -11.996  -3.152   2.221
  269    HA   GLN  32           HA       GLN  32 -14.532  -2.119   3.093
  270   1HB   GLN  32          HB2       GLN  32 -13.575  -4.499   3.372
  271   2HB   GLN  32          HB1       GLN  32 -12.715  -3.858   4.770
  272   1HG   GLN  32          HG2       GLN  32 -15.716  -3.639   4.397
  273   2HG   GLN  32          HG1       GLN  32 -14.932  -4.914   5.328
  274   1HE2  GLN  32          HE21      GLN  32 -12.950  -3.555   6.719
  275   2HE2  GLN  32          HE22      GLN  32 -13.641  -2.375   7.724
  276    H    PHE  33           HN       PHE  33 -11.231  -1.763   4.335
  277    HA   PHE  33           HA       PHE  33 -11.846  -0.421   6.756
  278   1HB   PHE  33          HB2       PHE  33  -9.615  -1.323   6.179
  279   2HB   PHE  33          HB1       PHE  33  -9.424  -0.052   4.974
  280    HD1  PHE  33           HD1      PHE  33  -9.694  -0.777   8.586
  281    HD2  PHE  33           HD2      PHE  33  -8.939   2.234   5.616
  282    HE1  PHE  33           HE1      PHE  33  -8.854   0.751  10.350
  283    HE2  PHE  33           HE2      PHE  33  -8.098   3.763   7.384
  284    HZ   PHE  33           HZ       PHE  33  -8.066   3.021   9.748
  285    H    ILE  34           HN       ILE  34 -11.165   0.976   3.526
  286    HA   ILE  34           HA       ILE  34 -11.342   3.699   4.312
  287    HB   ILE  34           HB       ILE  34 -11.904   2.330   1.673
  288   1HG1  ILE  34          HG12      ILE  34  -9.599   4.079   2.575
  289   2HG1  ILE  34          HG11      ILE  34  -9.583   2.320   2.683
  290   1HG2  ILE  34          HG21      ILE  34 -11.894   5.270   2.386
  291   2HG2  ILE  34          HG22      ILE  34 -13.135   4.371   1.516
  292   3HG2  ILE  34          HG23      ILE  34 -11.584   4.703   0.747
  293   1HD1  ILE  34          HD11      ILE  34  -9.696   2.068   0.319
  294   2HD1  ILE  34          HD12      ILE  34  -8.507   3.344   0.593
  295   3HD1  ILE  34          HD13      ILE  34 -10.144   3.759   0.084
  296    H    MET  35           HN       MET  35 -13.909   1.470   3.244
  297    HA   MET  35           HA       MET  35 -16.015   3.371   3.096
  298   1HB   MET  35          HB2       MET  35 -16.033   0.433   3.833
  299   2HB   MET  35          HB1       MET  35 -17.498   1.378   3.571
  300   1HG   MET  35          HG2       MET  35 -16.789   1.892   1.280
  301   2HG   MET  35          HG1       MET  35 -15.278   1.018   1.535
  302   1HE   MET  35          HE1       MET  35 -15.015  -1.091   0.440
  303   2HE   MET  35          HE2       MET  35 -15.990  -0.213  -0.733
  304   3HE   MET  35          HE3       MET  35 -16.341  -1.907  -0.399
  305    H    ASP  36           HN       ASP  36 -14.783   1.508   5.867
  306    HA   ASP  36           HA       ASP  36 -16.839   2.344   7.688
  307   1HB   ASP  36          HB2       ASP  36 -14.044   1.278   8.126
  308   2HB   ASP  36          HB1       ASP  36 -15.171   1.597   9.445
  309    H    ARG  37           HN       ARG  37 -13.445   3.510   7.375
  310    HA   ARG  37           HA       ARG  37 -13.852   5.598   9.322
  311   1HB   ARG  37          HB2       ARG  37 -11.753   5.400   7.141
  312   2HB   ARG  37          HB1       ARG  37 -11.675   6.454   8.550
  313   1HG   ARG  37          HG2       ARG  37 -12.017   3.479   8.906
  314   2HG   ARG  37          HG1       ARG  37 -10.421   4.158   8.612
  315   1HD   ARG  37          HD2       ARG  37 -10.463   5.426  10.611
  316   2HD   ARG  37          HD1       ARG  37 -12.200   5.227  10.811
  317    HE   ARG  37           HE       ARG  37 -11.202   2.635  10.864
  318   1HH1  ARG  37          HH21      ARG  37 -10.614   5.596  12.532
  319   2HH1  ARG  37          HH22      ARG  37 -10.163   4.821  14.015
  320   1HH2  ARG  37          HH11      ARG  37 -10.624   1.611  12.784
  321   2HH2  ARG  37          HH12      ARG  37 -10.169   2.563  14.158
  322    H    PHE  38           HN       PHE  38 -13.894   5.573   5.770
  323    HA   PHE  38           HA       PHE  38 -15.066   8.335   5.833
  324   1HB   PHE  38          HB2       PHE  38 -13.691   6.963   3.509
  325   2HB   PHE  38          HB1       PHE  38 -14.197   8.648   3.607
  326    HD1  PHE  38           HD1      PHE  38 -13.069  10.199   5.229
  327    HD2  PHE  38           HD2      PHE  38 -11.633   6.220   4.492
  328    HE1  PHE  38           HE1      PHE  38 -10.885  10.802   6.231
  329    HE2  PHE  38           HE2      PHE  38  -9.449   6.823   5.495
  330    HZ   PHE  38           HZ       PHE  38  -9.073   9.113   6.365
  331    HA   PRO  39           HA       PRO  39 -18.445   5.602   4.360
  332   1HB   PRO  39          HB2       PRO  39 -20.548   7.025   5.278
  333   2HB   PRO  39          HB1       PRO  39 -19.535   6.054   6.364
  334   1HG   PRO  39          HG2       PRO  39 -19.506   8.997   5.886
  335   2HG   PRO  39          HG1       PRO  39 -19.342   8.105   7.407
  336   1HD   PRO  39          HD2       PRO  39 -17.203   9.137   5.969
  337   2HD   PRO  39          HD1       PRO  39 -17.069   7.791   7.120
  338    H    PHE  40           HN       PHE  40 -17.548   8.735   3.426
  339    HA   PHE  40           HA       PHE  40 -19.725   9.493   1.744
  340   1HB   PHE  40          HB2       PHE  40 -16.936  10.030   0.785
  341   2HB   PHE  40          HB1       PHE  40 -18.306  11.128   0.917
  342    HD1  PHE  40           HD1      PHE  40 -19.147  10.819   3.709
  343    HD2  PHE  40           HD2      PHE  40 -15.197  10.973   2.029
  344    HE1  PHE  40           HE1      PHE  40 -18.268  11.686   5.858
  345    HE2  PHE  40           HE2      PHE  40 -14.320  11.851   4.176
  346    HZ   PHE  40           HZ       PHE  40 -15.854  12.201   6.094
  347    H    TYR  41           HN       TYR  41 -16.997   7.346   1.312
  348    HA   TYR  41           HA       TYR  41 -17.291   6.831  -1.475
  349   1HB   TYR  41          HB2       TYR  41 -16.108   5.183   0.771
  350   2HB   TYR  41          HB1       TYR  41 -15.940   4.785  -0.943
  351    HD1  TYR  41           HD1      TYR  41 -14.558   6.124  -2.420
  352    HD2  TYR  41           HD2      TYR  41 -15.103   7.244   1.685
  353    HE1  TYR  41           HE1      TYR  41 -12.715   7.755  -2.636
  354    HE2  TYR  41           HE2      TYR  41 -13.259   8.890   1.485
  355    HH   TYR  41           HH       TYR  41 -11.834   9.895   0.083
  356    H    ARG  42           HN       ARG  42 -19.047   5.613   1.308
  357    HA   ARG  42           HA       ARG  42 -20.059   3.203   0.170
  358   1HB   ARG  42          HB2       ARG  42 -21.295   5.129   2.158
  359   2HB   ARG  42          HB1       ARG  42 -22.017   3.580   1.733
  360   1HG   ARG  42          HG2       ARG  42 -19.970   2.416   2.472
  361   2HG   ARG  42          HG1       ARG  42 -19.245   3.966   2.899
  362   1HD   ARG  42          HD2       ARG  42 -21.048   4.368   4.532
  363   2HD   ARG  42          HD1       ARG  42 -21.793   2.832   4.097
  364    HE   ARG  42           HE       ARG  42 -19.209   2.139   4.835
  365   1HH1  ARG  42          HH21      ARG  42 -21.816   3.923   6.221
  366   2HH1  ARG  42          HH22      ARG  42 -21.416   3.497   7.850
  367   1HH2  ARG  42          HH11      ARG  42 -18.678   1.568   6.959
  368   2HH2  ARG  42          HH12      ARG  42 -19.640   2.166   8.268
  369    H    GLU  43           HN       GLU  43 -21.217   6.563  -0.069
  370    HA   GLU  43           HA       GLU  43 -23.564   5.891  -1.601
  371   1HB   GLU  43          HB2       GLU  43 -22.025   8.471  -1.270
  372   2HB   GLU  43          HB1       GLU  43 -23.525   8.354  -2.191
  373   1HG   GLU  43          HG2       GLU  43 -23.271   7.480   0.699
  374   2HG   GLU  43          HG1       GLU  43 -23.827   9.082   0.214
  375    H    ASN  44           HN       ASN  44 -20.312   6.864  -2.414
  376    HA   ASN  44           HA       ASN  44 -20.870   6.443  -5.325
  377   1HB   ASN  44          HB2       ASN  44 -19.737   8.589  -4.477
  378   2HB   ASN  44          HB1       ASN  44 -18.341   7.576  -4.108
  379   1HD2  ASN  44          HD21      ASN  44 -20.451   8.613  -6.813
  380   2HD2  ASN  44          HD22      ASN  44 -19.305   8.310  -8.028
  381    H    LYS  45           HN       LYS  45 -20.677   4.215  -5.588
  382    HA   LYS  45           HA       LYS  45 -18.383   2.821  -4.328
  383   1HB   LYS  45          HB2       LYS  45 -20.757   1.815  -5.920
  384   2HB   LYS  45          HB1       LYS  45 -19.505   0.780  -5.231
  385   1HG   LYS  45          HG2       LYS  45 -20.029   1.641  -2.977
  386   2HG   LYS  45          HG1       LYS  45 -21.283   2.672  -3.665
  387   1HD   LYS  45          HD2       LYS  45 -22.479   0.683  -4.492
  388   2HD   LYS  45          HD1       LYS  45 -21.229  -0.356  -3.806
  389   1HE   LYS  45          HE2       LYS  45 -21.737   0.513  -1.554
  390   2HE   LYS  45          HE1       LYS  45 -22.988   1.553  -2.236
  391   1HZ   LYS  45          HZ1       LYS  45 -23.921  -0.490  -1.347
  392   2HZ   LYS  45          HZ2       LYS  45 -22.934  -1.414  -2.377
  393   3HZ   LYS  45          HZ3       LYS  45 -24.144  -0.413  -3.027
  394    H    GLN  46           HN       GLN  46 -19.825   2.602  -7.601
  395    HA   GLN  46           HA       GLN  46 -17.398   1.672  -8.786
  396   1HB   GLN  46          HB2       GLN  46 -19.837   3.004  -9.989
  397   2HB   GLN  46          HB1       GLN  46 -18.525   2.322 -10.952
  398   1HG   GLN  46          HG2       GLN  46 -18.894   0.118  -9.987
  399   2HG   GLN  46          HG1       GLN  46 -20.115   0.768  -8.891
  400   1HE2  GLN  46          HE21      GLN  46 -20.731  -1.318 -10.769
  401   2HE2  GLN  46          HE22      GLN  46 -21.816  -0.695 -11.915
  402    H    GLY  47           HN       GLY  47 -15.724   2.749  -9.783
  403   1HA   GLY  47          HA2       GLY  47 -14.917   4.777 -10.975
  404   2HA   GLY  47          HA1       GLY  47 -15.803   5.748  -9.804
  405    H    TRP  48           HN       TRP  48 -15.094   5.000  -7.392
  406    HA   TRP  48           HA       TRP  48 -12.220   5.610  -7.301
  407   1HB   TRP  48          HB2       TRP  48 -12.539   6.064  -5.004
  408   2HB   TRP  48          HB1       TRP  48 -14.010   6.628  -5.787
  409    HD1  TRP  48           HD1      TRP  48 -16.239   5.202  -5.411
  410    HE1  TRP  48           HE1      TRP  48 -16.892   3.508  -3.584
  411    HE3  TRP  48           HE3      TRP  48 -11.631   4.185  -3.461
  412    HZ2  TRP  48           HZ2      TRP  48 -15.630   1.935  -1.551
  413    HZ3  TRP  48           HZ3      TRP  48 -11.385   2.588  -1.583
  414    HH2  TRP  48           HH2      TRP  48 -13.376   1.462  -0.628
  415    H    GLN  49           HN       GLN  49 -14.275   2.824  -6.773
  416    HA   GLN  49           HA       GLN  49 -12.532   1.277  -5.180
  417   1HB   GLN  49          HB2       GLN  49 -14.584   0.461  -7.240
  418   2HB   GLN  49          HB1       GLN  49 -13.742  -0.699  -6.212
  419   1HG   GLN  49          HG2       GLN  49 -14.588   0.437  -4.206
  420   2HG   GLN  49          HG1       GLN  49 -15.403   1.633  -5.212
  421   1HE2  GLN  49          HE21      GLN  49 -16.206  -0.922  -3.396
  422   2HE2  GLN  49          HE22      GLN  49 -17.447  -1.610  -4.326
  423    H    ASN  50           HN       ASN  50 -12.668   1.498  -8.747
  424    HA   ASN  50           HA       ASN  50 -10.596  -0.514  -9.068
  425   1HB   ASN  50          HB2       ASN  50 -11.855   1.471 -10.969
  426   2HB   ASN  50          HB1       ASN  50 -10.603   0.333 -11.468
  427   1HD2  ASN  50          HD21      ASN  50 -13.413   0.321 -12.395
  428   2HD2  ASN  50          HD22      ASN  50 -14.069  -1.168 -11.914
  429    H    SER  51           HN       SER  51 -10.593   3.025  -8.954
  430    HA   SER  51           HA       SER  51  -8.008   3.463 -10.024
  431   1HB   SER  51          HB2       SER  51  -9.478   5.332  -9.655
  432   2HB   SER  51          HB1       SER  51  -9.554   4.999  -7.927
  433    HG   SER  51           HG       SER  51  -8.055   6.679  -8.522
  434    H    ILE  52           HN       ILE  52  -8.954   2.712  -6.673
  435    HA   ILE  52           HA       ILE  52  -6.392   3.145  -5.501
  436    HB   ILE  52           HB       ILE  52  -8.568   1.205  -4.735
  437   1HG1  ILE  52          HG12      ILE  52  -9.386   3.509  -4.827
  438   2HG1  ILE  52          HG11      ILE  52  -9.265   2.983  -3.152
  439   1HG2  ILE  52          HG21      ILE  52  -6.126   2.173  -3.287
  440   2HG2  ILE  52          HG22      ILE  52  -6.660   0.515  -3.550
  441   3HG2  ILE  52          HG23      ILE  52  -7.527   1.553  -2.418
  442   1HD1  ILE  52          HD11      ILE  52  -8.292   5.092  -3.066
  443   2HD1  ILE  52          HD12      ILE  52  -7.552   4.930  -4.656
  444   3HD1  ILE  52          HD13      ILE  52  -6.872   4.072  -3.276
  445    H    ARG  53           HN       ARG  53  -7.833  -0.038  -6.364
  446    HA   ARG  53           HA       ARG  53  -5.318  -1.384  -5.953
  447   1HB   ARG  53          HB2       ARG  53  -6.428  -3.342  -6.904
  448   2HB   ARG  53          HB1       ARG  53  -7.505  -2.530  -5.770
  449   1HG   ARG  53          HG2       ARG  53  -8.523  -1.330  -7.747
  450   2HG   ARG  53          HG1       ARG  53  -7.590  -2.406  -8.789
  451   1HD   ARG  53          HD2       ARG  53  -8.639  -4.351  -7.541
  452   2HD   ARG  53          HD1       ARG  53  -9.705  -3.186  -6.767
  453    HE   ARG  53           HE       ARG  53  -9.988  -2.667  -9.485
  454   1HH1  ARG  53          HH21      ARG  53 -10.248  -5.401  -7.398
  455   2HH1  ARG  53          HH22      ARG  53 -11.473  -6.175  -8.347
  456   1HH2  ARG  53          HH11      ARG  53 -11.586  -3.664 -10.734
  457   2HH2  ARG  53          HH12      ARG  53 -12.228  -5.193 -10.235
  458    H    HIS  54           HN       HIS  54  -6.856   0.012  -8.807
  459    HA   HIS  54           HA       HIS  54  -5.182  -1.186 -10.775
  460   1HB   HIS  54          HB2       HIS  54  -7.189   0.136 -11.354
  461   2HB   HIS  54          HB1       HIS  54  -6.388   1.599 -10.775
  462    HD1  HIS  54           HD1      HIS  54  -4.796   2.759 -12.367
  463    HD2  HIS  54           HD2      HIS  54  -5.880  -1.039 -13.704
  464    HE1  HIS  54           HE1      HIS  54  -3.853   2.527 -14.706
  465    H    ASN  55           HN       ASN  55  -4.738   1.699  -8.768
  466    HA   ASN  55           HA       ASN  55  -2.297   2.562 -10.019
  467   1HB   ASN  55          HB2       ASN  55  -3.475   3.085  -7.279
  468   2HB   ASN  55          HB1       ASN  55  -2.043   3.905  -7.904
  469   1HD2  ASN  55          HD21      ASN  55  -4.793   5.026  -7.291
  470   2HD2  ASN  55          HD22      ASN  55  -5.300   5.757  -8.737
  471    H    LEU  56           HN       LEU  56  -2.948   0.088  -7.631
  472    HA   LEU  56           HA       LEU  56  -0.444   0.076  -6.291
  473   1HB   LEU  56          HB2       LEU  56  -2.330  -2.189  -6.963
  474   2HB   LEU  56          HB1       LEU  56  -0.919  -2.384  -5.926
  475    HG   LEU  56           HG       LEU  56  -3.169  -0.412  -5.423
  476   1HD1  LEU  56          HD11      LEU  56  -3.698  -2.922  -5.233
  477   2HD1  LEU  56          HD12      LEU  56  -4.028  -1.933  -3.811
  478   3HD1  LEU  56          HD13      LEU  56  -2.579  -2.936  -3.870
  479   1HD2  LEU  56          HD21      LEU  56  -1.974  -0.639  -3.039
  480   2HD2  LEU  56          HD22      LEU  56  -1.392   0.506  -4.238
  481   3HD2  LEU  56          HD23      LEU  56  -0.578  -1.045  -4.036
  482    H    SER  57           HN       SER  57  -1.417  -1.785  -9.205
  483    HA   SER  57           HA       SER  57   1.110  -3.037  -9.583
  484   1HB   SER  57          HB2       SER  57  -0.919  -2.216 -11.682
  485   2HB   SER  57          HB1       SER  57   0.396  -3.363 -11.924
  486    HG   SER  57           HG       SER  57  -0.886  -4.086  -9.737
  487    H    LEU  58           HN       LEU  58  -0.115   0.099 -10.717
  488    HA   LEU  58           HA       LEU  58   2.185   0.746 -12.323
  489   1HB   LEU  58          HB2       LEU  58  -0.025   2.340 -11.040
  490   2HB   LEU  58          HB1       LEU  58   1.342   3.178 -11.773
  491    HG   LEU  58           HG       LEU  58   0.918   1.982 -13.901
  492   1HD1  LEU  58          HD11      LEU  58  -1.360   0.821 -14.052
  493   2HD1  LEU  58          HD12      LEU  58  -1.351   0.808 -12.289
  494   3HD1  LEU  58          HD13      LEU  58  -0.100  -0.054 -13.181
  495   1HD2  LEU  58          HD21      LEU  58  -0.133   4.191 -13.438
  496   2HD2  LEU  58          HD22      LEU  58  -1.544   3.361 -12.781
  497   3HD2  LEU  58          HD23      LEU  58  -1.136   3.192 -14.489
  498    H    ASN  59           HN       ASN  59   1.347   1.317  -8.922
  499    HA   ASN  59           HA       ASN  59   3.768   2.844  -8.400
  500   1HB   ASN  59          HB2       ASN  59   1.726   1.555  -6.570
  501   2HB   ASN  59          HB1       ASN  59   3.066   2.551  -5.999
  502   1HD2  ASN  59          HD21      ASN  59   0.068   3.081  -5.955
  503   2HD2  ASN  59          HD22      ASN  59  -0.117   4.575  -6.735
  504    H    GLU  60           HN       GLU  60   5.712   1.874  -8.399
  505    HA   GLU  60           HA       GLU  60   5.971  -0.995  -7.727
  506   1HB   GLU  60          HB2       GLU  60   7.984   1.080  -8.658
  507   2HB   GLU  60          HB1       GLU  60   8.338  -0.632  -8.426
  508   1HG   GLU  60          HG2       GLU  60   6.650  -1.232 -10.105
  509   2HG   GLU  60          HG1       GLU  60   6.233   0.470 -10.319
  510    H    CYS  61           HN       CYS  61   5.952   1.934  -6.116
  511    HA   CYS  61           HA       CYS  61   8.104   1.669  -4.259
  512   1HB   CYS  61          HB2       CYS  61   6.815   3.231  -2.852
  513   2HB   CYS  61          HB1       CYS  61   6.814   3.757  -4.535
  514    HG   CYS  61           HG       CYS  61   4.375   2.855  -4.775
  515    H    PHE  62           HN       PHE  62   4.790   0.378  -4.232
  516    HA   PHE  62           HA       PHE  62   5.095  -0.730  -1.543
  517   1HB   PHE  62          HB2       PHE  62   3.048  -1.397  -3.685
  518   2HB   PHE  62          HB1       PHE  62   2.944  -1.825  -1.979
  519    HD1  PHE  62           HD1      PHE  62   2.283   0.707  -4.452
  520    HD2  PHE  62           HD2      PHE  62   2.916   0.071  -0.248
  521    HE1  PHE  62           HE1      PHE  62   1.233   2.898  -3.961
  522    HE2  PHE  62           HE2      PHE  62   1.862   2.263   0.240
  523    HZ   PHE  62           HZ       PHE  62   1.021   3.676  -1.617
  524    H    VAL  63           HN       VAL  63   5.175  -3.059  -1.117
  525    HA   VAL  63           HA       VAL  63   6.501  -4.617  -3.323
  526    HB   VAL  63           HB       VAL  63   6.969  -4.755  -0.329
  527   1HG1  VAL  63          HG11      VAL  63   8.948  -6.169  -1.138
  528   2HG1  VAL  63          HG12      VAL  63   8.105  -6.270  -2.684
  529   3HG1  VAL  63          HG13      VAL  63   7.357  -6.925  -1.227
  530   1HG2  VAL  63          HG21      VAL  63   9.180  -3.803  -0.892
  531   2HG2  VAL  63          HG22      VAL  63   7.880  -2.709  -1.361
  532   3HG2  VAL  63          HG23      VAL  63   8.696  -3.684  -2.584
  533    H    LYS  64           HN       LYS  64   5.496  -6.502  -3.850
  534    HA   LYS  64           HA       LYS  64   3.024  -7.256  -2.557
  535   1HB   LYS  64          HB2       LYS  64   4.767  -8.682  -4.584
  536   2HB   LYS  64          HB1       LYS  64   3.222  -9.313  -4.020
  537   1HG   LYS  64          HG2       LYS  64   2.091  -7.273  -4.814
  538   2HG   LYS  64          HG1       LYS  64   3.636  -6.637  -5.383
  539   1HD   LYS  64          HD2       LYS  64   3.878  -8.488  -6.945
  540   2HD   LYS  64          HD1       LYS  64   2.419  -9.253  -6.317
  541   1HE   LYS  64          HE2       LYS  64   1.041  -7.441  -7.126
  542   2HE   LYS  64          HE1       LYS  64   2.462  -6.501  -7.587
  543   1HZ   LYS  64          HZ1       LYS  64   1.160  -7.983  -9.309
  544   2HZ   LYS  64          HZ2       LYS  64   2.186  -9.191  -8.697
  545   3HZ   LYS  64          HZ3       LYS  64   2.843  -7.789  -9.399
  546    H    VAL  65           HN       VAL  65   2.635  -8.932  -1.127
  547    HA   VAL  65           HA       VAL  65   5.011 -10.395  -0.020
  548    HB   VAL  65           HB       VAL  65   2.624  -9.340   1.524
  549   1HG1  VAL  65          HG11      VAL  65   3.521 -11.411   2.462
  550   2HG1  VAL  65          HG12      VAL  65   3.990 -10.055   3.487
  551   3HG1  VAL  65          HG13      VAL  65   5.160 -10.767   2.377
  552   1HG2  VAL  65          HG21      VAL  65   5.512  -8.446   1.704
  553   2HG2  VAL  65          HG22      VAL  65   4.099  -7.693   2.444
  554   3HG2  VAL  65          HG23      VAL  65   4.323  -7.620   0.697
  555    HA   PRO  66           HA       PRO  66   1.951 -13.419  -1.809
  556   1HB   PRO  66          HB2       PRO  66   4.311 -15.119  -1.041
  557   2HB   PRO  66          HB1       PRO  66   3.295 -15.196  -2.495
  558   1HG   PRO  66          HG2       PRO  66   5.706 -14.088  -2.581
  559   2HG   PRO  66          HG1       PRO  66   4.352 -13.396  -3.490
  560   1HD   PRO  66          HD2       PRO  66   5.653 -12.386  -0.998
  561   2HD   PRO  66          HD1       PRO  66   4.854 -11.474  -2.298
  562    H    ARG  67           HN       ARG  67   1.271 -15.631  -0.794
  563    HA   ARG  67           HA       ARG  67   0.864 -15.171   2.119
  564   1HB   ARG  67          HB2       ARG  67  -0.482 -17.008   0.117
  565   2HB   ARG  67          HB1       ARG  67  -0.903 -16.917   1.828
  566   1HG   ARG  67          HG2       ARG  67  -1.640 -14.662   1.638
  567   2HG   ARG  67          HG1       ARG  67  -0.898 -14.475   0.048
  568   1HD   ARG  67          HD2       ARG  67  -3.098 -16.477   0.601
  569   2HD   ARG  67          HD1       ARG  67  -3.416 -14.835   0.032
  570    HE   ARG  67           HE       ARG  67  -1.573 -15.764  -1.787
  571   1HH1  ARG  67          HH21      ARG  67  -4.526 -16.956  -0.476
  572   2HH1  ARG  67          HH22      ARG  67  -4.987 -17.792  -1.922
  573   1HH2  ARG  67          HH11      ARG  67  -2.152 -16.850  -3.682
  574   2HH2  ARG  67          HH12      ARG  67  -3.640 -17.735  -3.736
  575    H    ASP  68           HN       ASP  68   1.122 -16.979   3.600
  576    HA   ASP  68           HA       ASP  68   3.536 -18.484   3.192
  577   1HB   ASP  68          HB2       ASP  68   1.304 -18.714   5.225
  578   2HB   ASP  68          HB1       ASP  68   2.747 -19.726   5.273
  579    H    ASP  69           HN       ASP  69   3.576 -20.945   3.325
  580    HA   ASP  69           HA       ASP  69   2.247 -22.128   1.144
  581   1HB   ASP  69          HB2       ASP  69   3.346 -23.384   3.675
  582   2HB   ASP  69          HB1       ASP  69   2.773 -24.325   2.298
  583    H    LYS  70           HN       LYS  70   1.224 -21.734   4.487
  584    HA   LYS  70           HA       LYS  70  -1.209 -23.348   4.087
  585   1HB   LYS  70          HB2       LYS  70  -0.327 -21.571   6.390
  586   2HB   LYS  70          HB1       LYS  70  -1.769 -22.586   6.394
  587   1HG   LYS  70          HG2       LYS  70  -0.365 -24.590   6.076
  588   2HG   LYS  70          HG1       LYS  70   1.079 -23.578   6.075
  589   1HD   LYS  70          HD2       LYS  70   0.550 -22.815   8.362
  590   2HD   LYS  70          HD1       LYS  70  -0.893 -23.830   8.367
  591   1HE   LYS  70          HE2       LYS  70   1.992 -24.738   8.219
  592   2HE   LYS  70          HE1       LYS  70   0.829 -25.065   9.503
  593   1HZ   LYS  70          HZ1       LYS  70   0.755 -26.990   8.275
  594   2HZ   LYS  70          HZ2       LYS  70   0.964 -26.192   6.790
  595   3HZ   LYS  70          HZ3       LYS  70  -0.530 -26.118   7.594
  596    H    LYS  71           HN       LYS  71  -1.313 -21.629   2.141
  597    HA   LYS  71           HA       LYS  71  -2.419 -19.039   2.816
  598   1HB   LYS  71          HB2       LYS  71  -2.899 -18.926   0.356
  599   2HB   LYS  71          HB1       LYS  71  -1.225 -19.298   0.742
  600   1HG   LYS  71          HG2       LYS  71  -1.444 -21.083  -0.662
  601   2HG   LYS  71          HG1       LYS  71  -2.377 -21.837   0.620
  602   1HD   LYS  71          HD2       LYS  71  -3.836 -22.005  -1.192
  603   2HD   LYS  71          HD1       LYS  71  -4.396 -20.520  -0.427
  604   1HE   LYS  71          HE2       LYS  71  -2.683 -19.345  -2.015
  605   2HE   LYS  71          HE1       LYS  71  -2.751 -20.852  -2.926
  606   1HZ   LYS  71          HZ1       LYS  71  -4.670 -18.752  -2.765
  607   2HZ   LYS  71          HZ2       LYS  71  -5.361 -20.254  -2.374
  608   3HZ   LYS  71          HZ3       LYS  71  -4.573 -20.041  -3.864
  609    HA   PRO  72           HA       PRO  72  -6.566 -20.793   3.254
  610   1HB   PRO  72          HB2       PRO  72  -7.919 -18.620   4.035
  611   2HB   PRO  72          HB1       PRO  72  -6.652 -19.313   5.072
  612   1HG   PRO  72          HG2       PRO  72  -6.493 -16.971   3.215
  613   2HG   PRO  72          HG1       PRO  72  -5.907 -17.117   4.882
  614   1HD   PRO  72          HD2       PRO  72  -4.286 -17.456   2.667
  615   2HD   PRO  72          HD1       PRO  72  -3.973 -18.212   4.248
  616    H    GLY  73           HN       GLY  73  -5.565 -18.908   0.766
  617   1HA   GLY  73          HA2       GLY  73  -6.570 -18.888  -1.423
  618   2HA   GLY  73          HA1       GLY  73  -8.128 -19.262  -0.690
  619    H    LYS  74           HN       LYS  74  -5.708 -16.665  -0.287
  620    HA   LYS  74           HA       LYS  74  -7.857 -14.647  -0.806
  621   1HB   LYS  74          HB2       LYS  74  -5.806 -14.651   1.425
  622   2HB   LYS  74          HB1       LYS  74  -6.709 -13.218   0.938
  623   1HG   LYS  74          HG2       LYS  74  -8.820 -14.310   1.464
  624   2HG   LYS  74          HG1       LYS  74  -7.987 -15.824   1.812
  625   1HD   LYS  74          HD2       LYS  74  -8.394 -14.824   3.940
  626   2HD   LYS  74          HD1       LYS  74  -6.688 -14.541   3.603
  627   1HE   LYS  74          HE2       LYS  74  -7.093 -12.260   2.984
  628   2HE   LYS  74          HE1       LYS  74  -8.838 -12.513   2.939
  629   1HZ   LYS  74          HZ1       LYS  74  -7.188 -11.833   5.132
  630   2HZ   LYS  74          HZ2       LYS  74  -8.002 -13.290   5.454
  631   3HZ   LYS  74          HZ3       LYS  74  -8.882 -11.894   5.048
  632    H    GLY  75           HN       GLY  75  -6.775 -12.439  -1.264
  633   1HA   GLY  75          HA2       GLY  75  -4.873 -12.808  -3.404
  634   2HA   GLY  75          HA1       GLY  75  -5.412 -11.253  -2.770
  635    H    SER  76           HN       SER  76  -2.851 -11.164  -3.324
  636    HA   SER  76           HA       SER  76  -1.147 -12.174  -1.169
  637   1HB   SER  76          HB2       SER  76   0.629 -10.887  -2.314
  638   2HB   SER  76          HB1       SER  76  -0.269 -11.882  -3.458
  639    HG   SER  76           HG       SER  76  -0.229  -9.114  -3.106
  640    H    TYR  77           HN       TYR  77  -0.309 -10.937   0.557
  641    HA   TYR  77           HA       TYR  77  -1.893  -8.582   1.292
  642   1HB   TYR  77          HB2       TYR  77   0.545  -9.644   2.737
  643   2HB   TYR  77          HB1       TYR  77  -0.781  -8.698   3.408
  644    HD1  TYR  77           HD1      TYR  77   0.507 -11.790   3.669
  645    HD2  TYR  77           HD2      TYR  77  -3.210  -9.983   2.481
  646    HE1  TYR  77           HE1      TYR  77  -0.693 -13.888   4.212
  647    HE2  TYR  77           HE2      TYR  77  -4.400 -12.079   3.023
  648    HH   TYR  77           HH       TYR  77  -2.981 -14.971   3.353
  649    H    TRP  78           HN       TRP  78  -0.927  -6.491   1.764
  650    HA   TRP  78           HA       TRP  78   1.519  -5.927   0.109
  651   1HB   TRP  78          HB2       TRP  78  -0.968  -4.259   0.584
  652   2HB   TRP  78          HB1       TRP  78   0.478  -3.674  -0.244
  653    HD1  TRP  78           HD1      TRP  78  -2.282  -6.336  -0.576
  654    HE1  TRP  78           HE1      TRP  78  -2.457  -7.019  -3.056
  655    HE3  TRP  78           HE3      TRP  78   1.657  -3.710  -2.504
  656    HZ2  TRP  78           HZ2      TRP  78  -1.102  -6.522  -5.530
  657    HZ3  TRP  78           HZ3      TRP  78   2.188  -3.831  -4.919
  658    HH2  TRP  78           HH2      TRP  78   0.813  -5.228  -6.434
  659    H    THR  79           HN       THR  79   3.110  -4.682   1.058
  660    HA   THR  79           HA       THR  79   2.558  -3.367   3.666
  661    HB   THR  79           HB       THR  79   3.384  -5.752   4.043
  662    HG1  THR  79           HG1      THR  79   5.389  -4.335   5.137
  663   1HG2  THR  79          HG21      THR  79   6.054  -4.642   3.175
  664   2HG2  THR  79          HG22      THR  79   5.028  -5.556   2.070
  665   3HG2  THR  79          HG23      THR  79   5.634  -6.314   3.544
  666    H    LEU  80           HN       LEU  80   4.326  -1.872   4.276
  667    HA   LEU  80           HA       LEU  80   5.404  -0.495   1.941
  668   1HB   LEU  80          HB2       LEU  80   5.889  -0.052   4.904
  669   2HB   LEU  80          HB1       LEU  80   6.417   1.034   3.623
  670    HG   LEU  80           HG       LEU  80   3.524   0.266   4.112
  671   1HD1  LEU  80          HD11      LEU  80   5.196   2.579   5.099
  672   2HD1  LEU  80          HD12      LEU  80   4.121   1.526   6.018
  673   3HD1  LEU  80          HD13      LEU  80   3.448   2.728   4.920
  674   1HD2  LEU  80          HD21      LEU  80   3.288   2.492   2.738
  675   2HD2  LEU  80          HD22      LEU  80   3.652   1.000   1.882
  676   3HD2  LEU  80          HD23      LEU  80   4.940   2.153   2.227
  677    H    ASP  81           HN       ASP  81   7.843   0.090   1.974
  678    HA   ASP  81           HA       ASP  81   9.370  -2.277   1.701
  679   1HB   ASP  81          HB2       ASP  81  10.459   0.491   2.309
  680   2HB   ASP  81          HB1       ASP  81  11.297  -0.813   1.469
  681    HA   PRO  82           HA       PRO  82  10.313  -3.286   5.926
  682   1HB   PRO  82          HB2       PRO  82  12.749  -4.544   5.639
  683   2HB   PRO  82          HB1       PRO  82  11.207  -5.277   5.168
  684   1HG   PRO  82          HG2       PRO  82  13.232  -3.891   3.467
  685   2HG   PRO  82          HG1       PRO  82  12.336  -5.389   3.155
  686   1HD   PRO  82          HD2       PRO  82  11.600  -3.028   2.043
  687   2HD   PRO  82          HD1       PRO  82  10.405  -4.258   2.502
  688    H    ASP  83           HN       ASP  83  12.989  -3.426   7.020
  689    HA   ASP  83           HA       ASP  83  13.344  -0.684   7.819
  690   1HB   ASP  83          HB2       ASP  83  15.245  -3.034   8.107
  691   2HB   ASP  83          HB1       ASP  83  15.326  -1.521   9.012
  692    H    SER  84           HN       SER  84  13.403  -0.494   5.140
  693    HA   SER  84           HA       SER  84  15.907  -0.822   3.843
  694   1HB   SER  84          HB2       SER  84  13.674  -0.284   2.760
  695   2HB   SER  84          HB1       SER  84  13.917   1.384   3.270
  696    HG   SER  84           HG       SER  84  15.271  -0.143   1.362
  697    H    TYR  85           HN       TYR  85  14.655   1.860   5.823
  698    HA   TYR  85           HA       TYR  85  16.710   3.735   5.250
  699   1HB   TYR  85          HB2       TYR  85  15.930   3.719   8.100
  700   2HB   TYR  85          HB1       TYR  85  15.718   4.982   6.893
  701    HD1  TYR  85           HD1      TYR  85  14.343   1.719   8.056
  702    HD2  TYR  85           HD2      TYR  85  13.590   5.376   5.932
  703    HE1  TYR  85           HE1      TYR  85  11.923   1.160   7.943
  704    HE2  TYR  85           HE2      TYR  85  11.177   4.813   5.813
  705    HH   TYR  85           HH       TYR  85   9.940   1.925   6.178
  706    H    ASN  86           HN       ASN  86  16.556   1.160   7.702
  707    HA   ASN  86           HA       ASN  86  19.524   1.046   7.694
  708   1HB   ASN  86          HB2       ASN  86  18.771   2.503   9.607
  709   2HB   ASN  86          HB1       ASN  86  17.912   1.102  10.247
  710   1HD2  ASN  86          HD21      ASN  86  19.151   0.277  11.943
  711   2HD2  ASN  86          HD22      ASN  86  20.829   0.033  11.888
  712    H    MET  87           HN       MET  87  19.103  -0.891   6.521
  713    HA   MET  87           HA       MET  87  17.664  -3.078   7.900
  714   1HB   MET  87          HB2       MET  87  18.711  -4.209   5.607
  715   2HB   MET  87          HB1       MET  87  17.138  -3.427   5.699
  716   1HG   MET  87          HG2       MET  87  18.483  -2.569   3.810
  717   2HG   MET  87          HG1       MET  87  18.113  -1.302   4.976
  718   1HE   MET  87          HE1       MET  87  19.747  -0.105   3.598
  719   2HE   MET  87          HE2       MET  87  21.420   0.084   4.118
  720   3HE   MET  87          HE3       MET  87  20.111   0.463   5.233
  721    H    PHE  88           HN       PHE  88  18.782  -4.260   9.360
  722    HA   PHE  88           HA       PHE  88  21.625  -4.221   9.640
  723   1HB   PHE  88          HB2       PHE  88  19.491  -6.120  10.636
  724   2HB   PHE  88          HB1       PHE  88  21.198  -6.375  10.997
  725    HD1  PHE  88           HD1      PHE  88  18.223  -4.434  11.762
  726    HD2  PHE  88           HD2      PHE  88  22.488  -4.609  12.238
  727    HE1  PHE  88           HE1      PHE  88  18.084  -2.785  13.608
  728    HE2  PHE  88           HE2      PHE  88  22.349  -2.959  14.085
  729    HZ   PHE  88           HZ       PHE  88  20.147  -2.048  14.770
  730    H    GLU  89           HN       GLU  89  19.430  -6.447   7.974
  731    HA   GLU  89           HA       GLU  89  21.436  -8.366   7.223
  732   1HB   GLU  89          HB2       GLU  89  18.742  -7.678   6.014
  733   2HB   GLU  89          HB1       GLU  89  19.731  -9.039   5.488
  734   1HG   GLU  89          HG2       GLU  89  19.677  -9.968   7.774
  735   2HG   GLU  89          HG1       GLU  89  18.684  -8.607   8.301
  736    H    ASN  90           HN       ASN  90  22.252  -8.689   4.995
  737    HA   ASN  90           HA       ASN  90  23.445  -6.343   3.898
  738   1HB   ASN  90          HB2       ASN  90  22.940  -9.037   2.590
  739   2HB   ASN  90          HB1       ASN  90  24.025  -7.795   1.964
  740   1HD2  ASN  90          HD21      ASN  90  25.570  -6.953   3.951
  741   2HD2  ASN  90          HD22      ASN  90  26.333  -8.217   4.788
  742    H    GLY  91           HN       GLY  91  22.912  -5.174   1.969
  743   1HA   GLY  91          HA2       GLY  91  20.692  -5.748   0.285
  744   2HA   GLY  91          HA1       GLY  91  20.142  -4.667   1.565
  745    H    SER  92           HN       SER  92  20.298  -2.550   1.084
  746    HA   SER  92           HA       SER  92  21.483  -1.567  -1.302
  747   1HB   SER  92          HB2       SER  92  21.031   0.645  -0.434
  748   2HB   SER  92          HB1       SER  92  19.699  -0.408   0.030
  749    HG   SER  92           HG       SER  92  21.669  -0.503   1.863
  750    H    PHE  93           HN       PHE  93  22.766  -1.708   2.022
  751    HA   PHE  93           HA       PHE  93  25.253  -0.373   1.173
  752   1HB   PHE  93          HB2       PHE  93  24.378   0.035   3.438
  753   2HB   PHE  93          HB1       PHE  93  24.518  -1.685   3.808
  754    HD1  PHE  93           HD1      PHE  93  26.369   1.442   3.205
  755    HD2  PHE  93           HD2      PHE  93  26.700  -2.750   4.081
  756    HE1  PHE  93           HE1      PHE  93  28.757   1.754   3.797
  757    HE2  PHE  93           HE2      PHE  93  29.087  -2.438   4.676
  758    HZ   PHE  93           HZ       PHE  93  30.116  -0.186   4.534
  759    H    LEU  94           HN       LEU  94  26.841  -1.482   0.201
  760    HA   LEU  94           HA       LEU  94  27.117  -4.426   0.717
  761   1HB   LEU  94          HB2       LEU  94  27.740  -2.687  -1.670
  762   2HB   LEU  94          HB1       LEU  94  28.557  -4.230  -1.460
  763    HG   LEU  94           HG       LEU  94  26.498  -4.331  -2.901
  764   1HD1  LEU  94          HD11      LEU  94  25.924  -5.998  -0.471
  765   2HD1  LEU  94          HD12      LEU  94  27.443  -6.244  -1.331
  766   3HD1  LEU  94          HD13      LEU  94  25.911  -6.446  -2.173
  767   1HD2  LEU  94          HD21      LEU  94  24.353  -3.945  -2.052
  768   2HD2  LEU  94          HD22      LEU  94  25.285  -2.645  -1.316
  769   3HD2  LEU  94          HD23      LEU  94  24.878  -4.083  -0.377
  Start of MODEL   13
    1   1H    MET   1          HT1       MET   1 -23.382  17.488   7.596
    2   2H    MET   1          HT2       MET   1 -21.760  17.062   7.321
    3   3H    MET   1          HT3       MET   1 -22.733  16.107   8.335
    4    HA   MET   1           HA       MET   1 -23.866  15.142   6.615
    5   1HB   MET   1          HB2       MET   1 -23.045  17.572   4.995
    6   2HB   MET   1          HB1       MET   1 -23.941  16.199   4.345
    7   1HG   MET   1          HG2       MET   1 -25.741  16.581   5.969
    8   2HG   MET   1          HG1       MET   1 -24.850  17.941   6.652
    9   1HE   MET   1          HE1       MET   1 -26.792  20.056   5.960
   10   2HE   MET   1          HE2       MET   1 -27.377  18.420   6.258
   11   3HE   MET   1          HE3       MET   1 -27.964  19.317   4.860
   12    H    LEU   2           HN       LEU   2 -23.001  14.248   4.345
   13    HA   LEU   2           HA       LEU   2 -20.386  13.141   4.888
   14   1HB   LEU   2          HB2       LEU   2 -22.019  13.110   2.330
   15   2HB   LEU   2          HB1       LEU   2 -20.628  12.081   2.674
   16    HG   LEU   2           HG       LEU   2 -23.152  12.143   4.353
   17   1HD1  LEU   2          HD11      LEU   2 -22.302  10.369   2.060
   18   2HD1  LEU   2          HD12      LEU   2 -23.817  11.249   2.259
   19   3HD1  LEU   2          HD13      LEU   2 -23.478   9.840   3.263
   20   1HD2  LEU   2          HD21      LEU   2 -21.464  11.285   5.738
   21   2HD2  LEU   2          HD22      LEU   2 -20.605  10.525   4.398
   22   3HD2  LEU   2          HD23      LEU   2 -22.104   9.821   5.000
   23    H    VAL   3           HN       VAL   3 -18.402  13.710   4.025
   24    HA   VAL   3           HA       VAL   3 -18.296  15.898   1.998
   25    HB   VAL   3           HB       VAL   3 -16.533  17.037   3.329
   26   1HG1  VAL   3          HG11      VAL   3 -19.009  16.705   5.031
   27   2HG1  VAL   3          HG12      VAL   3 -19.047  17.565   3.492
   28   3HG1  VAL   3          HG13      VAL   3 -18.027  18.152   4.804
   29   1HG2  VAL   3          HG21      VAL   3 -16.349  16.383   5.752
   30   2HG2  VAL   3          HG22      VAL   3 -15.730  15.159   4.642
   31   3HG2  VAL   3          HG23      VAL   3 -17.315  14.952   5.389
   32    H    LYS   4           HN       LYS   4 -16.416  15.828   0.707
   33    HA   LYS   4           HA       LYS   4 -15.062  13.231   0.645
   34   1HB   LYS   4          HB2       LYS   4 -15.784  14.503  -1.413
   35   2HB   LYS   4          HB1       LYS   4 -14.530  15.689  -1.048
   36   1HG   LYS   4          HG2       LYS   4 -12.794  14.029  -1.276
   37   2HG   LYS   4          HG1       LYS   4 -13.981  12.731  -1.404
   38   1HD   LYS   4          HD2       LYS   4 -14.793  13.599  -3.517
   39   2HD   LYS   4          HD1       LYS   4 -13.776  15.033  -3.366
   40   1HE   LYS   4          HE2       LYS   4 -12.798  13.315  -4.893
   41   2HE   LYS   4          HE1       LYS   4 -11.760  13.669  -3.511
   42   1HZ   LYS   4          HZ1       LYS   4 -11.919  11.305  -3.832
   43   2HZ   LYS   4          HZ2       LYS   4 -13.616  11.365  -3.778
   44   3HZ   LYS   4          HZ3       LYS   4 -12.705  11.724  -2.388
   45    HA   PRO   5           HA       PRO   5 -11.750  15.009   3.133
   46   1HB   PRO   5          HB2       PRO   5 -10.096  12.893   3.322
   47   2HB   PRO   5          HB1       PRO   5 -11.671  12.912   4.137
   48   1HG   PRO   5          HG2       PRO   5 -10.905  11.633   1.547
   49   2HG   PRO   5          HG1       PRO   5 -11.865  10.970   2.881
   50   1HD   PRO   5          HD2       PRO   5 -12.998  12.045   0.616
   51   2HD   PRO   5          HD1       PRO   5 -13.803  12.052   2.202
   52    HA   PRO   6           HA       PRO   6  -8.744  16.267   0.063
   53   1HB   PRO   6          HB2       PRO   6  -6.802  17.330   1.625
   54   2HB   PRO   6          HB1       PRO   6  -8.405  18.079   1.486
   55   1HG   PRO   6          HG2       PRO   6  -7.346  16.289   3.637
   56   2HG   PRO   6          HG1       PRO   6  -8.258  17.803   3.788
   57   1HD   PRO   6          HD2       PRO   6  -9.450  15.349   4.000
   58   2HD   PRO   6          HD1       PRO   6 -10.297  16.778   3.363
   59    H    TYR   7           HN       TYR   7  -8.153  13.616   2.083
   60    HA   TYR   7           HA       TYR   7  -5.347  13.199   1.668
   61   1HB   TYR   7          HB2       TYR   7  -7.429  11.015   1.897
   62   2HB   TYR   7          HB1       TYR   7  -5.726  10.919   2.326
   63    HD1  TYR   7           HD1      TYR   7  -5.101  13.149   3.970
   64    HD2  TYR   7           HD2      TYR   7  -8.804  10.980   3.765
   65    HE1  TYR   7           HE1      TYR   7  -5.651  13.855   6.282
   66    HE2  TYR   7           HE2      TYR   7  -9.352  11.681   6.065
   67    HH   TYR   7           HH       TYR   7  -7.284  13.953   7.837
   68    H    SER   8           HN       SER   8  -4.250  12.100   0.031
   69    HA   SER   8           HA       SER   8  -5.602  11.961  -2.566
   70   1HB   SER   8          HB2       SER   8  -3.253  12.716  -2.423
   71   2HB   SER   8          HB1       SER   8  -2.792  11.165  -1.730
   72    HG   SER   8           HG       SER   8  -3.516  10.186  -3.668
   73    H    TYR   9           HN       TYR   9  -5.402   9.844  -3.860
   74    HA   TYR   9           HA       TYR   9  -6.669   7.722  -2.444
   75   1HB   TYR   9          HB2       TYR   9  -5.130   7.694  -5.059
   76   2HB   TYR   9          HB1       TYR   9  -6.076   6.331  -4.460
   77    HD1  TYR   9           HD1      TYR   9  -6.178   9.505  -6.175
   78    HD2  TYR   9           HD2      TYR   9  -8.562   6.676  -3.988
   79    HE1  TYR   9           HE1      TYR   9  -8.239  10.527  -7.100
   80    HE2  TYR   9           HE2      TYR   9 -10.622   7.702  -4.910
   81    HH   TYR   9           HH       TYR   9 -10.561  10.695  -6.663
   82    H    ILE  10           HN       ILE  10  -3.263   8.273  -3.278
   83    HA   ILE  10           HA       ILE  10  -2.319   5.751  -2.257
   84    HB   ILE  10           HB       ILE  10  -0.925   8.397  -2.741
   85   1HG1  ILE  10          HG12      ILE  10  -0.756   5.758  -4.227
   86   2HG1  ILE  10          HG11      ILE  10  -1.860   7.055  -4.683
   87   1HG2  ILE  10          HG21      ILE  10   1.156   6.828  -2.653
   88   2HG2  ILE  10          HG22      ILE  10   0.115   5.748  -1.727
   89   3HG2  ILE  10          HG23      ILE  10   0.460   7.371  -1.129
   90   1HD1  ILE  10          HD11      ILE  10   0.108   7.326  -6.032
   91   2HD1  ILE  10          HD12      ILE  10   1.165   7.143  -4.633
   92   3HD1  ILE  10          HD13      ILE  10   0.166   8.586  -4.800
   93    H    ALA  11           HN       ALA  11  -2.691   8.980  -0.786
   94    HA   ALA  11           HA       ALA  11  -1.368   8.410   1.664
   95   1HB   ALA  11          HB1       ALA  11  -3.675  10.267   1.018
   96   2HB   ALA  11          HB2       ALA  11  -1.972  10.688   1.196
   97   3HB   ALA  11          HB3       ALA  11  -2.913  10.208   2.607
   98    H    LEU  12           HN       LEU  12  -4.807   7.937   0.768
   99    HA   LEU  12           HA       LEU  12  -5.641   6.968   3.322
  100   1HB   LEU  12          HB2       LEU  12  -6.612   6.332   0.522
  101   2HB   LEU  12          HB1       LEU  12  -7.425   5.757   1.975
  102    HG   LEU  12           HG       LEU  12  -6.847   8.685   1.446
  103   1HD1  LEU  12          HD11      LEU  12  -8.309   8.040  -0.317
  104   2HD1  LEU  12          HD12      LEU  12  -9.355   8.738   0.920
  105   3HD1  LEU  12          HD13      LEU  12  -9.247   6.986   0.743
  106   1HD2  LEU  12          HD21      LEU  12  -8.400   7.137   3.518
  107   2HD2  LEU  12          HD22      LEU  12  -8.925   8.760   3.084
  108   3HD2  LEU  12          HD23      LEU  12  -7.310   8.505   3.734
  109    H    ILE  13           HN       ILE  13  -4.344   5.283   0.472
  110    HA   ILE  13           HA       ILE  13  -4.411   2.651   1.609
  111    HB   ILE  13           HB       ILE  13  -2.578   3.848  -0.493
  112   1HG1  ILE  13          HG12      ILE  13  -5.054   2.123  -0.806
  113   2HG1  ILE  13          HG11      ILE  13  -5.060   3.880  -0.950
  114   1HG2  ILE  13          HG21      ILE  13  -3.108   0.974   0.310
  115   2HG2  ILE  13          HG22      ILE  13  -1.566   1.828   0.373
  116   3HG2  ILE  13          HG23      ILE  13  -2.297   1.444  -1.183
  117   1HD1  ILE  13          HD11      ILE  13  -3.690   1.861  -2.726
  118   2HD1  ILE  13          HD12      ILE  13  -3.195   3.553  -2.713
  119   3HD1  ILE  13          HD13      ILE  13  -4.836   3.119  -3.180
  120    H    THR  14           HN       THR  14  -1.861   5.137   1.469
  121    HA   THR  14           HA       THR  14   0.135   3.627   2.825
  122    HB   THR  14           HB       THR  14  -0.263   6.624   2.751
  123    HG1  THR  14           HG1      THR  14   1.087   4.774   1.097
  124   1HG2  THR  14          HG21      THR  14   2.087   4.880   3.511
  125   2HG2  THR  14          HG22      THR  14   1.285   6.098   4.504
  126   3HG2  THR  14          HG23      THR  14   2.250   6.589   3.112
  127    H    MET  15           HN       MET  15  -2.383   5.819   4.098
  128    HA   MET  15           HA       MET  15  -1.449   5.645   6.829
  129   1HB   MET  15          HB2       MET  15  -4.139   6.397   5.660
  130   2HB   MET  15          HB1       MET  15  -3.777   6.470   7.383
  131   1HG   MET  15          HG2       MET  15  -1.822   7.973   6.810
  132   2HG   MET  15          HG1       MET  15  -2.444   8.041   5.163
  133   1HE   MET  15          HE1       MET  15  -5.732   8.094   5.641
  134   2HE   MET  15          HE2       MET  15  -4.600   8.738   4.454
  135   3HE   MET  15          HE3       MET  15  -5.711   9.825   5.283
  136    H    ALA  16           HN       ALA  16  -3.829   3.865   4.914
  137    HA   ALA  16           HA       ALA  16  -4.997   2.342   6.995
  138   1HB   ALA  16          HB1       ALA  16  -5.809   0.908   5.270
  139   2HB   ALA  16          HB2       ALA  16  -4.461   1.310   4.206
  140   3HB   ALA  16          HB3       ALA  16  -5.704   2.513   4.546
  141    H    ILE  17           HN       ILE  17  -2.141   1.575   4.972
  142    HA   ILE  17           HA       ILE  17  -1.628  -0.989   6.113
  143    HB   ILE  17           HB       ILE  17   0.371   1.036   5.044
  144   1HG1  ILE  17          HG12      ILE  17  -0.931  -1.281   3.595
  145   2HG1  ILE  17          HG11      ILE  17  -1.582   0.356   3.546
  146   1HG2  ILE  17          HG21      ILE  17   0.484  -1.936   5.607
  147   2HG2  ILE  17          HG22      ILE  17   1.571  -0.679   6.198
  148   3HG2  ILE  17          HG23      ILE  17   1.608  -1.150   4.500
  149   1HD1  ILE  17          HD11      ILE  17   1.311  -0.151   2.869
  150   2HD1  ILE  17          HD12      ILE  17   0.285   1.206   2.400
  151   3HD1  ILE  17          HD13      ILE  17   0.053  -0.376   1.656
  152    H    GLN  18           HN       GLN  18  -0.327   2.212   6.918
  153    HA   GLN  18           HA       GLN  18   1.245   1.407   9.161
  154   1HB   GLN  18          HB2       GLN  18  -0.113   4.043   8.525
  155   2HB   GLN  18          HB1       GLN  18   1.025   3.823   9.854
  156   1HG   GLN  18          HG2       GLN  18   1.715   3.111   6.999
  157   2HG   GLN  18          HG1       GLN  18   2.017   4.711   7.673
  158   1HE2  GLN  18          HE21      GLN  18   2.974   4.230  10.200
  159   2HE2  GLN  18          HE22      GLN  18   4.365   3.259  10.152
  160    H    ASN  19           HN       ASN  19  -2.140   2.433   8.904
  161    HA   ASN  19           HA       ASN  19  -2.605   2.309  11.778
  162   1HB   ASN  19          HB2       ASN  19  -4.487   2.492   9.409
  163   2HB   ASN  19          HB1       ASN  19  -5.009   2.574  11.092
  164   1HD2  ASN  19          HD21      ASN  19  -4.272   4.551   8.534
  165   2HD2  ASN  19          HD22      ASN  19  -3.743   5.924   9.377
  166    H    ALA  20           HN       ALA  20  -2.250  -0.076   9.434
  167    HA   ALA  20           HA       ALA  20  -4.320  -1.889  10.369
  168   1HB   ALA  20          HB1       ALA  20  -1.825  -2.407   8.724
  169   2HB   ALA  20          HB2       ALA  20  -3.431  -2.047   8.087
  170   3HB   ALA  20          HB3       ALA  20  -3.144  -3.554   8.959
  171    HA   PRO  21           HA       PRO  21  -2.213  -3.134  14.197
  172   1HB   PRO  21          HB2       PRO  21  -3.432  -5.760  13.355
  173   2HB   PRO  21          HB1       PRO  21  -3.376  -5.018  14.968
  174   1HG   PRO  21          HG2       PRO  21  -5.585  -4.901  13.499
  175   2HG   PRO  21          HG1       PRO  21  -5.070  -3.521  14.484
  176   1HD   PRO  21          HD2       PRO  21  -4.998  -3.834  11.520
  177   2HD   PRO  21          HD1       PRO  21  -5.095  -2.352  12.497
  178    H    GLU  22           HN       GLU  22  -1.893  -4.554  11.067
  179    HA   GLU  22           HA       GLU  22   0.895  -5.395  11.701
  180   1HB   GLU  22          HB2       GLU  22   0.516  -7.403  10.201
  181   2HB   GLU  22          HB1       GLU  22  -0.332  -7.479  11.746
  182   1HG   GLU  22          HG2       GLU  22  -2.398  -6.718  10.694
  183   2HG   GLU  22          HG1       GLU  22  -1.571  -6.517   9.153
  184    H    LYS  23           HN       LYS  23   2.313  -4.942   9.993
  185    HA   LYS  23           HA       LYS  23   1.519  -2.983   8.080
  186   1HB   LYS  23          HB2       LYS  23   3.898  -4.871   8.007
  187   2HB   LYS  23          HB1       LYS  23   3.713  -3.437   7.000
  188   1HG   LYS  23          HG2       LYS  23   3.783  -3.424  10.033
  189   2HG   LYS  23          HG1       LYS  23   5.147  -3.024   8.992
  190   1HD   LYS  23          HD2       LYS  23   3.461  -1.294   7.925
  191   2HD   LYS  23          HD1       LYS  23   2.599  -1.487   9.452
  192   1HE   LYS  23          HE2       LYS  23   4.102   0.364   9.731
  193   2HE   LYS  23          HE1       LYS  23   4.781  -0.990  10.636
  194   1HZ   LYS  23          HZ1       LYS  23   6.581  -0.225   9.445
  195   2HZ   LYS  23          HZ2       LYS  23   5.660   0.151   8.068
  196   3HZ   LYS  23          HZ3       LYS  23   6.013  -1.469   8.442
  197    H    LYS  24           HN       LYS  24   1.691  -6.503   7.904
  198    HA   LYS  24           HA       LYS  24   1.168  -6.584   5.031
  199   1HB   LYS  24          HB2       LYS  24   0.960  -8.738   7.161
  200   2HB   LYS  24          HB1       LYS  24   0.900  -9.019   5.420
  201   1HG   LYS  24          HG2       LYS  24   3.171  -8.085   5.190
  202   2HG   LYS  24          HG1       LYS  24   3.237  -7.805   6.931
  203   1HD   LYS  24          HD2       LYS  24   2.940 -10.229   7.325
  204   2HD   LYS  24          HD1       LYS  24   2.893 -10.503   5.584
  205   1HE   LYS  24          HE2       LYS  24   5.175  -9.636   5.359
  206   2HE   LYS  24          HE1       LYS  24   5.226  -9.276   7.085
  207   1HZ   LYS  24          HZ1       LYS  24   4.864 -11.652   7.518
  208   2HZ   LYS  24          HZ2       LYS  24   6.305 -11.364   6.666
  209   3HZ   LYS  24          HZ3       LYS  24   4.938 -11.962   5.852
  210    H    ILE  25           HN       ILE  25  -0.815  -6.127   4.205
  211    HA   ILE  25           HA       ILE  25  -3.247  -7.023   5.699
  212    HB   ILE  25           HB       ILE  25  -3.005  -4.641   6.154
  213   1HG1  ILE  25          HG12      ILE  25  -5.061  -4.972   3.954
  214   2HG1  ILE  25          HG11      ILE  25  -5.271  -5.643   5.573
  215   1HG2  ILE  25          HG21      ILE  25  -2.891  -4.330   3.138
  216   2HG2  ILE  25          HG22      ILE  25  -1.536  -4.096   4.244
  217   3HG2  ILE  25          HG23      ILE  25  -2.925  -3.010   4.307
  218   1HD1  ILE  25          HD11      ILE  25  -4.895  -2.721   4.861
  219   2HD1  ILE  25          HD12      ILE  25  -4.930  -3.344   6.510
  220   3HD1  ILE  25          HD13      ILE  25  -6.362  -3.472   5.489
  221    H    THR  26           HN       THR  26  -5.125  -7.295   4.279
  222    HA   THR  26           HA       THR  26  -4.310  -8.322   1.646
  223    HB   THR  26           HB       THR  26  -6.727  -9.060   1.550
  224    HG1  THR  26           HG1      THR  26  -7.884  -7.887   2.871
  225   1HG2  THR  26          HG21      THR  26  -5.059  -9.845   3.955
  226   2HG2  THR  26          HG22      THR  26  -5.000 -10.576   2.351
  227   3HG2  THR  26          HG23      THR  26  -6.439 -10.762   3.353
  228    H    LEU  27           HN       LEU  27  -5.571  -7.822  -0.283
  229    HA   LEU  27           HA       LEU  27  -5.697  -5.041  -0.899
  230   1HB   LEU  27          HB2       LEU  27  -5.473  -7.093  -2.442
  231   2HB   LEU  27          HB1       LEU  27  -7.216  -7.260  -2.295
  232    HG   LEU  27           HG       LEU  27  -7.472  -4.928  -3.172
  233   1HD1  LEU  27          HD11      LEU  27  -4.477  -5.116  -3.148
  234   2HD1  LEU  27          HD12      LEU  27  -5.522  -3.736  -2.814
  235   3HD1  LEU  27          HD13      LEU  27  -5.236  -4.240  -4.474
  236   1HD2  LEU  27          HD21      LEU  27  -6.587  -5.598  -5.531
  237   2HD2  LEU  27          HD22      LEU  27  -7.796  -6.628  -4.771
  238   3HD2  LEU  27          HD23      LEU  27  -6.098  -7.102  -4.758
  239    H    ASN  28           HN       ASN  28  -8.268  -7.420  -0.345
  240    HA   ASN  28           HA       ASN  28 -10.491  -5.670  -0.525
  241   1HB   ASN  28          HB2       ASN  28 -10.083  -8.272   0.949
  242   2HB   ASN  28          HB1       ASN  28 -11.638  -7.437   0.911
  243   1HD2  ASN  28          HD21      ASN  28 -12.043  -6.612  -1.601
  244   2HD2  ASN  28          HD22      ASN  28 -11.893  -7.864  -2.737
  245    H    GLY  29           HN       GLY  29  -8.478  -6.550   2.270
  246   1HA   GLY  29          HA2       GLY  29 -10.027  -5.331   4.292
  247   2HA   GLY  29          HA1       GLY  29  -8.276  -5.512   4.363
  248    H    ILE  30           HN       ILE  30  -7.616  -3.860   2.113
  249    HA   ILE  30           HA       ILE  30  -7.541  -1.295   3.351
  250    HB   ILE  30           HB       ILE  30  -7.188  -2.073   0.440
  251   1HG1  ILE  30          HG12      ILE  30  -5.118  -1.411   2.555
  252   2HG1  ILE  30          HG11      ILE  30  -5.627  -3.059   2.186
  253   1HG2  ILE  30          HG21      ILE  30  -7.650   0.288   0.491
  254   2HG2  ILE  30          HG22      ILE  30  -5.900   0.123   0.370
  255   3HG2  ILE  30          HG23      ILE  30  -6.642   0.515   1.920
  256   1HD1  ILE  30          HD11      ILE  30  -3.544  -2.278   0.959
  257   2HD1  ILE  30          HD12      ILE  30  -4.579  -1.150   0.084
  258   3HD1  ILE  30          HD13      ILE  30  -4.837  -2.886  -0.075
  259    H    TYR  31           HN       TYR  31  -9.729  -2.595   0.850
  260    HA   TYR  31           HA       TYR  31 -11.083  -0.161   0.278
  261   1HB   TYR  31          HB2       TYR  31 -11.819  -3.064   0.083
  262   2HB   TYR  31          HB1       TYR  31 -13.054  -1.852  -0.217
  263    HD1  TYR  31           HD1      TYR  31 -12.337   0.100  -1.816
  264    HD2  TYR  31           HD2      TYR  31 -10.443  -3.737  -1.719
  265    HE1  TYR  31           HE1      TYR  31 -11.484   0.472  -4.103
  266    HE2  TYR  31           HE2      TYR  31  -9.591  -3.377  -4.019
  267    HH   TYR  31           HH       TYR  31  -9.146  -0.866  -5.438
  268    H    GLN  32           HN       GLN  32 -11.729  -2.561   2.825
  269    HA   GLN  32           HA       GLN  32 -14.176  -1.411   3.741
  270   1HB   GLN  32          HB2       GLN  32 -12.071  -3.091   5.101
  271   2HB   GLN  32          HB1       GLN  32 -13.556  -2.600   5.916
  272   1HG   GLN  32          HG2       GLN  32 -13.519  -4.042   3.253
  273   2HG   GLN  32          HG1       GLN  32 -13.659  -4.875   4.801
  274   1HE2  GLN  32          HE21      GLN  32 -15.625  -4.149   2.392
  275   2HE2  GLN  32          HE22      GLN  32 -17.023  -3.655   3.218
  276    H    PHE  33           HN       PHE  33 -10.811  -0.708   4.599
  277    HA   PHE  33           HA       PHE  33 -11.297   0.933   6.861
  278   1HB   PHE  33          HB2       PHE  33  -9.065   0.125   6.195
  279   2HB   PHE  33          HB1       PHE  33  -9.108   1.165   4.773
  280    HD1  PHE  33           HD1      PHE  33  -8.762   1.045   8.430
  281    HD2  PHE  33           HD2      PHE  33  -8.908   3.604   4.983
  282    HE1  PHE  33           HE1      PHE  33  -7.851   2.914   9.780
  283    HE2  PHE  33           HE2      PHE  33  -7.999   5.474   6.334
  284    HZ   PHE  33           HZ       PHE  33  -7.469   5.129   8.732
  285    H    ILE  34           HN       ILE  34 -11.073   1.858   3.407
  286    HA   ILE  34           HA       ILE  34 -11.455   4.666   3.915
  287    HB   ILE  34           HB       ILE  34 -11.846   3.015   1.409
  288   1HG1  ILE  34          HG12      ILE  34  -9.593   4.869   2.232
  289   2HG1  ILE  34          HG11      ILE  34  -9.556   3.125   2.489
  290   1HG2  ILE  34          HG21      ILE  34 -13.104   5.049   1.122
  291   2HG2  ILE  34          HG22      ILE  34 -11.569   5.270   0.282
  292   3HG2  ILE  34          HG23      ILE  34 -11.823   6.010   1.862
  293   1HD1  ILE  34          HD11      ILE  34  -8.422   3.928   0.363
  294   2HD1  ILE  34          HD12      ILE  34 -10.023   4.376  -0.226
  295   3HD1  ILE  34          HD13      ILE  34  -9.654   2.688   0.135
  296    H    MET  35           HN       MET  35 -13.791   2.234   2.627
  297    HA   MET  35           HA       MET  35 -15.988   4.044   2.523
  298   1HB   MET  35          HB2       MET  35 -15.896   1.042   2.841
  299   2HB   MET  35          HB1       MET  35 -17.403   1.937   2.655
  300   1HG   MET  35          HG2       MET  35 -16.551   2.892   0.525
  301   2HG   MET  35          HG1       MET  35 -15.087   1.927   0.704
  302   1HE   MET  35          HE1       MET  35 -14.801  -0.320  -0.283
  303   2HE   MET  35          HE2       MET  35 -15.964  -1.606   0.027
  304   3HE   MET  35          HE3       MET  35 -15.315  -0.670   1.372
  305    H    ASP  36           HN       ASP  36 -14.893   1.938   5.187
  306    HA   ASP  36           HA       ASP  36 -17.147   2.368   6.871
  307   1HB   ASP  36          HB2       ASP  36 -14.256   1.821   7.600
  308   2HB   ASP  36          HB1       ASP  36 -15.614   1.708   8.720
  309    H    ARG  37           HN       ARG  37 -14.000   4.093   6.848
  310    HA   ARG  37           HA       ARG  37 -14.824   5.969   8.873
  311   1HB   ARG  37          HB2       ARG  37 -12.573   6.016   6.861
  312   2HB   ARG  37          HB1       ARG  37 -12.806   7.274   8.076
  313   1HG   ARG  37          HG2       ARG  37 -12.693   5.570   9.857
  314   2HG   ARG  37          HG1       ARG  37 -12.444   4.317   8.646
  315   1HD   ARG  37          HD2       ARG  37 -10.359   5.297   7.950
  316   2HD   ARG  37          HD1       ARG  37 -10.621   6.722   8.945
  317    HE   ARG  37           HE       ARG  37  -9.446   4.210   9.756
  318   1HH1  ARG  37          HH21      ARG  37 -11.600   6.667  10.869
  319   2HH1  ARG  37          HH22      ARG  37 -11.439   6.220  12.535
  320   1HH2  ARG  37          HH11      ARG  37  -9.222   3.634  11.903
  321   2HH2  ARG  37          HH12      ARG  37 -10.092   4.508  13.120
  322    H    PHE  38           HN       PHE  38 -14.809   6.134   5.316
  323    HA   PHE  38           HA       PHE  38 -16.389   8.683   5.529
  324   1HB   PHE  38          HB2       PHE  38 -14.387   7.834   3.414
  325   2HB   PHE  38          HB1       PHE  38 -15.434   9.247   3.292
  326    HD1  PHE  38           HD1      PHE  38 -12.384   7.915   4.699
  327    HD2  PHE  38           HD2      PHE  38 -15.318  11.025   5.099
  328    HE1  PHE  38           HE1      PHE  38 -10.798   9.234   6.082
  329    HE2  PHE  38           HE2      PHE  38 -13.737  12.341   6.483
  330    HZ   PHE  38           HZ       PHE  38 -11.481  11.445   6.976
  331    HA   PRO  39           HA       PRO  39 -19.165   5.415   3.698
  332   1HB   PRO  39          HB2       PRO  39 -21.082   7.515   4.659
  333   2HB   PRO  39          HB1       PRO  39 -21.182   5.749   4.807
  334   1HG   PRO  39          HG2       PRO  39 -20.525   7.247   6.896
  335   2HG   PRO  39          HG1       PRO  39 -19.733   5.686   6.612
  336   1HD   PRO  39          HD2       PRO  39 -18.662   8.451   6.153
  337   2HD   PRO  39          HD1       PRO  39 -17.808   6.989   6.694
  338    H    PHE  40           HN       PHE  40 -18.205   8.531   3.018
  339    HA   PHE  40           HA       PHE  40 -20.031   9.446   1.044
  340   1HB   PHE  40          HB2       PHE  40 -18.405  10.992   1.799
  341   2HB   PHE  40          HB1       PHE  40 -17.084   9.851   1.564
  342    HD1  PHE  40           HD1      PHE  40 -19.703  11.744  -0.331
  343    HD2  PHE  40           HD2      PHE  40 -15.806   9.924  -0.407
  344    HE1  PHE  40           HE1      PHE  40 -19.319  12.661  -2.602
  345    HE2  PHE  40           HE2      PHE  40 -15.429  10.843  -2.682
  346    HZ   PHE  40           HZ       PHE  40 -17.183  12.210  -3.778
  347    H    TYR  41           HN       TYR  41 -17.244   7.279   0.874
  348    HA   TYR  41           HA       TYR  41 -17.293   6.949  -1.986
  349   1HB   TYR  41          HB2       TYR  41 -16.093   5.320   0.261
  350   2HB   TYR  41          HB1       TYR  41 -15.867   4.923  -1.443
  351    HD1  TYR  41           HD1      TYR  41 -14.578   6.356  -2.915
  352    HD2  TYR  41           HD2      TYR  41 -15.148   7.376   1.212
  353    HE1  TYR  41           HE1      TYR  41 -12.801   8.070  -3.110
  354    HE2  TYR  41           HE2      TYR  41 -13.383   9.100   1.035
  355    HH   TYR  41           HH       TYR  41 -12.384  10.515  -1.007
  356    H    ARG  42           HN       ARG  42 -18.989   5.343   0.657
  357    HA   ARG  42           HA       ARG  42 -19.760   2.998  -0.747
  358   1HB   ARG  42          HB2       ARG  42 -21.163   4.552   1.438
  359   2HB   ARG  42          HB1       ARG  42 -21.745   3.001   0.832
  360   1HG   ARG  42          HG2       ARG  42 -19.569   1.972   1.401
  361   2HG   ARG  42          HG1       ARG  42 -19.013   3.520   2.039
  362   1HD   ARG  42          HD2       ARG  42 -19.817   2.094   3.869
  363   2HD   ARG  42          HD1       ARG  42 -20.875   3.492   3.679
  364    HE   ARG  42           HE       ARG  42 -22.059   1.551   2.097
  365   1HH1  ARG  42          HH21      ARG  42 -20.971   1.790   5.362
  366   2HH1  ARG  42          HH22      ARG  42 -22.159   0.690   5.975
  367   1HH2  ARG  42          HH11      ARG  42 -23.620   0.122   2.884
  368   2HH2  ARG  42          HH12      ARG  42 -23.658  -0.252   4.574
  369    H    GLU  43           HN       GLU  43 -21.236   6.242  -0.667
  370    HA   GLU  43           HA       GLU  43 -23.560   5.571  -2.176
  371   1HB   GLU  43          HB2       GLU  43 -22.021   8.160  -1.933
  372   2HB   GLU  43          HB1       GLU  43 -23.558   8.027  -2.789
  373   1HG   GLU  43          HG2       GLU  43 -24.636   7.202  -0.725
  374   2HG   GLU  43          HG1       GLU  43 -23.099   7.342   0.130
  375    H    ASN  44           HN       ASN  44 -20.361   6.583  -3.142
  376    HA   ASN  44           HA       ASN  44 -21.038   6.047  -6.018
  377   1HB   ASN  44          HB2       ASN  44 -18.772   7.670  -4.816
  378   2HB   ASN  44          HB1       ASN  44 -19.042   7.417  -6.539
  379   1HD2  ASN  44          HD21      ASN  44 -21.612   7.908  -7.052
  380   2HD2  ASN  44          HD22      ASN  44 -22.129   9.415  -6.465
  381    H    LYS  45           HN       LYS  45 -20.705   3.683  -5.431
  382    HA   LYS  45           HA       LYS  45 -18.094   2.791  -4.580
  383   1HB   LYS  45          HB2       LYS  45 -20.329   1.341  -6.030
  384   2HB   LYS  45          HB1       LYS  45 -18.890   0.553  -5.383
  385   1HG   LYS  45          HG2       LYS  45 -19.453   1.370  -3.124
  386   2HG   LYS  45          HG1       LYS  45 -20.894   2.155  -3.772
  387   1HD   LYS  45          HD2       LYS  45 -21.765  -0.031  -4.505
  388   2HD   LYS  45          HD1       LYS  45 -20.325  -0.823  -3.860
  389   1HE   LYS  45          HE2       LYS  45 -22.120  -1.003  -2.224
  390   2HE   LYS  45          HE1       LYS  45 -20.892   0.099  -1.603
  391   1HZ   LYS  45          HZ1       LYS  45 -23.383   0.916  -2.996
  392   2HZ   LYS  45          HZ2       LYS  45 -22.210   1.963  -2.354
  393   3HZ   LYS  45          HZ3       LYS  45 -23.134   0.980  -1.320
  394    H    GLN  46           HN       GLN  46 -19.616   3.190  -7.767
  395    HA   GLN  46           HA       GLN  46 -17.332   2.080  -9.184
  396   1HB   GLN  46          HB2       GLN  46 -19.732   3.688 -10.089
  397   2HB   GLN  46          HB1       GLN  46 -18.511   3.063 -11.197
  398   1HG   GLN  46          HG2       GLN  46 -18.954   0.771 -10.403
  399   2HG   GLN  46          HG1       GLN  46 -20.174   1.391  -9.291
  400   1HE2  GLN  46          HE21      GLN  46 -20.559  -0.461 -11.632
  401   2HE2  GLN  46          HE22      GLN  46 -21.686   0.315 -12.638
  402    H    GLY  47           HN       GLY  47 -15.760   3.221 -10.373
  403   1HA   GLY  47          HA2       GLY  47 -14.805   5.292 -11.250
  404   2HA   GLY  47          HA1       GLY  47 -15.605   6.179  -9.957
  405    H    TRP  48           HN       TRP  48 -14.879   5.182  -7.659
  406    HA   TRP  48           HA       TRP  48 -11.943   5.510  -7.630
  407   1HB   TRP  48          HB2       TRP  48 -12.164   5.995  -5.346
  408   2HB   TRP  48          HB1       TRP  48 -13.616   6.680  -6.067
  409    HD1  TRP  48           HD1      TRP  48 -15.906   5.181  -5.812
  410    HE1  TRP  48           HE1      TRP  48 -16.627   3.622  -3.891
  411    HE3  TRP  48           HE3      TRP  48 -11.382   4.371  -3.589
  412    HZ2  TRP  48           HZ2      TRP  48 -15.439   2.216  -1.695
  413    HZ3  TRP  48           HZ3      TRP  48 -11.205   2.918  -1.595
  414    HH2  TRP  48           HH2      TRP  48 -13.219   1.842  -0.641
  415    H    GLN  49           HN       GLN  49 -14.127   2.893  -7.665
  416    HA   GLN  49           HA       GLN  49 -12.808   1.112  -5.861
  417   1HB   GLN  49          HB2       GLN  49 -15.075   0.695  -6.727
  418   2HB   GLN  49          HB1       GLN  49 -14.418   0.467  -8.346
  419   1HG   GLN  49          HG2       GLN  49 -13.134  -1.474  -7.595
  420   2HG   GLN  49          HG1       GLN  49 -13.675  -1.216  -5.935
  421   1HE2  GLN  49          HE21      GLN  49 -14.278  -3.685  -7.070
  422   2HE2  GLN  49          HE22      GLN  49 -15.934  -3.776  -7.430
  423    H    ASN  50           HN       ASN  50 -12.577   1.217  -9.444
  424    HA   ASN  50           HA       ASN  50 -10.375  -0.646  -9.515
  425   1HB   ASN  50          HB2       ASN  50 -11.316   1.376 -11.572
  426   2HB   ASN  50          HB1       ASN  50 -10.159   0.083 -11.883
  427   1HD2  ASN  50          HD21      ASN  50 -13.411   0.821 -12.153
  428   2HD2  ASN  50          HD22      ASN  50 -14.046  -0.753 -12.147
  429    H    SER  51           HN       SER  51 -10.577   2.860  -9.328
  430    HA   SER  51           HA       SER  51  -7.941   3.534 -10.092
  431   1HB   SER  51          HB2       SER  51  -9.831   5.136  -9.631
  432   2HB   SER  51          HB1       SER  51  -9.553   4.878  -7.911
  433    HG   SER  51           HG       SER  51  -7.250   5.422  -8.581
  434    H    ILE  52           HN       ILE  52  -9.181   2.498  -6.924
  435    HA   ILE  52           HA       ILE  52  -6.823   2.996  -5.425
  436    HB   ILE  52           HB       ILE  52  -8.954   0.868  -5.105
  437   1HG1  ILE  52          HG12      ILE  52  -9.456   3.447  -4.990
  438   2HG1  ILE  52          HG11      ILE  52 -10.106   2.384  -3.748
  439   1HG2  ILE  52          HG21      ILE  52  -7.085   0.082  -3.864
  440   2HG2  ILE  52          HG22      ILE  52  -8.141   0.869  -2.691
  441   3HG2  ILE  52          HG23      ILE  52  -6.700   1.700  -3.275
  442   1HD1  ILE  52          HD11      ILE  52  -8.541   3.096  -2.146
  443   2HD1  ILE  52          HD12      ILE  52  -8.941   4.581  -3.006
  444   3HD1  ILE  52          HD13      ILE  52  -7.436   3.736  -3.361
  445    H    ARG  53           HN       ARG  53  -7.833  -0.025  -7.066
  446    HA   ARG  53           HA       ARG  53  -5.381  -1.405  -6.413
  447   1HB   ARG  53          HB2       ARG  53  -7.532  -1.916  -8.482
  448   2HB   ARG  53          HB1       ARG  53  -6.165  -3.002  -8.212
  449   1HG   ARG  53          HG2       ARG  53  -6.801  -3.371  -5.937
  450   2HG   ARG  53          HG1       ARG  53  -8.012  -2.107  -6.003
  451   1HD   ARG  53          HD2       ARG  53  -8.990  -4.401  -6.195
  452   2HD   ARG  53          HD1       ARG  53  -9.338  -3.379  -7.595
  453    HE   ARG  53           HE       ARG  53  -7.041  -4.692  -8.352
  454   1HH1  ARG  53          HH21      ARG  53 -10.077  -5.640  -7.020
  455   2HH1  ARG  53          HH22      ARG  53 -10.110  -7.166  -7.839
  456   1HH2  ARG  53          HH11      ARG  53  -7.072  -6.678  -9.434
  457   2HH2  ARG  53          HH12      ARG  53  -8.411  -7.751  -9.208
  458    H    HIS  54           HN       HIS  54  -6.419   0.530  -9.206
  459    HA   HIS  54           HA       HIS  54  -4.281  -0.163 -10.949
  460   1HB   HIS  54          HB2       HIS  54  -5.949   2.343 -10.669
  461   2HB   HIS  54          HB1       HIS  54  -4.695   2.196 -11.901
  462    HD1  HIS  54           HD1      HIS  54  -5.173  -0.875 -12.483
  463    HD2  HIS  54           HD2      HIS  54  -8.134   2.057 -12.431
  464    HE1  HIS  54           HE1      HIS  54  -7.083  -1.765 -13.886
  465    H    ASN  55           HN       ASN  55  -4.441   2.319  -8.373
  466    HA   ASN  55           HA       ASN  55  -1.825   3.367  -9.001
  467   1HB   ASN  55          HB2       ASN  55  -1.945   4.550  -6.921
  468   2HB   ASN  55          HB1       ASN  55  -3.582   4.529  -7.570
  469   1HD2  ASN  55          HD21      ASN  55  -1.481   2.611  -5.347
  470   2HD2  ASN  55          HD22      ASN  55  -2.741   2.189  -4.291
  471    H    LEU  56           HN       LEU  56  -3.007   0.823  -6.823
  472    HA   LEU  56           HA       LEU  56  -0.528   0.231  -5.563
  473   1HB   LEU  56          HB2       LEU  56  -2.958  -1.448  -6.166
  474   2HB   LEU  56          HB1       LEU  56  -1.559  -2.125  -5.338
  475    HG   LEU  56           HG       LEU  56  -3.022   0.366  -4.414
  476   1HD1  LEU  56          HD11      LEU  56  -3.933  -1.181  -2.629
  477   2HD1  LEU  56          HD12      LEU  56  -3.338  -2.533  -3.593
  478   3HD1  LEU  56          HD13      LEU  56  -4.578  -1.462  -4.244
  479   1HD2  LEU  56          HD21      LEU  56  -0.695  -1.239  -3.401
  480   2HD2  LEU  56          HD22      LEU  56  -1.810  -0.590  -2.205
  481   3HD2  LEU  56          HD23      LEU  56  -0.988   0.497  -3.316
  482    H    SER  57           HN       SER  57  -1.979  -1.201  -8.506
  483    HA   SER  57           HA       SER  57   0.277  -2.922  -9.014
  484   1HB   SER  57          HB2       SER  57  -0.795  -3.442 -11.074
  485   2HB   SER  57          HB1       SER  57  -2.102  -3.146  -9.932
  486    HG   SER  57           HG       SER  57  -2.318  -2.043 -11.980
  487    H    LEU  58           HN       LEU  58  -0.634   0.299 -10.248
  488    HA   LEU  58           HA       LEU  58   1.575   0.472 -12.091
  489   1HB   LEU  58          HB2       LEU  58  -0.121   2.607 -10.779
  490   2HB   LEU  58          HB1       LEU  58   1.065   2.937 -12.040
  491    HG   LEU  58           HG       LEU  58  -1.185   0.938 -12.374
  492   1HD1  LEU  58          HD11      LEU  58  -1.140   3.778 -13.427
  493   2HD1  LEU  58          HD12      LEU  58  -1.994   3.310 -11.957
  494   3HD1  LEU  58          HD13      LEU  58  -2.470   2.623 -13.508
  495   1HD2  LEU  58          HD21      LEU  58   0.905   2.140 -14.185
  496   2HD2  LEU  58          HD22      LEU  58  -0.642   1.639 -14.864
  497   3HD2  LEU  58          HD23      LEU  58   0.377   0.463 -14.047
  498    H    ASN  59           HN       ASN  59   1.116   1.513  -8.724
  499    HA   ASN  59           HA       ASN  59   3.735   2.765  -8.574
  500   1HB   ASN  59          HB2       ASN  59   1.736   1.896  -6.477
  501   2HB   ASN  59          HB1       ASN  59   3.268   2.669  -6.070
  502   1HD2  ASN  59          HD21      ASN  59   0.707   3.898  -5.514
  503   2HD2  ASN  59          HD22      ASN  59   0.583   5.294  -6.473
  504    H    GLU  60           HN       GLU  60   5.593   1.647  -8.543
  505    HA   GLU  60           HA       GLU  60   5.593  -1.240  -8.014
  506   1HB   GLU  60          HB2       GLU  60   7.839   0.681  -8.708
  507   2HB   GLU  60          HB1       GLU  60   7.966  -1.080  -8.687
  508   1HG   GLU  60          HG2       GLU  60   6.254  -1.258 -10.426
  509   2HG   GLU  60          HG1       GLU  60   6.031   0.491 -10.419
  510    H    CYS  61           HN       CYS  61   5.928   1.569  -6.168
  511    HA   CYS  61           HA       CYS  61   7.958   0.859  -4.304
  512   1HB   CYS  61          HB2       CYS  61   5.427   2.492  -3.984
  513   2HB   CYS  61          HB1       CYS  61   6.651   2.349  -2.723
  514    HG   CYS  61           HG       CYS  61   7.530   4.353  -3.982
  515    H    PHE  62           HN       PHE  62   4.496   0.046  -4.419
  516    HA   PHE  62           HA       PHE  62   4.605  -1.411  -1.888
  517   1HB   PHE  62          HB2       PHE  62   2.498  -1.516  -4.072
  518   2HB   PHE  62          HB1       PHE  62   2.308  -2.038  -2.397
  519    HD1  PHE  62           HD1      PHE  62   2.139  -0.408  -0.572
  520    HD2  PHE  62           HD2      PHE  62   2.616   0.842  -4.645
  521    HE1  PHE  62           HE1      PHE  62   1.513   1.907   0.067
  522    HE2  PHE  62           HE2      PHE  62   1.985   3.158  -4.016
  523    HZ   PHE  62           HZ       PHE  62   1.436   3.690  -1.656
  524    H    VAL  63           HN       VAL  63   4.845  -3.633  -1.640
  525    HA   VAL  63           HA       VAL  63   5.551  -5.198  -4.106
  526    HB   VAL  63           HB       VAL  63   6.463  -5.700  -1.263
  527   1HG1  VAL  63          HG11      VAL  63   7.284  -6.772  -3.975
  528   2HG1  VAL  63          HG12      VAL  63   6.582  -7.678  -2.634
  529   3HG1  VAL  63          HG13      VAL  63   8.219  -7.033  -2.502
  530   1HG2  VAL  63          HG21      VAL  63   7.758  -4.157  -3.526
  531   2HG2  VAL  63          HG22      VAL  63   8.663  -4.774  -2.143
  532   3HG2  VAL  63          HG23      VAL  63   7.390  -3.578  -1.902
  533    H    LYS  64           HN       LYS  64   4.301  -6.956  -4.523
  534    HA   LYS  64           HA       LYS  64   2.044  -7.576  -2.803
  535   1HB   LYS  64          HB2       LYS  64   3.153  -9.074  -5.198
  536   2HB   LYS  64          HB1       LYS  64   1.579  -9.351  -4.452
  537   1HG   LYS  64          HG2       LYS  64   0.936  -7.015  -4.949
  538   2HG   LYS  64          HG1       LYS  64   2.503  -6.749  -5.702
  539   1HD   LYS  64          HD2       LYS  64   1.162  -7.231  -7.557
  540   2HD   LYS  64          HD1       LYS  64   1.870  -8.802  -7.198
  541   1HE   LYS  64          HE2       LYS  64  -0.809  -7.966  -6.060
  542   2HE   LYS  64          HE1       LYS  64  -0.660  -8.735  -7.635
  543   1HZ   LYS  64          HZ1       LYS  64  -0.169  -9.846  -4.975
  544   2HZ   LYS  64          HZ2       LYS  64   0.788 -10.412  -6.259
  545   3HZ   LYS  64          HZ3       LYS  64  -0.903 -10.557  -6.328
  546    H    VAL  65           HN       VAL  65   1.885  -9.177  -1.291
  547    HA   VAL  65           HA       VAL  65   4.170 -11.092  -0.984
  548    HB   VAL  65           HB       VAL  65   2.709  -9.516   1.152
  549   1HG1  VAL  65          HG11      VAL  65   3.092 -11.652   2.115
  550   2HG1  VAL  65          HG12      VAL  65   4.456 -10.671   2.646
  551   3HG1  VAL  65          HG13      VAL  65   4.658 -11.818   1.322
  552   1HG2  VAL  65          HG21      VAL  65   4.538  -8.386  -0.198
  553   2HG2  VAL  65          HG22      VAL  65   5.656  -9.583   0.457
  554   3HG2  VAL  65          HG23      VAL  65   4.833  -8.461   1.539
  555    HA   PRO  66           HA       PRO  66   0.474 -13.731  -0.894
  556   1HB   PRO  66          HB2       PRO  66   1.635 -16.148  -1.062
  557   2HB   PRO  66          HB1       PRO  66   1.674 -15.021  -2.436
  558   1HG   PRO  66          HG2       PRO  66   3.797 -15.596  -0.409
  559   2HG   PRO  66          HG1       PRO  66   3.944 -15.433  -2.169
  560   1HD   PRO  66          HD2       PRO  66   4.519 -13.389  -0.395
  561   2HD   PRO  66          HD1       PRO  66   4.017 -13.122  -2.079
  562    H    ARG  67           HN       ARG  67  -0.312 -15.620   0.500
  563    HA   ARG  67           HA       ARG  67   0.139 -15.063   3.302
  564   1HB   ARG  67          HB2       ARG  67  -1.363 -17.192   1.784
  565   2HB   ARG  67          HB1       ARG  67  -1.239 -17.234   3.543
  566   1HG   ARG  67          HG2       ARG  67  -2.376 -15.178   3.781
  567   2HG   ARG  67          HG1       ARG  67  -2.185 -14.772   2.080
  568   1HD   ARG  67          HD2       ARG  67  -3.838 -16.277   1.400
  569   2HD   ARG  67          HD1       ARG  67  -3.696 -17.267   2.847
  570    HE   ARG  67           HE       ARG  67  -5.452 -15.001   2.421
  571   1HH1  ARG  67          HH21      ARG  67  -3.452 -16.486   4.810
  572   2HH1  ARG  67          HH22      ARG  67  -4.237 -15.696   6.135
  573   1HH2  ARG  67          HH11      ARG  67  -6.473 -13.966   4.132
  574   2HH2  ARG  67          HH12      ARG  67  -5.940 -14.268   5.752
  575    H    ASP  68           HN       ASP  68   0.008 -18.380   2.798
  576    HA   ASP  68           HA       ASP  68   2.934 -18.803   2.951
  577   1HB   ASP  68          HB2       ASP  68   2.765 -20.132   5.009
  578   2HB   ASP  68          HB1       ASP  68   2.210 -18.484   5.304
  579    H    ASP  69           HN       ASP  69   3.369 -21.246   2.997
  580    HA   ASP  69           HA       ASP  69   1.995 -22.467   0.799
  581   1HB   ASP  69          HB2       ASP  69   3.909 -23.576   2.866
  582   2HB   ASP  69          HB1       ASP  69   3.313 -24.515   1.495
  583    H    LYS  70           HN       LYS  70   1.633 -22.777   4.302
  584    HA   LYS  70           HA       LYS  70   0.100 -25.161   4.346
  585   1HB   LYS  70          HB2       LYS  70   0.071 -22.745   6.169
  586   2HB   LYS  70          HB1       LYS  70  -0.827 -24.224   6.509
  587   1HG   LYS  70          HG2       LYS  70   1.267 -25.525   6.406
  588   2HG   LYS  70          HG1       LYS  70   2.167 -24.046   6.070
  589   1HD   LYS  70          HD2       LYS  70   1.449 -23.111   8.236
  590   2HD   LYS  70          HD1       LYS  70   0.550 -24.590   8.577
  591   1HE   LYS  70          HE2       LYS  70   3.548 -24.329   8.209
  592   2HE   LYS  70          HE1       LYS  70   2.695 -24.745   9.695
  593   1HZ   LYS  70          HZ1       LYS  70   1.739 -26.596   8.052
  594   2HZ   LYS  70          HZ2       LYS  70   3.127 -26.825   9.005
  595   3HZ   LYS  70          HZ3       LYS  70   3.277 -26.385   7.370
  596    H    LYS  71           HN       LYS  71  -0.947 -21.791   3.876
  597    HA   LYS  71           HA       LYS  71  -3.675 -22.823   3.164
  598   1HB   LYS  71          HB2       LYS  71  -2.823 -20.187   4.378
  599   2HB   LYS  71          HB1       LYS  71  -4.444 -20.501   3.758
  600   1HG   LYS  71          HG2       LYS  71  -4.716 -22.360   5.331
  601   2HG   LYS  71          HG1       LYS  71  -3.071 -22.122   5.922
  602   1HD   LYS  71          HD2       LYS  71  -3.620 -19.954   6.812
  603   2HD   LYS  71          HD1       LYS  71  -5.199 -19.970   6.025
  604   1HE   LYS  71          HE2       LYS  71  -4.347 -21.998   8.109
  605   2HE   LYS  71          HE1       LYS  71  -5.266 -20.540   8.483
  606   1HZ   LYS  71          HZ1       LYS  71  -6.099 -22.955   7.082
  607   2HZ   LYS  71          HZ2       LYS  71  -6.722 -21.485   6.500
  608   3HZ   LYS  71          HZ3       LYS  71  -6.982 -21.940   8.116
  609    HA   PRO  72           HA       PRO  72  -2.318 -21.597  -1.012
  610   1HB   PRO  72          HB2       PRO  72  -5.303 -21.257  -1.219
  611   2HB   PRO  72          HB1       PRO  72  -4.174 -21.978  -2.384
  612   1HG   PRO  72          HG2       PRO  72  -5.667 -23.514  -0.820
  613   2HG   PRO  72          HG1       PRO  72  -3.986 -23.948  -1.184
  614   1HD   PRO  72          HD2       PRO  72  -5.146 -22.911   1.361
  615   2HD   PRO  72          HD1       PRO  72  -3.711 -23.930   1.110
  616    H    GLY  73           HN       GLY  73  -2.531 -19.603  -2.354
  617   1HA   GLY  73          HA2       GLY  73  -2.503 -17.224  -0.712
  618   2HA   GLY  73          HA1       GLY  73  -2.366 -17.259  -2.470
  619    H    LYS  74           HN       LYS  74  -4.743 -17.516   0.167
  620    HA   LYS  74           HA       LYS  74  -7.075 -17.323  -1.448
  621   1HB   LYS  74          HB2       LYS  74  -6.547 -16.430   1.394
  622   2HB   LYS  74          HB1       LYS  74  -8.148 -16.403   0.652
  623   1HG   LYS  74          HG2       LYS  74  -7.988 -18.829   0.221
  624   2HG   LYS  74          HG1       LYS  74  -6.391 -18.855   0.968
  625   1HD   LYS  74          HD2       LYS  74  -7.366 -18.068   3.094
  626   2HD   LYS  74          HD1       LYS  74  -8.966 -18.046   2.349
  627   1HE   LYS  74          HE2       LYS  74  -8.835 -20.126   3.509
  628   2HE   LYS  74          HE1       LYS  74  -8.592 -20.517   1.806
  629   1HZ   LYS  74          HZ1       LYS  74  -6.748 -20.698   4.020
  630   2HZ   LYS  74          HZ2       LYS  74  -6.090 -19.992   2.623
  631   3HZ   LYS  74          HZ3       LYS  74  -6.769 -21.548   2.553
  632    H    GLY  75           HN       GLY  75  -5.001 -14.930  -0.025
  633   1HA   GLY  75          HA2       GLY  75  -6.003 -12.881  -1.929
  634   2HA   GLY  75          HA1       GLY  75  -6.053 -12.493  -0.206
  635    H    SER  76           HN       SER  76  -4.446 -11.044  -2.075
  636    HA   SER  76           HA       SER  76  -1.666 -11.989  -1.542
  637   1HB   SER  76          HB2       SER  76  -1.952 -11.381  -3.820
  638   2HB   SER  76          HB1       SER  76  -2.859  -9.929  -3.404
  639    HG   SER  76           HG       SER  76  -0.921  -9.134  -2.439
  640    H    TYR  77           HN       TYR  77  -0.685 -11.188   0.237
  641    HA   TYR  77           HA       TYR  77  -1.763  -8.896   1.684
  642   1HB   TYR  77          HB2       TYR  77   0.786 -10.499   2.039
  643   2HB   TYR  77          HB1       TYR  77   0.280  -9.214   3.117
  644    HD1  TYR  77           HD1      TYR  77   0.675 -11.320   4.649
  645    HD2  TYR  77           HD2      TYR  77  -2.695 -10.902   1.995
  646    HE1  TYR  77           HE1      TYR  77  -0.610 -12.939   6.003
  647    HE2  TYR  77           HE2      TYR  77  -3.963 -12.496   3.367
  648    HH   TYR  77           HH       TYR  77  -3.978 -13.365   5.645
  649    H    TRP  78           HN       TRP  78  -0.771  -6.863   1.930
  650    HA   TRP  78           HA       TRP  78   1.266  -6.161  -0.164
  651   1HB   TRP  78          HB2       TRP  78  -1.037  -4.531   0.947
  652   2HB   TRP  78          HB1       TRP  78   0.191  -3.907  -0.154
  653    HD1  TRP  78           HD1      TRP  78  -2.628  -6.517   0.000
  654    HE1  TRP  78           HE1      TRP  78  -3.407  -7.020  -2.405
  655    HE3  TRP  78           HE3      TRP  78   0.813  -3.811  -2.622
  656    HZ2  TRP  78           HZ2      TRP  78  -2.666  -6.356  -5.092
  657    HZ3  TRP  78           HZ3      TRP  78   0.757  -3.762  -5.097
  658    HH2  TRP  78           HH2      TRP  78  -0.975  -5.028  -6.335
  659    H    THR  79           HN       THR  79   3.005  -4.898   0.512
  660    HA   THR  79           HA       THR  79   3.010  -3.837   3.291
  661    HB   THR  79           HB       THR  79   4.000  -6.148   3.330
  662    HG1  THR  79           HG1      THR  79   5.674  -5.497   4.580
  663   1HG2  THR  79          HG21      THR  79   6.212  -4.916   1.668
  664   2HG2  THR  79          HG22      THR  79   4.958  -5.959   0.996
  665   3HG2  THR  79          HG23      THR  79   6.076  -6.590   2.206
  666    H    LEU  80           HN       LEU  80   4.797  -2.276   3.620
  667    HA   LEU  80           HA       LEU  80   5.284  -0.735   1.152
  668   1HB   LEU  80          HB2       LEU  80   6.067  -0.158   4.027
  669   2HB   LEU  80          HB1       LEU  80   6.176   0.976   2.680
  670    HG   LEU  80           HG       LEU  80   3.623  -0.300   3.694
  671   1HD1  LEU  80          HD11      LEU  80   3.135   2.134   4.324
  672   2HD1  LEU  80          HD12      LEU  80   4.855   2.434   4.073
  673   3HD1  LEU  80          HD13      LEU  80   4.330   1.298   5.315
  674   1HD2  LEU  80          HD21      LEU  80   2.703   1.670   2.194
  675   2HD2  LEU  80          HD22      LEU  80   3.175   0.151   1.445
  676   3HD2  LEU  80          HD23      LEU  80   4.268   1.534   1.393
  677    H    ASP  81           HN       ASP  81   7.230  -0.551   0.138
  678    HA   ASP  81           HA       ASP  81   9.321  -2.454   0.762
  679   1HB   ASP  81          HB2       ASP  81   8.795  -1.717  -1.557
  680   2HB   ASP  81          HB1       ASP  81   9.375  -0.102  -1.150
  681    HA   PRO  82           HA       PRO  82  11.400   0.458   3.519
  682   1HB   PRO  82          HB2       PRO  82  13.617  -0.963   4.128
  683   2HB   PRO  82          HB1       PRO  82  12.014  -1.456   4.712
  684   1HG   PRO  82          HG2       PRO  82  13.587  -2.515   2.402
  685   2HG   PRO  82          HG1       PRO  82  12.664  -3.399   3.630
  686   1HD   PRO  82          HD2       PRO  82  11.686  -2.842   1.110
  687   2HD   PRO  82          HD1       PRO  82  10.650  -3.082   2.535
  688    H    ASP  83           HN       ASP  83  14.169   0.822   3.666
  689    HA   ASP  83           HA       ASP  83  14.684   2.247   1.146
  690   1HB   ASP  83          HB2       ASP  83  16.224   2.019   3.746
  691   2HB   ASP  83          HB1       ASP  83  16.794   2.949   2.360
  692    H    SER  84           HN       SER  84  14.548  -0.480   0.690
  693    HA   SER  84           HA       SER  84  16.898  -1.998   0.880
  694   1HB   SER  84          HB2       SER  84  14.757  -2.875   0.009
  695   2HB   SER  84          HB1       SER  84  14.958  -1.906  -1.448
  696    HG   SER  84           HG       SER  84  16.110  -3.498  -2.168
  697    H    TYR  85           HN       TYR  85  16.127   0.639  -1.305
  698    HA   TYR  85           HA       TYR  85  18.184   0.234  -3.227
  699   1HB   TYR  85          HB2       TYR  85  17.617   3.069  -2.524
  700   2HB   TYR  85          HB1       TYR  85  17.493   2.251  -4.079
  701    HD1  TYR  85           HD1      TYR  85  15.478   0.828  -4.578
  702    HD2  TYR  85           HD2      TYR  85  15.747   3.312  -1.088
  703    HE1  TYR  85           HE1      TYR  85  13.020   0.672  -4.283
  704    HE2  TYR  85           HE2      TYR  85  13.284   3.163  -0.791
  705    HH   TYR  85           HH       TYR  85  11.452   1.417  -1.504
  706    H    ASN  86           HN       ASN  86  18.223   1.877  -0.080
  707    HA   ASN  86           HA       ASN  86  21.020   2.675  -0.440
  708   1HB   ASN  86          HB2       ASN  86  19.078   2.977   1.852
  709   2HB   ASN  86          HB1       ASN  86  20.745   3.547   1.916
  710   1HD2  ASN  86          HD21      ASN  86  21.201   4.703  -0.516
  711   2HD2  ASN  86          HD22      ASN  86  20.084   5.940  -0.834
  712    H    MET  87           HN       MET  87  19.841  -0.258   0.108
  713    HA   MET  87           HA       MET  87  21.415  -0.991   2.478
  714   1HB   MET  87          HB2       MET  87  19.810  -2.585   0.472
  715   2HB   MET  87          HB1       MET  87  20.789  -3.366   1.713
  716   1HG   MET  87          HG2       MET  87  18.687  -1.275   2.325
  717   2HG   MET  87          HG1       MET  87  18.373  -3.010   2.361
  718   1HE   MET  87          HE1       MET  87  18.732  -1.231   5.977
  719   2HE   MET  87          HE2       MET  87  17.804  -1.085   4.487
  720   3HE   MET  87          HE3       MET  87  19.239  -0.090   4.724
  721    H    PHE  88           HN       PHE  88  23.378  -2.086   2.479
  722    HA   PHE  88           HA       PHE  88  24.632  -2.848  -0.081
  723   1HB   PHE  88          HB2       PHE  88  25.813  -0.756   1.775
  724   2HB   PHE  88          HB1       PHE  88  26.663  -1.493   0.417
  725    HD1  PHE  88           HD1      PHE  88  24.722   1.281   1.373
  726    HD2  PHE  88           HD2      PHE  88  25.287  -1.477  -1.872
  727    HE1  PHE  88           HE1      PHE  88  23.705   2.913  -0.192
  728    HE2  PHE  88           HE2      PHE  88  24.269   0.155  -3.437
  729    HZ   PHE  88           HZ       PHE  88  23.478   2.351  -2.597
  730    H    GLU  89           HN       GLU  89  27.253  -2.688   1.586
  731    HA   GLU  89           HA       GLU  89  26.919  -5.367   2.782
  732   1HB   GLU  89          HB2       GLU  89  29.404  -3.672   2.388
  733   2HB   GLU  89          HB1       GLU  89  29.376  -5.354   2.910
  734   1HG   GLU  89          HG2       GLU  89  29.764  -5.536   0.598
  735   2HG   GLU  89          HG1       GLU  89  28.026  -5.789   0.729
  736    H    ASN  90           HN       ASN  90  26.223  -2.490   3.933
  737    HA   ASN  90           HA       ASN  90  27.294  -3.075   6.677
  738   1HB   ASN  90          HB2       ASN  90  28.357  -1.060   5.555
  739   2HB   ASN  90          HB1       ASN  90  26.762  -0.308   5.565
  740   1HD2  ASN  90          HD21      ASN  90  26.711   1.158   7.277
  741   2HD2  ASN  90          HD22      ASN  90  27.295   0.848   8.840
  742    H    GLY  91           HN       GLY  91  25.747  -3.097   8.269
  743   1HA   GLY  91          HA2       GLY  91  23.223  -1.677   7.983
  744   2HA   GLY  91          HA1       GLY  91  23.043  -3.419   7.774
  745    H    SER  92           HN       SER  92  23.870  -0.883  10.055
  746    HA   SER  92           HA       SER  92  24.012  -2.864  12.281
  747   1HB   SER  92          HB2       SER  92  24.505   0.125  12.368
  748   2HB   SER  92          HB1       SER  92  24.910  -1.056  13.611
  749    HG   SER  92           HG       SER  92  26.743  -0.661  12.410
  750    H    PHE  93           HN       PHE  93  21.574  -1.630  10.698
  751    HA   PHE  93           HA       PHE  93  20.052  -0.080  12.532
  752   1HB   PHE  93          HB2       PHE  93  19.370  -0.256  10.223
  753   2HB   PHE  93          HB1       PHE  93  19.203  -2.004  10.353
  754    HD1  PHE  93           HD1      PHE  93  16.994  -2.751  10.458
  755    HD2  PHE  93           HD2      PHE  93  18.013   1.008  12.277
  756    HE1  PHE  93           HE1      PHE  93  14.639  -2.452  11.165
  757    HE2  PHE  93           HE2      PHE  93  15.658   1.301  12.987
  758    HZ   PHE  93           HZ       PHE  93  13.970  -0.427  12.430
  759    H    LEU  94           HN       LEU  94  20.042  -3.617  11.990
  760    HA   LEU  94           HA       LEU  94  19.124  -3.975  14.814
  761   1HB   LEU  94          HB2       LEU  94  17.965  -5.236  12.317
  762   2HB   LEU  94          HB1       LEU  94  17.768  -5.969  13.906
  763    HG   LEU  94           HG       LEU  94  16.980  -3.113  13.267
  764   1HD1  LEU  94          HD11      LEU  94  14.697  -3.889  13.057
  765   2HD1  LEU  94          HD12      LEU  94  15.171  -5.537  13.469
  766   3HD1  LEU  94          HD13      LEU  94  15.695  -4.824  11.943
  767   1HD2  LEU  94          HD21      LEU  94  16.777  -4.894  15.680
  768   2HD2  LEU  94          HD22      LEU  94  15.463  -3.761  15.377
  769   3HD2  LEU  94          HD23      LEU  94  17.104  -3.165  15.583
  Start of MODEL   14
    1   1H    MET   1          HT1       MET   1 -24.930  15.094   1.768
    2   2H    MET   1          HT2       MET   1 -23.942  16.354   1.200
    3   3H    MET   1          HT3       MET   1 -25.408  16.708   1.982
    4    HA   MET   1           HA       MET   1 -23.598  17.113   3.489
    5   1HB   MET   1          HB2       MET   1 -24.234  15.385   5.251
    6   2HB   MET   1          HB1       MET   1 -25.569  16.314   4.571
    7   1HG   MET   1          HG2       MET   1 -26.076  14.475   3.020
    8   2HG   MET   1          HG1       MET   1 -24.720  13.549   3.660
    9   1HE   MET   1          HE1       MET   1 -28.737  14.573   5.425
   10   2HE   MET   1          HE2       MET   1 -27.752  15.491   4.291
   11   3HE   MET   1          HE3       MET   1 -27.498  15.681   6.023
   12    H    LEU   2           HN       LEU   2 -22.699  15.251   1.227
   13    HA   LEU   2           HA       LEU   2 -20.607  13.730   2.760
   14   1HB   LEU   2          HB2       LEU   2 -21.747  13.167   0.005
   15   2HB   LEU   2          HB1       LEU   2 -20.511  12.213   0.822
   16    HG   LEU   2           HG       LEU   2 -23.288  12.685   1.944
   17   1HD1  LEU   2          HD11      LEU   2 -23.243  11.392  -0.234
   18   2HD1  LEU   2          HD12      LEU   2 -23.891  10.498   1.140
   19   3HD1  LEU   2          HD13      LEU   2 -22.247  10.187   0.583
   20   1HD2  LEU   2          HD21      LEU   2 -20.917  10.991   2.745
   21   2HD2  LEU   2          HD22      LEU   2 -22.550  10.532   3.224
   22   3HD2  LEU   2          HD23      LEU   2 -21.885  12.077   3.741
   23    H    VAL   3           HN       VAL   3 -18.467  14.042   2.131
   24    HA   VAL   3           HA       VAL   3 -17.938  15.810  -0.222
   25    HB   VAL   3           HB       VAL   3 -16.358  17.139   1.084
   26   1HG1  VAL   3          HG11      VAL   3 -17.933  18.416   2.344
   27   2HG1  VAL   3          HG12      VAL   3 -18.948  17.004   2.639
   28   3HG1  VAL   3          HG13      VAL   3 -18.849  17.696   1.019
   29   1HG2  VAL   3          HG21      VAL   3 -16.407  16.818   3.618
   30   2HG2  VAL   3          HG22      VAL   3 -15.573  15.562   2.703
   31   3HG2  VAL   3          HG23      VAL   3 -17.202  15.274   3.313
   32    H    LYS   4           HN       LYS   4 -15.685  15.665  -0.952
   33    HA   LYS   4           HA       LYS   4 -14.636  12.934  -0.677
   34   1HB   LYS   4          HB2       LYS   4 -13.813  15.326  -2.335
   35   2HB   LYS   4          HB1       LYS   4 -12.963  13.782  -2.376
   36   1HG   LYS   4          HG2       LYS   4 -14.768  12.658  -3.357
   37   2HG   LYS   4          HG1       LYS   4 -15.945  13.848  -2.803
   38   1HD   LYS   4          HD2       LYS   4 -15.600  14.096  -5.208
   39   2HD   LYS   4          HD1       LYS   4 -14.958  15.510  -4.372
   40   1HE   LYS   4          HE2       LYS   4 -12.692  14.633  -4.531
   41   2HE   LYS   4          HE1       LYS   4 -13.289  13.127  -5.230
   42   1HZ   LYS   4          HZ1       LYS   4 -13.631  14.084  -7.226
   43   2HZ   LYS   4          HZ2       LYS   4 -12.444  15.173  -6.685
   44   3HZ   LYS   4          HZ3       LYS   4 -14.090  15.580  -6.570
   45    HA   PRO   5           HA       PRO   5 -11.993  14.411   2.750
   46   1HB   PRO   5          HB2       PRO   5 -10.449  11.953   1.986
   47   2HB   PRO   5          HB1       PRO   5 -10.958  12.508   3.596
   48   1HG   PRO   5          HG2       PRO   5 -12.228  10.524   2.359
   49   2HG   PRO   5          HG1       PRO   5 -13.107  11.714   3.334
   50   1HD   PRO   5          HD2       PRO   5 -12.978  11.450   0.355
   51   2HD   PRO   5          HD1       PRO   5 -14.301  12.045   1.385
   52    HA   PRO   6           HA       PRO   6  -8.778  16.307   0.282
   53   1HB   PRO   6          HB2       PRO   6  -7.106  17.247   2.196
   54   2HB   PRO   6          HB1       PRO   6  -8.741  17.903   1.976
   55   1HG   PRO   6          HG2       PRO   6  -7.772  15.892   3.967
   56   2HG   PRO   6          HG1       PRO   6  -8.825  17.297   4.216
   57   1HD   PRO   6          HD2       PRO   6  -9.804  14.750   3.935
   58   2HD   PRO   6          HD1       PRO   6 -10.710  16.195   3.428
   59    H    TYR   7           HN       TYR   7  -8.179  13.474   2.059
   60    HA   TYR   7           HA       TYR   7  -5.316  13.301   1.764
   61   1HB   TYR   7          HB2       TYR   7  -7.313  11.029   1.945
   62   2HB   TYR   7          HB1       TYR   7  -5.592  10.951   2.318
   63    HD1  TYR   7           HD1      TYR   7  -4.711  12.581   4.158
   64    HD2  TYR   7           HD2      TYR   7  -8.846  11.554   3.637
   65    HE1  TYR   7           HE1      TYR   7  -5.184  13.299   6.485
   66    HE2  TYR   7           HE2      TYR   7  -9.326  12.278   5.955
   67    HH   TYR   7           HH       TYR   7  -8.493  13.377   7.747
   68    H    SER   8           HN       SER   8  -4.108  12.393   0.107
   69    HA   SER   8           HA       SER   8  -5.284  12.347  -2.539
   70   1HB   SER   8          HB2       SER   8  -2.585  11.320  -1.601
   71   2HB   SER   8          HB1       SER   8  -3.048  11.622  -3.273
   72    HG   SER   8           HG       SER   8  -3.118  13.772  -2.868
   73    H    TYR   9           HN       TYR   9  -5.262  10.376  -3.953
   74    HA   TYR   9           HA       TYR   9  -6.613   8.184  -2.728
   75   1HB   TYR   9          HB2       TYR   9  -5.196   8.502  -5.381
   76   2HB   TYR   9          HB1       TYR   9  -5.939   6.971  -4.919
   77    HD1  TYR   9           HD1      TYR   9  -8.393   6.823  -4.541
   78    HD2  TYR   9           HD2      TYR   9  -6.532  10.430  -5.947
   79    HE1  TYR   9           HE1      TYR   9 -10.605   7.688  -5.242
   80    HE2  TYR   9           HE2      TYR   9  -8.749  11.297  -6.646
   81    HH   TYR   9           HH       TYR   9 -11.485   9.341  -6.895
   82    H    ILE  10           HN       ILE  10  -3.194   8.664  -3.570
   83    HA   ILE  10           HA       ILE  10  -2.368   6.016  -2.758
   84    HB   ILE  10           HB       ILE  10  -0.799   8.598  -3.039
   85   1HG1  ILE  10          HG12      ILE  10  -0.917   6.156  -4.834
   86   2HG1  ILE  10          HG11      ILE  10  -1.899   7.598  -5.090
   87   1HG2  ILE  10          HG21      ILE  10   1.172   7.017  -3.138
   88   2HG2  ILE  10          HG22      ILE  10   0.097   5.740  -2.571
   89   3HG2  ILE  10          HG23      ILE  10   0.421   7.140  -1.547
   90   1HD1  ILE  10          HD11      ILE  10   0.100   7.749  -6.469
   91   2HD1  ILE  10          HD12      ILE  10   1.128   7.462  -5.065
   92   3HD1  ILE  10          HD13      ILE  10   0.198   8.956  -5.185
   93    H    ALA  11           HN       ALA  11  -2.573   9.157  -1.127
   94    HA   ALA  11           HA       ALA  11  -1.282   8.435   1.303
   95   1HB   ALA  11          HB1       ALA  11  -3.621  10.342   0.943
   96   2HB   ALA  11          HB2       ALA  11  -1.932  10.765   0.662
   97   3HB   ALA  11          HB3       ALA  11  -2.476  10.336   2.284
   98    H    LEU  12           HN       LEU  12  -4.714   8.118   0.344
   99    HA   LEU  12           HA       LEU  12  -5.675   7.182   2.860
  100   1HB   LEU  12          HB2       LEU  12  -6.581   6.529   0.041
  101   2HB   LEU  12          HB1       LEU  12  -7.481   6.086   1.487
  102    HG   LEU  12           HG       LEU  12  -6.685   8.938   0.843
  103   1HD1  LEU  12          HD11      LEU  12  -9.025   9.218   0.064
  104   2HD1  LEU  12          HD12      LEU  12  -9.284   7.484   0.260
  105   3HD1  LEU  12          HD13      LEU  12  -8.134   8.074  -0.940
  106   1HD2  LEU  12          HD21      LEU  12  -8.466   7.608   2.891
  107   2HD2  LEU  12          HD22      LEU  12  -8.781   9.266   2.391
  108   3HD2  LEU  12          HD23      LEU  12  -7.240   8.851   3.131
  109    H    ILE  13           HN       ILE  13  -4.213   5.481   0.117
  110    HA   ILE  13           HA       ILE  13  -4.557   2.830   1.196
  111    HB   ILE  13           HB       ILE  13  -2.477   3.891  -0.742
  112   1HG1  ILE  13          HG12      ILE  13  -5.104   2.487  -1.324
  113   2HG1  ILE  13          HG11      ILE  13  -4.916   4.239  -1.362
  114   1HG2  ILE  13          HG21      ILE  13  -2.502   1.465  -1.504
  115   2HG2  ILE  13          HG22      ILE  13  -3.427   1.100  -0.048
  116   3HG2  ILE  13          HG23      ILE  13  -1.788   1.737   0.086
  117   1HD1  ILE  13          HD11      ILE  13  -3.726   2.172  -3.195
  118   2HD1  ILE  13          HD12      ILE  13  -2.917   3.726  -2.994
  119   3HD1  ILE  13          HD13      ILE  13  -4.568   3.665  -3.604
  120    H    THR  14           HN       THR  14  -1.955   5.238   1.354
  121    HA   THR  14           HA       THR  14  -0.052   3.594   2.712
  122    HB   THR  14           HB       THR  14  -0.382   6.600   2.781
  123    HG1  THR  14           HG1      THR  14   0.593   6.575   0.921
  124   1HG2  THR  14          HG21      THR  14   1.852   4.741   3.603
  125   2HG2  THR  14          HG22      THR  14   1.065   5.989   4.570
  126   3HG2  THR  14          HG23      THR  14   2.129   6.445   3.240
  127    H    MET  15           HN       MET  15  -2.590   5.767   3.922
  128    HA   MET  15           HA       MET  15  -1.833   5.501   6.696
  129   1HB   MET  15          HB2       MET  15  -4.417   6.344   5.364
  130   2HB   MET  15          HB1       MET  15  -4.177   6.373   7.110
  131   1HG   MET  15          HG2       MET  15  -2.141   7.822   6.716
  132   2HG   MET  15          HG1       MET  15  -2.624   7.927   5.024
  133   1HE   MET  15          HE1       MET  15  -5.773   9.891   4.878
  134   2HE   MET  15          HE2       MET  15  -5.867   8.148   5.105
  135   3HE   MET  15          HE3       MET  15  -4.582   8.832   4.112
  136    H    ALA  16           HN       ALA  16  -4.088   3.773   4.590
  137    HA   ALA  16           HA       ALA  16  -5.407   2.233   6.576
  138   1HB   ALA  16          HB1       ALA  16  -5.868   0.646   4.712
  139   2HB   ALA  16          HB2       ALA  16  -4.702   1.519   3.715
  140   3HB   ALA  16          HB3       ALA  16  -6.175   2.323   4.256
  141    H    ILE  17           HN       ILE  17  -2.446   1.499   4.712
  142    HA   ILE  17           HA       ILE  17  -1.951  -1.082   5.818
  143    HB   ILE  17           HB       ILE  17   0.053   1.030   4.934
  144   1HG1  ILE  17          HG12      ILE  17  -1.096  -1.276   3.346
  145   2HG1  ILE  17          HG11      ILE  17  -1.767   0.355   3.293
  146   1HG2  ILE  17          HG21      ILE  17   1.471  -1.000   4.458
  147   2HG2  ILE  17          HG22      ILE  17   0.260  -1.976   5.289
  148   3HG2  ILE  17          HG23      ILE  17   1.159  -0.746   6.176
  149   1HD1  ILE  17          HD11      ILE  17   1.155  -0.208   2.757
  150   2HD1  ILE  17          HD12      ILE  17   0.254   1.267   2.407
  151   3HD1  ILE  17          HD13      ILE  17  -0.056  -0.198   1.474
  152    H    GLN  18           HN       GLN  18  -0.762   2.111   6.761
  153    HA   GLN  18           HA       GLN  18   0.664   1.241   9.097
  154   1HB   GLN  18          HB2       GLN  18  -0.422   3.933   8.242
  155   2HB   GLN  18          HB1       GLN  18   0.564   3.705   9.688
  156   1HG   GLN  18          HG2       GLN  18   2.419   2.885   8.388
  157   2HG   GLN  18          HG1       GLN  18   1.433   2.812   6.928
  158   1HE2  GLN  18          HE21      GLN  18   3.924   4.428   7.419
  159   2HE2  GLN  18          HE22      GLN  18   3.477   6.041   7.137
  160    H    ASN  19           HN       ASN  19  -2.635   2.495   8.639
  161    HA   ASN  19           HA       ASN  19  -3.250   2.678  11.440
  162   1HB   ASN  19          HB2       ASN  19  -5.034   2.361   9.010
  163   2HB   ASN  19          HB1       ASN  19  -5.636   2.674  10.639
  164   1HD2  ASN  19          HD21      ASN  19  -2.633   4.179  10.330
  165   2HD2  ASN  19          HD22      ASN  19  -3.165   5.735   9.909
  166    H    ALA  20           HN       ALA  20  -3.017   0.006   9.277
  167    HA   ALA  20           HA       ALA  20  -4.787  -1.765  10.769
  168   1HB   ALA  20          HB1       ALA  20  -3.946  -3.494   9.265
  169   2HB   ALA  20          HB2       ALA  20  -2.589  -2.472   8.797
  170   3HB   ALA  20          HB3       ALA  20  -4.230  -2.031   8.325
  171    HA   PRO  21           HA       PRO  21  -1.905  -2.928  13.970
  172   1HB   PRO  21          HB2       PRO  21  -2.439  -5.661  14.175
  173   2HB   PRO  21          HB1       PRO  21  -3.409  -4.389  14.939
  174   1HG   PRO  21          HG2       PRO  21  -3.902  -5.870  12.397
  175   2HG   PRO  21          HG1       PRO  21  -5.051  -5.367  13.649
  176   1HD   PRO  21          HD2       PRO  21  -4.832  -4.015  11.326
  177   2HD   PRO  21          HD1       PRO  21  -5.163  -3.169  12.854
  178    H    GLU  22           HN       GLU  22  -2.149  -5.376  11.389
  179    HA   GLU  22           HA       GLU  22   0.829  -5.652  11.381
  180   1HB   GLU  22          HB2       GLU  22  -1.358  -7.328  10.096
  181   2HB   GLU  22          HB1       GLU  22   0.370  -7.643   9.941
  182   1HG   GLU  22          HG2       GLU  22  -1.112  -7.529  12.583
  183   2HG   GLU  22          HG1       GLU  22  -0.725  -9.020  11.723
  184    H    LYS  23           HN       LYS  23   1.954  -4.866   9.584
  185    HA   LYS  23           HA       LYS  23   0.600  -3.030   7.858
  186   1HB   LYS  23          HB2       LYS  23   3.339  -4.304   7.626
  187   2HB   LYS  23          HB1       LYS  23   2.758  -3.025   6.556
  188   1HG   LYS  23          HG2       LYS  23   2.385  -1.560   8.512
  189   2HG   LYS  23          HG1       LYS  23   2.980  -2.834   9.576
  190   1HD   LYS  23          HD2       LYS  23   5.168  -2.772   8.426
  191   2HD   LYS  23          HD1       LYS  23   4.566  -1.491   7.371
  192   1HE   LYS  23          HE2       LYS  23   5.849  -0.496   9.202
  193   2HE   LYS  23          HE1       LYS  23   4.145  -0.075   9.378
  194   1HZ   LYS  23          HZ1       LYS  23   5.364  -2.412  10.728
  195   2HZ   LYS  23          HZ2       LYS  23   3.860  -1.687  11.046
  196   3HZ   LYS  23          HZ3       LYS  23   5.299  -0.876  11.445
  197    H    LYS  24           HN       LYS  24   0.979  -6.455   7.702
  198    HA   LYS  24           HA       LYS  24   0.583  -6.629   4.804
  199   1HB   LYS  24          HB2       LYS  24   0.417  -8.683   7.025
  200   2HB   LYS  24          HB1       LYS  24   0.148  -9.074   5.330
  201   1HG   LYS  24          HG2       LYS  24   2.421  -8.209   4.800
  202   2HG   LYS  24          HG1       LYS  24   2.683  -7.906   6.518
  203   1HD   LYS  24          HD2       LYS  24   2.229 -10.337   6.954
  204   2HD   LYS  24          HD1       LYS  24   2.163 -10.592   5.210
  205   1HE   LYS  24          HE2       LYS  24   4.540  -9.550   6.782
  206   2HE   LYS  24          HE1       LYS  24   4.402 -11.135   6.023
  207   1HZ   LYS  24          HZ1       LYS  24   5.335 -10.166   4.270
  208   2HZ   LYS  24          HZ2       LYS  24   5.050  -8.597   4.855
  209   3HZ   LYS  24          HZ3       LYS  24   3.833  -9.424   4.004
  210    H    ILE  25           HN       ILE  25  -1.375  -6.449   3.816
  211    HA   ILE  25           HA       ILE  25  -3.832  -7.276   5.237
  212    HB   ILE  25           HB       ILE  25  -3.579  -4.916   5.877
  213   1HG1  ILE  25          HG12      ILE  25  -5.691  -5.049   3.717
  214   2HG1  ILE  25          HG11      ILE  25  -5.841  -5.976   5.210
  215   1HG2  ILE  25          HG21      ILE  25  -2.207  -4.391   3.763
  216   2HG2  ILE  25          HG22      ILE  25  -3.354  -3.162   4.294
  217   3HG2  ILE  25          HG23      ILE  25  -3.759  -4.220   2.942
  218   1HD1  ILE  25          HD11      ILE  25  -5.656  -3.907   6.529
  219   2HD1  ILE  25          HD12      ILE  25  -6.996  -3.796   5.388
  220   3HD1  ILE  25          HD13      ILE  25  -5.477  -2.969   5.046
  221    H    THR  26           HN       THR  26  -5.600  -7.642   3.769
  222    HA   THR  26           HA       THR  26  -4.714  -8.323   1.066
  223    HB   THR  26           HB       THR  26  -6.978  -9.223   0.791
  224    HG1  THR  26           HG1      THR  26  -7.791  -8.666   3.335
  225   1HG2  THR  26          HG21      THR  26  -5.899  -9.805   3.564
  226   2HG2  THR  26          HG22      THR  26  -5.307 -10.542   2.074
  227   3HG2  THR  26          HG23      THR  26  -6.957 -10.851   2.617
  228    H    LEU  27           HN       LEU  27  -5.832  -7.527  -0.870
  229    HA   LEU  27           HA       LEU  27  -5.992  -4.689  -1.007
  230   1HB   LEU  27          HB2       LEU  27  -5.544  -6.179  -2.936
  231   2HB   LEU  27          HB1       LEU  27  -7.187  -6.796  -2.840
  232    HG   LEU  27           HG       LEU  27  -8.067  -4.531  -3.362
  233   1HD1  LEU  27          HD11      LEU  27  -5.127  -3.851  -3.267
  234   2HD1  LEU  27          HD12      LEU  27  -6.480  -3.009  -2.509
  235   3HD1  LEU  27          HD13      LEU  27  -6.241  -2.901  -4.250
  236   1HD2  LEU  27          HD21      LEU  27  -6.050  -5.837  -5.189
  237   2HD2  LEU  27          HD22      LEU  27  -6.922  -4.398  -5.699
  238   3HD2  LEU  27          HD23      LEU  27  -7.811  -5.859  -5.283
  239    H    ASN  28           HN       ASN  28  -8.474  -7.197  -0.747
  240    HA   ASN  28           HA       ASN  28 -10.753  -5.494  -0.825
  241   1HB   ASN  28          HB2       ASN  28 -10.321  -8.195   0.453
  242   2HB   ASN  28          HB1       ASN  28 -11.891  -7.394   0.395
  243   1HD2  ASN  28          HD21      ASN  28 -11.869  -6.273  -2.177
  244   2HD2  ASN  28          HD22      ASN  28 -11.779  -7.509  -3.337
  245    H    GLY  29           HN       GLY  29  -8.747  -6.591   1.893
  246   1HA   GLY  29          HA2       GLY  29 -10.365  -5.567   3.990
  247   2HA   GLY  29          HA1       GLY  29  -8.617  -5.781   4.093
  248    H    ILE  30           HN       ILE  30  -7.942  -3.980   1.947
  249    HA   ILE  30           HA       ILE  30  -7.786  -1.537   3.387
  250    HB   ILE  30           HB       ILE  30  -7.444  -2.124   0.436
  251   1HG1  ILE  30          HG12      ILE  30  -5.407  -1.517   2.600
  252   2HG1  ILE  30          HG11      ILE  30  -5.874  -3.154   2.140
  253   1HG2  ILE  30          HG21      ILE  30  -7.931   0.206   0.528
  254   2HG2  ILE  30          HG22      ILE  30  -6.171   0.111   0.519
  255   3HG2  ILE  30          HG23      ILE  30  -7.030   0.414   2.029
  256   1HD1  ILE  30          HD11      ILE  30  -4.647  -1.065   0.316
  257   2HD1  ILE  30          HD12      ILE  30  -5.188  -2.660  -0.202
  258   3HD1  ILE  30          HD13      ILE  30  -3.847  -2.511   0.932
  259    H    TYR  31           HN       TYR  31 -10.098  -2.582   0.862
  260    HA   TYR  31           HA       TYR  31 -11.385  -0.028   0.639
  261   1HB   TYR  31          HB2       TYR  31 -12.508  -2.805   0.191
  262   2HB   TYR  31          HB1       TYR  31 -13.366  -1.329  -0.208
  263    HD1  TYR  31           HD1      TYR  31 -11.871  -3.841  -1.780
  264    HD2  TYR  31           HD2      TYR  31 -11.375   0.417  -1.466
  265    HE1  TYR  31           HE1      TYR  31 -10.724  -3.810  -3.968
  266    HE2  TYR  31           HE2      TYR  31 -10.244   0.440  -3.649
  267    HH   TYR  31           HH       TYR  31  -9.000  -1.123  -5.090
  268    H    GLN  32           HN       GLN  32 -12.001  -2.769   2.815
  269    HA   GLN  32           HA       GLN  32 -14.425  -1.780   3.925
  270   1HB   GLN  32          HB2       GLN  32 -13.540  -4.059   4.342
  271   2HB   GLN  32          HB1       GLN  32 -12.227  -3.369   5.292
  272   1HG   GLN  32          HG2       GLN  32 -13.979  -4.144   6.794
  273   2HG   GLN  32          HG1       GLN  32 -13.926  -2.384   6.845
  274   1HE2  GLN  32          HE21      GLN  32 -15.913  -1.366   6.541
  275   2HE2  GLN  32          HE22      GLN  32 -17.266  -2.075   5.800
  276    H    PHE  33           HN       PHE  33 -11.039  -1.142   4.774
  277    HA   PHE  33           HA       PHE  33 -11.534   0.431   7.096
  278   1HB   PHE  33          HB2       PHE  33  -9.307  -0.442   6.473
  279   2HB   PHE  33          HB1       PHE  33  -9.267   0.662   5.098
  280    HD1  PHE  33           HD1      PHE  33  -9.108   0.385   8.764
  281    HD2  PHE  33           HD2      PHE  33  -8.996   3.072   5.414
  282    HE1  PHE  33           HE1      PHE  33  -8.231   2.179  10.233
  283    HE2  PHE  33           HE2      PHE  33  -8.121   4.867   6.885
  284    HZ   PHE  33           HZ       PHE  33  -7.739   4.421   9.294
  285    H    ILE  34           HN       ILE  34 -11.026   1.490   3.706
  286    HA   ILE  34           HA       ILE  34 -11.298   4.265   4.204
  287    HB   ILE  34           HB       ILE  34 -11.841   2.613   1.733
  288   1HG1  ILE  34          HG12      ILE  34  -9.583   4.533   2.341
  289   2HG1  ILE  34          HG11      ILE  34  -9.505   2.825   2.771
  290   1HG2  ILE  34          HG21      ILE  34 -11.509   4.967   0.621
  291   2HG2  ILE  34          HG22      ILE  34 -12.024   5.589   2.188
  292   3HG2  ILE  34          HG23      ILE  34 -13.097   4.544   1.258
  293   1HD1  ILE  34          HD11      ILE  34  -9.967   2.258   0.372
  294   2HD1  ILE  34          HD12      ILE  34  -8.447   3.122   0.606
  295   3HD1  ILE  34          HD13      ILE  34  -9.861   3.977  -0.009
  296    H    MET  35           HN       MET  35 -13.876   1.996   3.094
  297    HA   MET  35           HA       MET  35 -15.903   3.987   2.995
  298   1HB   MET  35          HB2       MET  35 -15.999   0.999   3.383
  299   2HB   MET  35          HB1       MET  35 -17.474   1.964   3.402
  300   1HG   MET  35          HG2       MET  35 -16.866   2.884   1.168
  301   2HG   MET  35          HG1       MET  35 -15.453   1.828   1.145
  302   1HE   MET  35          HE1       MET  35 -15.808  -0.817   1.868
  303   2HE   MET  35          HE2       MET  35 -15.390  -0.344   0.224
  304   3HE   MET  35          HE3       MET  35 -16.595  -1.601   0.490
  305    H    ASP  36           HN       ASP  36 -14.840   1.934   5.705
  306    HA   ASP  36           HA       ASP  36 -16.920   2.730   7.498
  307   1HB   ASP  36          HB2       ASP  36 -14.125   1.695   7.992
  308   2HB   ASP  36          HB1       ASP  36 -15.292   1.976   9.284
  309    H    ARG  37           HN       ARG  37 -13.574   4.021   7.156
  310    HA   ARG  37           HA       ARG  37 -13.988   6.021   9.199
  311   1HB   ARG  37          HB2       ARG  37 -12.000   5.999   6.909
  312   2HB   ARG  37          HB1       ARG  37 -11.923   7.052   8.317
  313   1HG   ARG  37          HG2       ARG  37 -11.948   4.038   8.558
  314   2HG   ARG  37          HG1       ARG  37 -10.455   4.953   8.376
  315   1HD   ARG  37          HD2       ARG  37 -11.160   6.314  10.400
  316   2HD   ARG  37          HD1       ARG  37 -12.464   5.152  10.635
  317    HE   ARG  37           HE       ARG  37 -10.191   3.577  10.447
  318   1HH1  ARG  37          HH21      ARG  37 -11.262   6.262  12.326
  319   2HH1  ARG  37          HH22      ARG  37 -10.313   5.841  13.712
  320   1HH2  ARG  37          HH11      ARG  37  -8.940   3.015  12.246
  321   2HH2  ARG  37          HH12      ARG  37  -8.998   4.003  13.667
  322    H    PHE  38           HN       PHE  38 -14.182   6.111   5.649
  323    HA   PHE  38           HA       PHE  38 -15.532   8.780   5.865
  324   1HB   PHE  38          HB2       PHE  38 -14.079   7.653   3.460
  325   2HB   PHE  38          HB1       PHE  38 -14.689   9.294   3.668
  326    HD1  PHE  38           HD1      PHE  38 -11.926   7.048   4.236
  327    HD2  PHE  38           HD2      PHE  38 -13.717  10.724   5.552
  328    HE1  PHE  38           HE1      PHE  38  -9.787   7.708   5.303
  329    HE2  PHE  38           HE2      PHE  38 -11.577  11.384   6.619
  330    HZ   PHE  38           HZ       PHE  38  -9.612   9.876   6.495
  331    HA   PRO  39           HA       PRO  39 -18.810   6.014   4.290
  332   1HB   PRO  39          HB2       PRO  39 -20.957   7.550   4.864
  333   2HB   PRO  39          HB1       PRO  39 -20.051   6.706   6.136
  334   1HG   PRO  39          HG2       PRO  39 -19.909   9.571   5.304
  335   2HG   PRO  39          HG1       PRO  39 -19.929   8.876   6.934
  336   1HD   PRO  39          HD2       PRO  39 -17.624   9.686   5.649
  337   2HD   PRO  39          HD1       PRO  39 -17.654   8.438   6.915
  338    H    PHE  40           HN       PHE  40 -17.766   8.988   3.116
  339    HA   PHE  40           HA       PHE  40 -19.739   9.651   1.178
  340   1HB   PHE  40          HB2       PHE  40 -18.156  11.329   1.404
  341   2HB   PHE  40          HB1       PHE  40 -16.824  10.192   1.568
  342    HD1  PHE  40           HD1      PHE  40 -19.378  11.223  -0.998
  343    HD2  PHE  40           HD2      PHE  40 -15.319  10.041  -0.212
  344    HE1  PHE  40           HE1      PHE  40 -18.825  11.521  -3.397
  345    HE2  PHE  40           HE2      PHE  40 -14.771  10.341  -2.610
  346    HZ   PHE  40           HZ       PHE  40 -16.521  11.080  -4.203
  347    H    TYR  41           HN       TYR  41 -17.037   7.348   1.063
  348    HA   TYR  41           HA       TYR  41 -17.344   6.749  -1.735
  349   1HB   TYR  41          HB2       TYR  41 -16.059   5.189   0.515
  350   2HB   TYR  41          HB1       TYR  41 -15.951   4.741  -1.191
  351    HD1  TYR  41           HD1      TYR  41 -14.806   6.216  -2.807
  352    HD2  TYR  41           HD2      TYR  41 -14.888   7.106   1.380
  353    HE1  TYR  41           HE1      TYR  41 -12.989   7.868  -3.134
  354    HE2  TYR  41           HE2      TYR  41 -13.076   8.765   1.070
  355    HH   TYR  41           HH       TYR  41 -11.619   9.308  -2.149
  356    H    ARG  42           HN       ARG  42 -19.045   5.666   1.110
  357    HA   ARG  42           HA       ARG  42 -20.000   3.163   0.150
  358   1HB   ARG  42          HB2       ARG  42 -21.302   5.217   1.961
  359   2HB   ARG  42          HB1       ARG  42 -21.984   3.623   1.656
  360   1HG   ARG  42          HG2       ARG  42 -19.956   2.561   2.543
  361   2HG   ARG  42          HG1       ARG  42 -19.233   4.147   2.817
  362   1HD   ARG  42          HD2       ARG  42 -20.243   3.224   4.894
  363   2HD   ARG  42          HD1       ARG  42 -21.023   4.722   4.392
  364    HE   ARG  42           HE       ARG  42 -22.542   2.715   3.200
  365   1HH1  ARG  42          HH21      ARG  42 -21.456   3.520   6.372
  366   2HH1  ARG  42          HH22      ARG  42 -22.830   2.825   7.164
  367   1HH2  ARG  42          HH11      ARG  42 -24.347   1.805   4.216
  368   2HH2  ARG  42          HH12      ARG  42 -24.468   1.854   5.944
  369    H    GLU  43           HN       GLU  43 -21.221   6.474  -0.334
  370    HA   GLU  43           HA       GLU  43 -23.608   5.753  -1.700
  371   1HB   GLU  43          HB2       GLU  43 -23.171   8.033  -0.833
  372   2HB   GLU  43          HB1       GLU  43 -21.926   8.245  -2.061
  373   1HG   GLU  43          HG2       GLU  43 -24.026   9.289  -2.790
  374   2HG   GLU  43          HG1       GLU  43 -23.638   7.925  -3.834
  375    H    ASN  44           HN       ASN  44 -20.370   6.367  -2.874
  376    HA   ASN  44           HA       ASN  44 -21.191   5.367  -5.589
  377   1HB   ASN  44          HB2       ASN  44 -20.290   7.741  -5.425
  378   2HB   ASN  44          HB1       ASN  44 -18.750   7.033  -4.932
  379   1HD2  ASN  44          HD21      ASN  44 -17.422   7.196  -6.758
  380   2HD2  ASN  44          HD22      ASN  44 -17.859   6.679  -8.315
  381    H    LYS  45           HN       LYS  45 -20.767   3.162  -5.320
  382    HA   LYS  45           HA       LYS  45 -18.233   2.301  -4.101
  383   1HB   LYS  45          HB2       LYS  45 -20.437   0.731  -5.468
  384   2HB   LYS  45          HB1       LYS  45 -19.057   0.022  -4.631
  385   1HG   LYS  45          HG2       LYS  45 -19.759   1.117  -2.533
  386   2HG   LYS  45          HG1       LYS  45 -21.142   1.825  -3.369
  387   1HD   LYS  45          HD2       LYS  45 -21.987  -0.429  -3.897
  388   2HD   LYS  45          HD1       LYS  45 -20.607  -1.145  -3.065
  389   1HE   LYS  45          HE2       LYS  45 -22.383  -1.169  -1.476
  390   2HE   LYS  45          HE1       LYS  45 -21.354   0.184  -1.005
  391   1HZ   LYS  45          HZ1       LYS  45 -22.981   1.408  -2.688
  392   2HZ   LYS  45          HZ2       LYS  45 -23.319   1.261  -1.029
  393   3HZ   LYS  45          HZ3       LYS  45 -24.033   0.194  -2.143
  394    H    GLN  46           HN       GLN  46 -19.629   2.679  -7.302
  395    HA   GLN  46           HA       GLN  46 -17.331   1.345  -8.589
  396   1HB   GLN  46          HB2       GLN  46 -19.776   2.715  -9.736
  397   2HB   GLN  46          HB1       GLN  46 -18.560   1.857 -10.686
  398   1HG   GLN  46          HG2       GLN  46 -20.092   0.583  -8.408
  399   2HG   GLN  46          HG1       GLN  46 -20.597   0.472 -10.095
  400   1HE2  GLN  46          HE21      GLN  46 -19.356  -1.557  -8.037
  401   2HE2  GLN  46          HE22      GLN  46 -18.119  -2.295  -8.934
  402    H    GLY  47           HN       GLY  47 -15.794   2.396  -9.843
  403   1HA   GLY  47          HA2       GLY  47 -14.965   4.352 -11.045
  404   2HA   GLY  47          HA1       GLY  47 -15.870   5.383  -9.943
  405    H    TRP  48           HN       TRP  48 -15.133   4.938  -7.498
  406    HA   TRP  48           HA       TRP  48 -12.347   5.689  -7.446
  407   1HB   TRP  48          HB2       TRP  48 -12.614   6.009  -5.110
  408   2HB   TRP  48          HB1       TRP  48 -14.128   6.503  -5.855
  409    HD1  TRP  48           HD1      TRP  48 -16.236   4.786  -5.594
  410    HE1  TRP  48           HE1      TRP  48 -16.761   3.118  -3.716
  411    HE3  TRP  48           HE3      TRP  48 -11.614   4.350  -3.448
  412    HZ2  TRP  48           HZ2      TRP  48 -15.434   1.771  -1.583
  413    HZ3  TRP  48           HZ3      TRP  48 -11.281   2.862  -1.496
  414    HH2  TRP  48           HH2      TRP  48 -13.182   1.572  -0.562
  415    H    GLN  49           HN       GLN  49 -14.028   2.653  -6.702
  416    HA   GLN  49           HA       GLN  49 -11.873   1.390  -5.351
  417   1HB   GLN  49          HB2       GLN  49 -14.075   0.236  -7.075
  418   2HB   GLN  49          HB1       GLN  49 -12.940  -0.759  -6.161
  419   1HG   GLN  49          HG2       GLN  49 -13.624   0.387  -4.077
  420   2HG   GLN  49          HG1       GLN  49 -14.781   1.350  -4.997
  421   1HE2  GLN  49          HE21      GLN  49 -14.828  -1.541  -6.571
  422   2HE2  GLN  49          HE22      GLN  49 -16.067  -2.325  -5.716
  423    H    ASN  50           HN       ASN  50 -12.566   1.570  -8.851
  424    HA   ASN  50           HA       ASN  50 -10.466  -0.202  -9.651
  425   1HB   ASN  50          HB2       ASN  50 -11.810   2.097 -11.089
  426   2HB   ASN  50          HB1       ASN  50 -10.636   1.032 -11.860
  427   1HD2  ASN  50          HD21      ASN  50 -12.009  -1.071  -9.801
  428   2HD2  ASN  50          HD22      ASN  50 -13.319  -1.616 -10.731
  429    H    SER  51           HN       SER  51 -10.490   3.318  -9.126
  430    HA   SER  51           HA       SER  51  -7.894   3.857 -10.145
  431   1HB   SER  51          HB2       SER  51  -9.517   5.207  -7.981
  432   2HB   SER  51          HB1       SER  51  -7.989   5.849  -8.578
  433    HG   SER  51           HG       SER  51 -10.275   6.328  -9.594
  434    H    ILE  52           HN       ILE  52  -8.897   2.851  -6.885
  435    HA   ILE  52           HA       ILE  52  -6.381   3.170  -5.601
  436    HB   ILE  52           HB       ILE  52  -8.554   1.129  -5.086
  437   1HG1  ILE  52          HG12      ILE  52  -9.337   3.484  -5.010
  438   2HG1  ILE  52          HG11      ILE  52  -9.400   2.715  -3.431
  439   1HG2  ILE  52          HG21      ILE  52  -6.245   2.067  -3.374
  440   2HG2  ILE  52          HG22      ILE  52  -6.549   0.431  -3.956
  441   3HG2  ILE  52          HG23      ILE  52  -7.616   1.152  -2.752
  442   1HD1  ILE  52          HD11      ILE  52  -7.105   3.795  -2.982
  443   2HD1  ILE  52          HD12      ILE  52  -8.488   4.879  -3.053
  444   3HD1  ILE  52          HD13      ILE  52  -7.401   4.757  -4.428
  445    H    ARG  53           HN       ARG  53  -7.716   0.270  -7.212
  446    HA   ARG  53           HA       ARG  53  -5.368  -1.332  -6.708
  447   1HB   ARG  53          HB2       ARG  53  -7.309  -1.726  -9.002
  448   2HB   ARG  53          HB1       ARG  53  -6.386  -2.947  -8.121
  449   1HG   ARG  53          HG2       ARG  53  -7.657  -2.255  -6.039
  450   2HG   ARG  53          HG1       ARG  53  -8.661  -1.261  -7.085
  451   1HD   ARG  53          HD2       ARG  53  -9.521  -3.625  -6.479
  452   2HD   ARG  53          HD1       ARG  53  -9.620  -3.112  -8.162
  453    HE   ARG  53           HE       ARG  53  -7.181  -4.436  -7.991
  454   1HH1  ARG  53          HH21      ARG  53 -10.476  -5.098  -7.217
  455   2HH1  ARG  53          HH22      ARG  53 -10.331  -6.804  -7.480
  456   1HH2  ARG  53          HH11      ARG  53  -6.974  -6.655  -8.334
  457   2HH2  ARG  53          HH12      ARG  53  -8.348  -7.685  -8.111
  458    H    HIS  54           HN       HIS  54  -6.404   0.712  -9.416
  459    HA   HIS  54           HA       HIS  54  -4.410  -0.048 -11.290
  460   1HB   HIS  54          HB2       HIS  54  -6.361   1.351 -11.862
  461   2HB   HIS  54          HB1       HIS  54  -5.707   2.663 -10.883
  462    HD1  HIS  54           HD1      HIS  54  -4.251   0.426 -13.625
  463    HD2  HIS  54           HD2      HIS  54  -4.443   4.450 -12.551
  464    HE1  HIS  54           HE1      HIS  54  -2.976   1.703 -15.402
  465    H    ASN  55           HN       ASN  55  -4.349   2.424  -8.726
  466    HA   ASN  55           HA       ASN  55  -1.750   3.458  -9.359
  467   1HB   ASN  55          HB2       ASN  55  -3.313   3.378  -6.767
  468   2HB   ASN  55          HB1       ASN  55  -1.772   4.218  -6.943
  469   1HD2  ASN  55          HD21      ASN  55  -3.039   4.539  -9.946
  470   2HD2  ASN  55          HD22      ASN  55  -3.907   5.984  -9.758
  471    H    LEU  56           HN       LEU  56  -2.817   0.797  -7.250
  472    HA   LEU  56           HA       LEU  56  -0.302   0.251  -6.066
  473   1HB   LEU  56          HB2       LEU  56  -2.607  -1.587  -6.720
  474   2HB   LEU  56          HB1       LEU  56  -1.199  -2.101  -5.795
  475    HG   LEU  56           HG       LEU  56  -2.994   0.226  -5.041
  476   1HD1  LEU  56          HD11      LEU  56  -4.053  -2.080  -4.946
  477   2HD1  LEU  56          HD12      LEU  56  -3.991  -1.227  -3.405
  478   3HD1  LEU  56          HD13      LEU  56  -2.831  -2.510  -3.751
  479   1HD2  LEU  56          HD21      LEU  56  -1.749  -0.386  -2.754
  480   2HD2  LEU  56          HD22      LEU  56  -1.003   0.692  -3.924
  481   3HD2  LEU  56          HD23      LEU  56  -0.516  -1.001  -3.853
  482    H    SER  57           HN       SER  57  -1.676  -0.932  -9.132
  483    HA   SER  57           HA       SER  57   0.504  -2.731  -9.682
  484   1HB   SER  57          HB2       SER  57  -0.397  -2.826 -11.945
  485   2HB   SER  57          HB1       SER  57  -1.725  -2.863 -10.788
  486    HG   SER  57           HG       SER  57  -2.422  -1.107 -11.687
  487    H    LEU  58           HN       LEU  58  -0.148   0.625 -10.744
  488    HA   LEU  58           HA       LEU  58   2.251   0.778 -12.337
  489   1HB   LEU  58          HB2       LEU  58   0.465   2.909 -11.153
  490   2HB   LEU  58          HB1       LEU  58   1.837   3.273 -12.196
  491    HG   LEU  58           HG       LEU  58  -0.404   1.395 -12.991
  492   1HD1  LEU  58          HD11      LEU  58  -1.098   3.390 -14.447
  493   2HD1  LEU  58          HD12      LEU  58  -0.069   4.372 -13.405
  494   3HD1  LEU  58          HD13      LEU  58  -1.454   3.518 -12.723
  495   1HD2  LEU  58          HD21      LEU  58   1.386   0.938 -14.437
  496   2HD2  LEU  58          HD22      LEU  58   1.981   2.598 -14.394
  497   3HD2  LEU  58          HD23      LEU  58   0.538   2.199 -15.322
  498    H    ASN  59           HN       ASN  59   1.502   1.704  -8.978
  499    HA   ASN  59           HA       ASN  59   4.141   2.849  -8.545
  500   1HB   ASN  59          HB2       ASN  59   2.010   1.920  -6.597
  501   2HB   ASN  59          HB1       ASN  59   3.482   2.773  -6.129
  502   1HD2  ASN  59          HD21      ASN  59   0.423   3.519  -6.245
  503   2HD2  ASN  59          HD22      ASN  59   0.440   5.050  -6.977
  504    H    GLU  60           HN       GLU  60   5.935   1.610  -8.490
  505    HA   GLU  60           HA       GLU  60   5.732  -1.272  -7.867
  506   1HB   GLU  60          HB2       GLU  60   7.980   0.491  -8.874
  507   2HB   GLU  60          HB1       GLU  60   8.164  -1.235  -8.551
  508   1HG   GLU  60          HG2       GLU  60   6.485  -1.797 -10.191
  509   2HG   GLU  60          HG1       GLU  60   6.047  -0.101 -10.400
  510    H    CYS  61           HN       CYS  61   6.179   1.516  -6.079
  511    HA   CYS  61           HA       CYS  61   8.319   0.678  -4.330
  512   1HB   CYS  61          HB2       CYS  61   7.615   2.491  -2.887
  513   2HB   CYS  61          HB1       CYS  61   7.520   3.044  -4.559
  514    HG   CYS  61           HG       CYS  61   5.059   3.280  -4.342
  515    H    PHE  62           HN       PHE  62   5.010  -0.263  -4.595
  516    HA   PHE  62           HA       PHE  62   4.730  -1.087  -1.804
  517   1HB   PHE  62          HB2       PHE  62   3.121  -1.704  -4.296
  518   2HB   PHE  62          HB1       PHE  62   2.719  -2.342  -2.704
  519    HD1  PHE  62           HD1      PHE  62   1.978  -0.851  -0.892
  520    HD2  PHE  62           HD2      PHE  62   2.823   0.644  -4.827
  521    HE1  PHE  62           HE1      PHE  62   0.796   1.258  -0.343
  522    HE2  PHE  62           HE2      PHE  62   1.645   2.757  -4.278
  523    HZ   PHE  62           HZ       PHE  62   0.630   3.063  -2.036
  524    H    VAL  63           HN       VAL  63   4.687  -3.301  -1.093
  525    HA   VAL  63           HA       VAL  63   6.389  -5.127  -2.758
  526    HB   VAL  63           HB       VAL  63   5.898  -5.193   0.237
  527   1HG1  VAL  63          HG11      VAL  63   6.594  -7.327  -0.989
  528   2HG1  VAL  63          HG12      VAL  63   7.664  -6.804   0.308
  529   3HG1  VAL  63          HG13      VAL  63   8.103  -6.500  -1.372
  530   1HG2  VAL  63          HG21      VAL  63   7.150  -3.136  -0.694
  531   2HG2  VAL  63          HG22      VAL  63   8.423  -4.267  -1.146
  532   3HG2  VAL  63          HG23      VAL  63   7.975  -4.074   0.548
  533    H    LYS  64           HN       LYS  64   5.403  -6.949  -3.502
  534    HA   LYS  64           HA       LYS  64   2.654  -7.573  -2.532
  535   1HB   LYS  64          HB2       LYS  64   4.267  -8.598  -4.898
  536   2HB   LYS  64          HB1       LYS  64   2.626  -9.112  -4.511
  537   1HG   LYS  64          HG2       LYS  64   1.834  -6.791  -4.753
  538   2HG   LYS  64          HG1       LYS  64   3.477  -6.274  -5.145
  539   1HD   LYS  64          HD2       LYS  64   3.498  -7.761  -7.101
  540   2HD   LYS  64          HD1       LYS  64   1.873  -8.318  -6.713
  541   1HE   LYS  64          HE2       LYS  64   0.887  -6.359  -7.435
  542   2HE   LYS  64          HE1       LYS  64   2.280  -5.364  -7.007
  543   1HZ   LYS  64          HZ1       LYS  64   2.312  -5.429  -9.311
  544   2HZ   LYS  64          HZ2       LYS  64   1.888  -7.072  -9.382
  545   3HZ   LYS  64          HZ3       LYS  64   3.446  -6.615  -8.882
  546    H    VAL  65           HN       VAL  65   2.586  -9.064  -0.885
  547    HA   VAL  65           HA       VAL  65   4.645 -11.238  -0.846
  548    HB   VAL  65           HB       VAL  65   3.198 -11.057   1.658
  549   1HG1  VAL  65          HG11      VAL  65   6.069 -10.466   0.904
  550   2HG1  VAL  65          HG12      VAL  65   5.422 -12.014   1.447
  551   3HG1  VAL  65          HG13      VAL  65   5.472 -10.643   2.554
  552   1HG2  VAL  65          HG21      VAL  65   4.401  -8.462   0.650
  553   2HG2  VAL  65          HG22      VAL  65   4.024  -8.789   2.341
  554   3HG2  VAL  65          HG23      VAL  65   2.729  -8.733   1.146
  555    HA   PRO  66           HA       PRO  66   0.865 -13.534  -1.828
  556   1HB   PRO  66          HB2       PRO  66   1.962 -15.933  -2.429
  557   2HB   PRO  66          HB1       PRO  66   2.124 -14.532  -3.508
  558   1HG   PRO  66          HG2       PRO  66   4.086 -15.637  -1.545
  559   2HG   PRO  66          HG1       PRO  66   4.358 -15.055  -3.198
  560   1HD   PRO  66          HD2       PRO  66   4.860 -13.536  -0.951
  561   2HD   PRO  66          HD1       PRO  66   4.465 -12.837  -2.538
  562    H    ARG  67           HN       ARG  67   0.308 -16.079  -1.247
  563    HA   ARG  67           HA       ARG  67   0.922 -16.574   1.626
  564   1HB   ARG  67          HB2       ARG  67  -1.445 -16.921   2.117
  565   2HB   ARG  67          HB1       ARG  67  -1.215 -15.292   1.484
  566   1HG   ARG  67          HG2       ARG  67  -1.822 -16.159  -0.792
  567   2HG   ARG  67          HG1       ARG  67  -2.233 -17.698  -0.054
  568   1HD   ARG  67          HD2       ARG  67  -3.546 -15.014   0.372
  569   2HD   ARG  67          HD1       ARG  67  -4.288 -16.488  -0.232
  570    HE   ARG  67           HE       ARG  67  -4.127 -15.678   2.499
  571   1HH1  ARG  67          HH21      ARG  67  -3.571 -18.489   0.557
  572   2HH1  ARG  67          HH22      ARG  67  -3.712 -19.578   1.893
  573   1HH2  ARG  67          HH11      ARG  67  -4.341 -17.092   4.213
  574   2HH2  ARG  67          HH12      ARG  67  -4.158 -18.794   3.951
  575    H    ASP  68           HN       ASP  68  -0.783 -18.795   1.927
  576    HA   ASP  68           HA       ASP  68   0.709 -20.799   0.477
  577   1HB   ASP  68          HB2       ASP  68  -1.786 -20.963   2.184
  578   2HB   ASP  68          HB1       ASP  68  -0.998 -22.378   1.486
  579    H    ASP  69           HN       ASP  69   0.008 -22.139  -1.229
  580    HA   ASP  69           HA       ASP  69  -1.730 -20.899  -3.167
  581   1HB   ASP  69          HB2       ASP  69  -0.560 -23.694  -3.040
  582   2HB   ASP  69          HB1       ASP  69  -1.379 -23.014  -4.446
  583    H    LYS  70           HN       LYS  70  -2.387 -22.847  -0.463
  584    HA   LYS  70           HA       LYS  70  -4.545 -24.446  -1.379
  585   1HB   LYS  70          HB2       LYS  70  -4.021 -23.183   1.322
  586   2HB   LYS  70          HB1       LYS  70  -5.321 -24.338   1.026
  587   1HG   LYS  70          HG2       LYS  70  -3.667 -26.001   0.249
  588   2HG   LYS  70          HG1       LYS  70  -2.369 -24.846   0.554
  589   1HD   LYS  70          HD2       LYS  70  -2.982 -24.779   2.943
  590   2HD   LYS  70          HD1       LYS  70  -4.279 -25.936   2.641
  591   1HE   LYS  70          HE2       LYS  70  -2.637 -27.603   1.884
  592   2HE   LYS  70          HE1       LYS  70  -1.330 -26.449   2.151
  593   1HZ   LYS  70          HZ1       LYS  70  -2.251 -26.327   4.518
  594   2HZ   LYS  70          HZ2       LYS  70  -1.363 -27.708   4.081
  595   3HZ   LYS  70          HZ3       LYS  70  -3.060 -27.771   4.145
  596    H    LYS  71           HN       LYS  71  -4.498 -21.069  -0.271
  597    HA   LYS  71           HA       LYS  71  -7.354 -20.808  -1.173
  598   1HB   LYS  71          HB2       LYS  71  -5.949 -19.196   0.967
  599   2HB   LYS  71          HB1       LYS  71  -7.660 -19.136   0.544
  600   1HG   LYS  71          HG2       LYS  71  -7.722 -21.641   1.106
  601   2HG   LYS  71          HG1       LYS  71  -6.142 -21.395   1.851
  602   1HD   LYS  71          HD2       LYS  71  -8.681 -19.902   2.572
  603   2HD   LYS  71          HD1       LYS  71  -7.943 -21.190   3.523
  604   1HE   LYS  71          HE2       LYS  71  -7.121 -19.251   4.560
  605   2HE   LYS  71          HE1       LYS  71  -5.808 -19.682   3.465
  606   1HZ   LYS  71          HZ1       LYS  71  -7.110 -17.287   3.552
  607   2HZ   LYS  71          HZ2       LYS  71  -7.795 -18.059   2.202
  608   3HZ   LYS  71          HZ3       LYS  71  -6.113 -17.834   2.293
  609    HA   PRO  72           HA       PRO  72  -4.799 -17.860  -3.641
  610   1HB   PRO  72          HB2       PRO  72  -5.627 -18.583  -6.116
  611   2HB   PRO  72          HB1       PRO  72  -4.382 -19.498  -5.244
  612   1HG   PRO  72          HG2       PRO  72  -7.267 -20.128  -5.630
  613   2HG   PRO  72          HG1       PRO  72  -5.870 -21.216  -5.611
  614   1HD   PRO  72          HD2       PRO  72  -7.601 -20.802  -3.453
  615   2HD   PRO  72          HD1       PRO  72  -5.961 -21.473  -3.321
  616    H    GLY  73           HN       GLY  73  -7.970 -18.298  -2.924
  617   1HA   GLY  73          HA2       GLY  73  -9.316 -16.507  -4.722
  618   2HA   GLY  73          HA1       GLY  73  -9.902 -16.971  -3.124
  619    H    LYS  74           HN       LYS  74  -7.772 -16.021  -1.545
  620    HA   LYS  74           HA       LYS  74  -8.409 -13.175  -1.507
  621   1HB   LYS  74          HB2       LYS  74  -6.488 -14.847   0.143
  622   2HB   LYS  74          HB1       LYS  74  -6.822 -13.141   0.445
  623   1HG   LYS  74          HG2       LYS  74  -9.216 -13.665   0.753
  624   2HG   LYS  74          HG1       LYS  74  -8.880 -15.371   0.458
  625   1HD   LYS  74          HD2       LYS  74  -7.364 -15.407   2.410
  626   2HD   LYS  74          HD1       LYS  74  -7.718 -13.705   2.710
  627   1HE   LYS  74          HE2       LYS  74  -9.796 -15.913   2.677
  628   2HE   LYS  74          HE1       LYS  74  -9.084 -15.230   4.138
  629   1HZ   LYS  74          HZ1       LYS  74 -11.192 -14.219   2.546
  630   2HZ   LYS  74          HZ2       LYS  74  -9.927 -13.087   2.615
  631   3HZ   LYS  74          HZ3       LYS  74 -10.630 -13.668   4.048
  632    H    GLY  75           HN       GLY  75  -7.057 -11.478  -2.120
  633   1HA   GLY  75          HA2       GLY  75  -5.032 -12.027  -4.089
  634   2HA   GLY  75          HA1       GLY  75  -5.355 -10.446  -3.372
  635    H    SER  76           HN       SER  76  -2.796 -10.683  -3.650
  636    HA   SER  76           HA       SER  76  -1.498 -12.190  -1.505
  637   1HB   SER  76          HB2       SER  76  -0.472 -10.163  -3.509
  638   2HB   SER  76          HB1       SER  76   0.555 -10.955  -2.316
  639    HG   SER  76           HG       SER  76   0.039 -11.880  -4.625
  640    H    TYR  77           HN       TYR  77  -0.180 -11.116   0.166
  641    HA   TYR  77           HA       TYR  77  -1.653  -9.028   1.518
  642   1HB   TYR  77          HB2       TYR  77   1.082 -10.223   2.010
  643   2HB   TYR  77          HB1       TYR  77   0.327  -9.042   3.072
  644    HD1  TYR  77           HD1      TYR  77  -2.195  -9.629   3.746
  645    HD2  TYR  77           HD2      TYR  77   0.752 -12.488   2.490
  646    HE1  TYR  77           HE1      TYR  77  -3.494 -11.445   4.830
  647    HE2  TYR  77           HE2      TYR  77  -0.543 -14.303   3.574
  648    HH   TYR  77           HH       TYR  77  -2.707 -14.799   4.362
  649    H    TRP  78           HN       TRP  78  -0.958  -6.860   1.909
  650    HA   TRP  78           HA       TRP  78   1.105  -5.821  -0.016
  651   1HB   TRP  78          HB2       TRP  78  -1.530  -4.621   0.887
  652   2HB   TRP  78          HB1       TRP  78  -0.297  -3.719   0.001
  653    HD1  TRP  78           HD1      TRP  78  -2.658  -6.722  -0.381
  654    HE1  TRP  78           HE1      TRP  78  -2.939  -7.226  -2.894
  655    HE3  TRP  78           HE3      TRP  78   0.703  -3.418  -2.311
  656    HZ2  TRP  78           HZ2      TRP  78  -1.865  -6.336  -5.402
  657    HZ3  TRP  78           HZ3      TRP  78   1.057  -3.258  -4.755
  658    HH2  TRP  78           HH2      TRP  78  -0.231  -4.700  -6.302
  659    H    THR  79           HN       THR  79   2.737  -4.711   0.916
  660    HA   THR  79           HA       THR  79   2.373  -3.233   3.416
  661    HB   THR  79           HB       THR  79   2.707  -5.550   4.238
  662    HG1  THR  79           HG1      THR  79   5.072  -4.798   5.044
  663   1HG2  THR  79          HG21      THR  79   5.445  -5.428   2.969
  664   2HG2  THR  79          HG22      THR  79   4.074  -6.188   2.162
  665   3HG2  THR  79          HG23      THR  79   4.647  -6.817   3.707
  666    H    LEU  80           HN       LEU  80   4.461  -2.102   3.999
  667    HA   LEU  80           HA       LEU  80   6.030  -1.516   1.517
  668   1HB   LEU  80          HB2       LEU  80   5.806   0.077   4.089
  669   2HB   LEU  80          HB1       LEU  80   6.623   0.588   2.613
  670    HG   LEU  80           HG       LEU  80   3.664  -0.011   2.872
  671   1HD1  LEU  80          HD11      LEU  80   5.067   2.633   2.389
  672   2HD1  LEU  80          HD12      LEU  80   4.496   2.103   3.972
  673   3HD1  LEU  80          HD13      LEU  80   3.344   2.379   2.665
  674   1HD2  LEU  80          HD21      LEU  80   3.767   1.214   0.540
  675   2HD2  LEU  80          HD22      LEU  80   4.146  -0.503   0.632
  676   3HD2  LEU  80          HD23      LEU  80   5.449   0.683   0.543
  677    H    ASP  81           HN       ASP  81   7.061  -3.741   2.258
  678    HA   ASP  81           HA       ASP  81   9.575  -3.034   3.635
  679   1HB   ASP  81          HB2       ASP  81   7.910  -5.358   4.627
  680   2HB   ASP  81          HB1       ASP  81   9.430  -4.766   5.299
  681    HA   PRO  82           HA       PRO  82  10.090  -5.840  -0.031
  682   1HB   PRO  82          HB2       PRO  82  12.729  -4.429  -0.025
  683   2HB   PRO  82          HB1       PRO  82  11.612  -4.727  -1.368
  684   1HG   PRO  82          HG2       PRO  82  11.862  -2.307  -0.279
  685   2HG   PRO  82          HG1       PRO  82  10.294  -2.906  -0.849
  686   1HD   PRO  82          HD2       PRO  82  11.318  -2.687   1.966
  687   2HD   PRO  82          HD1       PRO  82   9.675  -2.412   1.341
  688    H    ASP  83           HN       ASP  83  13.185  -5.121   1.549
  689    HA   ASP  83           HA       ASP  83  13.239  -7.701   2.949
  690   1HB   ASP  83          HB2       ASP  83  14.970  -7.098   0.538
  691   2HB   ASP  83          HB1       ASP  83  15.453  -8.273   1.761
  692    H    SER  84           HN       SER  84  13.291  -5.038   3.829
  693    HA   SER  84           HA       SER  84  15.856  -3.899   4.165
  694   1HB   SER  84          HB2       SER  84  13.456  -3.769   6.010
  695   2HB   SER  84          HB1       SER  84  14.854  -2.700   6.094
  696    HG   SER  84           HG       SER  84  13.522  -1.607   4.802
  697    H    TYR  85           HN       TYR  85  14.166  -6.326   6.167
  698    HA   TYR  85           HA       TYR  85  15.992  -6.345   8.333
  699   1HB   TYR  85          HB2       TYR  85  14.969  -9.021   7.532
  700   2HB   TYR  85          HB1       TYR  85  14.818  -8.175   9.069
  701    HD1  TYR  85           HD1      TYR  85  13.442  -8.530   5.661
  702    HD2  TYR  85           HD2      TYR  85  12.910  -6.772   9.544
  703    HE1  TYR  85           HE1      TYR  85  11.108  -7.931   5.070
  704    HE2  TYR  85           HE2      TYR  85  10.577  -6.171   8.952
  705    HH   TYR  85           HH       TYR  85   8.855  -7.472   6.735
  706    H    ASN  86           HN       ASN  86  16.269  -7.722   5.115
  707    HA   ASN  86           HA       ASN  86  18.562  -9.372   5.788
  708   1HB   ASN  86          HB2       ASN  86  17.488  -8.468   3.102
  709   2HB   ASN  86          HB1       ASN  86  18.748  -9.683   3.328
  710   1HD2  ASN  86          HD21      ASN  86  15.316  -9.159   3.328
  711   2HD2  ASN  86          HD22      ASN  86  14.866 -10.721   3.816
  712    H    MET  87           HN       MET  87  18.142  -6.100   5.415
  713    HA   MET  87           HA       MET  87  20.816  -5.581   4.253
  714   1HB   MET  87          HB2       MET  87  18.623  -3.726   5.227
  715   2HB   MET  87          HB1       MET  87  20.163  -3.173   4.573
  716   1HG   MET  87          HG2       MET  87  19.712  -4.208   2.439
  717   2HG   MET  87          HG1       MET  87  18.272  -5.004   3.074
  718   1HE   MET  87          HE1       MET  87  17.880  -3.474   0.450
  719   2HE   MET  87          HE2       MET  87  16.367  -2.669   0.861
  720   3HE   MET  87          HE3       MET  87  16.677  -4.300   1.450
  721    H    PHE  88           HN       PHE  88  22.405  -6.051   5.744
  722    HA   PHE  88           HA       PHE  88  22.014  -5.289   8.583
  723   1HB   PHE  88          HB2       PHE  88  24.150  -6.501   8.935
  724   2HB   PHE  88          HB1       PHE  88  22.947  -7.502   8.123
  725    HD1  PHE  88           HD1      PHE  88  26.120  -5.683   7.753
  726    HD2  PHE  88           HD2      PHE  88  23.154  -8.050   5.739
  727    HE1  PHE  88           HE1      PHE  88  27.682  -6.030   5.857
  728    HE2  PHE  88           HE2      PHE  88  24.715  -8.396   3.845
  729    HZ   PHE  88           HZ       PHE  88  26.981  -7.387   3.904
  730    H    GLU  89           HN       GLU  89  23.032  -3.729   5.857
  731    HA   GLU  89           HA       GLU  89  25.251  -2.255   7.194
  732   1HB   GLU  89          HB2       GLU  89  24.225  -2.287   4.346
  733   2HB   GLU  89          HB1       GLU  89  25.482  -1.185   4.914
  734   1HG   GLU  89          HG2       GLU  89  26.855  -3.110   5.621
  735   2HG   GLU  89          HG1       GLU  89  25.603  -4.213   5.051
  736    H    ASN  90           HN       ASN  90  25.179   0.084   7.282
  737    HA   ASN  90           HA       ASN  90  22.453   1.106   7.788
  738   1HB   ASN  90          HB2       ASN  90  23.599   3.013   8.812
  739   2HB   ASN  90          HB1       ASN  90  24.288   1.509   9.426
  740   1HD2  ASN  90          HD21      ASN  90  25.751   4.031   9.356
  741   2HD2  ASN  90          HD22      ASN  90  27.055   3.830   8.288
  742    H    GLY  91           HN       GLY  91  24.053   0.754   5.073
  743   1HA   GLY  91          HA2       GLY  91  22.654   2.634   3.536
  744   2HA   GLY  91          HA1       GLY  91  24.184   3.410   3.955
  745    H    SER  92           HN       SER  92  22.944   0.320   2.669
  746    HA   SER  92           HA       SER  92  25.479  -0.394   1.469
  747   1HB   SER  92          HB2       SER  92  23.492  -1.928   2.131
  748   2HB   SER  92          HB1       SER  92  22.795  -1.457   0.584
  749    HG   SER  92           HG       SER  92  24.925  -2.100  -0.293
  750    H    PHE  93           HN       PHE  93  22.377   0.246  -0.202
  751    HA   PHE  93           HA       PHE  93  23.750   0.960  -2.652
  752   1HB   PHE  93          HB2       PHE  93  21.419  -0.020  -2.516
  753   2HB   PHE  93          HB1       PHE  93  20.867   1.554  -1.938
  754    HD1  PHE  93           HD1      PHE  93  22.174  -0.331  -4.806
  755    HD2  PHE  93           HD2      PHE  93  20.917   3.531  -3.407
  756    HE1  PHE  93           HE1      PHE  93  22.091   0.487  -7.145
  757    HE2  PHE  93           HE2      PHE  93  20.830   4.349  -5.748
  758    HZ   PHE  93           HZ       PHE  93  21.417   2.827  -7.617
  759    H    LEU  94           HN       LEU  94  22.421   2.759   0.070
  760    HA   LEU  94           HA       LEU  94  22.327   5.343  -1.110
  761   1HB   LEU  94          HB2       LEU  94  23.023   4.604   1.751
  762   2HB   LEU  94          HB1       LEU  94  22.499   6.193   1.199
  763    HG   LEU  94           HG       LEU  94  20.876   3.637   1.025
  764   1HD1  LEU  94          HD11      LEU  94  21.047   4.451   3.313
  765   2HD1  LEU  94          HD12      LEU  94  19.434   4.808   2.697
  766   3HD1  LEU  94          HD13      LEU  94  20.644   6.088   2.796
  767   1HD2  LEU  94          HD21      LEU  94  19.056   5.499   0.529
  768   2HD2  LEU  94          HD22      LEU  94  20.075   4.894  -0.772
  769   3HD2  LEU  94          HD23      LEU  94  20.452   6.436  -0.003
  Start of MODEL   15
    1   1H    MET   1          HT1       MET   1 -22.665  19.652   2.105
    2   2H    MET   1          HT2       MET   1 -22.471  18.844   3.587
    3   3H    MET   1          HT3       MET   1 -24.025  19.085   2.946
    4    HA   MET   1           HA       MET   1 -23.755  16.955   2.290
    5   1HB   MET   1          HB2       MET   1 -22.484  18.766   0.248
    6   2HB   MET   1          HB1       MET   1 -22.528  17.028  -0.050
    7   1HG   MET   1          HG2       MET   1 -24.498  18.261  -1.003
    8   2HG   MET   1          HG1       MET   1 -24.940  16.992   0.136
    9   1HE   MET   1          HE1       MET   1 -24.528  20.843  -0.458
   10   2HE   MET   1          HE2       MET   1 -26.086  21.287   0.236
   11   3HE   MET   1          HE3       MET   1 -26.012  20.077  -1.043
   12    H    LEU   2           HN       LEU   2 -21.919  15.454   1.038
   13    HA   LEU   2           HA       LEU   2 -19.669  15.367   2.998
   14   1HB   LEU   2          HB2       LEU   2 -20.586  13.254   1.028
   15   2HB   LEU   2          HB1       LEU   2 -19.428  13.042   2.342
   16    HG   LEU   2           HG       LEU   2 -22.357  13.763   2.660
   17   1HD1  LEU   2          HD11      LEU   2 -22.425  11.486   3.755
   18   2HD1  LEU   2          HD12      LEU   2 -20.796  11.213   3.134
   19   3HD1  LEU   2          HD13      LEU   2 -22.137  11.454   2.014
   20   1HD2  LEU   2          HD21      LEU   2 -21.677  13.136   5.130
   21   2HD2  LEU   2          HD22      LEU   2 -21.332  14.750   4.517
   22   3HD2  LEU   2          HD23      LEU   2 -20.049  13.543   4.586
   23    H    VAL   3           HN       VAL   3 -17.542  15.435   2.317
   24    HA   VAL   3           HA       VAL   3 -17.013  15.692  -0.624
   25    HB   VAL   3           HB       VAL   3 -15.361  17.455  -0.109
   26   1HG1  VAL   3          HG11      VAL   3 -16.946  19.234   0.313
   27   2HG1  VAL   3          HG12      VAL   3 -18.063  18.116   1.098
   28   3HG1  VAL   3          HG13      VAL   3 -17.769  17.997  -0.637
   29   1HG2  VAL   3          HG21      VAL   3 -15.439  18.474   2.189
   30   2HG2  VAL   3          HG22      VAL   3 -14.784  16.836   2.171
   31   3HG2  VAL   3          HG23      VAL   3 -16.441  17.118   2.706
   32    H    LYS   4           HN       LYS   4 -14.763  15.154  -1.193
   33    HA   LYS   4           HA       LYS   4 -13.868  12.794   0.195
   34   1HB   LYS   4          HB2       LYS   4 -12.663  14.457  -2.026
   35   2HB   LYS   4          HB1       LYS   4 -11.893  12.994  -1.409
   36   1HG   LYS   4          HG2       LYS   4 -13.791  11.645  -2.011
   37   2HG   LYS   4          HG1       LYS   4 -14.753  13.064  -2.402
   38   1HD   LYS   4          HD2       LYS   4 -12.155  12.594  -3.860
   39   2HD   LYS   4          HD1       LYS   4 -13.580  11.676  -4.330
   40   1HE   LYS   4          HE2       LYS   4 -13.622  13.571  -5.737
   41   2HE   LYS   4          HE1       LYS   4 -14.784  13.966  -4.477
   42   1HZ   LYS   4          HZ1       LYS   4 -13.511  15.619  -3.726
   43   2HZ   LYS   4          HZ2       LYS   4 -12.703  15.509  -5.216
   44   3HZ   LYS   4          HZ3       LYS   4 -12.078  14.719  -3.849
   45    HA   PRO   5           HA       PRO   5 -11.175  14.829   3.094
   46   1HB   PRO   5          HB2       PRO   5  -9.541  12.828   3.842
   47   2HB   PRO   5          HB1       PRO   5 -11.273  12.799   4.220
   48   1HG   PRO   5          HG2       PRO   5  -9.816  11.437   1.992
   49   2HG   PRO   5          HG1       PRO   5 -11.040  10.780   3.094
   50   1HD   PRO   5          HD2       PRO   5 -11.651  11.649   0.567
   51   2HD   PRO   5          HD1       PRO   5 -12.804  11.726   1.921
   52    HA   PRO   6           HA       PRO   6  -7.781  16.596   0.708
   53   1HB   PRO   6          HB2       PRO   6  -6.389  16.386   3.368
   54   2HB   PRO   6          HB1       PRO   6  -6.399  17.732   2.211
   55   1HG   PRO   6          HG2       PRO   6  -7.947  17.775   4.373
   56   2HG   PRO   6          HG1       PRO   6  -8.516  18.418   2.823
   57   1HD   PRO   6          HD2       PRO   6  -9.349  15.933   4.232
   58   2HD   PRO   6          HD1       PRO   6 -10.230  16.902   3.029
   59    H    TYR   7           HN       TYR   7  -7.347  13.663   2.614
   60    HA   TYR   7           HA       TYR   7  -4.687  13.026   1.844
   61   1HB   TYR   7          HB2       TYR   7  -6.820  10.915   2.132
   62   2HB   TYR   7          HB1       TYR   7  -5.128  10.845   2.616
   63    HD1  TYR   7           HD1      TYR   7  -8.119  10.705   4.062
   64    HD2  TYR   7           HD2      TYR   7  -4.711  13.323   4.120
   65    HE1  TYR   7           HE1      TYR   7  -8.754  11.481   6.316
   66    HE2  TYR   7           HE2      TYR   7  -5.351  14.100   6.381
   67    HH   TYR   7           HH       TYR   7  -8.141  13.933   7.662
   68    H    SER   8           HN       SER   8  -3.816  12.140   0.027
   69    HA   SER   8           HA       SER   8  -5.475  12.081  -2.397
   70   1HB   SER   8          HB2       SER   8  -3.429  11.879  -3.591
   71   2HB   SER   8          HB1       SER   8  -3.052  12.942  -2.237
   72    HG   SER   8           HG       SER   8  -2.285  11.072  -1.128
   73    H    TYR   9           HN       TYR   9  -5.021  10.079  -3.897
   74    HA   TYR   9           HA       TYR   9  -6.103   7.761  -2.617
   75   1HB   TYR   9          HB2       TYR   9  -4.702   8.118  -5.280
   76   2HB   TYR   9          HB1       TYR   9  -5.475   6.612  -4.777
   77    HD1  TYR   9           HD1      TYR   9  -7.944   6.834  -3.888
   78    HD2  TYR   9           HD2      TYR   9  -5.999   9.736  -6.389
   79    HE1  TYR   9           HE1      TYR   9 -10.155   7.727  -4.572
   80    HE2  TYR   9           HE2      TYR   9  -8.211  10.625  -7.075
   81    HH   TYR   9           HH       TYR   9 -11.218   9.365  -5.657
   82    H    ILE  10           HN       ILE  10  -2.789   8.694  -3.459
   83    HA   ILE  10           HA       ILE  10  -1.570   6.177  -2.757
   84    HB   ILE  10           HB       ILE  10  -0.409   8.980  -2.747
   85   1HG1  ILE  10          HG12      ILE  10  -1.293   8.423  -4.945
   86   2HG1  ILE  10          HG11      ILE  10   0.465   8.350  -4.994
   87   1HG2  ILE  10          HG21      ILE  10   1.023   7.491  -1.498
   88   2HG2  ILE  10          HG22      ILE  10   1.758   7.754  -3.079
   89   3HG2  ILE  10          HG23      ILE  10   0.900   6.250  -2.746
   90   1HD1  ILE  10          HD11      ILE  10  -0.110   6.383  -6.101
   91   2HD1  ILE  10          HD12      ILE  10  -1.527   6.105  -5.092
   92   3HD1  ILE  10          HD13      ILE  10   0.085   5.793  -4.452
   93    H    ALA  11           HN       ALA  11  -2.172   9.179  -0.931
   94    HA   ALA  11           HA       ALA  11  -0.799   8.341   1.451
   95   1HB   ALA  11          HB1       ALA  11  -3.033  10.356   1.046
   96   2HB   ALA  11          HB2       ALA  11  -1.301  10.693   1.097
   97   3HB   ALA  11          HB3       ALA  11  -2.138  10.156   2.553
   98    H    LEU  12           HN       LEU  12  -4.190   8.037   0.422
   99    HA   LEU  12           HA       LEU  12  -5.209   7.060   2.894
  100   1HB   LEU  12          HB2       LEU  12  -6.029   6.516   0.026
  101   2HB   LEU  12          HB1       LEU  12  -6.957   5.953   1.412
  102    HG   LEU  12           HG       LEU  12  -6.211   8.863   0.993
  103   1HD1  LEU  12          HD11      LEU  12  -8.650   9.073   0.285
  104   2HD1  LEU  12          HD12      LEU  12  -8.664   7.317   0.120
  105   3HD1  LEU  12          HD13      LEU  12  -7.586   8.288  -0.881
  106   1HD2  LEU  12          HD21      LEU  12  -8.385   9.005   2.494
  107   2HD2  LEU  12          HD22      LEU  12  -6.831   8.658   3.239
  108   3HD2  LEU  12          HD23      LEU  12  -7.965   7.348   2.921
  109    H    ILE  13           HN       ILE  13  -3.634   5.418   0.173
  110    HA   ILE  13           HA       ILE  13  -3.927   2.746   1.204
  111    HB   ILE  13           HB       ILE  13  -1.827   3.956  -0.617
  112   1HG1  ILE  13          HG12      ILE  13  -4.248   2.261  -1.299
  113   2HG1  ILE  13          HG11      ILE  13  -4.240   4.020  -1.382
  114   1HG2  ILE  13          HG21      ILE  13  -2.457   1.089   0.116
  115   2HG2  ILE  13          HG22      ILE  13  -0.914   1.929   0.270
  116   3HG2  ILE  13          HG23      ILE  13  -1.543   1.529  -1.326
  117   1HD1  ILE  13          HD11      ILE  13  -3.506   3.777  -3.507
  118   2HD1  ILE  13          HD12      ILE  13  -3.150   2.070  -3.266
  119   3HD1  ILE  13          HD13      ILE  13  -1.954   3.287  -2.830
  120    H    THR  14           HN       THR  14  -1.323   5.163   1.426
  121    HA   THR  14           HA       THR  14   0.498   3.572   2.917
  122    HB   THR  14           HB       THR  14   0.151   6.578   2.908
  123    HG1  THR  14           HG1      THR  14   1.776   4.824   1.383
  124   1HG2  THR  14          HG21      THR  14   2.620   6.494   3.482
  125   2HG2  THR  14          HG22      THR  14   2.406   4.774   3.810
  126   3HG2  THR  14          HG23      THR  14   1.536   5.970   4.771
  127    H    MET  15           HN       MET  15  -2.029   5.830   4.042
  128    HA   MET  15           HA       MET  15  -1.346   5.522   6.825
  129   1HB   MET  15          HB2       MET  15  -3.846   6.513   5.444
  130   2HB   MET  15          HB1       MET  15  -3.649   6.516   7.198
  131   1HG   MET  15          HG2       MET  15  -1.534   7.846   6.883
  132   2HG   MET  15          HG1       MET  15  -1.925   7.966   5.168
  133   1HE   MET  15          HE1       MET  15  -3.908   8.754   4.220
  134   2HE   MET  15          HE2       MET  15  -4.942  10.037   4.832
  135   3HE   MET  15          HE3       MET  15  -5.275   8.367   5.272
  136    H    ALA  16           HN       ALA  16  -3.717   3.904   4.732
  137    HA   ALA  16           HA       ALA  16  -5.130   2.467   6.702
  138   1HB   ALA  16          HB1       ALA  16  -6.000   2.261   4.541
  139   2HB   ALA  16          HB2       ALA  16  -5.250   0.681   4.767
  140   3HB   ALA  16          HB3       ALA  16  -4.421   1.929   3.833
  141    H    ILE  17           HN       ILE  17  -2.065   1.640   5.088
  142    HA   ILE  17           HA       ILE  17  -1.690  -0.915   6.294
  143    HB   ILE  17           HB       ILE  17   0.395   1.159   5.527
  144   1HG1  ILE  17          HG12      ILE  17  -0.672  -1.176   3.918
  145   2HG1  ILE  17          HG11      ILE  17  -1.274   0.473   3.752
  146   1HG2  ILE  17          HG21      ILE  17   1.446  -0.535   6.853
  147   2HG2  ILE  17          HG22      ILE  17   1.766  -0.974   5.176
  148   3HG2  ILE  17          HG23      ILE  17   0.510  -1.815   6.082
  149   1HD1  ILE  17          HD11      ILE  17   0.456   0.041   2.059
  150   2HD1  ILE  17          HD12      ILE  17   1.595  -0.421   3.323
  151   3HD1  ILE  17          HD13      ILE  17   1.025   1.245   3.216
  152    H    GLN  18           HN       GLN  18  -0.685   2.327   7.289
  153    HA   GLN  18           HA       GLN  18   0.679   1.616   9.678
  154   1HB   GLN  18          HB2       GLN  18  -0.824   4.123   8.893
  155   2HB   GLN  18          HB1       GLN  18   0.137   3.996  10.368
  156   1HG   GLN  18          HG2       GLN  18   2.122   3.406   9.026
  157   2HG   GLN  18          HG1       GLN  18   1.162   3.543   7.552
  158   1HE2  GLN  18          HE21      GLN  18   2.153   5.396   6.626
  159   2HE2  GLN  18          HE22      GLN  18   2.175   6.918   7.377
  160    H    ASN  19           HN       ASN  19  -2.759   2.481   9.192
  161    HA   ASN  19           HA       ASN  19  -3.315   1.842  12.030
  162   1HB   ASN  19          HB2       ASN  19  -5.628   2.576  11.475
  163   2HB   ASN  19          HB1       ASN  19  -4.416   3.807  11.116
  164   1HD2  ASN  19          HD21      ASN  19  -4.441   4.640   9.029
  165   2HD2  ASN  19          HD22      ASN  19  -5.248   3.938   7.712
  166    H    ALA  20           HN       ALA  20  -2.651  -0.132   9.682
  167    HA   ALA  20           HA       ALA  20  -5.052  -1.773   9.528
  168   1HB   ALA  20          HB1       ALA  20  -2.165  -2.413   8.833
  169   2HB   ALA  20          HB2       ALA  20  -3.382  -1.793   7.713
  170   3HB   ALA  20          HB3       ALA  20  -3.561  -3.405   8.405
  171    HA   PRO  21           HA       PRO  21  -4.619  -3.645  13.624
  172   1HB   PRO  21          HB2       PRO  21  -5.422  -6.100  12.081
  173   2HB   PRO  21          HB1       PRO  21  -6.019  -5.515  13.646
  174   1HG   PRO  21          HG2       PRO  21  -7.420  -5.163  11.395
  175   2HG   PRO  21          HG1       PRO  21  -7.406  -3.949  12.685
  176   1HD   PRO  21          HD2       PRO  21  -6.133  -3.832  10.002
  177   2HD   PRO  21          HD1       PRO  21  -6.602  -2.504  11.086
  178    H    GLU  22           HN       GLU  22  -3.368  -5.229  10.723
  179    HA   GLU  22           HA       GLU  22  -0.909  -6.033  12.243
  180   1HB   GLU  22          HB2       GLU  22  -2.297  -7.517   9.981
  181   2HB   GLU  22          HB1       GLU  22  -0.708  -7.925  10.613
  182   1HG   GLU  22          HG2       GLU  22  -2.072  -9.380  11.826
  183   2HG   GLU  22          HG1       GLU  22  -1.929  -8.021  12.937
  184    H    LYS  23           HN       LYS  23   1.061  -5.836  10.928
  185    HA   LYS  23           HA       LYS  23   1.074  -3.518   9.281
  186   1HB   LYS  23          HB2       LYS  23   3.102  -4.387  10.409
  187   2HB   LYS  23          HB1       LYS  23   3.081  -5.800   9.360
  188   1HG   LYS  23          HG2       LYS  23   4.696  -4.275   8.445
  189   2HG   LYS  23          HG1       LYS  23   3.292  -4.211   7.387
  190   1HD   LYS  23          HD2       LYS  23   2.572  -2.121   8.318
  191   2HD   LYS  23          HD1       LYS  23   3.717  -2.252   9.655
  192   1HE   LYS  23          HE2       LYS  23   4.529  -2.067   6.740
  193   2HE   LYS  23          HE1       LYS  23   4.442  -0.679   7.826
  194   1HZ   LYS  23          HZ1       LYS  23   6.679  -1.532   7.748
  195   2HZ   LYS  23          HZ2       LYS  23   6.146  -3.086   8.183
  196   3HZ   LYS  23          HZ3       LYS  23   6.028  -1.802   9.291
  197    H    LYS  24           HN       LYS  24   0.898  -6.974   8.470
  198    HA   LYS  24           HA       LYS  24   0.709  -6.335   5.581
  199   1HB   LYS  24          HB2       LYS  24   0.647  -8.965   7.092
  200   2HB   LYS  24          HB1       LYS  24   0.534  -8.826   5.336
  201   1HG   LYS  24          HG2       LYS  24   2.726  -7.693   5.284
  202   2HG   LYS  24          HG1       LYS  24   2.840  -7.837   7.039
  203   1HD   LYS  24          HD2       LYS  24   2.746 -10.296   6.844
  204   2HD   LYS  24          HD1       LYS  24   2.637 -10.151   5.090
  205   1HE   LYS  24          HE2       LYS  24   4.826  -8.940   5.101
  206   2HE   LYS  24          HE1       LYS  24   4.949  -9.250   6.833
  207   1HZ   LYS  24          HZ1       LYS  24   4.335 -11.610   5.341
  208   2HZ   LYS  24          HZ2       LYS  24   5.576 -11.335   6.469
  209   3HZ   LYS  24          HZ3       LYS  24   5.794 -10.907   4.840
  210    H    ILE  25           HN       ILE  25  -1.230  -6.007   4.624
  211    HA   ILE  25           HA       ILE  25  -3.698  -7.159   5.880
  212    HB   ILE  25           HB       ILE  25  -3.525  -4.763   6.457
  213   1HG1  ILE  25          HG12      ILE  25  -5.592  -5.179   4.280
  214   2HG1  ILE  25          HG11      ILE  25  -5.742  -5.855   5.903
  215   1HG2  ILE  25          HG21      ILE  25  -3.562  -4.289   3.463
  216   2HG2  ILE  25          HG22      ILE  25  -2.117  -4.158   4.467
  217   3HG2  ILE  25          HG23      ILE  25  -3.475  -3.063   4.727
  218   1HD1  ILE  25          HD11      ILE  25  -5.428  -2.906   5.265
  219   2HD1  ILE  25          HD12      ILE  25  -5.635  -3.602   6.872
  220   3HD1  ILE  25          HD13      ILE  25  -6.945  -3.694   5.695
  221    H    THR  26           HN       THR  26  -5.466  -7.446   4.320
  222    HA   THR  26           HA       THR  26  -4.448  -8.261   1.695
  223    HB   THR  26           HB       THR  26  -6.851  -8.959   1.331
  224    HG1  THR  26           HG1      THR  26  -7.266  -7.304   3.265
  225   1HG2  THR  26          HG21      THR  26  -6.715 -10.844   2.838
  226   2HG2  THR  26          HG22      THR  26  -5.638  -9.961   3.920
  227   3HG2  THR  26          HG23      THR  26  -5.078 -10.445   2.319
  228    H    LEU  27           HN       LEU  27  -5.434  -7.526  -0.320
  229    HA   LEU  27           HA       LEU  27  -5.531  -4.699  -0.583
  230   1HB   LEU  27          HB2       LEU  27  -4.982  -6.194  -2.451
  231   2HB   LEU  27          HB1       LEU  27  -6.596  -6.889  -2.397
  232    HG   LEU  27           HG       LEU  27  -7.596  -4.853  -3.185
  233   1HD1  LEU  27          HD11      LEU  27  -6.471  -3.125  -2.014
  234   2HD1  LEU  27          HD12      LEU  27  -6.007  -2.876  -3.694
  235   3HD1  LEU  27          HD13      LEU  27  -4.888  -3.659  -2.579
  236   1HD2  LEU  27          HD21      LEU  27  -6.400  -4.517  -5.323
  237   2HD2  LEU  27          HD22      LEU  27  -6.523  -6.227  -4.908
  238   3HD2  LEU  27          HD23      LEU  27  -5.002  -5.366  -4.664
  239    H    ASN  28           HN       ASN  28  -8.159  -7.104  -0.571
  240    HA   ASN  28           HA       ASN  28 -10.331  -5.284  -0.805
  241   1HB   ASN  28          HB2       ASN  28 -10.132  -7.997   0.520
  242   2HB   ASN  28          HB1       ASN  28 -11.652  -7.132   0.293
  243   1HD2  ASN  28          HD21      ASN  28  -9.792  -9.486  -1.127
  244   2HD2  ASN  28          HD22      ASN  28 -10.264  -9.287  -2.744
  245    H    GLY  29           HN       GLY  29  -8.578  -6.470   2.045
  246   1HA   GLY  29          HA2       GLY  29 -10.282  -5.400   4.040
  247   2HA   GLY  29          HA1       GLY  29  -8.560  -5.698   4.255
  248    H    ILE  30           HN       ILE  30  -7.577  -3.842   2.297
  249    HA   ILE  30           HA       ILE  30  -7.525  -1.451   3.848
  250    HB   ILE  30           HB       ILE  30  -6.849  -1.955   0.935
  251   1HG1  ILE  30          HG12      ILE  30  -5.049  -1.447   3.318
  252   2HG1  ILE  30          HG11      ILE  30  -5.512  -3.065   2.794
  253   1HG2  ILE  30          HG21      ILE  30  -7.308   0.397   1.079
  254   2HG2  ILE  30          HG22      ILE  30  -5.556   0.232   1.189
  255   3HG2  ILE  30          HG23      ILE  30  -6.507   0.522   2.646
  256   1HD1  ILE  30          HD11      ILE  30  -3.297  -2.222   1.872
  257   2HD1  ILE  30          HD12      ILE  30  -4.225  -1.043   0.945
  258   3HD1  ILE  30          HD13      ILE  30  -4.455  -2.768   0.659
  259    H    TYR  31           HN       TYR  31  -9.440  -2.317   0.974
  260    HA   TYR  31           HA       TYR  31 -10.673   0.218   0.591
  261   1HB   TYR  31          HB2       TYR  31 -11.500  -2.613  -0.050
  262   2HB   TYR  31          HB1       TYR  31 -12.547  -1.250  -0.442
  263    HD1  TYR  31           HD1      TYR  31 -11.491   0.702  -1.776
  264    HD2  TYR  31           HD2      TYR  31  -9.713  -3.180  -1.476
  265    HE1  TYR  31           HE1      TYR  31 -10.110   1.194  -3.756
  266    HE2  TYR  31           HE2      TYR  31  -8.320  -2.694  -3.461
  267    HH   TYR  31           HH       TYR  31  -8.880  -0.044  -5.502
  268    H    GLN  32           HN       GLN  32 -11.664  -2.520   2.626
  269    HA   GLN  32           HA       GLN  32 -14.190  -1.477   3.394
  270   1HB   GLN  32          HB2       GLN  32 -12.239  -3.286   4.828
  271   2HB   GLN  32          HB1       GLN  32 -13.857  -2.942   5.443
  272   1HG   GLN  32          HG2       GLN  32 -13.292  -4.062   2.683
  273   2HG   GLN  32          HG1       GLN  32 -13.715  -5.056   4.076
  274   1HE2  GLN  32          HE21      GLN  32 -15.621  -2.995   5.151
  275   2HE2  GLN  32          HE22      GLN  32 -16.981  -3.064   4.139
  276    H    PHE  33           HN       PHE  33 -10.953  -0.944   4.755
  277    HA   PHE  33           HA       PHE  33 -11.755   0.547   7.040
  278   1HB   PHE  33          HB2       PHE  33  -9.449  -0.284   6.659
  279   2HB   PHE  33          HB1       PHE  33  -9.252   0.893   5.361
  280    HD1  PHE  33           HD1      PHE  33  -9.801   0.497   9.011
  281    HD2  PHE  33           HD2      PHE  33  -8.820   3.206   5.825
  282    HE1  PHE  33           HE1      PHE  33  -9.135   2.210  10.675
  283    HE2  PHE  33           HE2      PHE  33  -8.158   4.923   7.489
  284    HZ   PHE  33           HZ       PHE  33  -8.313   4.423   9.914
  285    H    ILE  34           HN       ILE  34 -10.908   1.666   3.756
  286    HA   ILE  34           HA       ILE  34 -11.304   4.442   4.228
  287    HB   ILE  34           HB       ILE  34 -11.561   2.763   1.721
  288   1HG1  ILE  34          HG12      ILE  34  -9.441   4.774   2.502
  289   2HG1  ILE  34          HG11      ILE  34  -9.333   3.073   2.958
  290   1HG2  ILE  34          HG21      ILE  34 -11.798   5.750   2.114
  291   2HG2  ILE  34          HG22      ILE  34 -12.886   4.678   1.232
  292   3HG2  ILE  34          HG23      ILE  34 -11.292   5.052   0.576
  293   1HD1  ILE  34          HD11      ILE  34  -9.549   2.459   0.548
  294   2HD1  ILE  34          HD12      ILE  34  -8.106   3.416   0.885
  295   3HD1  ILE  34          HD13      ILE  34  -9.513   4.175   0.143
  296    H    MET  35           HN       MET  35 -13.631   2.033   2.918
  297    HA   MET  35           HA       MET  35 -15.785   3.908   2.716
  298   1HB   MET  35          HB2       MET  35 -15.776   0.894   3.008
  299   2HB   MET  35          HB1       MET  35 -17.243   1.836   2.743
  300   1HG   MET  35          HG2       MET  35 -16.285   2.759   0.669
  301   2HG   MET  35          HG1       MET  35 -14.815   1.824   0.927
  302   1HE   MET  35          HE1       MET  35 -15.562  -1.711   0.289
  303   2HE   MET  35          HE2       MET  35 -15.968  -1.176   1.917
  304   3HE   MET  35          HE3       MET  35 -14.582  -0.475   1.086
  305    H    ASP  36           HN       ASP  36 -14.775   1.758   5.370
  306    HA   ASP  36           HA       ASP  36 -17.027   2.332   7.059
  307   1HB   ASP  36          HB2       ASP  36 -14.202   1.428   7.685
  308   2HB   ASP  36          HB1       ASP  36 -15.470   1.566   8.906
  309    H    ARG  37           HN       ARG  37 -13.835   3.857   6.691
  310    HA   ARG  37           HA       ARG  37 -14.184   5.710   8.871
  311   1HB   ARG  37          HB2       ARG  37 -11.967   5.176   7.963
  312   2HB   ARG  37          HB1       ARG  37 -12.416   5.893   6.416
  313   1HG   ARG  37          HG2       ARG  37 -12.557   8.079   7.350
  314   2HG   ARG  37          HG1       ARG  37 -12.527   7.457   9.000
  315   1HD   ARG  37          HD2       ARG  37 -10.329   8.435   8.195
  316   2HD   ARG  37          HD1       ARG  37 -10.230   6.781   8.793
  317    HE   ARG  37           HE       ARG  37 -10.666   6.495   6.064
  318   1HH1  ARG  37          HH21      ARG  37  -8.439   8.176   8.091
  319   2HH1  ARG  37          HH22      ARG  37  -7.125   8.057   6.970
  320   1HH2  ARG  37          HH11      ARG  37  -8.953   6.318   4.594
  321   2HH2  ARG  37          HH12      ARG  37  -7.413   7.002   4.996
  322    H    PHE  38           HN       PHE  38 -14.429   6.185   5.328
  323    HA   PHE  38           HA       PHE  38 -16.044   8.643   5.857
  324   1HB   PHE  38          HB2       PHE  38 -14.372   7.796   3.485
  325   2HB   PHE  38          HB1       PHE  38 -15.417   9.217   3.484
  326    HD1  PHE  38           HD1      PHE  38 -15.130  10.836   5.534
  327    HD2  PHE  38           HD2      PHE  38 -12.159   8.017   4.240
  328    HE1  PHE  38           HE1      PHE  38 -13.383  12.134   6.719
  329    HE2  PHE  38           HE2      PHE  38 -10.406   9.322   5.422
  330    HZ   PHE  38           HZ       PHE  38 -11.027  11.378   6.666
  331    HA   PRO  39           HA       PRO  39 -19.340   6.048   4.094
  332   1HB   PRO  39          HB2       PRO  39 -21.429   7.734   4.452
  333   2HB   PRO  39          HB1       PRO  39 -20.670   6.890   5.817
  334   1HG   PRO  39          HG2       PRO  39 -20.291   9.705   4.892
  335   2HG   PRO  39          HG1       PRO  39 -20.466   9.080   6.541
  336   1HD   PRO  39          HD2       PRO  39 -18.034   9.703   5.409
  337   2HD   PRO  39          HD1       PRO  39 -18.229   8.492   6.695
  338    H    PHE  40           HN       PHE  40 -18.050   8.914   2.935
  339    HA   PHE  40           HA       PHE  40 -19.775   9.661   0.802
  340   1HB   PHE  40          HB2       PHE  40 -18.000  11.132   1.404
  341   2HB   PHE  40          HB1       PHE  40 -16.792   9.862   1.253
  342    HD1  PHE  40           HD1      PHE  40 -19.242  11.886  -0.720
  343    HD2  PHE  40           HD2      PHE  40 -15.652   9.517  -0.785
  344    HE1  PHE  40           HE1      PHE  40 -18.847  12.546  -3.079
  345    HE2  PHE  40           HE2      PHE  40 -15.267  10.175  -3.147
  346    HZ   PHE  40           HZ       PHE  40 -16.861  11.689  -4.290
  347    H    TYR  41           HN       TYR  41 -17.080   7.344   0.919
  348    HA   TYR  41           HA       TYR  41 -17.276   6.608  -1.854
  349   1HB   TYR  41          HB2       TYR  41 -16.030   5.186   0.503
  350   2HB   TYR  41          HB1       TYR  41 -15.809   4.718  -1.188
  351    HD1  TYR  41           HD1      TYR  41 -14.650   6.206  -2.764
  352    HD2  TYR  41           HD2      TYR  41 -15.037   7.208   1.377
  353    HE1  TYR  41           HE1      TYR  41 -12.903   7.932  -3.038
  354    HE2  TYR  41           HE2      TYR  41 -13.299   8.955   1.124
  355    HH   TYR  41           HH       TYR  41 -11.292   9.154  -1.636
  356    H    ARG  42           HN       ARG  42 -18.946   5.510   1.036
  357    HA   ARG  42           HA       ARG  42 -19.832   2.983   0.051
  358   1HB   ARG  42          HB2       ARG  42 -21.161   4.936   1.953
  359   2HB   ARG  42          HB1       ARG  42 -21.796   3.327   1.615
  360   1HG   ARG  42          HG2       ARG  42 -19.535   2.403   2.299
  361   2HG   ARG  42          HG1       ARG  42 -19.128   4.023   2.863
  362   1HD   ARG  42          HD2       ARG  42 -19.962   2.831   4.772
  363   2HD   ARG  42          HD1       ARG  42 -21.245   3.935   4.275
  364    HE   ARG  42           HE       ARG  42 -21.797   1.577   2.907
  365   1HH1  ARG  42          HH21      ARG  42 -21.285   2.550   6.177
  366   2HH1  ARG  42          HH22      ARG  42 -22.280   1.298   6.843
  367   1HH2  ARG  42          HH11      ARG  42 -23.093  -0.065   3.761
  368   2HH2  ARG  42          HH12      ARG  42 -23.305  -0.180   5.476
  369    H    GLU  43           HN       GLU  43 -21.123   6.265  -0.377
  370    HA   GLU  43           HA       GLU  43 -23.408   5.349  -1.923
  371   1HB   GLU  43          HB2       GLU  43 -22.159   8.076  -1.526
  372   2HB   GLU  43          HB1       GLU  43 -23.579   7.815  -2.539
  373   1HG   GLU  43          HG2       GLU  43 -24.790   6.864  -0.622
  374   2HG   GLU  43          HG1       GLU  43 -23.370   7.086   0.399
  375    H    ASN  44           HN       ASN  44 -20.195   5.385  -2.574
  376    HA   ASN  44           HA       ASN  44 -20.682   5.269  -5.507
  377   1HB   ASN  44          HB2       ASN  44 -19.870   7.596  -4.909
  378   2HB   ASN  44          HB1       ASN  44 -18.381   6.849  -4.325
  379   1HD2  ASN  44          HD21      ASN  44 -20.284   7.519  -7.246
  380   2HD2  ASN  44          HD22      ASN  44 -19.051   7.128  -8.344
  381    H    LYS  45           HN       LYS  45 -20.226   3.056  -5.556
  382    HA   LYS  45           HA       LYS  45 -17.697   2.106  -4.312
  383   1HB   LYS  45          HB2       LYS  45 -20.087   0.679  -5.491
  384   2HB   LYS  45          HB1       LYS  45 -18.631  -0.156  -4.943
  385   1HG   LYS  45          HG2       LYS  45 -18.918   0.653  -2.693
  386   2HG   LYS  45          HG1       LYS  45 -20.208   1.744  -3.191
  387   1HD   LYS  45          HD2       LYS  45 -21.298  -0.128  -2.187
  388   2HD   LYS  45          HD1       LYS  45 -21.506  -0.327  -3.925
  389   1HE   LYS  45          HE2       LYS  45 -19.780  -1.984  -4.033
  390   2HE   LYS  45          HE1       LYS  45 -19.244  -1.627  -2.390
  391   1HZ   LYS  45          HZ1       LYS  45 -20.550  -3.554  -2.242
  392   2HZ   LYS  45          HZ2       LYS  45 -21.766  -2.921  -3.244
  393   3HZ   LYS  45          HZ3       LYS  45 -21.544  -2.302  -1.677
  394    H    GLN  46           HN       GLN  46 -19.216   2.504  -7.487
  395    HA   GLN  46           HA       GLN  46 -16.958   1.150  -8.823
  396   1HB   GLN  46          HB2       GLN  46 -19.432   2.545  -9.867
  397   2HB   GLN  46          HB1       GLN  46 -18.193   1.854 -10.915
  398   1HG   GLN  46          HG2       GLN  46 -18.540  -0.355  -9.908
  399   2HG   GLN  46          HG1       GLN  46 -19.741   0.320  -8.806
  400   1HE2  GLN  46          HE21      GLN  46 -20.170  -1.758 -10.920
  401   2HE2  GLN  46          HE22      GLN  46 -21.350  -1.118 -11.959
  402    H    GLY  47           HN       GLY  47 -15.376   2.179 -10.016
  403   1HA   GLY  47          HA2       GLY  47 -14.439   4.107 -11.169
  404   2HA   GLY  47          HA1       GLY  47 -15.393   5.163 -10.131
  405    H    TRP  48           HN       TRP  48 -14.805   5.000  -7.727
  406    HA   TRP  48           HA       TRP  48 -11.985   5.516  -7.468
  407   1HB   TRP  48          HB2       TRP  48 -12.453   6.147  -5.266
  408   2HB   TRP  48          HB1       TRP  48 -13.962   6.480  -6.107
  409    HD1  TRP  48           HD1      TRP  48 -16.007   4.755  -5.689
  410    HE1  TRP  48           HE1      TRP  48 -16.508   3.223  -3.685
  411    HE3  TRP  48           HE3      TRP  48 -11.406   4.647  -3.474
  412    HZ2  TRP  48           HZ2      TRP  48 -15.153   2.092  -1.441
  413    HZ3  TRP  48           HZ3      TRP  48 -11.043   3.336  -1.407
  414    HH2  TRP  48           HH2      TRP  48 -12.904   2.059  -0.388
  415    H    GLN  49           HN       GLN  49 -14.020   2.749  -6.544
  416    HA   GLN  49           HA       GLN  49 -12.084   1.353  -5.015
  417   1HB   GLN  49          HB2       GLN  49 -14.500   0.759  -5.170
  418   2HB   GLN  49          HB1       GLN  49 -14.216   0.152  -6.801
  419   1HG   GLN  49          HG2       GLN  49 -12.620  -1.494  -5.944
  420   2HG   GLN  49          HG1       GLN  49 -12.812  -0.857  -4.310
  421   1HE2  GLN  49          HE21      GLN  49 -13.491  -3.607  -5.315
  422   2HE2  GLN  49          HE22      GLN  49 -15.142  -3.816  -4.980
  423    H    ASN  50           HN       ASN  50 -12.805   1.010  -8.515
  424    HA   ASN  50           HA       ASN  50 -10.626  -0.862  -8.911
  425   1HB   ASN  50          HB2       ASN  50 -12.293   0.761 -10.845
  426   2HB   ASN  50          HB1       ASN  50 -11.059  -0.390 -11.357
  427   1HD2  ASN  50          HD21      ASN  50 -11.357  -2.621  -9.939
  428   2HD2  ASN  50          HD22      ASN  50 -12.946  -3.217  -9.963
  429    H    SER  51           HN       SER  51 -10.958   2.638  -9.139
  430    HA   SER  51           HA       SER  51  -8.621   3.189 -10.652
  431   1HB   SER  51          HB2       SER  51  -9.996   4.775  -8.470
  432   2HB   SER  51          HB1       SER  51  -8.663   5.408  -9.428
  433    HG   SER  51           HG       SER  51 -10.359   4.344 -11.121
  434    H    ILE  52           HN       ILE  52  -9.006   2.673  -7.132
  435    HA   ILE  52           HA       ILE  52  -6.238   3.279  -6.563
  436    HB   ILE  52           HB       ILE  52  -8.343   1.764  -5.026
  437   1HG1  ILE  52          HG12      ILE  52  -7.158   4.538  -4.836
  438   2HG1  ILE  52          HG11      ILE  52  -8.826   4.098  -5.204
  439   1HG2  ILE  52          HG21      ILE  52  -6.114   0.906  -4.369
  440   2HG2  ILE  52          HG22      ILE  52  -6.798   1.871  -3.077
  441   3HG2  ILE  52          HG23      ILE  52  -5.555   2.558  -4.121
  442   1HD1  ILE  52          HD11      ILE  52  -8.865   4.763  -2.933
  443   2HD1  ILE  52          HD12      ILE  52  -7.383   3.882  -2.565
  444   3HD1  ILE  52          HD13      ILE  52  -8.876   3.000  -2.885
  445    H    ARG  53           HN       ARG  53  -8.007   0.206  -7.149
  446    HA   ARG  53           HA       ARG  53  -5.765  -1.514  -6.710
  447   1HB   ARG  53          HB2       ARG  53  -8.040  -1.883  -8.695
  448   2HB   ARG  53          HB1       ARG  53  -6.944  -3.148  -8.145
  449   1HG   ARG  53          HG2       ARG  53  -7.748  -2.522  -5.759
  450   2HG   ARG  53          HG1       ARG  53  -9.073  -1.697  -6.585
  451   1HD   ARG  53          HD2       ARG  53  -9.454  -3.890  -7.846
  452   2HD   ARG  53          HD1       ARG  53  -8.391  -4.634  -6.642
  453    HE   ARG  53           HE       ARG  53 -10.212  -3.351  -5.065
  454   1HH1  ARG  53          HH21      ARG  53 -10.458  -5.388  -7.840
  455   2HH1  ARG  53          HH22      ARG  53 -11.935  -6.131  -7.328
  456   1HH2  ARG  53          HH11      ARG  53 -12.136  -4.322  -4.377
  457   2HH2  ARG  53          HH12      ARG  53 -12.883  -5.532  -5.369
  458    H    HIS  54           HN       HIS  54  -6.966   0.052  -9.682
  459    HA   HIS  54           HA       HIS  54  -4.928  -0.931 -11.422
  460   1HB   HIS  54          HB2       HIS  54  -7.014   0.217 -12.182
  461   2HB   HIS  54          HB1       HIS  54  -6.373   1.736 -11.556
  462    HD1  HIS  54           HD1      HIS  54  -5.143  -1.024 -13.900
  463    HD2  HIS  54           HD2      HIS  54  -5.033   3.126 -13.520
  464    HE1  HIS  54           HE1      HIS  54  -3.923  -0.152 -15.939
  465    H    ASN  55           HN       ASN  55  -5.097   1.918  -9.318
  466    HA   ASN  55           HA       ASN  55  -2.606   3.097 -10.117
  467   1HB   ASN  55          HB2       ASN  55  -4.110   3.208  -7.484
  468   2HB   ASN  55          HB1       ASN  55  -2.703   4.200  -7.858
  469   1HD2  ASN  55          HD21      ASN  55  -5.249   5.385  -7.323
  470   2HD2  ASN  55          HD22      ASN  55  -5.817   6.106  -8.750
  471    H    LEU  56           HN       LEU  56  -3.473   0.702  -7.648
  472    HA   LEU  56           HA       LEU  56  -0.937   0.515  -6.399
  473   1HB   LEU  56          HB2       LEU  56  -3.241  -1.390  -6.704
  474   2HB   LEU  56          HB1       LEU  56  -1.763  -1.914  -5.907
  475    HG   LEU  56           HG       LEU  56  -3.283   0.590  -5.120
  476   1HD1  LEU  56          HD11      LEU  56  -3.945  -0.919  -3.113
  477   2HD1  LEU  56          HD12      LEU  56  -3.559  -2.265  -4.185
  478   3HD1  LEU  56          HD13      LEU  56  -4.820  -1.115  -4.629
  479   1HD2  LEU  56          HD21      LEU  56  -1.947  -0.131  -2.901
  480   2HD2  LEU  56          HD22      LEU  56  -1.202   0.868  -4.139
  481   3HD2  LEU  56          HD23      LEU  56  -0.866  -0.860  -4.082
  482    H    SER  57           HN       SER  57  -2.237  -1.335  -9.179
  483    HA   SER  57           HA       SER  57   0.091  -2.962  -9.517
  484   1HB   SER  57          HB2       SER  57  -1.966  -2.011 -11.531
  485   2HB   SER  57          HB1       SER  57  -0.729  -3.216 -11.881
  486    HG   SER  57           HG       SER  57  -1.638  -4.250  -9.865
  487    H    LEU  58           HN       LEU  58  -0.795   0.209 -10.869
  488    HA   LEU  58           HA       LEU  58   1.601   0.468 -12.461
  489   1HB   LEU  58          HB2       LEU  58  -0.408   2.479 -11.430
  490   2HB   LEU  58          HB1       LEU  58   0.958   2.940 -12.441
  491    HG   LEU  58           HG       LEU  58  -0.984   0.772 -13.268
  492   1HD1  LEU  58          HD11      LEU  58  -2.406   2.658 -13.008
  493   2HD1  LEU  58          HD12      LEU  58  -1.984   2.645 -14.721
  494   3HD1  LEU  58          HD13      LEU  58  -1.180   3.767 -13.624
  495   1HD2  LEU  58          HD21      LEU  58   1.120   2.448 -14.658
  496   2HD2  LEU  58          HD22      LEU  58  -0.176   1.683 -15.571
  497   3HD2  LEU  58          HD23      LEU  58   0.945   0.694 -14.645
  498    H    ASN  59           HN       ASN  59   0.713   1.434  -9.170
  499    HA   ASN  59           HA       ASN  59   3.084   3.003  -8.695
  500   1HB   ASN  59          HB2       ASN  59   1.158   1.604  -6.822
  501   2HB   ASN  59          HB1       ASN  59   2.478   2.631  -6.262
  502   1HD2  ASN  59          HD21      ASN  59   2.456   4.798  -7.924
  503   2HD2  ASN  59          HD22      ASN  59   0.948   5.577  -7.904
  504    H    GLU  60           HN       GLU  60   5.105   2.208  -8.631
  505    HA   GLU  60           HA       GLU  60   5.577  -0.659  -8.064
  506   1HB   GLU  60          HB2       GLU  60   7.416   1.602  -8.911
  507   2HB   GLU  60          HB1       GLU  60   7.938  -0.064  -8.671
  508   1HG   GLU  60          HG2       GLU  60   6.483  -0.849 -10.431
  509   2HG   GLU  60          HG1       GLU  60   5.734   0.742 -10.588
  510    H    CYS  61           HN       CYS  61   5.459   2.286  -6.388
  511    HA   CYS  61           HA       CYS  61   7.595   2.038  -4.531
  512   1HB   CYS  61          HB2       CYS  61   4.828   3.234  -4.211
  513   2HB   CYS  61          HB1       CYS  61   6.125   3.427  -3.032
  514    HG   CYS  61           HG       CYS  61   7.246   5.079  -4.519
  515    H    PHE  62           HN       PHE  62   4.316   0.676  -4.499
  516    HA   PHE  62           HA       PHE  62   4.700  -0.583  -1.887
  517   1HB   PHE  62          HB2       PHE  62   2.579  -0.963  -4.026
  518   2HB   PHE  62          HB1       PHE  62   2.524  -1.685  -2.417
  519    HD1  PHE  62           HD1      PHE  62   1.588   1.142  -4.345
  520    HD2  PHE  62           HD2      PHE  62   2.866  -0.003  -0.406
  521    HE1  PHE  62           HE1      PHE  62   0.637   3.240  -3.426
  522    HE2  PHE  62           HE2      PHE  62   1.913   2.094   0.512
  523    HZ   PHE  62           HZ       PHE  62   0.799   3.715  -0.999
  524    H    VAL  63           HN       VAL  63   5.106  -2.796  -1.531
  525    HA   VAL  63           HA       VAL  63   6.165  -4.313  -3.895
  526    HB   VAL  63           HB       VAL  63   6.799  -4.624  -0.942
  527   1HG1  VAL  63          HG11      VAL  63   8.637  -6.088  -1.848
  528   2HG1  VAL  63          HG12      VAL  63   7.877  -5.971  -3.434
  529   3HG1  VAL  63          HG13      VAL  63   7.018  -6.742  -2.100
  530   1HG2  VAL  63          HG21      VAL  63   8.599  -3.615  -3.158
  531   2HG2  VAL  63          HG22      VAL  63   8.892  -3.565  -1.419
  532   3HG2  VAL  63          HG23      VAL  63   7.656  -2.531  -2.135
  533    H    LYS  64           HN       LYS  64   4.963  -6.044  -4.492
  534    HA   LYS  64           HA       LYS  64   2.626  -6.800  -2.931
  535   1HB   LYS  64          HB2       LYS  64   3.747  -8.322  -5.290
  536   2HB   LYS  64          HB1       LYS  64   2.080  -8.253  -4.734
  537   1HG   LYS  64          HG2       LYS  64   3.049  -5.558  -5.343
  538   2HG   LYS  64          HG1       LYS  64   3.295  -6.616  -6.723
  539   1HD   LYS  64          HD2       LYS  64   0.637  -6.533  -5.293
  540   2HD   LYS  64          HD1       LYS  64   1.053  -5.347  -6.527
  541   1HE   LYS  64          HE2       LYS  64  -0.214  -7.425  -7.322
  542   2HE   LYS  64          HE1       LYS  64   1.244  -6.997  -8.218
  543   1HZ   LYS  64          HZ1       LYS  64   1.192  -9.349  -7.725
  544   2HZ   LYS  64          HZ2       LYS  64   1.056  -9.029  -6.062
  545   3HZ   LYS  64          HZ3       LYS  64   2.474  -8.609  -6.897
  546    H    VAL  65           HN       VAL  65   2.403  -8.543  -1.577
  547    HA   VAL  65           HA       VAL  65   4.597 -10.564  -1.477
  548    HB   VAL  65           HB       VAL  65   4.081 -10.494   1.124
  549   1HG1  VAL  65          HG11      VAL  65   5.880  -8.762   1.378
  550   2HG1  VAL  65          HG12      VAL  65   5.752  -8.437  -0.350
  551   3HG1  VAL  65          HG13      VAL  65   6.281 -10.023   0.211
  552   1HG2  VAL  65          HG21      VAL  65   2.246  -8.813   0.829
  553   2HG2  VAL  65          HG22      VAL  65   3.447  -7.650   0.276
  554   3HG2  VAL  65          HG23      VAL  65   3.512  -8.270   1.927
  555    HA   PRO  66           HA       PRO  66   0.929 -13.156  -1.494
  556   1HB   PRO  66          HB2       PRO  66   2.056 -15.589  -1.214
  557   2HB   PRO  66          HB1       PRO  66   2.339 -14.611  -2.669
  558   1HG   PRO  66          HG2       PRO  66   4.078 -14.933  -0.254
  559   2HG   PRO  66          HG1       PRO  66   4.521 -15.024  -1.969
  560   1HD   PRO  66          HD2       PRO  66   4.883 -12.756  -0.471
  561   2HD   PRO  66          HD1       PRO  66   4.563 -12.719  -2.221
  562    H    ARG  67           HN       ARG  67   0.753 -15.576   0.008
  563    HA   ARG  67           HA       ARG  67   0.982 -14.757   2.862
  564   1HB   ARG  67          HB2       ARG  67  -1.347 -15.475   3.260
  565   2HB   ARG  67          HB1       ARG  67  -1.293 -14.146   2.100
  566   1HG   ARG  67          HG2       ARG  67  -1.382 -15.806   0.250
  567   2HG   ARG  67          HG1       ARG  67  -1.565 -17.093   1.436
  568   1HD   ARG  67          HD2       ARG  67  -3.627 -16.066   2.270
  569   2HD   ARG  67          HD1       ARG  67  -3.458 -14.741   1.122
  570    HE   ARG  67           HE       ARG  67  -4.592 -17.347   0.617
  571   1HH1  ARG  67          HH21      ARG  67  -2.595 -14.936  -0.839
  572   2HH1  ARG  67          HH22      ARG  67  -2.736 -15.607  -2.430
  573   1HH2  ARG  67          HH11      ARG  67  -4.775 -18.222  -1.441
  574   2HH2  ARG  67          HH12      ARG  67  -3.965 -17.462  -2.769
  575    H    ASP  68           HN       ASP  68   0.452 -16.746   4.277
  576    HA   ASP  68           HA       ASP  68   2.096 -18.938   3.499
  577   1HB   ASP  68          HB2       ASP  68  -0.060 -18.697   5.611
  578   2HB   ASP  68          HB1       ASP  68   0.950 -20.130   5.429
  579    H    ASP  69           HN       ASP  69   1.567 -20.989   2.675
  580    HA   ASP  69           HA       ASP  69  -0.683 -21.091   0.872
  581   1HB   ASP  69          HB2       ASP  69   1.283 -23.193   1.815
  582   2HB   ASP  69          HB1       ASP  69   0.053 -23.502   0.589
  583    H    LYS  70           HN       LYS  70  -0.277 -21.948   4.198
  584    HA   LYS  70           HA       LYS  70  -2.368 -23.938   4.328
  585   1HB   LYS  70          HB2       LYS  70  -1.059 -22.201   6.428
  586   2HB   LYS  70          HB1       LYS  70  -2.314 -23.380   6.813
  587   1HG   LYS  70          HG2       LYS  70  -0.939 -25.171   5.816
  588   2HG   LYS  70          HG1       LYS  70   0.318 -23.993   5.433
  589   1HD   LYS  70          HD2       LYS  70   0.571 -23.475   7.832
  590   2HD   LYS  70          HD1       LYS  70  -0.691 -24.644   8.221
  591   1HE   LYS  70          HE2       LYS  70   1.747 -25.469   6.647
  592   2HE   LYS  70          HE1       LYS  70   1.777 -25.421   8.409
  593   1HZ   LYS  70          HZ1       LYS  70  -0.469 -26.730   8.072
  594   2HZ   LYS  70          HZ2       LYS  70   1.031 -27.525   8.111
  595   3HZ   LYS  70          HZ3       LYS  70   0.286 -27.186   6.622
  596    H    LYS  71           HN       LYS  71  -2.489 -20.593   3.819
  597    HA   LYS  71           HA       LYS  71  -5.373 -20.541   4.659
  598   1HB   LYS  71          HB2       LYS  71  -3.435 -18.221   4.832
  599   2HB   LYS  71          HB1       LYS  71  -5.114 -18.245   5.375
  600   1HG   LYS  71          HG2       LYS  71  -4.351 -20.259   6.859
  601   2HG   LYS  71          HG1       LYS  71  -2.724 -19.650   6.557
  602   1HD   LYS  71          HD2       LYS  71  -5.019 -18.097   7.788
  603   2HD   LYS  71          HD1       LYS  71  -3.589 -18.691   8.633
  604   1HE   LYS  71          HE2       LYS  71  -2.215 -17.312   6.967
  605   2HE   LYS  71          HE1       LYS  71  -3.736 -16.540   6.516
  606   1HZ   LYS  71          HZ1       LYS  71  -3.391 -16.678   9.347
  607   2HZ   LYS  71          HZ2       LYS  71  -3.731 -15.335   8.364
  608   3HZ   LYS  71          HZ3       LYS  71  -2.123 -15.833   8.602
  609    HA   PRO  72           HA       PRO  72  -5.006 -19.190   0.250
  610   1HB   PRO  72          HB2       PRO  72  -6.393 -21.157  -0.935
  611   2HB   PRO  72          HB1       PRO  72  -4.721 -21.426  -0.398
  612   1HG   PRO  72          HG2       PRO  72  -7.278 -22.248   0.907
  613   2HG   PRO  72          HG1       PRO  72  -5.767 -23.157   0.730
  614   1HD   PRO  72          HD2       PRO  72  -6.513 -21.750   3.029
  615   2HD   PRO  72          HD1       PRO  72  -4.846 -22.216   2.628
  616    H    GLY  73           HN       GLY  73  -7.033 -18.917  -1.343
  617   1HA   GLY  73          HA2       GLY  73  -9.284 -18.256  -1.664
  618   2HA   GLY  73          HA1       GLY  73  -9.629 -18.744  -0.006
  619    H    LYS  74           HN       LYS  74  -6.902 -16.732  -0.242
  620    HA   LYS  74           HA       LYS  74  -8.525 -14.317   0.506
  621   1HB   LYS  74          HB2       LYS  74  -5.875 -15.290   1.615
  622   2HB   LYS  74          HB1       LYS  74  -6.566 -13.703   1.955
  623   1HG   LYS  74          HG2       LYS  74  -8.583 -14.776   2.898
  624   2HG   LYS  74          HG1       LYS  74  -7.886 -16.362   2.559
  625   1HD   LYS  74          HD2       LYS  74  -5.990 -15.861   4.046
  626   2HD   LYS  74          HD1       LYS  74  -6.662 -14.267   4.380
  627   1HE   LYS  74          HE2       LYS  74  -7.126 -16.352   6.005
  628   2HE   LYS  74          HE1       LYS  74  -8.342 -15.107   5.734
  629   1HZ   LYS  74          HZ1       LYS  74  -9.263 -17.321   5.481
  630   2HZ   LYS  74          HZ2       LYS  74  -8.140 -17.674   4.256
  631   3HZ   LYS  74          HZ3       LYS  74  -9.321 -16.478   4.010
  632    H    GLY  75           HN       GLY  75  -7.515 -12.264  -0.083
  633   1HA   GLY  75          HA2       GLY  75  -6.304 -12.368  -2.716
  634   2HA   GLY  75          HA1       GLY  75  -6.627 -10.905  -1.788
  635    H    SER  76           HN       SER  76  -4.359 -10.634  -2.969
  636    HA   SER  76           HA       SER  76  -2.103 -11.876  -1.589
  637   1HB   SER  76          HB2       SER  76  -2.137 -11.099  -4.029
  638   2HB   SER  76          HB1       SER  76  -2.010  -9.458  -3.403
  639    HG   SER  76           HG       SER  76  -0.104 -10.147  -2.303
  640    H    TYR  77           HN       TYR  77  -0.763 -10.908  -0.065
  641    HA   TYR  77           HA       TYR  77  -1.932  -8.730   1.513
  642   1HB   TYR  77          HB2       TYR  77   0.689 -10.237   1.773
  643   2HB   TYR  77          HB1       TYR  77   0.088  -9.072   2.942
  644    HD1  TYR  77           HD1      TYR  77   0.654 -11.331   4.241
  645    HD2  TYR  77           HD2      TYR  77  -2.803 -10.784   1.726
  646    HE1  TYR  77           HE1      TYR  77  -0.514 -13.164   5.424
  647    HE2  TYR  77           HE2      TYR  77  -3.952 -12.600   2.922
  648    HH   TYR  77           HH       TYR  77  -2.594 -14.851   4.610
  649    H    TRP  78           HN       TRP  78  -0.700  -6.766   2.046
  650    HA   TRP  78           HA       TRP  78   1.254  -5.924  -0.069
  651   1HB   TRP  78          HB2       TRP  78  -1.144  -4.387   0.976
  652   2HB   TRP  78          HB1       TRP  78   0.140  -3.666   0.004
  653    HD1  TRP  78           HD1      TRP  78  -2.402  -6.570  -0.216
  654    HE1  TRP  78           HE1      TRP  78  -3.061  -6.878  -2.688
  655    HE3  TRP  78           HE3      TRP  78   0.654  -3.100  -2.377
  656    HZ2  TRP  78           HZ2      TRP  78  -2.381  -5.791  -5.250
  657    HZ3  TRP  78           HZ3      TRP  78   0.623  -2.752  -4.829
  658    HH2  TRP  78           HH2      TRP  78  -0.891  -4.088  -6.265
  659    H    THR  79           HN       THR  79   2.808  -4.347   0.670
  660    HA   THR  79           HA       THR  79   2.738  -3.567   3.524
  661    HB   THR  79           HB       THR  79   3.849  -5.836   3.377
  662    HG1  THR  79           HG1      THR  79   5.903  -4.785   4.364
  663   1HG2  THR  79          HG21      THR  79   4.946  -5.250   1.133
  664   2HG2  THR  79          HG22      THR  79   5.966  -6.069   2.318
  665   3HG2  THR  79          HG23      THR  79   6.119  -4.328   2.074
  666    H    LEU  80           HN       LEU  80   4.717  -2.145   4.025
  667    HA   LEU  80           HA       LEU  80   4.938  -0.136   1.920
  668   1HB   LEU  80          HB2       LEU  80   6.179  -0.346   4.672
  669   2HB   LEU  80          HB1       LEU  80   6.456   1.015   3.591
  670    HG   LEU  80           HG       LEU  80   3.720   0.114   4.536
  671   1HD1  LEU  80          HD11      LEU  80   5.341   2.507   5.444
  672   2HD1  LEU  80          HD12      LEU  80   5.237   0.996   6.348
  673   3HD1  LEU  80          HD13      LEU  80   3.789   1.968   6.086
  674   1HD2  LEU  80          HD21      LEU  80   3.304   1.324   2.579
  675   2HD2  LEU  80          HD22      LEU  80   4.731   2.341   2.775
  676   3HD2  LEU  80          HD23      LEU  80   3.303   2.619   3.768
  677    H    ASP  81           HN       ASP  81   7.015   0.715   1.202
  678    HA   ASP  81           HA       ASP  81   8.733  -1.323   0.147
  679   1HB   ASP  81          HB2       ASP  81  10.151   0.788  -0.434
  680   2HB   ASP  81          HB1       ASP  81   8.539   0.665  -1.130
  681    HA   PRO  82           HA       PRO  82  11.779  -1.829   3.347
  682   1HB   PRO  82          HB2       PRO  82  13.990  -0.922   1.539
  683   2HB   PRO  82          HB1       PRO  82  13.810  -2.455   2.419
  684   1HG   PRO  82          HG2       PRO  82  13.442  -2.370  -0.192
  685   2HG   PRO  82          HG1       PRO  82  12.357  -3.334   0.831
  686   1HD   PRO  82          HD2       PRO  82  11.893  -0.612  -0.363
  687   2HD   PRO  82          HD1       PRO  82  10.791  -2.010  -0.302
  688    H    ASP  83           HN       ASP  83  14.390  -0.162   3.162
  689    HA   ASP  83           HA       ASP  83  13.509   1.986   4.896
  690   1HB   ASP  83          HB2       ASP  83  15.855   2.681   4.877
  691   2HB   ASP  83          HB1       ASP  83  15.769   0.928   5.052
  692    H    SER  84           HN       SER  84  13.207   1.544   1.662
  693    HA   SER  84           HA       SER  84  13.895   4.223   0.727
  694   1HB   SER  84          HB2       SER  84  12.285   2.041  -0.620
  695   2HB   SER  84          HB1       SER  84  12.948   3.472  -1.404
  696    HG   SER  84           HG       SER  84  14.940   2.669  -1.214
  697    H    TYR  85           HN       TYR  85  12.019   4.212   2.934
  698    HA   TYR  85           HA       TYR  85   9.313   4.450   2.088
  699   1HB   TYR  85          HB2       TYR  85   9.092   5.903   4.182
  700   2HB   TYR  85          HB1       TYR  85   9.689   4.263   4.417
  701    HD1  TYR  85           HD1      TYR  85  12.159   3.870   4.684
  702    HD2  TYR  85           HD2      TYR  85  10.440   7.803   4.701
  703    HE1  TYR  85           HE1      TYR  85  14.220   4.763   5.733
  704    HE2  TYR  85           HE2      TYR  85  12.503   8.699   5.750
  705    HH   TYR  85           HH       TYR  85  14.660   8.237   6.249
  706    H    ASN  86           HN       ASN  86  11.730   7.058   2.583
  707    HA   ASN  86           HA       ASN  86  10.198   8.703   0.603
  708   1HB   ASN  86          HB2       ASN  86  10.427  10.663   1.999
  709   2HB   ASN  86          HB1       ASN  86   9.627   9.396   2.928
  710   1HD2  ASN  86          HD21      ASN  86  10.632  11.027   4.686
  711   2HD2  ASN  86          HD22      ASN  86  12.165  10.583   5.266
  712    H    MET  87           HN       MET  87  12.818   7.150   0.734
  713    HA   MET  87           HA       MET  87  15.084   8.763   0.770
  714   1HB   MET  87          HB2       MET  87  15.916   7.257  -1.162
  715   2HB   MET  87          HB1       MET  87  15.462   6.471   0.347
  716   1HG   MET  87          HG2       MET  87  14.498   5.223  -1.494
  717   2HG   MET  87          HG1       MET  87  13.191   6.024  -0.630
  718   1HE   MET  87          HE1       MET  87  11.341   6.544  -2.036
  719   2HE   MET  87          HE2       MET  87  11.989   5.223  -3.004
  720   3HE   MET  87          HE3       MET  87  11.422   6.690  -3.796
  721    H    PHE  88           HN       PHE  88  16.325   9.473  -1.318
  722    HA   PHE  88           HA       PHE  88  14.556  11.328  -2.793
  723   1HB   PHE  88          HB2       PHE  88  17.578  11.026  -2.737
  724   2HB   PHE  88          HB1       PHE  88  16.710  12.258  -3.651
  725    HD1  PHE  88           HD1      PHE  88  17.896  11.215  -0.367
  726    HD2  PHE  88           HD2      PHE  88  15.372  13.997  -2.451
  727    HE1  PHE  88           HE1      PHE  88  17.829  12.662   1.645
  728    HE2  PHE  88           HE2      PHE  88  15.302  15.443  -0.437
  729    HZ   PHE  88           HZ       PHE  88  16.532  14.776   1.611
  730    H    GLU  89           HN       GLU  89  13.572  10.226  -4.431
  731    HA   GLU  89           HA       GLU  89  14.537   7.976  -5.811
  732   1HB   GLU  89          HB2       GLU  89  13.021   8.806  -7.714
  733   2HB   GLU  89          HB1       GLU  89  12.258   8.531  -6.150
  734   1HG   GLU  89          HG2       GLU  89  12.448  10.944  -5.637
  735   2HG   GLU  89          HG1       GLU  89  13.196  11.215  -7.212
  736    H    ASN  90           HN       ASN  90  16.109   7.685  -7.296
  737    HA   ASN  90           HA       ASN  90  17.006   9.910  -9.013
  738   1HB   ASN  90          HB2       ASN  90  19.272   9.903  -8.278
  739   2HB   ASN  90          HB1       ASN  90  18.307   9.978  -6.805
  740   1HD2  ASN  90          HD21      ASN  90  20.982   8.956  -6.774
  741   2HD2  ASN  90          HD22      ASN  90  20.918   7.295  -6.427
  742    H    GLY  91           HN       GLY  91  19.347   8.642  -9.972
  743   1HA   GLY  91          HA2       GLY  91  18.302   6.825 -11.868
  744   2HA   GLY  91          HA1       GLY  91  20.013   6.946 -11.457
  745    H    SER  92           HN       SER  92  20.133   6.097  -8.874
  746    HA   SER  92           HA       SER  92  18.564   3.665  -8.476
  747   1HB   SER  92          HB2       SER  92  20.238   2.050  -8.814
  748   2HB   SER  92          HB1       SER  92  20.487   3.146 -10.171
  749    HG   SER  92           HG       SER  92  22.253   3.937  -9.225
  750    H    PHE  93           HN       PHE  93  18.185   3.856  -6.328
  751    HA   PHE  93           HA       PHE  93  20.479   4.563  -4.524
  752   1HB   PHE  93          HB2       PHE  93  18.689   6.369  -4.773
  753   2HB   PHE  93          HB1       PHE  93  17.579   5.245  -3.987
  754    HD1  PHE  93           HD1      PHE  93  17.529   5.084  -1.630
  755    HD2  PHE  93           HD2      PHE  93  20.928   6.854  -3.572
  756    HE1  PHE  93           HE1      PHE  93  18.466   5.712   0.579
  757    HE2  PHE  93           HE2      PHE  93  21.861   7.487  -1.363
  758    HZ   PHE  93           HZ       PHE  93  20.630   6.913   0.712
  759    H    LEU  94           HN       LEU  94  18.712   2.091  -5.519
  760    HA   LEU  94           HA       LEU  94  17.576   0.940  -3.171
  761   1HB   LEU  94          HB2       LEU  94  17.102   0.121  -5.449
  762   2HB   LEU  94          HB1       LEU  94  18.770  -0.419  -5.608
  763    HG   LEU  94           HG       LEU  94  18.447  -1.985  -3.727
  764   1HD1  LEU  94          HD11      LEU  94  15.902  -2.333  -3.133
  765   2HD1  LEU  94          HD12      LEU  94  15.745  -0.654  -3.649
  766   3HD1  LEU  94          HD13      LEU  94  16.819  -1.072  -2.314
  767   1HD2  LEU  94          HD21      LEU  94  16.401  -2.133  -5.961
  768   2HD2  LEU  94          HD22      LEU  94  16.790  -3.483  -4.895
  769   3HD2  LEU  94          HD23      LEU  94  18.026  -2.819  -5.964
  Start of MODEL   16
    1   1H    MET   1          HT1       MET   1 -23.276  17.709  -2.459
    2   2H    MET   1          HT2       MET   1 -22.193  18.789  -1.719
    3   3H    MET   1          HT3       MET   1 -23.868  19.017  -1.555
    4    HA   MET   1           HA       MET   1 -23.609  17.982   0.403
    5   1HB   MET   1          HB2       MET   1 -23.305  15.613  -1.472
    6   2HB   MET   1          HB1       MET   1 -23.850  15.541   0.207
    7   1HG   MET   1          HG2       MET   1 -25.235  17.182  -1.924
    8   2HG   MET   1          HG1       MET   1 -25.717  15.540  -1.510
    9   1HE   MET   1          HE1       MET   1 -25.756  15.554   2.042
   10   2HE   MET   1          HE2       MET   1 -26.194  14.701   0.566
   11   3HE   MET   1          HE3       MET   1 -27.446  15.471   1.534
   12    H    LEU   2           HN       LEU   2 -22.069  15.331   0.568
   13    HA   LEU   2           HA       LEU   2 -19.559  16.525   1.446
   14   1HB   LEU   2          HB2       LEU   2 -20.224  13.581   1.163
   15   2HB   LEU   2          HB1       LEU   2 -18.969  14.292   2.175
   16    HG   LEU   2           HG       LEU   2 -21.963  14.645   2.497
   17   1HD1  LEU   2          HD11      LEU   2 -21.382  13.584   4.759
   18   2HD1  LEU   2          HD12      LEU   2 -19.830  13.160   4.039
   19   3HD1  LEU   2          HD13      LEU   2 -21.324  12.521   3.354
   20   1HD2  LEU   2          HD21      LEU   2 -21.093  16.719   3.186
   21   2HD2  LEU   2          HD22      LEU   2 -19.603  16.003   3.800
   22   3HD2  LEU   2          HD23      LEU   2 -21.112  15.798   4.688
   23    H    VAL   3           HN       VAL   3 -17.475  16.082   0.572
   24    HA   VAL   3           HA       VAL   3 -17.470  15.153  -2.287
   25    HB   VAL   3           HB       VAL   3 -15.488  16.706  -2.529
   26   1HG1  VAL   3          HG11      VAL   3 -18.190  17.845  -1.762
   27   2HG1  VAL   3          HG12      VAL   3 -17.638  17.414  -3.380
   28   3HG1  VAL   3          HG13      VAL   3 -16.918  18.787  -2.540
   29   1HG2  VAL   3          HG21      VAL   3 -16.503  17.870   0.077
   30   2HG2  VAL   3          HG22      VAL   3 -15.084  18.372  -0.842
   31   3HG2  VAL   3          HG23      VAL   3 -15.095  16.814  -0.018
   32    H    LYS   4           HN       LYS   4 -15.590  13.952  -2.940
   33    HA   LYS   4           HA       LYS   4 -14.654  12.027  -1.147
   34   1HB   LYS   4          HB2       LYS   4 -12.655  11.857  -2.808
   35   2HB   LYS   4          HB1       LYS   4 -14.279  11.538  -3.412
   36   1HG   LYS   4          HG2       LYS   4 -14.438  13.835  -4.266
   37   2HG   LYS   4          HG1       LYS   4 -12.840  14.200  -3.617
   38   1HD   LYS   4          HD2       LYS   4 -11.855  12.461  -5.070
   39   2HD   LYS   4          HD1       LYS   4 -13.455  12.110  -5.726
   40   1HE   LYS   4          HE2       LYS   4 -13.627  14.275  -6.726
   41   2HE   LYS   4          HE1       LYS   4 -12.230  14.873  -5.832
   42   1HZ   LYS   4          HZ1       LYS   4 -11.446  12.594  -7.247
   43   2HZ   LYS   4          HZ2       LYS   4 -10.938  14.199  -7.475
   44   3HZ   LYS   4          HZ3       LYS   4 -12.281  13.602  -8.327
   45    HA   PRO   5           HA       PRO   5 -12.042  14.385   1.688
   46   1HB   PRO   5          HB2       PRO   5 -10.395  11.873   1.473
   47   2HB   PRO   5          HB1       PRO   5 -10.824  12.811   2.922
   48   1HG   PRO   5          HG2       PRO   5 -12.118  10.578   2.331
   49   2HG   PRO   5          HG1       PRO   5 -12.980  11.986   2.977
   50   1HD   PRO   5          HD2       PRO   5 -13.006  10.885   0.207
   51   2HD   PRO   5          HD1       PRO   5 -14.252  11.816   1.071
   52    HA   PRO   6           HA       PRO   6  -8.818  15.919  -0.982
   53   1HB   PRO   6          HB2       PRO   6  -7.154  17.148   0.764
   54   2HB   PRO   6          HB1       PRO   6  -8.804  17.737   0.471
   55   1HG   PRO   6          HG2       PRO   6  -7.781  16.039   2.712
   56   2HG   PRO   6          HG1       PRO   6  -8.855  17.449   2.776
   57   1HD   PRO   6          HD2       PRO   6  -9.792  14.878   2.863
   58   2HD   PRO   6          HD1       PRO   6 -10.729  16.220   2.168
   59    H    TYR   7           HN       TYR   7  -8.111  13.429   1.264
   60    HA   TYR   7           HA       TYR   7  -5.263  13.249   0.900
   61   1HB   TYR   7          HB2       TYR   7  -7.218  11.003   1.479
   62   2HB   TYR   7          HB1       TYR   7  -5.486  10.993   1.803
   63    HD1  TYR   7           HD1      TYR   7  -8.720  11.848   3.073
   64    HD2  TYR   7           HD2      TYR   7  -4.553  12.817   3.393
   65    HE1  TYR   7           HE1      TYR   7  -9.153  12.942   5.249
   66    HE2  TYR   7           HE2      TYR   7  -4.977  13.904   5.582
   67    HH   TYR   7           HH       TYR   7  -8.278  14.162   6.899
   68    H    SER   8           HN       SER   8  -4.085  12.081  -0.652
   69    HA   SER   8           HA       SER   8  -5.348  11.708  -3.228
   70   1HB   SER   8          HB2       SER   8  -2.985  12.280  -3.130
   71   2HB   SER   8          HB1       SER   8  -2.638  10.851  -2.159
   72    HG   SER   8           HG       SER   8  -3.911  10.015  -4.295
   73    H    TYR   9           HN       TYR   9  -5.457   9.572  -4.362
   74    HA   TYR   9           HA       TYR   9  -6.811   7.616  -2.797
   75   1HB   TYR   9          HB2       TYR   9  -5.474   7.452  -5.509
   76   2HB   TYR   9          HB1       TYR   9  -6.355   6.097  -4.805
   77    HD1  TYR   9           HD1      TYR   9  -6.628   9.453  -6.262
   78    HD2  TYR   9           HD2      TYR   9  -8.786   6.231  -4.421
   79    HE1  TYR   9           HE1      TYR   9  -8.768  10.457  -7.014
   80    HE2  TYR   9           HE2      TYR   9 -10.928   7.234  -5.171
   81    HH   TYR   9           HH       TYR   9 -11.165  10.399  -6.331
   82    H    ILE  10           HN       ILE  10  -3.430   7.875  -3.836
   83    HA   ILE  10           HA       ILE  10  -2.571   5.340  -2.770
   84    HB   ILE  10           HB       ILE  10  -1.042   7.919  -3.253
   85   1HG1  ILE  10          HG12      ILE  10  -1.139   5.384  -4.913
   86   2HG1  ILE  10          HG11      ILE  10  -2.162   6.785  -5.232
   87   1HG2  ILE  10          HG21      ILE  10   0.257   6.621  -1.732
   88   2HG2  ILE  10          HG22      ILE  10   0.926   6.282  -3.328
   89   3HG2  ILE  10          HG23      ILE  10  -0.147   5.116  -2.555
   90   1HD1  ILE  10          HD11      ILE  10   0.851   6.983  -5.041
   91   2HD1  ILE  10          HD12      ILE  10  -0.273   8.180  -5.681
   92   3HD1  ILE  10          HD13      ILE  10   0.015   6.680  -6.564
   93    H    ALA  11           HN       ALA  11  -2.734   8.624  -1.426
   94    HA   ALA  11           HA       ALA  11  -1.391   8.109   1.029
   95   1HB   ALA  11          HB1       ALA  11  -3.662  10.042   0.440
   96   2HB   ALA  11          HB2       ALA  11  -1.939  10.388   0.296
   97   3HB   ALA  11          HB3       ALA  11  -2.647  10.086   1.882
   98    H    LEU  12           HN       LEU  12  -4.852   7.815   0.196
   99    HA   LEU  12           HA       LEU  12  -5.738   7.086   2.805
  100   1HB   LEU  12          HB2       LEU  12  -6.790   6.342   0.062
  101   2HB   LEU  12          HB1       LEU  12  -7.629   5.945   1.558
  102    HG   LEU  12           HG       LEU  12  -6.831   8.766   0.781
  103   1HD1  LEU  12          HD11      LEU  12  -8.443   7.804  -0.835
  104   2HD1  LEU  12          HD12      LEU  12  -9.182   9.078   0.136
  105   3HD1  LEU  12          HD13      LEU  12  -9.518   7.386   0.499
  106   1HD2  LEU  12          HD21      LEU  12  -8.823   9.151   2.482
  107   2HD2  LEU  12          HD22      LEU  12  -7.207   8.827   3.090
  108   3HD2  LEU  12          HD23      LEU  12  -8.404   7.533   3.040
  109    H    ILE  13           HN       ILE  13  -4.424   5.145   0.136
  110    HA   ILE  13           HA       ILE  13  -4.790   2.599   1.444
  111    HB   ILE  13           HB       ILE  13  -2.811   3.489  -0.681
  112   1HG1  ILE  13          HG12      ILE  13  -5.334   1.833  -0.954
  113   2HG1  ILE  13          HG11      ILE  13  -5.295   3.574  -1.215
  114   1HG2  ILE  13          HG21      ILE  13  -3.498   0.753   0.422
  115   2HG2  ILE  13          HG22      ILE  13  -1.909   1.516   0.348
  116   3HG2  ILE  13          HG23      ILE  13  -2.701   0.987  -1.135
  117   1HD1  ILE  13          HD11      ILE  13  -4.370   3.339  -3.266
  118   2HD1  ILE  13          HD12      ILE  13  -4.782   1.632  -3.141
  119   3HD1  ILE  13          HD13      ILE  13  -3.170   2.179  -2.696
  120    H    THR  14           HN       THR  14  -2.109   4.930   1.297
  121    HA   THR  14           HA       THR  14  -0.199   3.396   2.736
  122    HB   THR  14           HB       THR  14  -0.534   6.407   2.692
  123    HG1  THR  14           HG1      THR  14   1.438   5.431   1.180
  124   1HG2  THR  14          HG21      THR  14   1.942   6.337   3.140
  125   2HG2  THR  14          HG22      THR  14   1.790   4.600   3.409
  126   3HG2  THR  14          HG23      THR  14   0.962   5.734   4.477
  127    H    MET  15           HN       MET  15  -2.745   5.598   3.867
  128    HA   MET  15           HA       MET  15  -1.996   5.523   6.641
  129   1HB   MET  15          HB2       MET  15  -4.650   6.059   5.273
  130   2HB   MET  15          HB1       MET  15  -4.402   6.228   7.010
  131   1HG   MET  15          HG2       MET  15  -2.619   7.881   6.602
  132   2HG   MET  15          HG1       MET  15  -2.862   7.714   4.863
  133   1HE   MET  15          HE1       MET  15  -2.764  10.292   6.193
  134   2HE   MET  15          HE2       MET  15  -4.220  11.238   5.888
  135   3HE   MET  15          HE3       MET  15  -3.416  10.415   4.554
  136    H    ALA  16           HN       ALA  16  -4.175   3.573   4.654
  137    HA   ALA  16           HA       ALA  16  -5.325   2.006   6.725
  138   1HB   ALA  16          HB1       ALA  16  -4.691   1.081   3.915
  139   2HB   ALA  16          HB2       ALA  16  -6.046   2.135   4.307
  140   3HB   ALA  16          HB3       ALA  16  -5.984   0.499   4.966
  141    H    ILE  17           HN       ILE  17  -2.438   1.351   4.709
  142    HA   ILE  17           HA       ILE  17  -1.797  -1.175   5.856
  143    HB   ILE  17           HB       ILE  17   0.113   0.947   4.815
  144   1HG1  ILE  17          HG12      ILE  17  -1.121  -1.395   3.342
  145   2HG1  ILE  17          HG11      ILE  17  -1.772   0.242   3.275
  146   1HG2  ILE  17          HG21      ILE  17   1.519  -1.081   4.308
  147   2HG2  ILE  17          HG22      ILE  17   0.360  -2.049   5.217
  148   3HG2  ILE  17          HG23      ILE  17   1.293  -0.795   6.032
  149   1HD1  ILE  17          HD11      ILE  17   0.433   1.060   2.458
  150   2HD1  ILE  17          HD12      ILE  17  -0.284  -0.121   1.363
  151   3HD1  ILE  17          HD13      ILE  17   1.022  -0.604   2.446
  152    H    GLN  18           HN       GLN  18  -0.632   2.080   6.662
  153    HA   GLN  18           HA       GLN  18   0.971   1.287   8.903
  154   1HB   GLN  18          HB2       GLN  18  -0.342   3.916   8.171
  155   2HB   GLN  18          HB1       GLN  18   0.756   3.734   9.539
  156   1HG   GLN  18          HG2       GLN  18   2.568   3.078   8.096
  157   2HG   GLN  18          HG1       GLN  18   1.488   2.960   6.705
  158   1HE2  GLN  18          HE21      GLN  18   3.870   4.753   7.018
  159   2HE2  GLN  18          HE22      GLN  18   3.280   6.334   6.833
  160    H    ASN  19           HN       ASN  19  -2.405   2.389   8.664
  161    HA   ASN  19           HA       ASN  19  -2.862   2.432  11.516
  162   1HB   ASN  19          HB2       ASN  19  -4.740   2.291   9.146
  163   2HB   ASN  19          HB1       ASN  19  -5.298   2.420  10.814
  164   1HD2  ASN  19          HD21      ASN  19  -2.581   4.123  11.119
  165   2HD2  ASN  19          HD22      ASN  19  -3.099   5.664  10.634
  166    H    ALA  20           HN       ALA  20  -2.780  -0.116   9.170
  167    HA   ALA  20           HA       ALA  20  -4.474  -1.932  10.692
  168   1HB   ALA  20          HB1       ALA  20  -2.470  -2.720   8.574
  169   2HB   ALA  20          HB2       ALA  20  -4.026  -1.994   8.171
  170   3HB   ALA  20          HB3       ALA  20  -3.968  -3.539   9.019
  171    HA   PRO  21           HA       PRO  21  -1.232  -2.829  13.776
  172   1HB   PRO  21          HB2       PRO  21  -2.760  -5.424  13.775
  173   2HB   PRO  21          HB1       PRO  21  -2.152  -4.481  15.152
  174   1HG   PRO  21          HG2       PRO  21  -4.720  -4.395  14.466
  175   2HG   PRO  21          HG1       PRO  21  -3.874  -2.947  15.035
  176   1HD   PRO  21          HD2       PRO  21  -4.779  -3.624  12.277
  177   2HD   PRO  21          HD1       PRO  21  -4.522  -2.029  13.019
  178    H    GLU  22           HN       GLU  22  -2.180  -4.851  11.083
  179    HA   GLU  22           HA       GLU  22   0.590  -6.002  10.922
  180   1HB   GLU  22          HB2       GLU  22  -1.318  -7.644  11.236
  181   2HB   GLU  22          HB1       GLU  22  -1.958  -7.098   9.686
  182   1HG   GLU  22          HG2       GLU  22   0.145  -7.758   8.580
  183   2HG   GLU  22          HG1       GLU  22   0.787  -8.311  10.127
  184    H    LYS  23           HN       LYS  23   1.747  -5.281   9.162
  185    HA   LYS  23           HA       LYS  23   0.571  -3.339   7.387
  186   1HB   LYS  23          HB2       LYS  23   3.222  -4.792   7.298
  187   2HB   LYS  23          HB1       LYS  23   2.764  -3.534   6.149
  188   1HG   LYS  23          HG2       LYS  23   2.429  -1.950   8.013
  189   2HG   LYS  23          HG1       LYS  23   2.894  -3.205   9.162
  190   1HD   LYS  23          HD2       LYS  23   5.113  -3.366   8.086
  191   2HD   LYS  23          HD1       LYS  23   4.642  -2.105   6.946
  192   1HE   LYS  23          HE2       LYS  23   5.787  -0.859   8.552
  193   2HE   LYS  23          HE1       LYS  23   4.129  -0.720   9.135
  194   1HZ   LYS  23          HZ1       LYS  23   4.539  -2.047  10.892
  195   2HZ   LYS  23          HZ2       LYS  23   6.141  -1.534  10.652
  196   3HZ   LYS  23          HZ3       LYS  23   5.629  -3.038  10.048
  197    H    LYS  24           HN       LYS  24   1.002  -6.814   7.186
  198    HA   LYS  24           HA       LYS  24   0.525  -6.885   4.302
  199   1HB   LYS  24          HB2       LYS  24   0.605  -9.018   6.440
  200   2HB   LYS  24          HB1       LYS  24   0.189  -9.382   4.768
  201   1HG   LYS  24          HG2       LYS  24   2.341  -8.407   4.028
  202   2HG   LYS  24          HG1       LYS  24   2.755  -8.066   5.709
  203   1HD   LYS  24          HD2       LYS  24   2.636 -10.474   6.233
  204   2HD   LYS  24          HD1       LYS  24   2.224 -10.819   4.550
  205   1HE   LYS  24          HE2       LYS  24   4.394  -9.643   3.910
  206   2HE   LYS  24          HE1       LYS  24   4.813  -9.677   5.623
  207   1HZ   LYS  24          HZ1       LYS  24   5.620 -11.592   4.196
  208   2HZ   LYS  24          HZ2       LYS  24   4.006 -12.120   4.165
  209   3HZ   LYS  24          HZ3       LYS  24   4.834 -11.997   5.644
  210    H    ILE  25           HN       ILE  25  -1.423  -5.479   4.510
  211    HA   ILE  25           HA       ILE  25  -3.854  -6.768   5.584
  212    HB   ILE  25           HB       ILE  25  -3.458  -4.315   5.848
  213   1HG1  ILE  25          HG12      ILE  25  -5.826  -4.848   4.039
  214   2HG1  ILE  25          HG11      ILE  25  -5.767  -5.387   5.716
  215   1HG2  ILE  25          HG21      ILE  25  -2.327  -4.057   3.614
  216   2HG2  ILE  25          HG22      ILE  25  -3.568  -2.846   3.934
  217   3HG2  ILE  25          HG23      ILE  25  -3.911  -4.196   2.854
  218   1HD1  ILE  25          HD11      ILE  25  -5.429  -2.512   4.812
  219   2HD1  ILE  25          HD12      ILE  25  -5.461  -3.082   6.480
  220   3HD1  ILE  25          HD13      ILE  25  -6.912  -3.190   5.483
  221    H    THR  26           HN       THR  26  -5.587  -7.449   4.238
  222    HA   THR  26           HA       THR  26  -4.753  -8.377   1.595
  223    HB   THR  26           HB       THR  26  -6.958  -9.439   1.513
  224    HG1  THR  26           HG1      THR  26  -7.463  -7.506   3.411
  225   1HG2  THR  26          HG21      THR  26  -6.900 -10.531   3.892
  226   2HG2  THR  26          HG22      THR  26  -5.421  -9.599   4.099
  227   3HG2  THR  26          HG23      THR  26  -5.542 -10.786   2.801
  228    H    LEU  27           HN       LEU  27  -5.987  -7.911  -0.367
  229    HA   LEU  27           HA       LEU  27  -6.242  -5.135  -0.876
  230   1HB   LEU  27          HB2       LEU  27  -5.863  -6.969  -2.576
  231   2HB   LEU  27          HB1       LEU  27  -7.567  -7.385  -2.418
  232    HG   LEU  27           HG       LEU  27  -8.177  -5.075  -3.119
  233   1HD1  LEU  27          HD11      LEU  27  -5.201  -4.766  -2.990
  234   2HD1  LEU  27          HD12      LEU  27  -6.473  -3.605  -2.622
  235   3HD1  LEU  27          HD13      LEU  27  -6.038  -3.931  -4.291
  236   1HD2  LEU  27          HD21      LEU  27  -7.306  -5.321  -5.500
  237   2HD2  LEU  27          HD22      LEU  27  -8.127  -6.739  -4.846
  238   3HD2  LEU  27          HD23      LEU  27  -6.366  -6.698  -4.926
  239    H    ASN  28           HN       ASN  28  -8.773  -7.601  -0.450
  240    HA   ASN  28           HA       ASN  28 -11.009  -5.860  -0.664
  241   1HB   ASN  28          HB2       ASN  28 -10.638  -8.458   0.843
  242   2HB   ASN  28          HB1       ASN  28 -12.194  -7.644   0.687
  243   1HD2  ASN  28          HD21      ASN  28 -11.429 -10.283  -0.472
  244   2HD2  ASN  28          HD22      ASN  28 -11.616 -10.127  -2.151
  245    H    GLY  29           HN       GLY  29  -9.038  -6.784   2.135
  246   1HA   GLY  29          HA2       GLY  29 -10.615  -5.555   4.149
  247   2HA   GLY  29          HA1       GLY  29  -8.878  -5.829   4.268
  248    H    ILE  30           HN       ILE  30  -8.097  -4.174   2.042
  249    HA   ILE  30           HA       ILE  30  -7.882  -1.664   3.356
  250    HB   ILE  30           HB       ILE  30  -7.529  -2.410   0.439
  251   1HG1  ILE  30          HG12      ILE  30  -5.493  -1.761   2.588
  252   2HG1  ILE  30          HG11      ILE  30  -6.012  -3.403   2.210
  253   1HG2  ILE  30          HG21      ILE  30  -7.954  -0.047   0.448
  254   2HG2  ILE  30          HG22      ILE  30  -6.201  -0.230   0.386
  255   3HG2  ILE  30          HG23      ILE  30  -6.990   0.183   1.908
  256   1HD1  ILE  30          HD11      ILE  30  -4.942  -1.548   0.078
  257   2HD1  ILE  30          HD12      ILE  30  -5.111  -3.301   0.015
  258   3HD1  ILE  30          HD13      ILE  30  -3.879  -2.571   1.042
  259    H    TYR  31           HN       TYR  31 -10.111  -2.710   0.759
  260    HA   TYR  31           HA       TYR  31 -11.358  -0.182   0.358
  261   1HB   TYR  31          HB2       TYR  31 -12.308  -3.028   0.021
  262   2HB   TYR  31          HB1       TYR  31 -13.377  -1.671  -0.317
  263    HD1  TYR  31           HD1      TYR  31 -10.781  -3.760  -1.620
  264    HD2  TYR  31           HD2      TYR  31 -12.473   0.175  -1.901
  265    HE1  TYR  31           HE1      TYR  31  -9.719  -3.464  -3.840
  266    HE2  TYR  31           HE2      TYR  31 -11.410   0.469  -4.117
  267    HH   TYR  31           HH       TYR  31 -10.605  -1.333  -6.022
  268    H    GLN  32           HN       GLN  32 -12.220  -2.821   2.593
  269    HA   GLN  32           HA       GLN  32 -14.562  -1.633   3.664
  270   1HB   GLN  32          HB2       GLN  32 -12.541  -3.543   4.845
  271   2HB   GLN  32          HB1       GLN  32 -14.033  -3.096   5.676
  272   1HG   GLN  32          HG2       GLN  32 -14.019  -4.177   2.852
  273   2HG   GLN  32          HG1       GLN  32 -14.123  -5.232   4.262
  274   1HE2  GLN  32          HE21      GLN  32 -15.815  -3.877   5.971
  275   2HE2  GLN  32          HE22      GLN  32 -17.330  -3.633   5.244
  276    H    PHE  33           HN       PHE  33 -11.159  -1.283   4.630
  277    HA   PHE  33           HA       PHE  33 -11.601   0.213   7.006
  278   1HB   PHE  33          HB2       PHE  33  -9.403  -0.732   6.301
  279   2HB   PHE  33          HB1       PHE  33  -9.315   0.482   5.027
  280    HD1  PHE  33           HD1      PHE  33  -8.942   2.847   5.554
  281    HD2  PHE  33           HD2      PHE  33  -9.143  -0.126   8.648
  282    HE1  PHE  33           HE1      PHE  33  -7.962   4.458   7.168
  283    HE2  PHE  33           HE2      PHE  33  -8.167   1.484  10.260
  284    HZ   PHE  33           HZ       PHE  33  -7.577   3.776   9.521
  285    H    ILE  34           HN       ILE  34 -11.131   1.324   3.642
  286    HA   ILE  34           HA       ILE  34 -11.356   4.118   4.226
  287    HB   ILE  34           HB       ILE  34 -11.876   2.543   1.695
  288   1HG1  ILE  34          HG12      ILE  34  -9.530   4.314   2.416
  289   2HG1  ILE  34          HG11      ILE  34  -9.551   2.583   2.764
  290   1HG2  ILE  34          HG21      ILE  34 -13.034   4.561   1.326
  291   2HG2  ILE  34          HG22      ILE  34 -11.436   4.885   0.657
  292   3HG2  ILE  34          HG23      ILE  34 -11.868   5.510   2.249
  293   1HD1  ILE  34          HD11      ILE  34  -8.483   3.303   0.535
  294   2HD1  ILE  34          HD12      ILE  34 -10.126   3.651  -0.002
  295   3HD1  ILE  34          HD13      ILE  34  -9.681   2.010   0.465
  296    H    MET  35           HN       MET  35 -13.829   1.829   2.959
  297    HA   MET  35           HA       MET  35 -15.916   3.748   2.814
  298   1HB   MET  35          HB2       MET  35 -16.009   0.753   3.194
  299   2HB   MET  35          HB1       MET  35 -17.451   1.739   2.951
  300   1HG   MET  35          HG2       MET  35 -16.493   2.591   0.828
  301   2HG   MET  35          HG1       MET  35 -15.085   1.561   1.066
  302   1HE   MET  35          HE1       MET  35 -16.118  -1.931   0.526
  303   2HE   MET  35          HE2       MET  35 -16.368  -1.309   2.154
  304   3HE   MET  35          HE3       MET  35 -14.992  -0.752   1.206
  305    H    ASP  36           HN       ASP  36 -14.941   1.656   5.532
  306    HA   ASP  36           HA       ASP  36 -17.149   2.361   7.226
  307   1HB   ASP  36          HB2       ASP  36 -14.366   1.347   7.852
  308   2HB   ASP  36          HB1       ASP  36 -15.614   1.573   9.079
  309    H    ARG  37           HN       ARG  37 -13.908   3.773   6.828
  310    HA   ARG  37           HA       ARG  37 -14.285   5.665   8.997
  311   1HB   ARG  37          HB2       ARG  37 -12.058   4.848   8.276
  312   2HB   ARG  37          HB1       ARG  37 -12.266   5.688   6.739
  313   1HG   ARG  37          HG2       ARG  37 -12.451   7.836   7.933
  314   2HG   ARG  37          HG1       ARG  37 -12.254   7.001   9.470
  315   1HD   ARG  37          HD2       ARG  37 -10.222   6.825   7.240
  316   2HD   ARG  37          HD1       ARG  37 -10.139   8.064   8.485
  317    HE   ARG  37           HE       ARG  37  -9.324   5.298   8.705
  318   1HH1  ARG  37          HH21      ARG  37 -10.864   7.821  10.490
  319   2HH1  ARG  37          HH22      ARG  37 -10.627   7.047  12.020
  320   1HH2  ARG  37          HH11      ARG  37  -9.009   4.292  10.682
  321   2HH2  ARG  37          HH12      ARG  37  -9.580   5.054  12.129
  322    H    PHE  38           HN       PHE  38 -13.778   6.378   5.501
  323    HA   PHE  38           HA       PHE  38 -15.144   8.945   5.882
  324   1HB   PHE  38          HB2       PHE  38 -13.861   7.648   3.475
  325   2HB   PHE  38          HB1       PHE  38 -14.612   9.241   3.434
  326    HD1  PHE  38           HD1      PHE  38 -13.745  11.041   5.012
  327    HD2  PHE  38           HD2      PHE  38 -11.677   7.336   4.342
  328    HE1  PHE  38           HE1      PHE  38 -11.662  12.038   5.919
  329    HE2  PHE  38           HE2      PHE  38  -9.596   8.333   5.248
  330    HZ   PHE  38           HZ       PHE  38  -9.588  10.685   6.036
  331    HA   PRO  39           HA       PRO  39 -19.021   7.064   4.507
  332   1HB   PRO  39          HB2       PRO  39 -20.648   9.210   4.650
  333   2HB   PRO  39          HB1       PRO  39 -19.978   8.459   6.114
  334   1HG   PRO  39          HG2       PRO  39 -19.048  10.899   4.656
  335   2HG   PRO  39          HG1       PRO  39 -19.262  10.649   6.398
  336   1HD   PRO  39          HD2       PRO  39 -16.818  10.455   5.145
  337   2HD   PRO  39          HD1       PRO  39 -17.230   9.565   6.629
  338    H    PHE  40           HN       PHE  40 -17.346   9.545   2.787
  339    HA   PHE  40           HA       PHE  40 -19.178  10.095   0.685
  340   1HB   PHE  40          HB2       PHE  40 -17.088  11.357   0.982
  341   2HB   PHE  40          HB1       PHE  40 -16.151   9.919   0.571
  342    HD1  PHE  40           HD1      PHE  40 -18.625  12.366  -0.731
  343    HD2  PHE  40           HD2      PHE  40 -15.820   9.253  -1.715
  344    HE1  PHE  40           HE1      PHE  40 -18.851  12.919  -3.138
  345    HE2  PHE  40           HE2      PHE  40 -16.057   9.808  -4.118
  346    HZ   PHE  40           HZ       PHE  40 -17.569  11.639  -4.830
  347    H    TYR  41           HN       TYR  41 -16.732   7.533   0.974
  348    HA   TYR  41           HA       TYR  41 -17.273   6.419  -1.617
  349   1HB   TYR  41          HB2       TYR  41 -15.987   5.152   0.810
  350   2HB   TYR  41          HB1       TYR  41 -15.875   4.560  -0.849
  351    HD1  TYR  41           HD1      TYR  41 -15.220   6.468  -2.636
  352    HD2  TYR  41           HD2      TYR  41 -14.257   6.537   1.543
  353    HE1  TYR  41           HE1      TYR  41 -13.434   8.115  -3.079
  354    HE2  TYR  41           HE2      TYR  41 -12.450   8.178   1.104
  355    HH   TYR  41           HH       TYR  41 -12.218  10.031  -1.352
  356    H    ARG  42           HN       ARG  42 -18.716   5.895   1.543
  357    HA   ARG  42           HA       ARG  42 -19.947   3.388   1.010
  358   1HB   ARG  42          HB2       ARG  42 -20.821   5.701   2.754
  359   2HB   ARG  42          HB1       ARG  42 -21.656   4.147   2.720
  360   1HG   ARG  42          HG2       ARG  42 -19.560   3.005   3.351
  361   2HG   ARG  42          HG1       ARG  42 -18.727   4.558   3.391
  362   1HD   ARG  42          HD2       ARG  42 -19.341   4.014   5.659
  363   2HD   ARG  42          HD1       ARG  42 -20.407   5.312   5.124
  364    HE   ARG  42           HE       ARG  42 -21.840   3.039   4.514
  365   1HH1  ARG  42          HH21      ARG  42 -20.190   4.252   7.286
  366   2HH1  ARG  42          HH22      ARG  42 -21.281   3.526   8.420
  367   1HH2  ARG  42          HH11      ARG  42 -23.281   2.089   5.978
  368   2HH2  ARG  42          HH12      ARG  42 -23.030   2.301   7.679
  369    H    GLU  43           HN       GLU  43 -21.034   6.696   0.254
  370    HA   GLU  43           HA       GLU  43 -23.473   5.611  -1.032
  371   1HB   GLU  43          HB2       GLU  43 -24.194   7.898  -1.209
  372   2HB   GLU  43          HB1       GLU  43 -23.522   7.681   0.406
  373   1HG   GLU  43          HG2       GLU  43 -21.317   8.541  -0.531
  374   2HG   GLU  43          HG1       GLU  43 -22.214   9.007  -1.977
  375    H    ASN  44           HN       ASN  44 -20.367   5.992  -1.913
  376    HA   ASN  44           HA       ASN  44 -21.061   6.485  -4.796
  377   1HB   ASN  44          HB2       ASN  44 -19.711   8.325  -3.686
  378   2HB   ASN  44          HB1       ASN  44 -18.414   7.148  -3.487
  379   1HD2  ASN  44          HD21      ASN  44 -17.105   8.520  -4.992
  380   2HD2  ASN  44          HD22      ASN  44 -17.371   8.409  -6.664
  381    H    LYS  45           HN       LYS  45 -20.547   4.827  -6.116
  382    HA   LYS  45           HA       LYS  45 -18.523   2.800  -5.228
  383   1HB   LYS  45          HB2       LYS  45 -21.157   2.348  -6.645
  384   2HB   LYS  45          HB1       LYS  45 -19.984   1.096  -6.256
  385   1HG   LYS  45          HG2       LYS  45 -21.250   2.867  -4.152
  386   2HG   LYS  45          HG1       LYS  45 -21.942   1.319  -4.632
  387   1HD   LYS  45          HD2       LYS  45 -19.640   0.307  -4.094
  388   2HD   LYS  45          HD1       LYS  45 -19.278   1.839  -3.298
  389   1HE   LYS  45          HE2       LYS  45 -20.156   0.205  -1.681
  390   2HE   LYS  45          HE1       LYS  45 -21.259   1.570  -1.859
  391   1HZ   LYS  45          HZ1       LYS  45 -22.307  -0.691  -1.914
  392   2HZ   LYS  45          HZ2       LYS  45 -21.541  -0.940  -3.409
  393   3HZ   LYS  45          HZ3       LYS  45 -22.678   0.310  -3.232
  394    H    GLN  46           HN       GLN  46 -18.719   5.195  -7.231
  395    HA   GLN  46           HA       GLN  46 -18.544   4.007  -9.836
  396   1HB   GLN  46          HB2       GLN  46 -17.781   6.186 -10.607
  397   2HB   GLN  46          HB1       GLN  46 -19.134   6.375  -9.491
  398   1HG   GLN  46          HG2       GLN  46 -17.549   6.792  -7.653
  399   2HG   GLN  46          HG1       GLN  46 -16.206   6.649  -8.783
  400   1HE2  GLN  46          HE21      GLN  46 -15.520   8.592  -9.691
  401   2HE2  GLN  46          HE22      GLN  46 -16.466   9.995  -9.819
  402    H    GLY  47           HN       GLY  47 -16.280   5.246 -10.916
  403   1HA   GLY  47          HA2       GLY  47 -14.366   3.237 -10.844
  404   2HA   GLY  47          HA1       GLY  47 -14.010   4.892 -11.317
  405    H    TRP  48           HN       TRP  48 -14.974   5.385  -8.243
  406    HA   TRP  48           HA       TRP  48 -12.303   5.750  -7.299
  407   1HB   TRP  48          HB2       TRP  48 -13.228   6.466  -5.280
  408   2HB   TRP  48          HB1       TRP  48 -14.579   6.718  -6.375
  409    HD1  TRP  48           HD1      TRP  48 -16.755   5.434  -5.907
  410    HE1  TRP  48           HE1      TRP  48 -17.499   3.725  -4.127
  411    HE3  TRP  48           HE3      TRP  48 -12.245   4.362  -3.756
  412    HZ2  TRP  48           HZ2      TRP  48 -16.344   2.115  -2.059
  413    HZ3  TRP  48           HZ3      TRP  48 -12.106   2.741  -1.882
  414    HH2  TRP  48           HH2      TRP  48 -14.135   1.610  -1.046
  415    H    GLN  49           HN       GLN  49 -14.565   3.088  -7.069
  416    HA   GLN  49           HA       GLN  49 -13.168   1.459  -5.210
  417   1HB   GLN  49          HB2       GLN  49 -15.010   0.804  -7.517
  418   2HB   GLN  49          HB1       GLN  49 -14.411  -0.418  -6.392
  419   1HG   GLN  49          HG2       GLN  49 -15.390   0.839  -4.508
  420   2HG   GLN  49          HG1       GLN  49 -15.990   2.057  -5.634
  421   1HE2  GLN  49          HE21      GLN  49 -17.101  -0.514  -3.913
  422   2HE2  GLN  49          HE22      GLN  49 -18.301  -1.086  -4.969
  423    H    ASN  50           HN       ASN  50 -12.918   1.604  -8.780
  424    HA   ASN  50           HA       ASN  50 -10.885  -0.488  -8.838
  425   1HB   ASN  50          HB2       ASN  50 -11.924   1.418 -10.944
  426   2HB   ASN  50          HB1       ASN  50 -10.718   0.173 -11.267
  427   1HD2  ASN  50          HD21      ASN  50 -11.909  -1.825  -9.440
  428   2HD2  ASN  50          HD22      ASN  50 -13.347  -2.349 -10.172
  429    H    SER  51           HN       SER  51 -10.828   3.022  -8.694
  430    HA   SER  51           HA       SER  51  -8.148   3.332  -9.693
  431   1HB   SER  51          HB2       SER  51  -8.282   5.586  -8.869
  432   2HB   SER  51          HB1       SER  51  -9.880   5.159  -9.476
  433    HG   SER  51           HG       SER  51  -9.058   5.759  -6.943
  434    H    ILE  52           HN       ILE  52  -9.397   2.379  -6.583
  435    HA   ILE  52           HA       ILE  52  -7.088   3.103  -5.023
  436    HB   ILE  52           HB       ILE  52  -9.201   0.990  -4.585
  437   1HG1  ILE  52          HG12      ILE  52  -9.780   3.542  -4.752
  438   2HG1  ILE  52          HG11      ILE  52 -10.443   2.593  -3.434
  439   1HG2  ILE  52          HG21      ILE  52  -8.483   1.258  -2.155
  440   2HG2  ILE  52          HG22      ILE  52  -7.042   2.063  -2.772
  441   3HG2  ILE  52          HG23      ILE  52  -7.367   0.383  -3.204
  442   1HD1  ILE  52          HD11      ILE  52  -7.910   4.247  -3.206
  443   2HD1  ILE  52          HD12      ILE  52  -8.774   3.447  -1.895
  444   3HD1  ILE  52          HD13      ILE  52  -9.506   4.813  -2.725
  445    H    ARG  53           HN       ARG  53  -8.138  -0.180  -6.035
  446    HA   ARG  53           HA       ARG  53  -5.594  -1.330  -5.347
  447   1HB   ARG  53          HB2       ARG  53  -6.453  -3.358  -6.472
  448   2HB   ARG  53          HB1       ARG  53  -7.627  -2.663  -5.350
  449   1HG   ARG  53          HG2       ARG  53  -8.669  -1.481  -7.323
  450   2HG   ARG  53          HG1       ARG  53  -7.601  -2.413  -8.366
  451   1HD   ARG  53          HD2       ARG  53  -9.159  -4.009  -6.377
  452   2HD   ARG  53          HD1       ARG  53 -10.088  -3.264  -7.679
  453    HE   ARG  53           HE       ARG  53  -7.978  -4.442  -9.011
  454   1HH1  ARG  53          HH21      ARG  53 -10.308  -5.439  -6.672
  455   2HH1  ARG  53          HH22      ARG  53 -10.383  -7.072  -7.245
  456   1HH2  ARG  53          HH11      ARG  53  -8.067  -6.572  -9.777
  457   2HH2  ARG  53          HH12      ARG  53  -9.114  -7.713  -9.000
  458    H    HIS  54           HN       HIS  54  -6.861   0.007  -8.348
  459    HA   HIS  54           HA       HIS  54  -4.955  -1.136 -10.126
  460   1HB   HIS  54          HB2       HIS  54  -6.959   0.150 -10.865
  461   2HB   HIS  54          HB1       HIS  54  -6.190   1.631 -10.291
  462    HD1  HIS  54           HD1      HIS  54  -5.280  -1.274 -12.598
  463    HD2  HIS  54           HD2      HIS  54  -4.697   2.842 -12.277
  464    HE1  HIS  54           HE1      HIS  54  -3.993  -0.572 -14.661
  465    H    ASN  55           HN       ASN  55  -4.775   1.685  -8.007
  466    HA   ASN  55           HA       ASN  55  -2.273   2.680  -9.021
  467   1HB   ASN  55          HB2       ASN  55  -3.716   3.085  -6.395
  468   2HB   ASN  55          HB1       ASN  55  -2.225   3.927  -6.820
  469   1HD2  ASN  55          HD21      ASN  55  -4.740   5.298  -6.410
  470   2HD2  ASN  55          HD22      ASN  55  -5.201   5.985  -7.892
  471    H    LEU  56           HN       LEU  56  -3.020   0.050  -6.891
  472    HA   LEU  56           HA       LEU  56  -0.684   0.025  -5.278
  473   1HB   LEU  56          HB2       LEU  56  -2.342  -2.257  -6.365
  474   2HB   LEU  56          HB1       LEU  56  -1.076  -2.464  -5.158
  475    HG   LEU  56           HG       LEU  56  -3.446  -0.604  -4.822
  476   1HD1  LEU  56          HD11      LEU  56  -3.037  -3.296  -3.503
  477   2HD1  LEU  56          HD12      LEU  56  -3.985  -3.096  -4.976
  478   3HD1  LEU  56          HD13      LEU  56  -4.488  -2.292  -3.489
  479   1HD2  LEU  56          HD21      LEU  56  -1.841   0.178  -3.309
  480   2HD2  LEU  56          HD22      LEU  56  -1.121  -1.416  -3.086
  481   3HD2  LEU  56          HD23      LEU  56  -2.660  -1.029  -2.325
  482    H    SER  57           HN       SER  57  -1.236  -1.457  -8.486
  483    HA   SER  57           HA       SER  57   1.418  -2.578  -8.622
  484   1HB   SER  57          HB2       SER  57   0.916  -3.074 -10.924
  485   2HB   SER  57          HB1       SER  57  -0.557  -3.338  -9.994
  486    HG   SER  57           HG       SER  57  -1.429  -1.565 -10.848
  487    H    LEU  58           HN       LEU  58  -0.002   0.465  -9.790
  488    HA   LEU  58           HA       LEU  58   2.238   1.345 -11.296
  489   1HB   LEU  58          HB2       LEU  58   0.151   2.927  -9.783
  490   2HB   LEU  58          HB1       LEU  58   1.340   3.660 -10.860
  491    HG   LEU  58           HG       LEU  58  -0.581   1.472 -11.694
  492   1HD1  LEU  58          HD11      LEU  58  -1.871   3.451 -11.148
  493   2HD1  LEU  58          HD12      LEU  58  -1.766   3.335 -12.901
  494   3HD1  LEU  58          HD13      LEU  58  -0.747   4.480 -12.030
  495   1HD2  LEU  58          HD21      LEU  58   1.538   3.077 -13.096
  496   2HD2  LEU  58          HD22      LEU  58   0.094   2.627 -14.001
  497   3HD2  LEU  58          HD23      LEU  58   1.105   1.379 -13.287
  498    H    ASN  59           HN       ASN  59   1.515   1.689  -7.828
  499    HA   ASN  59           HA       ASN  59   3.741   3.394  -7.228
  500   1HB   ASN  59          HB2       ASN  59   2.303   1.369  -5.485
  501   2HB   ASN  59          HB1       ASN  59   3.401   2.615  -4.890
  502   1HD2  ASN  59          HD21      ASN  59   0.203   2.063  -5.006
  503   2HD2  ASN  59          HD22      ASN  59  -0.385   3.632  -5.276
  504    H    GLU  60           HN       GLU  60   5.847   2.889  -7.453
  505    HA   GLU  60           HA       GLU  60   6.713   0.109  -7.765
  506   1HB   GLU  60          HB2       GLU  60   8.202   2.748  -7.769
  507   2HB   GLU  60          HB1       GLU  60   8.975   1.186  -8.049
  508   1HG   GLU  60          HG2       GLU  60   7.567   0.780  -9.991
  509   2HG   GLU  60          HG1       GLU  60   6.650   2.254  -9.678
  510    H    CYS  61           HN       CYS  61   7.058   2.666  -5.327
  511    HA   CYS  61           HA       CYS  61   8.945   1.281  -3.675
  512   1HB   CYS  61          HB2       CYS  61   6.881   3.403  -3.034
  513   2HB   CYS  61          HB1       CYS  61   8.060   2.812  -1.862
  514    HG   CYS  61           HG       CYS  61   8.755   4.468  -4.405
  515    H    PHE  62           HN       PHE  62   5.684   0.621  -4.342
  516    HA   PHE  62           HA       PHE  62   5.022  -0.545  -1.741
  517   1HB   PHE  62          HB2       PHE  62   3.707  -0.361  -4.438
  518   2HB   PHE  62          HB1       PHE  62   3.125  -1.585  -3.312
  519    HD1  PHE  62           HD1      PHE  62   1.055  -0.770  -2.555
  520    HD2  PHE  62           HD2      PHE  62   4.452   1.856  -2.598
  521    HE1  PHE  62           HE1      PHE  62  -0.256   0.948  -1.342
  522    HE2  PHE  62           HE2      PHE  62   3.142   3.572  -1.387
  523    HZ   PHE  62           HZ       PHE  62   0.788   3.120  -0.757
  524    H    VAL  63           HN       VAL  63   5.455  -2.614  -1.106
  525    HA   VAL  63           HA       VAL  63   6.846  -4.404  -3.039
  526    HB   VAL  63           HB       VAL  63   6.544  -4.539  -0.024
  527   1HG1  VAL  63          HG11      VAL  63   6.719  -6.791  -0.779
  528   2HG1  VAL  63          HG12      VAL  63   8.363  -6.330  -0.333
  529   3HG1  VAL  63          HG13      VAL  63   7.886  -6.361  -2.031
  530   1HG2  VAL  63          HG21      VAL  63   8.053  -2.770  -0.688
  531   2HG2  VAL  63          HG22      VAL  63   8.836  -3.816  -1.874
  532   3HG2  VAL  63          HG23      VAL  63   9.037  -4.130  -0.150
  533    H    LYS  64           HN       LYS  64   5.796  -6.114  -3.895
  534    HA   LYS  64           HA       LYS  64   3.098  -6.816  -2.818
  535   1HB   LYS  64          HB2       LYS  64   3.341  -6.111  -5.210
  536   2HB   LYS  64          HB1       LYS  64   4.360  -7.523  -5.479
  537   1HG   LYS  64          HG2       LYS  64   2.527  -9.007  -4.825
  538   2HG   LYS  64          HG1       LYS  64   1.503  -7.614  -4.469
  539   1HD   LYS  64          HD2       LYS  64   1.615  -6.899  -6.811
  540   2HD   LYS  64          HD1       LYS  64   2.694  -8.243  -7.188
  541   1HE   LYS  64          HE2       LYS  64  -0.118  -8.554  -6.098
  542   2HE   LYS  64          HE1       LYS  64   0.318  -8.710  -7.801
  543   1HZ   LYS  64          HZ1       LYS  64   2.023 -10.273  -6.146
  544   2HZ   LYS  64          HZ2       LYS  64   1.059 -10.758  -7.459
  545   3HZ   LYS  64          HZ3       LYS  64   0.398 -10.688  -5.895
  546    H    VAL  65           HN       VAL  65   3.034  -8.575  -1.552
  547    HA   VAL  65           HA       VAL  65   4.991 -10.796  -2.012
  548    HB   VAL  65           HB       VAL  65   4.039 -11.335   0.466
  549   1HG1  VAL  65          HG11      VAL  65   5.994  -9.949   1.339
  550   2HG1  VAL  65          HG12      VAL  65   6.242  -9.422  -0.325
  551   3HG1  VAL  65          HG13      VAL  65   6.380 -11.131   0.089
  552   1HG2  VAL  65          HG21      VAL  65   3.420  -9.438   1.699
  553   2HG2  VAL  65          HG22      VAL  65   2.612  -9.149   0.159
  554   3HG2  VAL  65          HG23      VAL  65   4.122  -8.321   0.528
  555    HA   PRO  66           HA       PRO  66   1.057 -12.716  -3.218
  556   1HB   PRO  66          HB2       PRO  66   2.021 -15.074  -4.187
  557   2HB   PRO  66          HB1       PRO  66   2.143 -13.549  -5.085
  558   1HG   PRO  66          HG2       PRO  66   4.217 -14.962  -3.477
  559   2HG   PRO  66          HG1       PRO  66   4.377 -14.106  -5.020
  560   1HD   PRO  66          HD2       PRO  66   5.085 -13.016  -2.583
  561   2HD   PRO  66          HD1       PRO  66   4.620 -12.044  -3.996
  562    H    ARG  67           HN       ARG  67  -0.293 -14.425  -2.424
  563    HA   ARG  67           HA       ARG  67   0.305 -15.235   0.296
  564   1HB   ARG  67          HB2       ARG  67  -2.002 -14.713  -0.533
  565   2HB   ARG  67          HB1       ARG  67  -1.939 -16.180  -1.510
  566   1HG   ARG  67          HG2       ARG  67  -1.714 -17.564   0.456
  567   2HG   ARG  67          HG1       ARG  67  -1.534 -16.147   1.491
  568   1HD   ARG  67          HD2       ARG  67  -3.819 -15.433   0.944
  569   2HD   ARG  67          HD1       ARG  67  -4.006 -16.819  -0.131
  570    HE   ARG  67           HE       ARG  67  -3.328 -17.969   2.289
  571   1HH1  ARG  67          HH21      ARG  67  -5.657 -15.672   1.201
  572   2HH1  ARG  67          HH22      ARG  67  -6.855 -16.137   2.362
  573   1HH2  ARG  67          HH11      ARG  67  -4.878 -18.590   3.813
  574   2HH2  ARG  67          HH12      ARG  67  -6.414 -17.790   3.842
  575    H    ASP  68           HN       ASP  68   0.407 -17.494   1.027
  576    HA   ASP  68           HA       ASP  68   2.243 -19.070  -0.469
  577   1HB   ASP  68          HB2       ASP  68   0.371 -19.792   1.797
  578   2HB   ASP  68          HB1       ASP  68   1.553 -20.920   1.132
  579    H    ASP  69           HN       ASP  69   1.949 -20.757  -1.903
  580    HA   ASP  69           HA       ASP  69  -0.558 -20.896  -3.331
  581   1HB   ASP  69          HB2       ASP  69   1.940 -22.608  -3.403
  582   2HB   ASP  69          HB1       ASP  69   0.570 -22.845  -4.491
  583    H    LYS  70           HN       LYS  70   0.719 -22.507  -0.560
  584    HA   LYS  70           HA       LYS  70  -0.656 -24.996  -0.679
  585   1HB   LYS  70          HB2       LYS  70   0.072 -23.258   1.700
  586   2HB   LYS  70          HB1       LYS  70  -0.486 -24.922   1.830
  587   1HG   LYS  70          HG2       LYS  70   1.895 -24.221   0.116
  588   2HG   LYS  70          HG1       LYS  70   2.074 -24.476   1.849
  589   1HD   LYS  70          HD2       LYS  70   0.986 -26.721   1.574
  590   2HD   LYS  70          HD1       LYS  70   1.005 -26.471  -0.171
  591   1HE   LYS  70          HE2       LYS  70   3.410 -26.344  -0.206
  592   2HE   LYS  70          HE1       LYS  70   3.485 -26.338   1.557
  593   1HZ   LYS  70          HZ1       LYS  70   2.971 -28.551  -0.277
  594   2HZ   LYS  70          HZ2       LYS  70   2.147 -28.566   1.210
  595   3HZ   LYS  70          HZ3       LYS  70   3.845 -28.528   1.176
  596    H    LYS  71           HN       LYS  71  -1.697 -21.811   0.520
  597    HA   LYS  71           HA       LYS  71  -4.517 -22.794   0.502
  598   1HB   LYS  71          HB2       LYS  71  -3.757 -22.682   2.817
  599   2HB   LYS  71          HB1       LYS  71  -3.157 -21.040   2.567
  600   1HG   LYS  71          HG2       LYS  71  -5.303 -20.133   2.415
  601   2HG   LYS  71          HG1       LYS  71  -6.039 -21.672   1.975
  602   1HD   LYS  71          HD2       LYS  71  -5.597 -22.515   4.270
  603   2HD   LYS  71          HD1       LYS  71  -4.936 -20.938   4.703
  604   1HE   LYS  71          HE2       LYS  71  -7.126 -19.901   4.082
  605   2HE   LYS  71          HE1       LYS  71  -7.772 -21.517   3.799
  606   1HZ   LYS  71          HZ1       LYS  71  -6.543 -21.548   6.289
  607   2HZ   LYS  71          HZ2       LYS  71  -8.203 -21.653   5.947
  608   3HZ   LYS  71          HZ3       LYS  71  -7.487 -20.140   6.237
  609    HA   PRO  72           HA       PRO  72  -4.078 -18.873  -1.910
  610   1HB   PRO  72          HB2       PRO  72  -5.295 -19.667  -4.192
  611   2HB   PRO  72          HB1       PRO  72  -3.609 -20.091  -3.838
  612   1HG   PRO  72          HG2       PRO  72  -6.067 -21.759  -3.597
  613   2HG   PRO  72          HG1       PRO  72  -4.447 -22.215  -4.150
  614   1HD   PRO  72          HD2       PRO  72  -5.440 -22.701  -1.589
  615   2HD   PRO  72          HD1       PRO  72  -3.713 -22.655  -2.005
  616    H    GLY  73           HN       GLY  73  -5.959 -17.617  -3.079
  617   1HA   GLY  73          HA2       GLY  73  -8.623 -17.920  -3.022
  618   2HA   GLY  73          HA1       GLY  73  -8.317 -17.764  -1.290
  619    H    LYS  74           HN       LYS  74  -6.902 -15.792  -0.712
  620    HA   LYS  74           HA       LYS  74  -8.167 -13.435  -1.876
  621   1HB   LYS  74          HB2       LYS  74  -5.933 -13.680   0.164
  622   2HB   LYS  74          HB1       LYS  74  -6.787 -12.189  -0.237
  623   1HG   LYS  74          HG2       LYS  74  -8.916 -13.212   0.481
  624   2HG   LYS  74          HG1       LYS  74  -8.062 -14.701   0.886
  625   1HD   LYS  74          HD2       LYS  74  -6.697 -13.475   2.536
  626   2HD   LYS  74          HD1       LYS  74  -7.552 -11.985   2.135
  627   1HE   LYS  74          HE2       LYS  74  -8.886 -14.494   3.193
  628   2HE   LYS  74          HE1       LYS  74  -8.459 -13.098   4.182
  629   1HZ   LYS  74          HZ1       LYS  74 -10.543 -13.371   2.146
  630   2HZ   LYS  74          HZ2       LYS  74  -9.793 -11.855   2.312
  631   3HZ   LYS  74          HZ3       LYS  74 -10.586 -12.564   3.637
  632    H    GLY  75           HN       GLY  75  -7.074 -11.762  -3.037
  633   1HA   GLY  75          HA2       GLY  75  -5.364 -12.475  -5.097
  634   2HA   GLY  75          HA1       GLY  75  -5.424 -10.840  -4.442
  635    H    SER  76           HN       SER  76  -3.812 -10.176  -2.984
  636    HA   SER  76           HA       SER  76  -1.763 -12.114  -2.102
  637   1HB   SER  76          HB2       SER  76  -0.792 -11.617  -4.203
  638   2HB   SER  76          HB1       SER  76  -1.277  -9.926  -4.124
  639    HG   SER  76           HG       SER  76   0.258  -9.571  -2.574
  640    H    TYR  77           HN       TYR  77  -0.246 -11.093  -0.553
  641    HA   TYR  77           HA       TYR  77  -1.619  -9.130   1.114
  642   1HB   TYR  77          HB2       TYR  77   1.095 -10.455   1.319
  643   2HB   TYR  77          HB1       TYR  77   0.495  -9.302   2.503
  644    HD1  TYR  77           HD1      TYR  77   0.782 -12.709   1.821
  645    HD2  TYR  77           HD2      TYR  77  -2.070  -9.840   3.268
  646    HE1  TYR  77           HE1      TYR  77  -0.481 -14.526   2.939
  647    HE2  TYR  77           HE2      TYR  77  -3.329 -11.657   4.385
  648    HH   TYR  77           HH       TYR  77  -3.167 -13.839   5.096
  649    H    TRP  78           HN       TRP  78  -0.649  -7.064   1.741
  650    HA   TRP  78           HA       TRP  78   1.230  -5.921  -0.298
  651   1HB   TRP  78          HB2       TRP  78  -1.340  -4.745   0.789
  652   2HB   TRP  78          HB1       TRP  78  -0.134  -3.800  -0.089
  653    HD1  TRP  78           HD1      TRP  78  -2.827  -6.429  -0.571
  654    HE1  TRP  78           HE1      TRP  78  -3.134  -6.862  -3.098
  655    HE3  TRP  78           HE3      TRP  78   1.153  -3.808  -2.414
  656    HZ2  TRP  78           HZ2      TRP  78  -1.855  -6.185  -5.575
  657    HZ3  TRP  78           HZ3      TRP  78   1.586  -3.718  -4.848
  658    HH2  TRP  78           HH2      TRP  78   0.094  -4.899  -6.429
  659    H    THR  79           HN       THR  79   2.930  -4.867   0.605
  660    HA   THR  79           HA       THR  79   2.668  -3.655   3.291
  661    HB   THR  79           HB       THR  79   3.369  -6.068   3.609
  662    HG1  THR  79           HG1      THR  79   5.570  -4.585   4.369
  663   1HG2  THR  79          HG21      THR  79   5.459  -6.841   2.842
  664   2HG2  THR  79          HG22      THR  79   6.026  -5.212   2.475
  665   3HG2  THR  79          HG23      THR  79   4.806  -5.974   1.453
  666    H    LEU  80           HN       LEU  80   4.534  -2.261   3.784
  667    HA   LEU  80           HA       LEU  80   5.534  -0.949   1.365
  668   1HB   LEU  80          HB2       LEU  80   6.107  -0.397   4.293
  669   2HB   LEU  80          HB1       LEU  80   6.544   0.656   2.949
  670    HG   LEU  80           HG       LEU  80   3.712  -0.152   3.682
  671   1HD1  LEU  80          HD11      LEU  80   5.188   2.474   4.051
  672   2HD1  LEU  80          HD12      LEU  80   4.752   1.354   5.342
  673   3HD1  LEU  80          HD13      LEU  80   3.490   2.187   4.433
  674   1HD2  LEU  80          HD21      LEU  80   3.614   0.325   1.389
  675   2HD2  LEU  80          HD22      LEU  80   4.922   1.506   1.473
  676   3HD2  LEU  80          HD23      LEU  80   3.320   1.915   2.084
  677    H    ASP  81           HN       ASP  81   8.068  -0.117   2.278
  678    HA   ASP  81           HA       ASP  81   9.780  -2.074   1.274
  679   1HB   ASP  81          HB2       ASP  81  11.577  -0.740   2.135
  680   2HB   ASP  81          HB1       ASP  81  10.265   0.384   1.811
  681    HA   PRO  82           HA       PRO  82  10.286  -5.131   4.421
  682   1HB   PRO  82          HB2       PRO  82  13.221  -4.763   4.710
  683   2HB   PRO  82          HB1       PRO  82  12.319  -6.168   4.112
  684   1HG   PRO  82          HG2       PRO  82  13.734  -4.632   2.459
  685   2HG   PRO  82          HG1       PRO  82  12.176  -5.324   1.962
  686   1HD   PRO  82          HD2       PRO  82  12.770  -2.530   2.929
  687   2HD   PRO  82          HD1       PRO  82  11.789  -3.048   1.532
  688    H    ASP  83           HN       ASP  83  12.477  -5.189   6.449
  689    HA   ASP  83           HA       ASP  83  11.185  -3.391   8.415
  690   1HB   ASP  83          HB2       ASP  83  13.214  -5.626   8.674
  691   2HB   ASP  83          HB1       ASP  83  12.667  -4.647  10.036
  692    H    SER  84           HN       SER  84  13.252  -2.636   6.194
  693    HA   SER  84           HA       SER  84  15.714  -1.880   7.246
  694   1HB   SER  84          HB2       SER  84  15.709  -0.024   5.644
  695   2HB   SER  84          HB1       SER  84  15.012  -1.461   4.902
  696    HG   SER  84           HG       SER  84  13.917   0.896   5.107
  697    H    TYR  85           HN       TYR  85  15.747  -1.195   9.389
  698    HA   TYR  85           HA       TYR  85  13.852   0.800  10.362
  699   1HB   TYR  85          HB2       TYR  85  15.598  -1.132  11.504
  700   2HB   TYR  85          HB1       TYR  85  16.160   0.419  12.108
  701    HD1  TYR  85           HD1      TYR  85  13.962  -2.217  12.770
  702    HD2  TYR  85           HD2      TYR  85  14.128   2.077  12.790
  703    HE1  TYR  85           HE1      TYR  85  12.088  -2.152  14.390
  704    HE2  TYR  85           HE2      TYR  85  12.254   2.140  14.412
  705    HH   TYR  85           HH       TYR  85  10.849   0.951  15.646
  706    H    ASN  86           HN       ASN  86  17.422   0.859  10.463
  707    HA   ASN  86           HA       ASN  86  17.334   3.730   9.594
  708   1HB   ASN  86          HB2       ASN  86  19.120   4.206  11.171
  709   2HB   ASN  86          HB1       ASN  86  17.772   3.477  12.042
  710   1HD2  ASN  86          HD21      ASN  86  20.183   3.247  13.318
  711   2HD2  ASN  86          HD22      ASN  86  20.807   1.675  13.173
  712    H    MET  87           HN       MET  87  18.014   0.887   8.519
  713    HA   MET  87           HA       MET  87  20.807   1.272   7.629
  714   1HB   MET  87          HB2       MET  87  18.745  -0.900   7.155
  715   2HB   MET  87          HB1       MET  87  20.360  -0.923   6.445
  716   1HG   MET  87          HG2       MET  87  21.403  -0.971   8.613
  717   2HG   MET  87          HG1       MET  87  19.866  -0.660   9.419
  718   1HE   MET  87          HE1       MET  87  18.487  -2.393  10.420
  719   2HE   MET  87          HE2       MET  87  17.958  -3.807   9.511
  720   3HE   MET  87          HE3       MET  87  17.741  -2.198   8.829
  721    H    PHE  88           HN       PHE  88  20.996   2.794   6.050
  722    HA   PHE  88           HA       PHE  88  18.903   3.457   4.185
  723   1HB   PHE  88          HB2       PHE  88  21.867   4.081   4.228
  724   2HB   PHE  88          HB1       PHE  88  20.751   4.742   3.032
  725    HD1  PHE  88           HD1      PHE  88  22.067   5.076   6.364
  726    HD2  PHE  88           HD2      PHE  88  18.700   6.036   3.876
  727    HE1  PHE  88           HE1      PHE  88  21.389   6.843   7.966
  728    HE2  PHE  88           HE2      PHE  88  18.022   7.803   5.478
  729    HZ   PHE  88           HZ       PHE  88  19.365   8.207   7.522
  730    H    GLU  89           HN       GLU  89  21.824   1.447   3.946
  731    HA   GLU  89           HA       GLU  89  21.650   0.989   1.128
  732   1HB   GLU  89          HB2       GLU  89  22.888  -0.702   3.318
  733   2HB   GLU  89          HB1       GLU  89  23.153  -0.944   1.589
  734   1HG   GLU  89          HG2       GLU  89  24.050   1.351   1.407
  735   2HG   GLU  89          HG1       GLU  89  23.791   1.588   3.134
  736    H    ASN  90           HN       ASN  90  20.785  -0.769  -0.033
  737    HA   ASN  90           HA       ASN  90  18.486  -2.106   1.301
  738   1HB   ASN  90          HB2       ASN  90  19.254  -1.734  -1.606
  739   2HB   ASN  90          HB1       ASN  90  17.873  -2.698  -1.083
  740   1HD2  ASN  90          HD21      ASN  90  17.728  -0.225  -2.679
  741   2HD2  ASN  90          HD22      ASN  90  16.846   0.896  -1.758
  742    H    GLY  91           HN       GLY  91  21.575  -2.862   1.130
  743   1HA   GLY  91          HA2       GLY  91  21.022  -5.766   0.952
  744   2HA   GLY  91          HA1       GLY  91  22.205  -5.127  -0.189
  745    H    SER  92           HN       SER  92  21.496  -5.295   3.304
  746    HA   SER  92           HA       SER  92  24.404  -5.662   3.797
  747   1HB   SER  92          HB2       SER  92  22.739  -3.629   5.311
  748   2HB   SER  92          HB1       SER  92  24.452  -3.971   5.540
  749    HG   SER  92           HG       SER  92  23.180  -2.458   3.638
  750    H    PHE  93           HN       PHE  93  21.102  -5.641   5.110
  751    HA   PHE  93           HA       PHE  93  21.836  -7.180   7.460
  752   1HB   PHE  93          HB2       PHE  93  19.857  -5.684   7.417
  753   2HB   PHE  93          HB1       PHE  93  19.096  -6.753   6.238
  754    HD1  PHE  93           HD1      PHE  93  18.325  -8.986   6.865
  755    HD2  PHE  93           HD2      PHE  93  20.176  -6.388   9.741
  756    HE1  PHE  93           HE1      PHE  93  17.528 -10.450   8.701
  757    HE2  PHE  93           HE2      PHE  93  19.378  -7.852  11.578
  758    HZ   PHE  93           HZ       PHE  93  18.054  -9.883  11.057
  759    H    LEU  94           HN       LEU  94  21.104  -8.023   4.173
  760    HA   LEU  94           HA       LEU  94  19.957 -10.592   4.532
  761   1HB   LEU  94          HB2       LEU  94  21.795  -9.473   2.406
  762   2HB   LEU  94          HB1       LEU  94  21.209 -11.133   2.335
  763    HG   LEU  94           HG       LEU  94  18.858 -10.223   2.522
  764   1HD1  LEU  94          HD11      LEU  94  19.178  -8.053   3.448
  765   2HD1  LEU  94          HD12      LEU  94  18.695  -7.770   1.776
  766   3HD1  LEU  94          HD13      LEU  94  20.390  -7.631   2.238
  767   1HD2  LEU  94          HD21      LEU  94  20.605  -9.402   0.187
  768   2HD2  LEU  94          HD22      LEU  94  18.842  -9.392   0.142
  769   3HD2  LEU  94          HD23      LEU  94  19.712 -10.912   0.364
  Start of MODEL   17
    1   1H    MET   1          HT1       MET   1 -24.400  15.623   3.996
    2   2H    MET   1          HT2       MET   1 -24.150  15.918   2.342
    3   3H    MET   1          HT3       MET   1 -25.201  16.910   3.235
    4    HA   MET   1           HA       MET   1 -23.162  18.089   2.902
    5   1HB   MET   1          HB2       MET   1 -23.545  16.976   5.692
    6   2HB   MET   1          HB1       MET   1 -22.450  18.310   5.324
    7   1HG   MET   1          HG2       MET   1 -24.337  19.603   4.392
    8   2HG   MET   1          HG1       MET   1 -25.431  18.270   4.766
    9   1HE   MET   1          HE1       MET   1 -26.577  20.365   5.578
   10   2HE   MET   1          HE2       MET   1 -25.416  21.598   6.065
   11   3HE   MET   1          HE3       MET   1 -26.516  20.912   7.258
   12    H    LEU   2           HN       LEU   2 -22.686  15.115   2.339
   13    HA   LEU   2           HA       LEU   2 -20.159  14.489   3.637
   14   1HB   LEU   2          HB2       LEU   2 -21.299  13.320   1.081
   15   2HB   LEU   2          HB1       LEU   2 -20.073  12.594   2.120
   16    HG   LEU   2           HG       LEU   2 -22.962  13.140   2.857
   17   1HD1  LEU   2          HD11      LEU   2 -21.434  10.538   2.567
   18   2HD1  LEU   2          HD12      LEU   2 -22.549  11.188   1.364
   19   3HD1  LEU   2          HD13      LEU   2 -23.147  10.709   2.953
   20   1HD2  LEU   2          HD21      LEU   2 -22.178  11.719   4.924
   21   2HD2  LEU   2          HD22      LEU   2 -21.830  13.445   4.888
   22   3HD2  LEU   2          HD23      LEU   2 -20.567  12.284   4.478
   23    H    VAL   3           HN       VAL   3 -18.076  14.578   2.689
   24    HA   VAL   3           HA       VAL   3 -17.804  16.077   0.126
   25    HB   VAL   3           HB       VAL   3 -15.980  16.776   2.415
   26   1HG1  VAL   3          HG11      VAL   3 -15.505  17.630   0.156
   27   2HG1  VAL   3          HG12      VAL   3 -15.943  18.949   1.240
   28   3HG1  VAL   3          HG13      VAL   3 -17.119  18.336   0.077
   29   1HG2  VAL   3          HG21      VAL   3 -18.178  17.034   3.419
   30   2HG2  VAL   3          HG22      VAL   3 -18.775  17.871   1.987
   31   3HG2  VAL   3          HG23      VAL   3 -17.558  18.633   3.011
   32    H    LYS   4           HN       LYS   4 -15.401  16.003  -0.546
   33    HA   LYS   4           HA       LYS   4 -14.504  13.206  -0.322
   34   1HB   LYS   4          HB2       LYS   4 -14.579  14.360  -2.509
   35   2HB   LYS   4          HB1       LYS   4 -13.400  15.530  -1.921
   36   1HG   LYS   4          HG2       LYS   4 -11.725  13.801  -1.658
   37   2HG   LYS   4          HG1       LYS   4 -12.902  12.543  -2.037
   38   1HD   LYS   4          HD2       LYS   4 -13.223  13.617  -4.288
   39   2HD   LYS   4          HD1       LYS   4 -11.895  14.709  -3.901
   40   1HE   LYS   4          HE2       LYS   4 -11.078  12.799  -5.218
   41   2HE   LYS   4          HE1       LYS   4 -10.395  12.764  -3.593
   42   1HZ   LYS   4          HZ1       LYS   4 -12.745  11.207  -4.529
   43   2HZ   LYS   4          HZ2       LYS   4 -12.119  11.190  -2.949
   44   3HZ   LYS   4          HZ3       LYS   4 -11.193  10.587  -4.239
   45    HA   PRO   5           HA       PRO   5 -11.849  14.524   3.176
   46   1HB   PRO   5          HB2       PRO   5 -10.517  11.946   2.406
   47   2HB   PRO   5          HB1       PRO   5 -10.938  12.560   4.020
   48   1HG   PRO   5          HG2       PRO   5 -12.425  10.703   2.865
   49   2HG   PRO   5          HG1       PRO   5 -13.177  12.022   3.781
   50   1HD   PRO   5          HD2       PRO   5 -13.039  11.635   0.814
   51   2HD   PRO   5          HD1       PRO   5 -14.319  12.374   1.801
   52    HA   PRO   6           HA       PRO   6  -8.784  16.589   0.492
   53   1HB   PRO   6          HB2       PRO   6  -7.385  16.783   3.146
   54   2HB   PRO   6          HB1       PRO   6  -7.618  18.029   1.904
   55   1HG   PRO   6          HG2       PRO   6  -9.110  17.984   4.106
   56   2HG   PRO   6          HG1       PRO   6  -9.798  18.439   2.538
   57   1HD   PRO   6          HD2       PRO   6 -10.192  15.929   4.101
   58   2HD   PRO   6          HD1       PRO   6 -11.273  16.717   2.930
   59    H    TYR   7           HN       TYR   7  -8.326  13.683   2.251
   60    HA   TYR   7           HA       TYR   7  -5.487  13.362   1.797
   61   1HB   TYR   7          HB2       TYR   7  -7.545  11.170   2.161
   62   2HB   TYR   7          HB1       TYR   7  -5.814  11.071   2.481
   63    HD1  TYR   7           HD1      TYR   7  -8.906  11.456   4.029
   64    HD2  TYR   7           HD2      TYR   7  -4.943  13.107   4.075
   65    HE1  TYR   7           HE1      TYR   7  -9.291  12.307   6.321
   66    HE2  TYR   7           HE2      TYR   7  -5.322  13.950   6.376
   67    HH   TYR   7           HH       TYR   7  -8.210  13.100   8.191
   68    H    SER   8           HN       SER   8  -4.433  12.261   0.118
   69    HA   SER   8           HA       SER   8  -5.887  12.149  -2.430
   70   1HB   SER   8          HB2       SER   8  -3.012  11.592  -1.656
   71   2HB   SER   8          HB1       SER   8  -3.620  11.391  -3.297
   72    HG   SER   8           HG       SER   8  -4.468  13.690  -2.758
   73    H    TYR   9           HN       TYR   9  -5.514  10.108  -3.826
   74    HA   TYR   9           HA       TYR   9  -6.722   7.866  -2.551
   75   1HB   TYR   9          HB2       TYR   9  -5.110   8.044  -5.114
   76   2HB   TYR   9          HB1       TYR   9  -6.002   6.609  -4.613
   77    HD1  TYR   9           HD1      TYR   9  -8.449   6.590  -4.566
   78    HD2  TYR   9           HD2      TYR   9  -6.273  10.076  -5.815
   79    HE1  TYR   9           HE1      TYR   9 -10.528   7.544  -5.520
   80    HE2  TYR   9           HE2      TYR   9  -8.353  11.032  -6.769
   81    HH   TYR   9           HH       TYR   9 -11.176  10.377  -6.044
   82    H    ILE  10           HN       ILE  10  -3.319   8.614  -3.257
   83    HA   ILE  10           HA       ILE  10  -2.297   6.075  -2.324
   84    HB   ILE  10           HB       ILE  10  -0.894   8.766  -2.431
   85   1HG1  ILE  10          HG12      ILE  10  -1.809   8.273  -4.624
   86   2HG1  ILE  10          HG11      ILE  10  -0.076   7.965  -4.660
   87   1HG2  ILE  10          HG21      ILE  10   0.279   7.004  -1.129
   88   2HG2  ILE  10          HG22      ILE  10   1.151   7.430  -2.599
   89   3HG2  ILE  10          HG23      ILE  10   0.207   5.943  -2.536
   90   1HD1  ILE  10          HD11      ILE  10  -0.744   5.506  -4.077
   91   2HD1  ILE  10          HD12      ILE  10  -0.959   6.079  -5.728
   92   3HD1  ILE  10          HD13      ILE  10  -2.343   5.986  -4.644
   93    H    ALA  11           HN       ALA  11  -2.817   9.239  -0.786
   94    HA   ALA  11           HA       ALA  11  -1.567   8.631   1.702
   95   1HB   ALA  11          HB1       ALA  11  -3.862  10.497   1.038
   96   2HB   ALA  11          HB2       ALA  11  -2.155  10.917   1.189
   97   3HB   ALA  11          HB3       ALA  11  -3.075  10.436   2.615
   98    H    LEU  12           HN       LEU  12  -5.006   8.278   0.724
   99    HA   LEU  12           HA       LEU  12  -5.895   7.253   3.232
  100   1HB   LEU  12          HB2       LEU  12  -6.892   6.706   0.420
  101   2HB   LEU  12          HB1       LEU  12  -7.739   6.189   1.875
  102    HG   LEU  12           HG       LEU  12  -7.000   9.071   1.295
  103   1HD1  LEU  12          HD11      LEU  12  -9.561   7.542   0.769
  104   2HD1  LEU  12          HD12      LEU  12  -8.552   8.378  -0.411
  105   3HD1  LEU  12          HD13      LEU  12  -9.463   9.303   0.780
  106   1HD2  LEU  12          HD21      LEU  12  -8.598   7.664   3.435
  107   2HD2  LEU  12          HD22      LEU  12  -8.997   9.322   2.995
  108   3HD2  LEU  12          HD23      LEU  12  -7.394   8.940   3.608
  109    H    ILE  13           HN       ILE  13  -4.527   5.631   0.382
  110    HA   ILE  13           HA       ILE  13  -4.775   2.961   1.427
  111    HB   ILE  13           HB       ILE  13  -2.810   4.154  -0.554
  112   1HG1  ILE  13          HG12      ILE  13  -5.259   2.433  -1.039
  113   2HG1  ILE  13          HG11      ILE  13  -5.295   4.193  -1.101
  114   1HG2  ILE  13          HG21      ILE  13  -3.333   1.314   0.334
  115   2HG2  ILE  13          HG22      ILE  13  -1.788   2.151   0.183
  116   3HG2  ILE  13          HG23      ILE  13  -2.672   1.667  -1.262
  117   1HD1  ILE  13          HD11      ILE  13  -3.809   2.283  -2.904
  118   2HD1  ILE  13          HD12      ILE  13  -3.340   3.978  -2.790
  119   3HD1  ILE  13          HD13      ILE  13  -4.952   3.548  -3.352
  120    H    THR  14           HN       THR  14  -2.227   5.428   1.563
  121    HA   THR  14           HA       THR  14  -0.288   3.876   2.968
  122    HB   THR  14           HB       THR  14  -0.785   6.863   3.066
  123    HG1  THR  14           HG1      THR  14  -0.394   6.059   0.980
  124   1HG2  THR  14          HG21      THR  14   0.646   6.197   4.897
  125   2HG2  THR  14          HG22      THR  14   1.659   6.924   3.650
  126   3HG2  THR  14          HG23      THR  14   1.606   5.171   3.831
  127    H    MET  15           HN       MET  15  -2.974   5.907   4.104
  128    HA   MET  15           HA       MET  15  -2.338   5.659   6.904
  129   1HB   MET  15          HB2       MET  15  -4.919   6.315   5.460
  130   2HB   MET  15          HB1       MET  15  -4.756   6.345   7.215
  131   1HG   MET  15          HG2       MET  15  -2.940   8.003   7.024
  132   2HG   MET  15          HG1       MET  15  -3.097   7.977   5.269
  133   1HE   MET  15          HE1       MET  15  -2.977  10.393   6.674
  134   2HE   MET  15          HE2       MET  15  -4.417  11.405   6.604
  135   3HE   MET  15          HE3       MET  15  -3.724  10.766   5.115
  136    H    ALA  16           HN       ALA  16  -4.416   3.819   4.696
  137    HA   ALA  16           HA       ALA  16  -5.658   2.142   6.614
  138   1HB   ALA  16          HB1       ALA  16  -6.546   1.940   4.459
  139   2HB   ALA  16          HB2       ALA  16  -5.591   0.462   4.573
  140   3HB   ALA  16          HB3       ALA  16  -4.954   1.861   3.705
  141    H    ILE  17           HN       ILE  17  -2.601   1.655   4.815
  142    HA   ILE  17           HA       ILE  17  -1.922  -0.852   6.001
  143    HB   ILE  17           HB       ILE  17  -0.035   1.355   5.112
  144   1HG1  ILE  17          HG12      ILE  17  -1.063  -0.989   3.496
  145   2HG1  ILE  17          HG11      ILE  17  -1.790   0.617   3.427
  146   1HG2  ILE  17          HG21      ILE  17   0.263  -1.617   5.596
  147   2HG2  ILE  17          HG22      ILE  17   1.199  -0.301   6.305
  148   3HG2  ILE  17          HG23      ILE  17   1.404  -0.710   4.602
  149   1HD1  ILE  17          HD11      ILE  17   1.097  -0.059   2.792
  150   2HD1  ILE  17          HD12      ILE  17   0.415   1.569   2.794
  151   3HD1  ILE  17          HD13      ILE  17  -0.149   0.378   1.622
  152    H    GLN  18           HN       GLN  18  -0.970   2.463   6.854
  153    HA   GLN  18           HA       GLN  18   0.545   1.807   9.173
  154   1HB   GLN  18          HB2       GLN  18  -1.017   4.319   8.508
  155   2HB   GLN  18          HB1       GLN  18   0.146   4.187   9.829
  156   1HG   GLN  18          HG2       GLN  18   0.814   3.600   6.937
  157   2HG   GLN  18          HG1       GLN  18   1.112   5.155   7.712
  158   1HE2  GLN  18          HE21      GLN  18   2.797   2.543   6.799
  159   2HE2  GLN  18          HE22      GLN  18   3.921   2.421   8.064
  160    H    ASN  19           HN       ASN  19  -2.916   2.519   8.777
  161    HA   ASN  19           HA       ASN  19  -3.430   2.311  11.643
  162   1HB   ASN  19          HB2       ASN  19  -5.258   2.405   9.226
  163   2HB   ASN  19          HB1       ASN  19  -5.849   2.318  10.887
  164   1HD2  ASN  19          HD21      ASN  19  -5.195   4.530   8.485
  165   2HD2  ASN  19          HD22      ASN  19  -4.865   5.892   9.441
  166    H    ALA  20           HN       ALA  20  -2.688   0.082   9.299
  167    HA   ALA  20           HA       ALA  20  -4.516  -2.041  10.113
  168   1HB   ALA  20          HB1       ALA  20  -1.900  -2.372   8.627
  169   2HB   ALA  20          HB2       ALA  20  -3.375  -1.823   7.833
  170   3HB   ALA  20          HB3       ALA  20  -3.316  -3.422   8.575
  171    HA   PRO  21           HA       PRO  21  -2.254  -2.809  13.996
  172   1HB   PRO  21          HB2       PRO  21  -3.247  -5.575  13.333
  173   2HB   PRO  21          HB1       PRO  21  -3.229  -4.737  14.899
  174   1HG   PRO  21          HG2       PRO  21  -5.463  -4.898  13.470
  175   2HG   PRO  21          HG1       PRO  21  -5.058  -3.425  14.370
  176   1HD   PRO  21          HD2       PRO  21  -5.011  -3.892  11.429
  177   2HD   PRO  21          HD1       PRO  21  -5.212  -2.369  12.324
  178    H    GLU  22           HN       GLU  22  -1.883  -4.572  11.003
  179    HA   GLU  22           HA       GLU  22   1.002  -5.019  11.635
  180   1HB   GLU  22          HB2       GLU  22   0.885  -7.226  10.536
  181   2HB   GLU  22          HB1       GLU  22  -0.185  -7.171  11.937
  182   1HG   GLU  22          HG2       GLU  22  -2.102  -6.700  10.453
  183   2HG   GLU  22          HG1       GLU  22  -1.032  -6.767   9.054
  184    H    LYS  23           HN       LYS  23   2.335  -4.995   9.701
  185    HA   LYS  23           HA       LYS  23   1.427  -3.086   7.763
  186   1HB   LYS  23          HB2       LYS  23   3.841  -4.918   7.807
  187   2HB   LYS  23          HB1       LYS  23   3.592  -3.670   6.589
  188   1HG   LYS  23          HG2       LYS  23   3.508  -3.000   9.532
  189   2HG   LYS  23          HG1       LYS  23   5.041  -3.091   8.671
  190   1HD   LYS  23          HD2       LYS  23   4.092  -1.441   6.996
  191   2HD   LYS  23          HD1       LYS  23   2.717  -1.235   8.080
  192   1HE   LYS  23          HE2       LYS  23   4.389   0.503   8.507
  193   2HE   LYS  23          HE1       LYS  23   4.259  -0.572   9.898
  194   1HZ   LYS  23          HZ1       LYS  23   6.573   0.058   8.875
  195   2HZ   LYS  23          HZ2       LYS  23   6.216  -1.227   7.821
  196   3HZ   LYS  23          HZ3       LYS  23   6.285  -1.493   9.498
  197    H    LYS  24           HN       LYS  24   1.511  -6.625   7.724
  198    HA   LYS  24           HA       LYS  24   0.973  -6.755   4.853
  199   1HB   LYS  24          HB2       LYS  24   0.776  -8.841   7.042
  200   2HB   LYS  24          HB1       LYS  24   0.531  -9.183   5.332
  201   1HG   LYS  24          HG2       LYS  24   2.814  -8.383   4.843
  202   2HG   LYS  24          HG1       LYS  24   3.062  -8.052   6.559
  203   1HD   LYS  24          HD2       LYS  24   2.649 -10.445   7.067
  204   2HD   LYS  24          HD1       LYS  24   2.457 -10.765   5.342
  205   1HE   LYS  24          HE2       LYS  24   4.959  -9.631   6.629
  206   2HE   LYS  24          HE1       LYS  24   4.747 -11.311   6.138
  207   1HZ   LYS  24          HZ1       LYS  24   4.395 -10.569   3.870
  208   2HZ   LYS  24          HZ2       LYS  24   5.901 -10.035   4.447
  209   3HZ   LYS  24          HZ3       LYS  24   4.595  -8.952   4.341
  210    H    ILE  25           HN       ILE  25  -0.990  -6.417   3.950
  211    HA   ILE  25           HA       ILE  25  -3.449  -7.112   5.486
  212    HB   ILE  25           HB       ILE  25  -2.938  -4.661   5.764
  213   1HG1  ILE  25          HG12      ILE  25  -5.405  -5.152   4.078
  214   2HG1  ILE  25          HG11      ILE  25  -5.274  -5.676   5.757
  215   1HG2  ILE  25          HG21      ILE  25  -1.950  -4.495   3.412
  216   2HG2  ILE  25          HG22      ILE  25  -3.029  -3.186   3.893
  217   3HG2  ILE  25          HG23      ILE  25  -3.611  -4.462   2.823
  218   1HD1  ILE  25          HD11      ILE  25  -6.381  -3.452   5.542
  219   2HD1  ILE  25          HD12      ILE  25  -4.906  -2.819   4.812
  220   3HD1  ILE  25          HD13      ILE  25  -4.893  -3.377   6.485
  221    H    THR  26           HN       THR  26  -5.291  -7.517   4.100
  222    HA   THR  26           HA       THR  26  -4.497  -8.558   1.475
  223    HB   THR  26           HB       THR  26  -6.820  -9.381   1.363
  224    HG1  THR  26           HG1      THR  26  -7.060  -7.607   3.510
  225   1HG2  THR  26          HG21      THR  26  -5.292  -9.775   3.935
  226   2HG2  THR  26          HG22      THR  26  -5.401 -10.856   2.545
  227   3HG2  THR  26          HG23      THR  26  -6.790 -10.648   3.611
  228    H    LEU  27           HN       LEU  27  -5.439  -7.914  -0.522
  229    HA   LEU  27           HA       LEU  27  -5.639  -5.111  -0.965
  230   1HB   LEU  27          HB2       LEU  27  -5.067  -6.822  -2.690
  231   2HB   LEU  27          HB1       LEU  27  -6.731  -7.391  -2.650
  232    HG   LEU  27           HG       LEU  27  -7.510  -5.168  -3.437
  233   1HD1  LEU  27          HD11      LEU  27  -4.575  -4.545  -3.137
  234   2HD1  LEU  27          HD12      LEU  27  -5.972  -3.575  -2.669
  235   3HD1  LEU  27          HD13      LEU  27  -5.521  -3.707  -4.365
  236   1HD2  LEU  27          HD21      LEU  27  -6.845  -7.013  -5.008
  237   2HD2  LEU  27          HD22      LEU  27  -5.255  -6.261  -5.142
  238   3HD2  LEU  27          HD23      LEU  27  -6.688  -5.402  -5.701
  239    H    ASN  28           HN       ASN  28  -8.169  -7.617  -0.803
  240    HA   ASN  28           HA       ASN  28 -10.411  -5.897  -1.132
  241   1HB   ASN  28          HB2       ASN  28 -10.118  -8.532   0.323
  242   2HB   ASN  28          HB1       ASN  28 -11.668  -7.725   0.084
  243   1HD2  ASN  28          HD21      ASN  28 -11.073 -10.299  -1.089
  244   2HD2  ASN  28          HD22      ASN  28 -11.035 -10.106  -2.775
  245    H    GLY  29           HN       GLY  29  -8.627  -6.871   1.777
  246   1HA   GLY  29          HA2       GLY  29 -10.362  -5.741   3.712
  247   2HA   GLY  29          HA1       GLY  29  -8.628  -5.966   3.937
  248    H    ILE  30           HN       ILE  30  -7.729  -4.216   1.847
  249    HA   ILE  30           HA       ILE  30  -7.712  -1.736   3.234
  250    HB   ILE  30           HB       ILE  30  -7.128  -2.357   0.325
  251   1HG1  ILE  30          HG12      ILE  30  -5.245  -1.813   2.637
  252   2HG1  ILE  30          HG11      ILE  30  -5.720  -3.437   2.140
  253   1HG2  ILE  30          HG21      ILE  30  -6.754   0.158   1.966
  254   2HG2  ILE  30          HG22      ILE  30  -7.569  -0.011   0.412
  255   3HG2  ILE  30          HG23      ILE  30  -5.816  -0.161   0.507
  256   1HD1  ILE  30          HD11      ILE  30  -4.244  -1.374   0.481
  257   2HD1  ILE  30          HD12      ILE  30  -4.893  -2.874  -0.180
  258   3HD1  ILE  30          HD13      ILE  30  -3.628  -2.927   1.047
  259    H    TYR  31           HN       TYR  31  -9.712  -2.817   0.482
  260    HA   TYR  31           HA       TYR  31 -10.984  -0.322  -0.018
  261   1HB   TYR  31          HB2       TYR  31 -11.801  -3.192  -0.436
  262   2HB   TYR  31          HB1       TYR  31 -12.917  -1.886  -0.820
  263    HD1  TYR  31           HD1      TYR  31 -10.081  -3.783  -1.950
  264    HD2  TYR  31           HD2      TYR  31 -12.078  -0.009  -2.373
  265    HE1  TYR  31           HE1      TYR  31  -8.909  -3.410  -4.100
  266    HE2  TYR  31           HE2      TYR  31 -10.903   0.367  -4.518
  267    HH   TYR  31           HH       TYR  31  -9.780  -0.827  -6.237
  268    H    GLN  32           HN       GLN  32 -11.969  -2.961   2.178
  269    HA   GLN  32           HA       GLN  32 -14.397  -1.757   3.049
  270   1HB   GLN  32          HB2       GLN  32 -12.523  -3.706   4.395
  271   2HB   GLN  32          HB1       GLN  32 -14.076  -3.236   5.086
  272   1HG   GLN  32          HG2       GLN  32 -13.770  -4.371   2.294
  273   2HG   GLN  32          HG1       GLN  32 -14.137  -5.359   3.710
  274   1HE2  GLN  32          HE21      GLN  32 -15.696  -4.026   1.167
  275   2HE2  GLN  32          HE22      GLN  32 -17.187  -3.645   1.881
  276    H    PHE  33           HN       PHE  33 -11.081  -1.390   4.235
  277    HA   PHE  33           HA       PHE  33 -11.661   0.010   6.632
  278   1HB   PHE  33          HB2       PHE  33  -9.427  -0.838   6.089
  279   2HB   PHE  33          HB1       PHE  33  -9.300   0.305   4.754
  280    HD1  PHE  33           HD1      PHE  33  -8.997   2.693   5.152
  281    HD2  PHE  33           HD2      PHE  33  -9.280  -0.086   8.416
  282    HE1  PHE  33           HE1      PHE  33  -8.119   4.420   6.699
  283    HE2  PHE  33           HE2      PHE  33  -8.403   1.642   9.963
  284    HZ   PHE  33           HZ       PHE  33  -7.822   3.896   9.104
  285    H    ILE  34           HN       ILE  34 -10.980   1.343   3.372
  286    HA   ILE  34           HA       ILE  34 -11.245   4.072   4.102
  287    HB   ILE  34           HB       ILE  34 -11.816   2.697   1.464
  288   1HG1  ILE  34          HG12      ILE  34  -9.397   4.295   2.352
  289   2HG1  ILE  34          HG11      ILE  34  -9.492   2.539   2.496
  290   1HG2  ILE  34          HG21      ILE  34 -11.638   5.612   2.248
  291   2HG2  ILE  34          HG22      ILE  34 -12.896   4.806   1.309
  292   3HG2  ILE  34          HG23      ILE  34 -11.304   5.078   0.600
  293   1HD1  ILE  34          HD11      ILE  34  -9.914   4.023  -0.111
  294   2HD1  ILE  34          HD12      ILE  34  -9.737   2.282   0.111
  295   3HD1  ILE  34          HD13      ILE  34  -8.361   3.351   0.386
  296    H    MET  35           HN       MET  35 -13.748   1.879   2.737
  297    HA   MET  35           HA       MET  35 -15.836   3.842   2.842
  298   1HB   MET  35          HB2       MET  35 -15.923   0.818   2.849
  299   2HB   MET  35          HB1       MET  35 -17.367   1.826   2.758
  300   1HG   MET  35          HG2       MET  35 -16.485   2.903   0.717
  301   2HG   MET  35          HG1       MET  35 -15.052   1.880   0.799
  302   1HE   MET  35          HE1       MET  35 -16.191  -1.112   1.581
  303   2HE   MET  35          HE2       MET  35 -14.894  -0.441   0.594
  304   3HE   MET  35          HE3       MET  35 -16.053  -1.556  -0.123
  305    H    ASP  36           HN       ASP  36 -14.782   1.382   5.184
  306    HA   ASP  36           HA       ASP  36 -16.912   1.771   7.045
  307   1HB   ASP  36          HB2       ASP  36 -14.055   0.849   7.434
  308   2HB   ASP  36          HB1       ASP  36 -15.258   0.845   8.724
  309    H    ARG  37           HN       ARG  37 -13.781   3.386   6.664
  310    HA   ARG  37           HA       ARG  37 -14.193   5.086   9.007
  311   1HB   ARG  37          HB2       ARG  37 -12.210   5.269   6.719
  312   2HB   ARG  37          HB1       ARG  37 -12.144   6.236   8.186
  313   1HG   ARG  37          HG2       ARG  37 -12.110   3.208   8.216
  314   2HG   ARG  37          HG1       ARG  37 -10.638   4.171   8.137
  315   1HD   ARG  37          HD2       ARG  37 -12.687   4.107  10.371
  316   2HD   ARG  37          HD1       ARG  37 -10.982   3.670  10.448
  317    HE   ARG  37           HE       ARG  37 -10.865   6.298   9.694
  318   1HH1  ARG  37          HH21      ARG  37 -12.518   4.536  12.152
  319   2HH1  ARG  37          HH22      ARG  37 -12.503   5.846  13.285
  320   1HH2  ARG  37          HH11      ARG  37 -10.841   8.017  11.151
  321   2HH2  ARG  37          HH12      ARG  37 -11.554   7.819  12.717
  322    H    PHE  38           HN       PHE  38 -13.656   6.030   5.596
  323    HA   PHE  38           HA       PHE  38 -15.290   8.440   6.058
  324   1HB   PHE  38          HB2       PHE  38 -13.790   7.500   3.596
  325   2HB   PHE  38          HB1       PHE  38 -14.541   9.082   3.800
  326    HD1  PHE  38           HD1      PHE  38 -13.746  10.585   5.689
  327    HD2  PHE  38           HD2      PHE  38 -11.637   7.040   4.490
  328    HE1  PHE  38           HE1      PHE  38 -11.712  11.402   6.848
  329    HE2  PHE  38           HE2      PHE  38  -9.603   7.857   5.649
  330    HZ   PHE  38           HZ       PHE  38  -9.641  10.038   6.829
  331    HA   PRO  39           HA       PRO  39 -18.678   6.023   4.184
  332   1HB   PRO  39          HB2       PRO  39 -20.746   7.622   4.862
  333   2HB   PRO  39          HB1       PRO  39 -19.914   6.623   6.071
  334   1HG   PRO  39          HG2       PRO  39 -19.622   9.538   5.504
  335   2HG   PRO  39          HG1       PRO  39 -19.671   8.696   7.063
  336   1HD   PRO  39          HD2       PRO  39 -17.331   9.517   5.814
  337   2HD   PRO  39          HD1       PRO  39 -17.413   8.201   7.006
  338    H    PHE  40           HN       PHE  40 -17.387   8.970   3.323
  339    HA   PHE  40           HA       PHE  40 -19.220  10.013   1.410
  340   1HB   PHE  40          HB2       PHE  40 -17.399  11.406   1.996
  341   2HB   PHE  40          HB1       PHE  40 -16.220  10.124   1.738
  342    HD1  PHE  40           HD1      PHE  40 -18.796  12.123  -0.121
  343    HD2  PHE  40           HD2      PHE  40 -15.022  10.068  -0.276
  344    HE1  PHE  40           HE1      PHE  40 -18.466  12.907  -2.450
  345    HE2  PHE  40           HE2      PHE  40 -14.695  10.854  -2.607
  346    HZ   PHE  40           HZ       PHE  40 -16.417  12.271  -3.693
  347    H    TYR  41           HN       TYR  41 -16.715   7.532   1.182
  348    HA   TYR  41           HA       TYR  41 -16.962   7.110  -1.655
  349   1HB   TYR  41          HB2       TYR  41 -15.874   5.369   0.571
  350   2HB   TYR  41          HB1       TYR  41 -15.717   4.993  -1.150
  351    HD1  TYR  41           HD1      TYR  41 -14.798   7.370   1.515
  352    HD2  TYR  41           HD2      TYR  41 -14.262   6.269  -2.590
  353    HE1  TYR  41           HE1      TYR  41 -12.890   8.938   1.350
  354    HE2  TYR  41           HE2      TYR  41 -12.349   7.824  -2.772
  355    HH   TYR  41           HH       TYR  41 -11.071   9.301  -1.705
  356    H    ARG  42           HN       ARG  42 -18.743   5.882   1.117
  357    HA   ARG  42           HA       ARG  42 -19.848   3.560  -0.105
  358   1HB   ARG  42          HB2       ARG  42 -21.026   5.457   1.951
  359   2HB   ARG  42          HB1       ARG  42 -21.777   3.931   1.486
  360   1HG   ARG  42          HG2       ARG  42 -19.738   2.715   2.174
  361   2HG   ARG  42          HG1       ARG  42 -18.995   4.241   2.654
  362   1HD   ARG  42          HD2       ARG  42 -19.912   3.221   4.645
  363   2HD   ARG  42          HD1       ARG  42 -20.930   4.599   4.231
  364    HE   ARG  42           HE       ARG  42 -22.110   2.422   2.941
  365   1HH1  ARG  42          HH21      ARG  42 -21.185   3.291   6.149
  366   2HH1  ARG  42          HH22      ARG  42 -22.416   2.335   6.904
  367   1HH2  ARG  42          HH11      ARG  42 -23.717   1.168   3.909
  368   2HH2  ARG  42          HH12      ARG  42 -23.850   1.133   5.636
  369    H    GLU  43           HN       GLU  43 -20.804   6.977  -0.218
  370    HA   GLU  43           HA       GLU  43 -23.200   6.631  -1.723
  371   1HB   GLU  43          HB2       GLU  43 -22.608   8.766  -0.634
  372   2HB   GLU  43          HB1       GLU  43 -21.258   8.956  -1.751
  373   1HG   GLU  43          HG2       GLU  43 -22.819   9.022  -3.653
  374   2HG   GLU  43          HG1       GLU  43 -24.179   8.782  -2.556
  375    H    ASN  44           HN       ASN  44 -19.866   7.027  -2.687
  376    HA   ASN  44           HA       ASN  44 -20.608   6.449  -5.538
  377   1HB   ASN  44          HB2       ASN  44 -18.182   7.824  -4.342
  378   2HB   ASN  44          HB1       ASN  44 -18.369   7.451  -6.056
  379   1HD2  ASN  44          HD21      ASN  44 -18.190  10.167  -4.910
  380   2HD2  ASN  44          HD22      ASN  44 -19.653  10.946  -5.281
  381    H    LYS  45           HN       LYS  45 -20.383   4.254  -5.837
  382    HA   LYS  45           HA       LYS  45 -18.164   2.826  -4.467
  383   1HB   LYS  45          HB2       LYS  45 -20.533   1.853  -6.087
  384   2HB   LYS  45          HB1       LYS  45 -19.308   0.792  -5.398
  385   1HG   LYS  45          HG2       LYS  45 -19.857   1.625  -3.138
  386   2HG   LYS  45          HG1       LYS  45 -21.086   2.685  -3.829
  387   1HD   LYS  45          HD2       LYS  45 -22.241   0.687  -4.766
  388   2HD   LYS  45          HD1       LYS  45 -21.047  -0.345  -3.980
  389   1HE   LYS  45          HE2       LYS  45 -22.695   1.656  -2.428
  390   2HE   LYS  45          HE1       LYS  45 -23.259   0.012  -2.726
  391   1HZ   LYS  45          HZ1       LYS  45 -22.050   0.320  -0.595
  392   2HZ   LYS  45          HZ2       LYS  45 -20.642   0.652  -1.485
  393   3HZ   LYS  45          HZ3       LYS  45 -21.384  -0.872  -1.600
  394    H    GLN  46           HN       GLN  46 -19.379   3.478  -7.754
  395    HA   GLN  46           HA       GLN  46 -17.078   2.065  -8.941
  396   1HB   GLN  46          HB2       GLN  46 -19.423   3.559 -10.132
  397   2HB   GLN  46          HB1       GLN  46 -18.139   2.838 -11.103
  398   1HG   GLN  46          HG2       GLN  46 -18.622   0.632 -10.111
  399   2HG   GLN  46          HG1       GLN  46 -19.910   1.349  -9.142
  400   1HE2  GLN  46          HE21      GLN  46 -21.734   0.358 -10.138
  401   2HE2  GLN  46          HE22      GLN  46 -22.128   0.565 -11.776
  402    H    GLY  47           HN       GLY  47 -15.375   3.041  -9.994
  403   1HA   GLY  47          HA2       GLY  47 -14.355   4.996 -11.092
  404   2HA   GLY  47          HA1       GLY  47 -15.229   6.035  -9.968
  405    H    TRP  48           HN       TRP  48 -14.729   5.084  -7.528
  406    HA   TRP  48           HA       TRP  48 -11.817   5.500  -7.245
  407   1HB   TRP  48          HB2       TRP  48 -12.265   6.032  -4.995
  408   2HB   TRP  48          HB1       TRP  48 -13.687   6.633  -5.841
  409    HD1  TRP  48           HD1      TRP  48 -15.979   5.292  -5.516
  410    HE1  TRP  48           HE1      TRP  48 -16.732   3.588  -3.741
  411    HE3  TRP  48           HE3      TRP  48 -11.468   4.122  -3.456
  412    HZ2  TRP  48           HZ2      TRP  48 -15.571   1.930  -1.720
  413    HZ3  TRP  48           HZ3      TRP  48 -11.312   2.473  -1.612
  414    HH2  TRP  48           HH2      TRP  48 -13.358   1.378  -0.739
  415    H    GLN  49           HN       GLN  49 -13.812   2.876  -7.682
  416    HA   GLN  49           HA       GLN  49 -12.709   1.060  -5.720
  417   1HB   GLN  49          HB2       GLN  49 -14.921   0.775  -6.877
  418   2HB   GLN  49          HB1       GLN  49 -14.040   0.377  -8.352
  419   1HG   GLN  49          HG2       GLN  49 -14.619  -1.701  -7.270
  420   2HG   GLN  49          HG1       GLN  49 -12.885  -1.467  -7.063
  421   1HE2  GLN  49          HE21      GLN  49 -12.575  -2.472  -5.024
  422   2HE2  GLN  49          HE22      GLN  49 -13.361  -1.975  -3.604
  423    H    ASN  50           HN       ASN  50 -12.308   1.079  -9.281
  424    HA   ASN  50           HA       ASN  50 -10.076  -0.737  -9.212
  425   1HB   ASN  50          HB2       ASN  50 -11.098   1.156 -11.347
  426   2HB   ASN  50          HB1       ASN  50  -9.785   0.010 -11.612
  427   1HD2  ASN  50          HD21      ASN  50 -10.402  -2.371 -10.977
  428   2HD2  ASN  50          HD22      ASN  50 -11.976  -2.869 -11.374
  429    H    SER  51           HN       SER  51 -10.296   2.804  -9.448
  430    HA   SER  51           HA       SER  51  -7.654   3.452 -10.061
  431   1HB   SER  51          HB2       SER  51  -9.566   4.822  -8.156
  432   2HB   SER  51          HB1       SER  51  -8.051   5.537  -8.702
  433    HG   SER  51           HG       SER  51  -8.863   5.195 -10.872
  434    H    ILE  52           HN       ILE  52  -8.915   2.302  -6.972
  435    HA   ILE  52           HA       ILE  52  -6.596   3.011  -5.412
  436    HB   ILE  52           HB       ILE  52  -8.719   0.900  -5.022
  437   1HG1  ILE  52          HG12      ILE  52  -9.259   3.463  -5.071
  438   2HG1  ILE  52          HG11      ILE  52  -9.928   2.459  -3.789
  439   1HG2  ILE  52          HG21      ILE  52  -6.528   1.850  -3.182
  440   2HG2  ILE  52          HG22      ILE  52  -6.901   0.199  -3.674
  441   3HG2  ILE  52          HG23      ILE  52  -7.987   1.060  -2.585
  442   1HD1  ILE  52          HD11      ILE  52  -8.474   3.320  -2.180
  443   2HD1  ILE  52          HD12      ILE  52  -8.786   4.736  -3.181
  444   3HD1  ILE  52          HD13      ILE  52  -7.285   3.834  -3.375
  445    H    ARG  53           HN       ARG  53  -7.669  -0.277  -6.338
  446    HA   ARG  53           HA       ARG  53  -5.072  -1.401  -5.809
  447   1HB   ARG  53          HB2       ARG  53  -5.991  -3.458  -6.757
  448   2HB   ARG  53          HB1       ARG  53  -7.168  -2.710  -5.677
  449   1HG   ARG  53          HG2       ARG  53  -8.134  -1.590  -7.773
  450   2HG   ARG  53          HG1       ARG  53  -7.155  -2.729  -8.696
  451   1HD   ARG  53          HD2       ARG  53  -8.263  -4.546  -7.173
  452   2HD   ARG  53          HD1       ARG  53  -9.457  -3.292  -6.842
  453    HE   ARG  53           HE       ARG  53  -9.318  -3.298  -9.594
  454   1HH1  ARG  53          HH21      ARG  53  -9.754  -5.680  -7.138
  455   2HH1  ARG  53          HH22      ARG  53 -10.757  -6.697  -8.118
  456   1HH2  ARG  53          HH11      ARG  53 -10.624  -4.614 -10.886
  457   2HH2  ARG  53          HH12      ARG  53 -11.249  -6.094 -10.238
  458    H    HIS  54           HN       HIS  54  -6.563  -0.091  -8.727
  459    HA   HIS  54           HA       HIS  54  -4.773  -1.255 -10.621
  460   1HB   HIS  54          HB2       HIS  54  -6.785   0.027 -11.292
  461   2HB   HIS  54          HB1       HIS  54  -6.040   1.505 -10.681
  462    HD1  HIS  54           HD1      HIS  54  -4.049   2.494 -12.025
  463    HD2  HIS  54           HD2      HIS  54  -5.705  -0.919 -13.756
  464    HE1  HIS  54           HE1      HIS  54  -3.112   2.355 -14.372
  465    H    ASN  55           HN       ASN  55  -4.563   1.789  -8.772
  466    HA   ASN  55           HA       ASN  55  -2.028   2.602  -9.786
  467   1HB   ASN  55          HB2       ASN  55  -3.497   4.101  -8.489
  468   2HB   ASN  55          HB1       ASN  55  -3.236   3.114  -7.049
  469   1HD2  ASN  55          HD21      ASN  55  -1.695   5.430  -9.244
  470   2HD2  ASN  55          HD22      ASN  55  -0.330   5.707  -8.274
  471    H    LEU  56           HN       LEU  56  -2.863   0.579  -6.957
  472    HA   LEU  56           HA       LEU  56  -0.218   0.306  -5.964
  473   1HB   LEU  56          HB2       LEU  56  -2.606  -1.535  -5.815
  474   2HB   LEU  56          HB1       LEU  56  -1.083  -1.902  -5.008
  475    HG   LEU  56           HG       LEU  56  -2.661   0.658  -4.602
  476   1HD1  LEU  56          HD11      LEU  56  -3.157  -0.406  -2.342
  477   2HD1  LEU  56          HD12      LEU  56  -2.576  -1.925  -3.024
  478   3HD1  LEU  56          HD13      LEU  56  -3.989  -1.130  -3.720
  479   1HD2  LEU  56          HD21      LEU  56  -0.061  -0.412  -3.559
  480   2HD2  LEU  56          HD22      LEU  56  -1.089   0.433  -2.410
  481   3HD2  LEU  56          HD23      LEU  56  -0.551   1.251  -3.870
  482    H    SER  57           HN       SER  57  -1.958  -1.615  -8.406
  483    HA   SER  57           HA       SER  57   0.082  -3.587  -8.734
  484   1HB   SER  57          HB2       SER  57  -1.006  -3.925 -10.999
  485   2HB   SER  57          HB1       SER  57  -2.097  -4.026  -9.620
  486    HG   SER  57           HG       SER  57  -2.546  -2.581 -11.612
  487    H    LEU  58           HN       LEU  58  -0.540  -0.609 -10.658
  488    HA   LEU  58           HA       LEU  58   1.826  -0.986 -12.276
  489   1HB   LEU  58          HB2       LEU  58   0.003   1.365 -11.767
  490   2HB   LEU  58          HB1       LEU  58   1.475   1.559 -12.713
  491    HG   LEU  58           HG       LEU  58   0.638  -0.395 -14.149
  492   1HD1  LEU  58          HD11      LEU  58  -1.853  -0.672 -14.101
  493   2HD1  LEU  58          HD12      LEU  58  -1.888   0.271 -12.611
  494   3HD1  LEU  58          HD13      LEU  58  -1.058  -1.285 -12.652
  495   1HD2  LEU  58          HD21      LEU  58  -1.053   1.139 -15.313
  496   2HD2  LEU  58          HD22      LEU  58   0.561   1.806 -15.064
  497   3HD2  LEU  58          HD23      LEU  58  -0.764   2.281 -14.000
  498    H    ASN  59           HN       ASN  59   1.150   0.902  -9.339
  499    HA   ASN  59           HA       ASN  59   3.697   2.220  -9.281
  500   1HB   ASN  59          HB2       ASN  59   1.751   1.548  -7.057
  501   2HB   ASN  59          HB1       ASN  59   3.158   2.594  -6.858
  502   1HD2  ASN  59          HD21      ASN  59   1.394   2.601  -9.910
  503   2HD2  ASN  59          HD22      ASN  59   0.688   4.132  -9.711
  504    H    GLU  60           HN       GLU  60   5.649   1.314  -8.926
  505    HA   GLU  60           HA       GLU  60   5.815  -1.433  -7.882
  506   1HB   GLU  60          HB2       GLU  60   7.935   0.495  -8.875
  507   2HB   GLU  60          HB1       GLU  60   8.254  -1.166  -8.372
  508   1HG   GLU  60          HG2       GLU  60   6.682  -1.988 -10.098
  509   2HG   GLU  60          HG1       GLU  60   6.384  -0.327 -10.610
  510    H    CYS  61           HN       CYS  61   5.837   1.698  -6.591
  511    HA   CYS  61           HA       CYS  61   7.785   1.469  -4.516
  512   1HB   CYS  61          HB2       CYS  61   5.182   3.004  -4.690
  513   2HB   CYS  61          HB1       CYS  61   6.273   3.135  -3.310
  514    HG   CYS  61           HG       CYS  61   6.730   4.390  -6.051
  515    H    PHE  62           HN       PHE  62   4.385   0.473  -4.694
  516    HA   PHE  62           HA       PHE  62   4.416  -0.581  -1.950
  517   1HB   PHE  62          HB2       PHE  62   2.404  -0.748  -4.215
  518   2HB   PHE  62          HB1       PHE  62   2.152  -1.498  -2.640
  519    HD1  PHE  62           HD1      PHE  62   2.426   1.691  -4.466
  520    HD2  PHE  62           HD2      PHE  62   1.746  -0.154  -0.647
  521    HE1  PHE  62           HE1      PHE  62   1.581   3.846  -3.574
  522    HE2  PHE  62           HE2      PHE  62   0.905   2.001   0.246
  523    HZ   PHE  62           HZ       PHE  62   0.821   4.001  -1.219
  524    H    VAL  63           HN       VAL  63   5.057  -2.648  -1.448
  525    HA   VAL  63           HA       VAL  63   5.542  -4.550  -3.719
  526    HB   VAL  63           HB       VAL  63   6.782  -4.458  -0.952
  527   1HG1  VAL  63          HG11      VAL  63   6.691  -6.743  -1.622
  528   2HG1  VAL  63          HG12      VAL  63   8.311  -6.203  -2.060
  529   3HG1  VAL  63          HG13      VAL  63   7.065  -6.347  -3.299
  530   1HG2  VAL  63          HG21      VAL  63   8.861  -3.978  -2.310
  531   2HG2  VAL  63          HG22      VAL  63   7.665  -2.682  -2.344
  532   3HG2  VAL  63          HG23      VAL  63   7.821  -3.776  -3.720
  533    H    LYS  64           HN       LYS  64   4.089  -6.148  -3.853
  534    HA   LYS  64           HA       LYS  64   2.370  -6.785  -1.544
  535   1HB   LYS  64          HB2       LYS  64   1.182  -8.242  -3.152
  536   2HB   LYS  64          HB1       LYS  64   1.357  -6.604  -3.775
  537   1HG   LYS  64          HG2       LYS  64   3.584  -7.577  -4.841
  538   2HG   LYS  64          HG1       LYS  64   2.762  -9.121  -4.632
  539   1HD   LYS  64          HD2       LYS  64   1.554  -6.741  -6.076
  540   2HD   LYS  64          HD1       LYS  64   2.403  -8.051  -6.883
  541   1HE   LYS  64          HE2       LYS  64   0.417  -9.201  -5.132
  542   2HE   LYS  64          HE1       LYS  64  -0.349  -7.983  -6.147
  543   1HZ   LYS  64          HZ1       LYS  64  -0.041  -9.202  -7.968
  544   2HZ   LYS  64          HZ2       LYS  64   0.201 -10.503  -6.902
  545   3HZ   LYS  64          HZ3       LYS  64   1.534  -9.661  -7.536
  546    H    VAL  65           HN       VAL  65   2.321  -8.906  -0.584
  547    HA   VAL  65           HA       VAL  65   4.843 -10.474  -1.010
  548    HB   VAL  65           HB       VAL  65   3.235 -10.733   1.512
  549   1HG1  VAL  65          HG11      VAL  65   5.346 -12.033   0.987
  550   2HG1  VAL  65          HG12      VAL  65   5.398 -11.107   2.487
  551   3HG1  VAL  65          HG13      VAL  65   6.217 -10.502   1.048
  552   1HG2  VAL  65          HG21      VAL  65   4.971  -8.350   0.810
  553   2HG2  VAL  65          HG22      VAL  65   4.464  -8.763   2.449
  554   3HG2  VAL  65          HG23      VAL  65   3.259  -8.328   1.238
  555    HA   PRO  66           HA       PRO  66   1.507 -13.240  -2.685
  556   1HB   PRO  66          HB2       PRO  66   4.052 -14.739  -3.247
  557   2HB   PRO  66          HB1       PRO  66   2.626 -14.518  -4.282
  558   1HG   PRO  66          HG2       PRO  66   4.832 -13.113  -4.711
  559   2HG   PRO  66          HG1       PRO  66   3.234 -12.365  -4.882
  560   1HD   PRO  66          HD2       PRO  66   5.244 -12.025  -2.692
  561   2HD   PRO  66          HD1       PRO  66   4.071 -10.854  -3.333
  562    H    ARG  67           HN       ARG  67   0.524 -14.829  -1.472
  563    HA   ARG  67           HA       ARG  67   1.499 -15.547   1.094
  564   1HB   ARG  67          HB2       ARG  67  -0.494 -17.027  -0.645
  565   2HB   ARG  67          HB1       ARG  67  -0.257 -17.289   1.083
  566   1HG   ARG  67          HG2       ARG  67  -0.738 -14.793   1.378
  567   2HG   ARG  67          HG1       ARG  67  -1.298 -14.810  -0.296
  568   1HD   ARG  67          HD2       ARG  67  -3.232 -15.177   1.090
  569   2HD   ARG  67          HD1       ARG  67  -2.829 -16.724   0.340
  570    HE   ARG  67           HE       ARG  67  -1.455 -16.806   2.729
  571   1HH1  ARG  67          HH21      ARG  67  -4.698 -16.128   1.773
  572   2HH1  ARG  67          HH22      ARG  67  -5.398 -16.767   3.222
  573   1HH2  ARG  67          HH11      ARG  67  -2.350 -17.644   4.623
  574   2HH2  ARG  67          HH12      ARG  67  -4.069 -17.628   4.836
  575    H    ASP  68           HN       ASP  68   2.354 -17.541   1.870
  576    HA   ASP  68           HA       ASP  68   4.347 -18.733   0.154
  577   1HB   ASP  68          HB2       ASP  68   3.247 -19.605   2.849
  578   2HB   ASP  68          HB1       ASP  68   4.652 -20.329   2.065
  579    H    ASP  69           HN       ASP  69   4.353 -20.964  -0.610
  580    HA   ASP  69           HA       ASP  69   1.801 -21.799  -1.673
  581   1HB   ASP  69          HB2       ASP  69   4.502 -23.169  -1.538
  582   2HB   ASP  69          HB1       ASP  69   3.106 -23.861  -2.367
  583    H    LYS  70           HN       LYS  70   3.482 -22.382   1.270
  584    HA   LYS  70           HA       LYS  70   2.414 -24.933   1.980
  585   1HB   LYS  70          HB2       LYS  70   3.326 -22.579   3.657
  586   2HB   LYS  70          HB1       LYS  70   2.868 -24.139   4.346
  587   1HG   LYS  70          HG2       LYS  70   4.607 -25.273   3.098
  588   2HG   LYS  70          HG1       LYS  70   4.979 -23.807   2.201
  589   1HD   LYS  70          HD2       LYS  70   6.646 -24.058   3.938
  590   2HD   LYS  70          HD1       LYS  70   5.608 -22.697   4.356
  591   1HE   LYS  70          HE2       LYS  70   6.173 -24.387   6.226
  592   2HE   LYS  70          HE1       LYS  70   4.485 -23.916   6.040
  593   1HZ   LYS  70          HZ1       LYS  70   3.905 -25.954   5.343
  594   2HZ   LYS  70          HZ2       LYS  70   5.325 -26.442   6.140
  595   3HZ   LYS  70          HZ3       LYS  70   5.333 -26.194   4.459
  596    H    LYS  71           HN       LYS  71   1.147 -21.632   2.433
  597    HA   LYS  71           HA       LYS  71  -1.525 -22.818   3.043
  598   1HB   LYS  71          HB2       LYS  71  -0.666 -22.154   5.172
  599   2HB   LYS  71          HB1       LYS  71  -0.053 -20.635   4.530
  600   1HG   LYS  71          HG2       LYS  71  -2.144 -19.648   4.463
  601   2HG   LYS  71          HG1       LYS  71  -2.988 -21.176   4.255
  602   1HD   LYS  71          HD2       LYS  71  -1.546 -20.587   6.840
  603   2HD   LYS  71          HD1       LYS  71  -3.151 -19.918   6.556
  604   1HE   LYS  71          HE2       LYS  71  -3.958 -22.257   6.055
  605   2HE   LYS  71          HE1       LYS  71  -2.380 -22.851   6.570
  606   1HZ   LYS  71          HZ1       LYS  71  -3.306 -22.894   8.583
  607   2HZ   LYS  71          HZ2       LYS  71  -4.579 -21.859   8.142
  608   3HZ   LYS  71          HZ3       LYS  71  -3.073 -21.214   8.589
  609    HA   PRO  72           HA       PRO  72  -1.886 -19.539  -0.182
  610   1HB   PRO  72          HB2       PRO  72  -3.141 -20.970  -2.085
  611   2HB   PRO  72          HB1       PRO  72  -1.399 -21.146  -1.803
  612   1HG   PRO  72          HG2       PRO  72  -3.635 -22.931  -0.976
  613   2HG   PRO  72          HG1       PRO  72  -2.006 -23.350  -1.530
  614   1HD   PRO  72          HD2       PRO  72  -2.835 -23.244   1.161
  615   2HD   PRO  72          HD1       PRO  72  -1.147 -23.252   0.605
  616    H    GLY  73           HN       GLY  73  -3.885 -18.532  -1.117
  617   1HA   GLY  73          HA2       GLY  73  -6.525 -19.337  -0.699
  618   2HA   GLY  73          HA1       GLY  73  -6.057 -18.529   0.798
  619    H    LYS  74           HN       LYS  74  -5.756 -16.286   0.787
  620    HA   LYS  74           HA       LYS  74  -7.145 -14.818  -1.283
  621   1HB   LYS  74          HB2       LYS  74  -5.462 -13.933   1.076
  622   2HB   LYS  74          HB1       LYS  74  -6.324 -12.812   0.021
  623   1HG   LYS  74          HG2       LYS  74  -8.452 -13.939   0.554
  624   2HG   LYS  74          HG1       LYS  74  -7.595 -15.060   1.613
  625   1HD   LYS  74          HD2       LYS  74  -6.849 -13.170   3.014
  626   2HD   LYS  74          HD1       LYS  74  -7.710 -12.048   1.960
  627   1HE   LYS  74          HE2       LYS  74  -9.162 -12.470   3.820
  628   2HE   LYS  74          HE1       LYS  74  -9.819 -13.381   2.460
  629   1HZ   LYS  74          HZ1       LYS  74  -8.003 -15.065   3.635
  630   2HZ   LYS  74          HZ2       LYS  74  -9.695 -15.157   3.759
  631   3HZ   LYS  74          HZ3       LYS  74  -8.797 -14.332   4.942
  632    H    GLY  75           HN       GLY  75  -6.170 -13.124  -2.623
  633   1HA   GLY  75          HA2       GLY  75  -4.081 -13.903  -4.254
  634   2HA   GLY  75          HA1       GLY  75  -4.488 -12.209  -3.993
  635    H    SER  76           HN       SER  76  -3.131 -10.956  -2.683
  636    HA   SER  76           HA       SER  76  -0.938 -12.325  -1.202
  637   1HB   SER  76          HB2       SER  76  -0.402 -10.090  -3.166
  638   2HB   SER  76          HB1       SER  76   0.783 -11.049  -2.288
  639    HG   SER  76           HG       SER  76  -0.091 -12.890  -3.438
  640    H    TYR  77           HN       TYR  77   0.158 -10.872   0.301
  641    HA   TYR  77           HA       TYR  77  -1.668  -8.906   1.470
  642   1HB   TYR  77          HB2       TYR  77   1.157  -9.715   2.221
  643   2HB   TYR  77          HB1       TYR  77   0.144  -8.613   3.151
  644    HD1  TYR  77           HD1      TYR  77  -2.041  -9.448   4.106
  645    HD2  TYR  77           HD2      TYR  77   0.887 -12.072   2.384
  646    HE1  TYR  77           HE1      TYR  77  -3.114 -11.382   5.231
  647    HE2  TYR  77           HE2      TYR  77  -0.185 -14.007   3.505
  648    HH   TYR  77           HH       TYR  77  -1.959 -14.698   4.675
  649    H    TRP  78           HN       TRP  78  -0.908  -6.680   1.976
  650    HA   TRP  78           HA       TRP  78   0.971  -5.593  -0.099
  651   1HB   TRP  78          HB2       TRP  78  -1.672  -4.513   0.904
  652   2HB   TRP  78          HB1       TRP  78  -0.489  -3.494   0.079
  653    HD1  TRP  78           HD1      TRP  78  -3.014  -6.250  -0.525
  654    HE1  TRP  78           HE1      TRP  78  -3.186  -6.700  -3.059
  655    HE3  TRP  78           HE3      TRP  78   0.908  -3.435  -2.194
  656    HZ2  TRP  78           HZ2      TRP  78  -1.832  -5.966  -5.477
  657    HZ3  TRP  78           HZ3      TRP  78   1.445  -3.328  -4.608
  658    HH2  TRP  78           HH2      TRP  78   0.082  -4.588  -6.252
  659    H    THR  79           HN       THR  79   2.622  -4.420   0.717
  660    HA   THR  79           HA       THR  79   2.360  -3.127   3.374
  661    HB   THR  79           HB       THR  79   3.242  -5.273   4.006
  662    HG1  THR  79           HG1      THR  79   5.007  -4.551   4.988
  663   1HG2  THR  79          HG21      THR  79   3.943  -6.200   1.934
  664   2HG2  THR  79          HG22      THR  79   5.415  -6.051   2.893
  665   3HG2  THR  79          HG23      THR  79   5.063  -4.872   1.630
  666    H    LEU  80           HN       LEU  80   4.192  -1.627   3.773
  667    HA   LEU  80           HA       LEU  80   4.876  -0.166   1.361
  668   1HB   LEU  80          HB2       LEU  80   5.926   0.169   4.190
  669   2HB   LEU  80          HB1       LEU  80   6.058   1.351   2.889
  670    HG   LEU  80           HG       LEU  80   3.438   0.303   3.999
  671   1HD1  LEU  80          HD11      LEU  80   3.304   2.719   4.869
  672   2HD1  LEU  80          HD12      LEU  80   5.042   2.797   4.580
  673   3HD1  LEU  80          HD13      LEU  80   4.389   1.624   5.725
  674   1HD2  LEU  80          HD21      LEU  80   2.674   2.492   2.760
  675   2HD2  LEU  80          HD22      LEU  80   2.958   1.031   1.820
  676   3HD2  LEU  80          HD23      LEU  80   4.182   2.301   1.865
  677    H    ASP  81           HN       ASP  81   7.263   0.471   0.987
  678    HA   ASP  81           HA       ASP  81   8.751  -1.701   0.144
  679   1HB   ASP  81          HB2       ASP  81  10.245   0.671   1.239
  680   2HB   ASP  81          HB1       ASP  81  10.485  -0.194  -0.279
  681    HA   PRO  82           HA       PRO  82  10.598  -3.831   3.553
  682   1HB   PRO  82          HB2       PRO  82  13.347  -2.997   2.692
  683   2HB   PRO  82          HB1       PRO  82  12.713  -4.622   3.026
  684   1HG   PRO  82          HG2       PRO  82  13.088  -3.830   0.539
  685   2HG   PRO  82          HG1       PRO  82  11.644  -4.765   0.972
  686   1HD   PRO  82          HD2       PRO  82  11.896  -1.818   0.455
  687   2HD   PRO  82          HD1       PRO  82  10.595  -2.936  -0.017
  688    H    ASP  83           HN       ASP  83  13.241  -3.115   4.743
  689    HA   ASP  83           HA       ASP  83  12.285  -0.905   6.501
  690   1HB   ASP  83          HB2       ASP  83  14.434  -3.016   6.831
  691   2HB   ASP  83          HB1       ASP  83  14.191  -1.696   7.975
  692    H    SER  84           HN       SER  84  13.518  -0.655   3.785
  693    HA   SER  84           HA       SER  84  15.698   0.155   2.902
  694   1HB   SER  84          HB2       SER  84  13.613   2.140   3.735
  695   2HB   SER  84          HB1       SER  84  15.066   2.692   2.909
  696    HG   SER  84           HG       SER  84  13.132   2.025   1.613
  697    H    TYR  85           HN       TYR  85  16.919  -0.582   5.068
  698    HA   TYR  85           HA       TYR  85  17.750   1.737   6.709
  699   1HB   TYR  85          HB2       TYR  85  17.373  -0.510   7.745
  700   2HB   TYR  85          HB1       TYR  85  18.707  -1.143   6.782
  701    HD1  TYR  85           HD1      TYR  85  17.764   0.956   9.637
  702    HD2  TYR  85           HD2      TYR  85  21.024  -0.391   7.185
  703    HE1  TYR  85           HE1      TYR  85  19.378   1.765  11.338
  704    HE2  TYR  85           HE2      TYR  85  22.637   0.417   8.886
  705    HH   TYR  85           HH       TYR  85  21.558   2.224  11.731
  706    H    ASN  86           HN       ASN  86  18.887  -0.262   4.073
  707    HA   ASN  86           HA       ASN  86  21.576   1.018   4.150
  708   1HB   ASN  86          HB2       ASN  86  20.465  -1.254   2.483
  709   2HB   ASN  86          HB1       ASN  86  22.116  -0.643   2.370
  710   1HD2  ASN  86          HD21      ASN  86  23.139  -0.449   4.792
  711   2HD2  ASN  86          HD22      ASN  86  22.942  -1.847   5.733
  712    H    MET  87           HN       MET  87  18.771   2.034   3.102
  713    HA   MET  87           HA       MET  87  19.448   2.583   0.292
  714   1HB   MET  87          HB2       MET  87  17.131   3.332   2.077
  715   2HB   MET  87          HB1       MET  87  17.280   3.970   0.449
  716   1HG   MET  87          HG2       MET  87  17.024   1.065   1.272
  717   2HG   MET  87          HG1       MET  87  15.831   2.017   0.401
  718   1HE   MET  87          HE1       MET  87  18.360   3.547  -1.549
  719   2HE   MET  87          HE2       MET  87  16.608   3.388  -1.688
  720   3HE   MET  87          HE3       MET  87  17.650   2.740  -2.953
  721    H    PHE  88           HN       PHE  88  20.737   4.181  -0.260
  722    HA   PHE  88           HA       PHE  88  20.900   6.629   1.466
  723   1HB   PHE  88          HB2       PHE  88  23.219   6.855   0.668
  724   2HB   PHE  88          HB1       PHE  88  22.987   5.305   1.477
  725    HD1  PHE  88           HD1      PHE  88  22.784   3.213   0.164
  726    HD2  PHE  88           HD2      PHE  88  23.652   6.981  -1.708
  727    HE1  PHE  88           HE1      PHE  88  23.519   2.027  -1.886
  728    HE2  PHE  88           HE2      PHE  88  24.382   5.795  -3.758
  729    HZ   PHE  88           HZ       PHE  88  24.317   3.318  -3.848
  730    H    GLU  89           HN       GLU  89  19.135   5.924  -0.891
  731    HA   GLU  89           HA       GLU  89  19.996   7.247  -3.236
  732   1HB   GLU  89          HB2       GLU  89  17.595   7.456  -3.789
  733   2HB   GLU  89          HB1       GLU  89  17.962   5.852  -3.153
  734   1HG   GLU  89          HG2       GLU  89  17.237   6.637  -0.889
  735   2HG   GLU  89          HG1       GLU  89  16.747   8.168  -1.617
  736    H    ASN  90           HN       ASN  90  19.457   8.508  -0.209
  737    HA   ASN  90           HA       ASN  90  19.375  11.295  -1.299
  738   1HB   ASN  90          HB2       ASN  90  17.806  10.201   1.054
  739   2HB   ASN  90          HB1       ASN  90  17.954  11.917   0.668
  740   1HD2  ASN  90          HD21      ASN  90  17.779  11.799  -2.169
  741   2HD2  ASN  90          HD22      ASN  90  16.234  11.245  -2.601
  742    H    GLY  91           HN       GLY  91  20.743  12.727  -0.239
  743   1HA   GLY  91          HA2       GLY  91  22.964  11.684   1.203
  744   2HA   GLY  91          HA1       GLY  91  22.533  13.394   1.129
  745    H    SER  92           HN       SER  92  19.928  13.143   2.301
  746    HA   SER  92           HA       SER  92  20.562  13.360   5.065
  747   1HB   SER  92          HB2       SER  92  17.933  12.852   3.649
  748   2HB   SER  92          HB1       SER  92  18.056  13.154   5.380
  749    HG   SER  92           HG       SER  92  18.096  14.895   3.338
  750    H    PHE  93           HN       PHE  93  19.292  10.632   3.164
  751    HA   PHE  93           HA       PHE  93  18.990   8.927   5.494
  752   1HB   PHE  93          HB2       PHE  93  17.982   8.840   2.972
  753   2HB   PHE  93          HB1       PHE  93  19.303   7.700   2.775
  754    HD1  PHE  93           HD1      PHE  93  15.963   8.146   3.940
  755    HD2  PHE  93           HD2      PHE  93  19.521   5.827   4.588
  756    HE1  PHE  93           HE1      PHE  93  14.620   6.409   5.088
  757    HE2  PHE  93           HE2      PHE  93  18.175   4.088   5.736
  758    HZ   PHE  93           HZ       PHE  93  15.724   4.383   5.989
  759    H    LEU  94           HN       LEU  94  21.436   9.858   5.895
  760    HA   LEU  94           HA       LEU  94  23.127   7.496   5.665
  761   1HB   LEU  94          HB2       LEU  94  23.502   8.477   3.452
  762   2HB   LEU  94          HB1       LEU  94  23.878  10.035   4.183
  763    HG   LEU  94           HG       LEU  94  25.849   9.071   5.285
  764   1HD1  LEU  94          HD11      LEU  94  24.734   6.519   4.133
  765   2HD1  LEU  94          HD12      LEU  94  25.364   6.829   5.751
  766   3HD1  LEU  94          HD13      LEU  94  26.472   6.675   4.392
  767   1HD2  LEU  94          HD21      LEU  94  27.187   8.667   3.270
  768   2HD2  LEU  94          HD22      LEU  94  26.029   9.963   2.969
  769   3HD2  LEU  94          HD23      LEU  94  25.723   8.343   2.342
  Start of MODEL   18
    1   1H    MET   1          HT1       MET   1 -21.352  19.801   3.591
    2   2H    MET   1          HT2       MET   1 -22.813  20.063   4.415
    3   3H    MET   1          HT3       MET   1 -22.729  20.301   2.735
    4    HA   MET   1           HA       MET   1 -23.422  17.974   4.104
    5   1HB   MET   1          HB2       MET   1 -22.897  18.637   1.194
    6   2HB   MET   1          HB1       MET   1 -23.608  17.114   1.731
    7   1HG   MET   1          HG2       MET   1 -25.448  18.348   2.814
    8   2HG   MET   1          HG1       MET   1 -24.741  19.874   2.280
    9   1HE   MET   1          HE1       MET   1 -27.361  19.501   1.964
   10   2HE   MET   1          HE2       MET   1 -28.069  19.022   0.425
   11   3HE   MET   1          HE3       MET   1 -27.181  20.539   0.543
   12    H    LEU   2           HN       LEU   2 -22.511  15.852   2.635
   13    HA   LEU   2           HA       LEU   2 -19.921  15.357   3.821
   14   1HB   LEU   2          HB2       LEU   2 -21.314  13.771   1.645
   15   2HB   LEU   2          HB1       LEU   2 -20.038  13.195   2.718
   16    HG   LEU   2           HG       LEU   2 -22.814  14.081   3.563
   17   1HD1  LEU   2          HD11      LEU   2 -22.512  11.831   2.369
   18   2HD1  LEU   2          HD12      LEU   2 -23.271  11.779   3.959
   19   3HD1  LEU   2          HD13      LEU   2 -21.575  11.332   3.777
   20   1HD2  LEU   2          HD21      LEU   2 -21.461  14.619   5.406
   21   2HD2  LEU   2          HD22      LEU   2 -20.341  13.293   5.099
   22   3HD2  LEU   2          HD23      LEU   2 -21.936  12.963   5.772
   23    H    VAL   3           HN       VAL   3 -17.905  15.364   2.865
   24    HA   VAL   3           HA       VAL   3 -17.690  15.999  -0.040
   25    HB   VAL   3           HB       VAL   3 -16.030  17.762   0.433
   26   1HG1  VAL   3          HG11      VAL   3 -18.569  18.296   1.996
   27   2HG1  VAL   3          HG12      VAL   3 -18.510  18.258   0.234
   28   3HG1  VAL   3          HG13      VAL   3 -17.581  19.466   1.121
   29   1HG2  VAL   3          HG21      VAL   3 -16.713  17.055   3.294
   30   2HG2  VAL   3          HG22      VAL   3 -15.989  18.604   2.860
   31   3HG2  VAL   3          HG23      VAL   3 -15.121  17.103   2.536
   32    H    LYS   4           HN       LYS   4 -15.717  15.230  -0.958
   33    HA   LYS   4           HA       LYS   4 -14.503  13.042   0.505
   34   1HB   LYS   4          HB2       LYS   4 -13.612  14.320  -2.100
   35   2HB   LYS   4          HB1       LYS   4 -13.125  12.737  -1.499
   36   1HG   LYS   4          HG2       LYS   4 -15.959  13.558  -2.203
   37   2HG   LYS   4          HG1       LYS   4 -14.914  12.532  -3.184
   38   1HD   LYS   4          HD2       LYS   4 -14.753  11.073  -0.993
   39   2HD   LYS   4          HD1       LYS   4 -16.235  11.921  -0.548
   40   1HE   LYS   4          HE2       LYS   4 -16.971   9.959  -1.661
   41   2HE   LYS   4          HE1       LYS   4 -17.125  11.244  -2.860
   42   1HZ   LYS   4          HZ1       LYS   4 -14.563  10.368  -3.152
   43   2HZ   LYS   4          HZ2       LYS   4 -15.875   9.962  -4.154
   44   3HZ   LYS   4          HZ3       LYS   4 -15.432   8.938  -2.873
   45    HA   PRO   5           HA       PRO   5 -11.291  15.455   2.423
   46   1HB   PRO   5          HB2       PRO   5  -9.445  13.547   2.958
   47   2HB   PRO   5          HB1       PRO   5 -10.995  13.622   3.813
   48   1HG   PRO   5          HG2       PRO   5 -10.207  11.909   1.494
   49   2HG   PRO   5          HG1       PRO   5 -11.068  11.458   2.977
   50   1HD   PRO   5          HD2       PRO   5 -12.381  11.930   0.641
   51   2HD   PRO   5          HD1       PRO   5 -13.098  12.318   2.221
   52    HA   PRO   6           HA       PRO   6  -8.283  16.433  -0.701
   53   1HB   PRO   6          HB2       PRO   6  -6.301  17.604   0.727
   54   2HB   PRO   6          HB1       PRO   6  -7.910  18.340   0.583
   55   1HG   PRO   6          HG2       PRO   6  -6.779  16.715   2.824
   56   2HG   PRO   6          HG1       PRO   6  -7.702  18.227   2.892
   57   1HD   PRO   6          HD2       PRO   6  -8.852  15.772   3.307
   58   2HD   PRO   6          HD1       PRO   6  -9.742  17.151   2.621
   59    H    TYR   7           HN       TYR   7  -7.655  13.938   1.494
   60    HA   TYR   7           HA       TYR   7  -4.865  13.468   1.013
   61   1HB   TYR   7          HB2       TYR   7  -6.999  11.374   1.525
   62   2HB   TYR   7          HB1       TYR   7  -5.273  11.209   1.824
   63    HD1  TYR   7           HD1      TYR   7  -8.247  11.626   3.473
   64    HD2  TYR   7           HD2      TYR   7  -4.364  13.455   3.254
   65    HE1  TYR   7           HE1      TYR   7  -8.579  12.597   5.724
   66    HE2  TYR   7           HE2      TYR   7  -4.695  14.419   5.509
   67    HH   TYR   7           HH       TYR   7  -7.134  13.407   7.604
   68    H    SER   8           HN       SER   8  -3.849  12.444  -0.698
   69    HA   SER   8           HA       SER   8  -5.406  12.079  -3.145
   70   1HB   SER   8          HB2       SER   8  -2.504  11.405  -2.559
   71   2HB   SER   8          HB1       SER   8  -3.247  11.466  -4.155
   72    HG   SER   8           HG       SER   8  -3.319  13.660  -2.376
   73    H    TYR   9           HN       TYR   9  -5.118   9.912  -4.366
   74    HA   TYR   9           HA       TYR   9  -6.215   7.807  -2.792
   75   1HB   TYR   9          HB2       TYR   9  -4.794   7.744  -5.471
   76   2HB   TYR   9          HB1       TYR   9  -5.615   6.351  -4.766
   77    HD1  TYR   9           HD1      TYR   9  -8.085   6.633  -4.089
   78    HD2  TYR   9           HD2      TYR   9  -6.021   9.359  -6.687
   79    HE1  TYR   9           HE1      TYR   9 -10.258   7.466  -4.936
   80    HE2  TYR   9           HE2      TYR   9  -8.196  10.196  -7.535
   81    HH   TYR   9           HH       TYR   9 -10.531   9.390  -7.719
   82    H    ILE  10           HN       ILE  10  -2.897   8.559  -3.747
   83    HA   ILE  10           HA       ILE  10  -1.650   6.171  -2.826
   84    HB   ILE  10           HB       ILE  10  -0.516   8.985  -2.736
   85   1HG1  ILE  10          HG12      ILE  10  -1.378   8.609  -4.965
   86   2HG1  ILE  10          HG11      ILE  10   0.370   8.409  -5.022
   87   1HG2  ILE  10          HG21      ILE  10   0.959   7.504  -1.608
   88   2HG2  ILE  10          HG22      ILE  10   1.617   7.648  -3.237
   89   3HG2  ILE  10          HG23      ILE  10   0.692   6.217  -2.782
   90   1HD1  ILE  10          HD11      ILE  10  -0.403   6.555  -6.232
   91   2HD1  ILE  10          HD12      ILE  10  -1.775   6.301  -5.156
   92   3HD1  ILE  10          HD13      ILE  10  -0.146   5.878  -4.624
   93    H    ALA  11           HN       ALA  11  -2.303   9.242  -1.121
   94    HA   ALA  11           HA       ALA  11  -1.131   8.446   1.368
   95   1HB   ALA  11          HB1       ALA  11  -2.673  10.280   2.300
   96   2HB   ALA  11          HB2       ALA  11  -3.226  10.504   0.641
   97   3HB   ALA  11          HB3       ALA  11  -1.531  10.775   1.050
   98    H    LEU  12           HN       LEU  12  -4.488   8.202   0.161
   99    HA   LEU  12           HA       LEU  12  -5.604   7.234   2.603
  100   1HB   LEU  12          HB2       LEU  12  -6.412   6.641  -0.263
  101   2HB   LEU  12          HB1       LEU  12  -7.397   6.278   1.153
  102    HG   LEU  12           HG       LEU  12  -6.417   9.057   0.417
  103   1HD1  LEU  12          HD11      LEU  12  -9.109   7.718   0.005
  104   2HD1  LEU  12          HD12      LEU  12  -8.001   8.259  -1.256
  105   3HD1  LEU  12          HD13      LEU  12  -8.804   9.440  -0.221
  106   1HD2  LEU  12          HD21      LEU  12  -6.857   9.168   2.707
  107   2HD2  LEU  12          HD22      LEU  12  -8.104   7.923   2.642
  108   3HD2  LEU  12          HD23      LEU  12  -8.446   9.548   2.051
  109    H    ILE  13           HN       ILE  13  -4.019   5.567  -0.093
  110    HA   ILE  13           HA       ILE  13  -4.435   2.898   0.880
  111    HB   ILE  13           HB       ILE  13  -2.226   4.084  -0.831
  112   1HG1  ILE  13          HG12      ILE  13  -4.597   2.374  -1.633
  113   2HG1  ILE  13          HG11      ILE  13  -4.636   4.134  -1.669
  114   1HG2  ILE  13          HG21      ILE  13  -1.369   2.044   0.093
  115   2HG2  ILE  13          HG22      ILE  13  -1.933   1.651  -1.531
  116   3HG2  ILE  13          HG23      ILE  13  -2.912   1.220  -0.129
  117   1HD1  ILE  13          HD11      ILE  13  -2.502   3.972  -3.115
  118   2HD1  ILE  13          HD12      ILE  13  -4.024   3.512  -3.874
  119   3HD1  ILE  13          HD13      ILE  13  -2.912   2.268  -3.302
  120    H    THR  14           HN       THR  14  -1.864   5.290   1.358
  121    HA   THR  14           HA       THR  14  -0.140   3.657   2.944
  122    HB   THR  14           HB       THR  14  -0.485   6.666   2.972
  123    HG1  THR  14           HG1      THR  14   0.423   6.507   1.106
  124   1HG2  THR  14          HG21      THR  14   1.925   6.555   3.760
  125   2HG2  THR  14          HG22      THR  14   1.676   4.830   4.024
  126   3HG2  THR  14          HG23      THR  14   0.729   6.006   4.933
  127    H    MET  15           HN       MET  15  -2.813   5.819   3.829
  128    HA   MET  15           HA       MET  15  -2.425   5.620   6.667
  129   1HB   MET  15          HB2       MET  15  -4.867   6.274   4.997
  130   2HB   MET  15          HB1       MET  15  -4.847   6.359   6.758
  131   1HG   MET  15          HG2       MET  15  -2.987   7.971   6.668
  132   2HG   MET  15          HG1       MET  15  -2.998   7.894   4.907
  133   1HE   MET  15          HE1       MET  15  -3.344  10.556   6.810
  134   2HE   MET  15          HE2       MET  15  -4.407  11.422   5.703
  135   3HE   MET  15          HE3       MET  15  -3.073  10.464   5.066
  136    H    ALA  16           HN       ALA  16  -4.328   3.749   4.350
  137    HA   ALA  16           HA       ALA  16  -5.758   2.138   6.198
  138   1HB   ALA  16          HB1       ALA  16  -4.734   1.526   3.414
  139   2HB   ALA  16          HB2       ALA  16  -6.322   2.162   3.840
  140   3HB   ALA  16          HB3       ALA  16  -5.884   0.512   4.289
  141    H    ILE  17           HN       ILE  17  -2.526   1.678   4.761
  142    HA   ILE  17           HA       ILE  17  -2.094  -0.914   5.957
  143    HB   ILE  17           HB       ILE  17  -0.032   1.143   5.098
  144   1HG1  ILE  17          HG12      ILE  17  -1.144  -1.158   3.475
  145   2HG1  ILE  17          HG11      ILE  17  -1.795   0.477   3.374
  146   1HG2  ILE  17          HG21      ILE  17   0.908  -0.675   6.456
  147   2HG2  ILE  17          HG22      ILE  17   1.384  -0.885   4.771
  148   3HG2  ILE  17          HG23      ILE  17   0.090  -1.871   5.450
  149   1HD1  ILE  17          HD11      ILE  17   1.082  -0.312   2.833
  150   2HD1  ILE  17          HD12      ILE  17   0.442   1.331   2.766
  151   3HD1  ILE  17          HD13      ILE  17  -0.118   0.120   1.613
  152    H    GLN  18           HN       GLN  18  -1.000   2.356   6.827
  153    HA   GLN  18           HA       GLN  18   0.348   1.566   9.231
  154   1HB   GLN  18          HB2       GLN  18  -0.832   4.215   8.358
  155   2HB   GLN  18          HB1       GLN  18   0.108   4.012   9.837
  156   1HG   GLN  18          HG2       GLN  18   2.027   3.207   8.535
  157   2HG   GLN  18          HG1       GLN  18   1.089   3.343   7.047
  158   1HE2  GLN  18          HE21      GLN  18   3.544   4.844   7.552
  159   2HE2  GLN  18          HE22      GLN  18   3.129   6.489   7.591
  160    H    ASN  19           HN       ASN  19  -2.982   2.689   8.645
  161    HA   ASN  19           HA       ASN  19  -3.622   2.612  11.500
  162   1HB   ASN  19          HB2       ASN  19  -5.313   3.023   9.024
  163   2HB   ASN  19          HB1       ASN  19  -5.960   3.063  10.666
  164   1HD2  ASN  19          HD21      ASN  19  -4.159   4.883   8.291
  165   2HD2  ASN  19          HD22      ASN  19  -3.893   6.256   9.253
  166    H    ALA  20           HN       ALA  20  -3.433   0.255   9.054
  167    HA   ALA  20           HA       ALA  20  -5.632  -1.398  10.028
  168   1HB   ALA  20          HB1       ALA  20  -5.055  -1.759   7.750
  169   2HB   ALA  20          HB2       ALA  20  -4.422  -3.173   8.592
  170   3HB   ALA  20          HB3       ALA  20  -3.333  -1.867   8.121
  171    HA   PRO  21           HA       PRO  21  -3.512  -3.243  13.465
  172   1HB   PRO  21          HB2       PRO  21  -4.352  -5.911  13.194
  173   2HB   PRO  21          HB1       PRO  21  -5.250  -4.634  14.029
  174   1HG   PRO  21          HG2       PRO  21  -5.629  -5.721  11.289
  175   2HG   PRO  21          HG1       PRO  21  -6.830  -5.123  12.444
  176   1HD   PRO  21          HD2       PRO  21  -6.038  -3.661  10.293
  177   2HD   PRO  21          HD1       PRO  21  -6.512  -2.898  11.828
  178    H    GLU  22           HN       GLU  22  -3.512  -5.512  10.689
  179    HA   GLU  22           HA       GLU  22  -0.577  -5.948  11.122
  180   1HB   GLU  22          HB2       GLU  22  -2.666  -7.566   9.625
  181   2HB   GLU  22          HB1       GLU  22  -0.940  -7.910   9.580
  182   1HG   GLU  22          HG2       GLU  22  -1.725  -9.331  11.280
  183   2HG   GLU  22          HG1       GLU  22  -1.083  -7.956  12.172
  184    H    LYS  23           HN       LYS  23   0.775  -4.986   9.639
  185    HA   LYS  23           HA       LYS  23  -0.247  -3.303   7.584
  186   1HB   LYS  23          HB2       LYS  23   2.510  -4.501   7.961
  187   2HB   LYS  23          HB1       LYS  23   2.123  -3.324   6.705
  188   1HG   LYS  23          HG2       LYS  23   1.274  -1.777   8.492
  189   2HG   LYS  23          HG1       LYS  23   1.827  -2.936   9.694
  190   1HD   LYS  23          HD2       LYS  23   3.683  -1.558   9.622
  191   2HD   LYS  23          HD1       LYS  23   4.130  -2.709   8.368
  192   1HE   LYS  23          HE2       LYS  23   2.704  -0.090   7.820
  193   2HE   LYS  23          HE1       LYS  23   4.449  -0.298   7.728
  194   1HZ   LYS  23          HZ1       LYS  23   3.614  -0.600   5.561
  195   2HZ   LYS  23          HZ2       LYS  23   2.385  -1.648   6.089
  196   3HZ   LYS  23          HZ3       LYS  23   4.007  -2.149   6.130
  197    H    LYS  24           HN       LYS  24   0.558  -6.722   7.613
  198    HA   LYS  24           HA       LYS  24   0.443  -6.959   4.696
  199   1HB   LYS  24          HB2       LYS  24   0.382  -9.019   6.919
  200   2HB   LYS  24          HB1       LYS  24   0.320  -9.440   5.209
  201   1HG   LYS  24          HG2       LYS  24   2.478  -8.294   4.850
  202   2HG   LYS  24          HG1       LYS  24   2.541  -7.881   6.564
  203   1HD   LYS  24          HD2       LYS  24   2.521 -10.283   7.143
  204   2HD   LYS  24          HD1       LYS  24   2.464 -10.692   5.426
  205   1HE   LYS  24          HE2       LYS  24   4.642  -9.816   5.038
  206   2HE   LYS  24          HE1       LYS  24   4.666  -8.977   6.589
  207   1HZ   LYS  24          HZ1       LYS  24   5.789 -11.358   6.175
  208   2HZ   LYS  24          HZ2       LYS  24   4.255 -11.845   6.720
  209   3HZ   LYS  24          HZ3       LYS  24   5.223 -10.837   7.688
  210    H    ILE  25           HN       ILE  25  -1.573  -5.855   4.399
  211    HA   ILE  25           HA       ILE  25  -4.018  -7.384   5.213
  212    HB   ILE  25           HB       ILE  25  -3.886  -5.032   6.006
  213   1HG1  ILE  25          HG12      ILE  25  -5.915  -5.291   3.770
  214   2HG1  ILE  25          HG11      ILE  25  -6.072  -6.126   5.316
  215   1HG2  ILE  25          HG21      ILE  25  -3.757  -3.200   4.472
  216   2HG2  ILE  25          HG22      ILE  25  -3.962  -4.263   3.080
  217   3HG2  ILE  25          HG23      ILE  25  -2.468  -4.312   4.015
  218   1HD1  ILE  25          HD11      ILE  25  -5.658  -3.135   5.163
  219   2HD1  ILE  25          HD12      ILE  25  -6.249  -4.089   6.524
  220   3HD1  ILE  25          HD13      ILE  25  -7.265  -3.856   5.102
  221    H    THR  26           HN       THR  26  -5.549  -7.866   3.556
  222    HA   THR  26           HA       THR  26  -4.378  -8.169   0.896
  223    HB   THR  26           HB       THR  26  -6.401  -9.364   0.347
  224    HG1  THR  26           HG1      THR  26  -7.472  -7.614   2.011
  225   1HG2  THR  26          HG21      THR  26  -5.746  -9.853   3.266
  226   2HG2  THR  26          HG22      THR  26  -4.839 -10.505   1.901
  227   3HG2  THR  26          HG23      THR  26  -6.511 -11.001   2.166
  228    H    LEU  27           HN       LEU  27  -5.496  -7.330  -1.066
  229    HA   LEU  27           HA       LEU  27  -5.903  -4.524  -0.929
  230   1HB   LEU  27          HB2       LEU  27  -5.237  -5.668  -2.997
  231   2HB   LEU  27          HB1       LEU  27  -6.782  -6.506  -3.053
  232    HG   LEU  27           HG       LEU  27  -7.977  -4.446  -3.457
  233   1HD1  LEU  27          HD11      LEU  27  -6.520  -2.304  -3.733
  234   2HD1  LEU  27          HD12      LEU  27  -5.337  -3.164  -2.748
  235   3HD1  LEU  27          HD13      LEU  27  -6.941  -2.818  -2.102
  236   1HD2  LEU  27          HD21      LEU  27  -5.442  -4.714  -5.092
  237   2HD2  LEU  27          HD22      LEU  27  -6.753  -3.624  -5.530
  238   3HD2  LEU  27          HD23      LEU  27  -7.038  -5.363  -5.463
  239    H    ASN  28           HN       ASN  28  -8.220  -7.212  -1.041
  240    HA   ASN  28           HA       ASN  28 -10.579  -5.631  -1.135
  241   1HB   ASN  28          HB2       ASN  28 -10.054  -8.376   0.016
  242   2HB   ASN  28          HB1       ASN  28 -11.665  -7.662  -0.056
  243   1HD2  ASN  28          HD21      ASN  28 -10.871 -10.050  -1.542
  244   2HD2  ASN  28          HD22      ASN  28 -10.981  -9.672  -3.193
  245    H    GLY  29           HN       GLY  29  -8.626  -6.760   1.590
  246   1HA   GLY  29          HA2       GLY  29 -10.344  -5.892   3.685
  247   2HA   GLY  29          HA1       GLY  29  -8.597  -6.081   3.833
  248    H    ILE  30           HN       ILE  30  -7.923  -4.159   1.771
  249    HA   ILE  30           HA       ILE  30  -7.807  -1.795   3.345
  250    HB   ILE  30           HB       ILE  30  -7.440  -2.211   0.369
  251   1HG1  ILE  30          HG12      ILE  30  -5.428  -1.749   2.594
  252   2HG1  ILE  30          HG11      ILE  30  -5.870  -3.345   1.994
  253   1HG2  ILE  30          HG21      ILE  30  -7.931   0.108   0.592
  254   2HG2  ILE  30          HG22      ILE  30  -6.170   0.022   0.595
  255   3HG2  ILE  30          HG23      ILE  30  -7.046   0.229   2.111
  256   1HD1  ILE  30          HD11      ILE  30  -4.378  -1.144   0.585
  257   2HD1  ILE  30          HD12      ILE  30  -5.241  -2.362  -0.352
  258   3HD1  ILE  30          HD13      ILE  30  -3.949  -2.846   0.744
  259    H    TYR  31           HN       TYR  31 -10.074  -2.690   0.703
  260    HA   TYR  31           HA       TYR  31 -11.363  -0.149   0.576
  261   1HB   TYR  31          HB2       TYR  31 -12.715  -2.839   0.249
  262   2HB   TYR  31          HB1       TYR  31 -13.309  -1.307  -0.356
  263    HD1  TYR  31           HD1      TYR  31 -11.029  -0.029  -1.645
  264    HD2  TYR  31           HD2      TYR  31 -12.137  -4.176  -1.541
  265    HE1  TYR  31           HE1      TYR  31  -9.804  -0.410  -3.759
  266    HE2  TYR  31           HE2      TYR  31 -10.870  -4.566  -3.637
  267    HH   TYR  31           HH       TYR  31  -9.314  -3.660  -5.026
  268    H    GLN  32           HN       GLN  32 -11.925  -2.938   2.672
  269    HA   GLN  32           HA       GLN  32 -14.300  -2.018   3.923
  270   1HB   GLN  32          HB2       GLN  32 -13.312  -4.307   4.129
  271   2HB   GLN  32          HB1       GLN  32 -12.060  -3.635   5.172
  272   1HG   GLN  32          HG2       GLN  32 -13.727  -2.937   6.802
  273   2HG   GLN  32          HG1       GLN  32 -15.034  -3.459   5.736
  274   1HE2  GLN  32          HE21      GLN  32 -15.659  -4.965   7.564
  275   2HE2  GLN  32          HE22      GLN  32 -14.826  -6.434   7.737
  276    H    PHE  33           HN       PHE  33 -10.886  -1.380   4.713
  277    HA   PHE  33           HA       PHE  33 -11.433   0.089   7.120
  278   1HB   PHE  33          HB2       PHE  33  -9.211  -0.795   6.654
  279   2HB   PHE  33          HB1       PHE  33  -9.080   0.219   5.217
  280    HD1  PHE  33           HD1      PHE  33  -9.254   0.235   8.918
  281    HD2  PHE  33           HD2      PHE  33  -8.562   2.562   5.374
  282    HE1  PHE  33           HE1      PHE  33  -8.361   2.085  10.307
  283    HE2  PHE  33           HE2      PHE  33  -7.672   4.413   6.762
  284    HZ   PHE  33           HZ       PHE  33  -7.569   4.173   9.229
  285    H    ILE  34           HN       ILE  34 -10.843   1.189   3.767
  286    HA   ILE  34           HA       ILE  34 -11.022   3.975   4.284
  287    HB   ILE  34           HB       ILE  34 -11.665   2.349   1.812
  288   1HG1  ILE  34          HG12      ILE  34  -9.334   4.201   2.346
  289   2HG1  ILE  34          HG11      ILE  34  -9.294   2.499   2.812
  290   1HG2  ILE  34          HG21      ILE  34 -11.341   4.650   0.674
  291   2HG2  ILE  34          HG22      ILE  34 -11.660   5.337   2.267
  292   3HG2  ILE  34          HG23      ILE  34 -12.887   4.355   1.469
  293   1HD1  ILE  34          HD11      ILE  34  -9.713   3.586   0.013
  294   2HD1  ILE  34          HD12      ILE  34  -9.811   1.879   0.453
  295   3HD1  ILE  34          HD13      ILE  34  -8.282   2.745   0.611
  296    H    MET  35           HN       MET  35 -13.627   1.741   3.202
  297    HA   MET  35           HA       MET  35 -15.657   3.748   3.222
  298   1HB   MET  35          HB2       MET  35 -15.812   0.747   3.560
  299   2HB   MET  35          HB1       MET  35 -17.240   1.776   3.445
  300   1HG   MET  35          HG2       MET  35 -16.425   2.635   1.265
  301   2HG   MET  35          HG1       MET  35 -15.035   1.557   1.372
  302   1HE   MET  35          HE1       MET  35 -16.227  -1.278   2.476
  303   2HE   MET  35          HE2       MET  35 -14.983  -0.772   1.334
  304   3HE   MET  35          HE3       MET  35 -16.237  -1.895   0.820
  305    H    ASP  36           HN       ASP  36 -14.486   1.566   5.766
  306    HA   ASP  36           HA       ASP  36 -16.449   2.223   7.725
  307   1HB   ASP  36          HB2       ASP  36 -13.574   1.321   7.983
  308   2HB   ASP  36          HB1       ASP  36 -14.661   1.492   9.362
  309    H    ARG  37           HN       ARG  37 -13.181   3.643   7.204
  310    HA   ARG  37           HA       ARG  37 -13.542   5.615   9.282
  311   1HB   ARG  37          HB2       ARG  37 -11.294   4.974   8.519
  312   2HB   ARG  37          HB1       ARG  37 -11.641   5.625   6.917
  313   1HG   ARG  37          HG2       ARG  37 -11.878   7.867   7.809
  314   2HG   ARG  37          HG1       ARG  37 -11.745   7.269   9.460
  315   1HD   ARG  37          HD2       ARG  37  -9.488   6.667   7.583
  316   2HD   ARG  37          HD1       ARG  37  -9.641   8.311   8.190
  317    HE   ARG  37           HE       ARG  37  -9.877   6.692  10.451
  318   1HH1  ARG  37          HH21      ARG  37  -7.636   7.157   7.875
  319   2HH1  ARG  37          HH22      ARG  37  -6.250   6.746   8.827
  320   1HH2  ARG  37          HH11      ARG  37  -8.082   6.159  11.714
  321   2HH2  ARG  37          HH12      ARG  37  -6.502   6.183  11.005
  322    H    PHE  38           HN       PHE  38 -13.483   6.021   5.715
  323    HA   PHE  38           HA       PHE  38 -15.006   8.556   6.051
  324   1HB   PHE  38          HB2       PHE  38 -13.743   7.418   3.545
  325   2HB   PHE  38          HB1       PHE  38 -14.333   9.062   3.787
  326    HD1  PHE  38           HD1      PHE  38 -13.135  10.614   5.313
  327    HD2  PHE  38           HD2      PHE  38 -11.626   6.689   4.435
  328    HE1  PHE  38           HE1      PHE  38 -10.914  11.268   6.204
  329    HE2  PHE  38           HE2      PHE  38  -9.408   7.342   5.329
  330    HZ   PHE  38           HZ       PHE  38  -9.052   9.632   6.213
  331    HA   PRO  39           HA       PRO  39 -18.435   5.865   4.680
  332   1HB   PRO  39          HB2       PRO  39 -20.507   7.419   5.442
  333   2HB   PRO  39          HB1       PRO  39 -19.515   6.545   6.627
  334   1HG   PRO  39          HG2       PRO  39 -19.411   9.422   5.834
  335   2HG   PRO  39          HG1       PRO  39 -19.292   8.696   7.447
  336   1HD   PRO  39          HD2       PRO  39 -17.103   9.509   5.953
  337   2HD   PRO  39          HD1       PRO  39 -17.028   8.268   7.225
  338    H    PHE  40           HN       PHE  40 -17.540   8.947   3.508
  339    HA   PHE  40           HA       PHE  40 -19.663   9.525   1.700
  340   1HB   PHE  40          HB2       PHE  40 -16.842  10.061   0.827
  341   2HB   PHE  40          HB1       PHE  40 -18.244  11.127   0.804
  342    HD1  PHE  40           HD1      PHE  40 -15.188  11.152   2.080
  343    HD2  PHE  40           HD2      PHE  40 -19.221  11.005   3.564
  344    HE1  PHE  40           HE1      PHE  40 -14.447  12.190   4.207
  345    HE2  PHE  40           HE2      PHE  40 -18.471  12.034   5.694
  346    HZ   PHE  40           HZ       PHE  40 -16.087  12.628   6.013
  347    H    TYR  41           HN       TYR  41 -16.845   7.431   1.433
  348    HA   TYR  41           HA       TYR  41 -17.068   6.791  -1.332
  349   1HB   TYR  41          HB2       TYR  41 -15.893   5.275   1.005
  350   2HB   TYR  41          HB1       TYR  41 -15.713   4.768  -0.677
  351    HD1  TYR  41           HD1      TYR  41 -14.149   5.833  -2.124
  352    HD2  TYR  41           HD2      TYR  41 -15.082   7.571   1.683
  353    HE1  TYR  41           HE1      TYR  41 -12.304   7.457  -2.424
  354    HE2  TYR  41           HE2      TYR  41 -13.238   9.200   1.403
  355    HH   TYR  41           HH       TYR  41 -11.344   9.316  -1.613
  356    H    ARG  42           HN       ARG  42 -18.785   5.512   1.475
  357    HA   ARG  42           HA       ARG  42 -19.696   3.081   0.310
  358   1HB   ARG  42          HB2       ARG  42 -21.010   4.928   2.321
  359   2HB   ARG  42          HB1       ARG  42 -21.677   3.360   1.872
  360   1HG   ARG  42          HG2       ARG  42 -19.595   2.260   2.599
  361   2HG   ARG  42          HG1       ARG  42 -18.924   3.828   3.053
  362   1HD   ARG  42          HD2       ARG  42 -20.748   4.148   4.678
  363   2HD   ARG  42          HD1       ARG  42 -21.442   2.595   4.215
  364    HE   ARG  42           HE       ARG  42 -18.834   1.985   4.964
  365   1HH1  ARG  42          HH21      ARG  42 -21.527   3.637   6.346
  366   2HH1  ARG  42          HH22      ARG  42 -21.133   3.194   7.974
  367   1HH2  ARG  42          HH11      ARG  42 -18.307   1.395   7.083
  368   2HH2  ARG  42          HH12      ARG  42 -19.311   1.927   8.390
  369    H    GLU  43           HN       GLU  43 -20.987   6.393   0.106
  370    HA   GLU  43           HA       GLU  43 -23.365   5.740  -1.320
  371   1HB   GLU  43          HB2       GLU  43 -21.672   8.247  -1.377
  372   2HB   GLU  43          HB1       GLU  43 -23.283   8.122  -2.085
  373   1HG   GLU  43          HG2       GLU  43 -24.212   7.525   0.121
  374   2HG   GLU  43          HG1       GLU  43 -22.604   7.654   0.833
  375    H    ASN  44           HN       ASN  44 -20.119   6.439  -2.382
  376    HA   ASN  44           HA       ASN  44 -20.844   5.612  -5.180
  377   1HB   ASN  44          HB2       ASN  44 -18.654   7.436  -4.138
  378   2HB   ASN  44          HB1       ASN  44 -18.741   6.867  -5.806
  379   1HD2  ASN  44          HD21      ASN  44 -19.061   9.676  -4.761
  380   2HD2  ASN  44          HD22      ASN  44 -20.589  10.183  -5.301
  381    H    LYS  45           HN       LYS  45 -20.357   3.432  -5.206
  382    HA   LYS  45           HA       LYS  45 -17.858   2.502  -3.892
  383   1HB   LYS  45          HB2       LYS  45 -20.248   1.048  -5.027
  384   2HB   LYS  45          HB1       LYS  45 -18.802   0.228  -4.432
  385   1HG   LYS  45          HG2       LYS  45 -19.098   1.165  -2.221
  386   2HG   LYS  45          HG1       LYS  45 -20.409   2.198  -2.784
  387   1HD   LYS  45          HD2       LYS  45 -21.405   0.312  -1.657
  388   2HD   LYS  45          HD1       LYS  45 -21.694   0.115  -3.385
  389   1HE   LYS  45          HE2       LYS  45 -20.039  -1.567  -3.585
  390   2HE   LYS  45          HE1       LYS  45 -19.299  -1.142  -2.042
  391   1HZ   LYS  45          HZ1       LYS  45 -20.677  -2.488  -0.978
  392   2HZ   LYS  45          HZ2       LYS  45 -21.215  -3.063  -2.483
  393   3HZ   LYS  45          HZ3       LYS  45 -22.040  -1.795  -1.713
  394    H    GLN  46           HN       GLN  46 -19.341   2.790  -7.076
  395    HA   GLN  46           HA       GLN  46 -17.080   1.369  -8.344
  396   1HB   GLN  46          HB2       GLN  46 -19.578   2.685  -9.431
  397   2HB   GLN  46          HB1       GLN  46 -18.344   1.952 -10.456
  398   1HG   GLN  46          HG2       GLN  46 -18.689  -0.213  -9.460
  399   2HG   GLN  46          HG1       GLN  46 -19.727   0.466  -8.206
  400   1HE2  GLN  46          HE21      GLN  46 -20.673  -1.614  -9.943
  401   2HE2  GLN  46          HE22      GLN  46 -21.888  -0.966 -10.935
  402    H    GLY  47           HN       GLY  47 -15.426   2.360  -9.390
  403   1HA   GLY  47          HA2       GLY  47 -14.596   4.273 -10.735
  404   2HA   GLY  47          HA1       GLY  47 -15.467   5.348  -9.646
  405    H    TRP  48           HN       TRP  48 -14.767   4.928  -7.205
  406    HA   TRP  48           HA       TRP  48 -11.933   5.519  -7.119
  407   1HB   TRP  48          HB2       TRP  48 -12.226   5.925  -4.807
  408   2HB   TRP  48          HB1       TRP  48 -13.724   6.446  -5.567
  409    HD1  TRP  48           HD1      TRP  48 -15.914   5.015  -5.104
  410    HE1  TRP  48           HE1      TRP  48 -16.475   3.298  -3.277
  411    HE3  TRP  48           HE3      TRP  48 -11.217   3.951  -3.393
  412    HZ2  TRP  48           HZ2      TRP  48 -15.138   1.670  -1.359
  413    HZ3  TRP  48           HZ3      TRP  48 -10.896   2.306  -1.573
  414    HH2  TRP  48           HH2      TRP  48 -12.851   1.165  -0.556
  415    H    GLN  49           HN       GLN  49 -13.870   2.664  -6.318
  416    HA   GLN  49           HA       GLN  49 -11.843   1.148  -5.012
  417   1HB   GLN  49          HB2       GLN  49 -14.180   0.445  -5.005
  418   2HB   GLN  49          HB1       GLN  49 -14.156   0.237  -6.755
  419   1HG   GLN  49          HG2       GLN  49 -12.587  -1.586  -6.592
  420   2HG   GLN  49          HG1       GLN  49 -12.334  -1.284  -4.874
  421   1HE2  GLN  49          HE21      GLN  49 -14.597  -2.623  -7.241
  422   2HE2  GLN  49          HE22      GLN  49 -15.618  -3.368  -6.109
  423    H    ASN  50           HN       ASN  50 -12.693   1.320  -8.485
  424    HA   ASN  50           HA       ASN  50 -10.684  -0.578  -9.289
  425   1HB   ASN  50          HB2       ASN  50 -12.170   1.566 -10.822
  426   2HB   ASN  50          HB1       ASN  50 -11.053   0.431 -11.582
  427   1HD2  ASN  50          HD21      ASN  50 -13.849   0.440 -12.244
  428   2HD2  ASN  50          HD22      ASN  50 -14.531  -1.011 -11.688
  429    H    SER  51           HN       SER  51 -10.692   2.956  -8.989
  430    HA   SER  51           HA       SER  51  -8.219   3.470 -10.288
  431   1HB   SER  51          HB2       SER  51  -9.579   4.896  -7.987
  432   2HB   SER  51          HB1       SER  51  -8.152   5.517  -8.814
  433    HG   SER  51           HG       SER  51 -10.197   4.693 -10.469
  434    H    ILE  52           HN       ILE  52  -8.909   2.539  -6.928
  435    HA   ILE  52           HA       ILE  52  -6.292   2.897  -5.891
  436    HB   ILE  52           HB       ILE  52  -8.418   0.866  -5.160
  437   1HG1  ILE  52          HG12      ILE  52  -8.877   3.425  -5.008
  438   2HG1  ILE  52          HG11      ILE  52  -9.252   2.420  -3.616
  439   1HG2  ILE  52          HG21      ILE  52  -7.155   0.989  -2.896
  440   2HG2  ILE  52          HG22      ILE  52  -5.808   1.604  -3.853
  441   3HG2  ILE  52          HG23      ILE  52  -6.470   0.004  -4.186
  442   1HD1  ILE  52          HD11      ILE  52  -6.651   3.957  -3.921
  443   2HD1  ILE  52          HD12      ILE  52  -7.223   3.109  -2.486
  444   3HD1  ILE  52          HD13      ILE  52  -8.055   4.555  -3.046
  445    H    ARG  53           HN       ARG  53  -7.753  -0.027  -7.373
  446    HA   ARG  53           HA       ARG  53  -5.411  -1.658  -7.063
  447   1HB   ARG  53          HB2       ARG  53  -7.236  -2.038  -9.425
  448   2HB   ARG  53          HB1       ARG  53  -6.562  -3.244  -8.328
  449   1HG   ARG  53          HG2       ARG  53  -8.067  -1.968  -6.545
  450   2HG   ARG  53          HG1       ARG  53  -8.968  -1.484  -7.974
  451   1HD   ARG  53          HD2       ARG  53  -8.617  -4.212  -6.789
  452   2HD   ARG  53          HD1       ARG  53 -10.067  -3.458  -7.434
  453    HE   ARG  53           HE       ARG  53  -8.278  -5.196  -8.837
  454   1HH1  ARG  53          HH21      ARG  53  -9.919  -2.191  -9.263
  455   2HH1  ARG  53          HH22      ARG  53  -9.861  -2.265 -10.991
  456   1HH2  ARG  53          HH11      ARG  53  -8.218  -5.317 -11.065
  457   2HH2  ARG  53          HH12      ARG  53  -8.903  -4.040 -12.013
  458    H    HIS  54           HN       HIS  54  -6.520   0.445  -9.715
  459    HA   HIS  54           HA       HIS  54  -4.501  -0.231 -11.592
  460   1HB   HIS  54          HB2       HIS  54  -6.581   1.186 -11.986
  461   2HB   HIS  54          HB1       HIS  54  -5.696   2.528 -11.260
  462    HD1  HIS  54           HD1      HIS  54  -4.212  -0.102 -13.551
  463    HD2  HIS  54           HD2      HIS  54  -5.118   3.968 -13.593
  464    HE1  HIS  54           HE1      HIS  54  -3.215   0.831 -15.682
  465    H    ASN  55           HN       ASN  55  -4.537   2.303  -9.080
  466    HA   ASN  55           HA       ASN  55  -1.934   3.329  -9.710
  467   1HB   ASN  55          HB2       ASN  55  -3.558   3.388  -7.154
  468   2HB   ASN  55          HB1       ASN  55  -2.012   4.218  -7.337
  469   1HD2  ASN  55          HD21      ASN  55  -5.285   4.785  -7.547
  470   2HD2  ASN  55          HD22      ASN  55  -5.277   6.057  -8.671
  471    H    LEU  56           HN       LEU  56  -3.022   0.766  -7.487
  472    HA   LEU  56           HA       LEU  56  -0.521   0.327  -6.240
  473   1HB   LEU  56          HB2       LEU  56  -2.887  -1.452  -6.759
  474   2HB   LEU  56          HB1       LEU  56  -1.444  -2.096  -5.983
  475    HG   LEU  56           HG       LEU  56  -2.688   0.446  -4.933
  476   1HD1  LEU  56          HD11      LEU  56  -3.970  -1.019  -3.326
  477   2HD1  LEU  56          HD12      LEU  56  -3.584  -2.393  -4.363
  478   3HD1  LEU  56          HD13      LEU  56  -4.568  -1.069  -4.983
  479   1HD2  LEU  56          HD21      LEU  56  -1.664  -0.261  -2.855
  480   2HD2  LEU  56          HD22      LEU  56  -0.445  -0.430  -4.113
  481   3HD2  LEU  56          HD23      LEU  56  -1.296  -1.851  -3.518
  482    H    SER  57           HN       SER  57  -1.864  -1.210  -9.182
  483    HA   SER  57           HA       SER  57   0.433  -2.867  -9.636
  484   1HB   SER  57          HB2       SER  57  -1.661  -3.332 -10.780
  485   2HB   SER  57          HB1       SER  57  -1.619  -1.758 -11.574
  486    HG   SER  57           HG       SER  57  -0.708  -3.886 -12.587
  487    H    LEU  58           HN       LEU  58  -0.439   0.379 -10.847
  488    HA   LEU  58           HA       LEU  58   1.940   0.692 -12.442
  489   1HB   LEU  58          HB2       LEU  58   0.054   2.701 -11.192
  490   2HB   LEU  58          HB1       LEU  58   1.376   3.157 -12.261
  491    HG   LEU  58           HG       LEU  58  -0.643   1.086 -13.134
  492   1HD1  LEU  58          HD11      LEU  58  -1.770   3.099 -14.311
  493   2HD1  LEU  58          HD12      LEU  58  -0.953   4.089 -13.104
  494   3HD1  LEU  58          HD13      LEU  58  -2.109   2.858 -12.599
  495   1HD2  LEU  58          HD21      LEU  58  -0.041   2.091 -15.379
  496   2HD2  LEU  58          HD22      LEU  58   1.305   1.306 -14.561
  497   3HD2  LEU  58          HD23      LEU  58   1.174   3.063 -14.556
  498    H    ASN  59           HN       ASN  59   1.100   1.679  -9.119
  499    HA   ASN  59           HA       ASN  59   3.804   2.768  -8.699
  500   1HB   ASN  59          HB2       ASN  59   1.469   2.374  -6.799
  501   2HB   ASN  59          HB1       ASN  59   2.981   3.181  -6.381
  502   1HD2  ASN  59          HD21      ASN  59  -0.138   3.812  -7.446
  503   2HD2  ASN  59          HD22      ASN  59   0.131   5.315  -8.186
  504    H    GLU  60           HN       GLU  60   5.360   1.229  -8.575
  505    HA   GLU  60           HA       GLU  60   4.805  -1.361  -7.262
  506   1HB   GLU  60          HB2       GLU  60   7.266  -0.294  -8.678
  507   2HB   GLU  60          HB1       GLU  60   7.089  -1.938  -8.058
  508   1HG   GLU  60          HG2       GLU  60   5.125  -2.278  -9.516
  509   2HG   GLU  60          HG1       GLU  60   5.303  -0.639 -10.141
  510    H    CYS  61           HN       CYS  61   5.364   1.534  -6.038
  511    HA   CYS  61           HA       CYS  61   7.712   1.232  -4.426
  512   1HB   CYS  61          HB2       CYS  61   5.214   2.904  -4.070
  513   2HB   CYS  61          HB1       CYS  61   6.607   3.007  -2.993
  514    HG   CYS  61           HG       CYS  61   7.799   3.368  -5.613
  515    H    PHE  62           HN       PHE  62   4.449   0.007  -4.088
  516    HA   PHE  62           HA       PHE  62   4.777  -0.634  -1.252
  517   1HB   PHE  62          HB2       PHE  62   2.709  -1.570  -3.265
  518   2HB   PHE  62          HB1       PHE  62   2.638  -1.849  -1.525
  519    HD1  PHE  62           HD1      PHE  62   2.067   0.531  -4.207
  520    HD2  PHE  62           HD2      PHE  62   2.516   0.120   0.046
  521    HE1  PHE  62           HE1      PHE  62   1.045   2.767  -3.882
  522    HE2  PHE  62           HE2      PHE  62   1.493   2.357   0.370
  523    HZ   PHE  62           HZ       PHE  62   0.757   3.680  -1.593
  524    H    VAL  63           HN       VAL  63   5.148  -2.725  -0.401
  525    HA   VAL  63           HA       VAL  63   6.682  -4.496  -2.210
  526    HB   VAL  63           HB       VAL  63   6.183  -4.766   0.771
  527   1HG1  VAL  63          HG11      VAL  63   6.992  -6.791  -0.427
  528   2HG1  VAL  63          HG12      VAL  63   8.194  -6.162   0.701
  529   3HG1  VAL  63          HG13      VAL  63   8.365  -5.861  -1.029
  530   1HG2  VAL  63          HG21      VAL  63   7.257  -2.573   0.113
  531   2HG2  VAL  63          HG22      VAL  63   8.562  -3.499  -0.626
  532   3HG2  VAL  63          HG23      VAL  63   8.285  -3.598   1.111
  533    H    LYS  64           HN       LYS  64   5.614  -6.118  -3.236
  534    HA   LYS  64           HA       LYS  64   2.998  -7.039  -2.183
  535   1HB   LYS  64          HB2       LYS  64   4.490  -7.632  -4.757
  536   2HB   LYS  64          HB1       LYS  64   2.911  -8.306  -4.347
  537   1HG   LYS  64          HG2       LYS  64   1.925  -6.091  -4.244
  538   2HG   LYS  64          HG1       LYS  64   3.501  -5.337  -4.455
  539   1HD   LYS  64          HD2       LYS  64   2.552  -5.249  -6.614
  540   2HD   LYS  64          HD1       LYS  64   3.632  -6.637  -6.683
  541   1HE   LYS  64          HE2       LYS  64   0.709  -6.960  -5.978
  542   2HE   LYS  64          HE1       LYS  64   1.261  -6.930  -7.650
  543   1HZ   LYS  64          HZ1       LYS  64   2.983  -8.635  -6.388
  544   2HZ   LYS  64          HZ2       LYS  64   1.691  -9.075  -7.400
  545   3HZ   LYS  64          HZ3       LYS  64   1.472  -9.015  -5.717
  546    H    VAL  65           HN       VAL  65   3.413  -8.417  -0.489
  547    HA   VAL  65           HA       VAL  65   5.391 -10.612  -0.864
  548    HB   VAL  65           HB       VAL  65   4.560 -10.942   1.691
  549   1HG1  VAL  65          HG11      VAL  65   6.507  -8.809   0.765
  550   2HG1  VAL  65          HG12      VAL  65   6.878 -10.518   0.983
  551   3HG1  VAL  65          HG13      VAL  65   6.460  -9.522   2.377
  552   1HG2  VAL  65          HG21      VAL  65   4.414  -7.942   1.461
  553   2HG2  VAL  65          HG22      VAL  65   3.791  -8.997   2.729
  554   3HG2  VAL  65          HG23      VAL  65   2.961  -8.895   1.180
  555    HA   PRO  66           HA       PRO  66   1.653 -13.080  -1.615
  556   1HB   PRO  66          HB2       PRO  66   2.800 -15.381  -2.402
  557   2HB   PRO  66          HB1       PRO  66   2.892 -13.923  -3.414
  558   1HG   PRO  66          HG2       PRO  66   4.941 -15.054  -1.550
  559   2HG   PRO  66          HG1       PRO  66   5.148 -14.435  -3.199
  560   1HD   PRO  66          HD2       PRO  66   5.689 -12.938  -0.945
  561   2HD   PRO  66          HD1       PRO  66   5.213 -12.228  -2.504
  562    H    ARG  67           HN       ARG  67   0.838 -15.306  -0.873
  563    HA   ARG  67           HA       ARG  67   1.347 -15.601   1.998
  564   1HB   ARG  67          HB2       ARG  67  -0.583 -16.750   0.006
  565   2HB   ARG  67          HB1       ARG  67  -0.330 -17.628   1.513
  566   1HG   ARG  67          HG2       ARG  67  -1.003 -15.740   2.822
  567   2HG   ARG  67          HG1       ARG  67  -1.001 -14.677   1.419
  568   1HD   ARG  67          HD2       ARG  67  -2.956 -15.619   0.548
  569   2HD   ARG  67          HD1       ARG  67  -2.751 -17.123   1.429
  570    HE   ARG  67           HE       ARG  67  -4.182 -14.756   2.288
  571   1HH1  ARG  67          HH21      ARG  67  -2.091 -17.243   3.451
  572   2HH1  ARG  67          HH22      ARG  67  -2.574 -17.045   5.103
  573   1HH2  ARG  67          HH11      ARG  67  -4.826 -14.503   4.420
  574   2HH2  ARG  67          HH12      ARG  67  -4.120 -15.498   5.650
  575    H    ASP  68           HN       ASP  68   1.944 -17.710   2.938
  576    HA   ASP  68           HA       ASP  68   4.164 -18.919   1.462
  577   1HB   ASP  68          HB2       ASP  68   4.034 -18.424   4.008
  578   2HB   ASP  68          HB1       ASP  68   3.092 -19.911   4.103
  579    H    ASP  69           HN       ASP  69   4.334 -21.359   1.429
  580    HA   ASP  69           HA       ASP  69   2.187 -22.492  -0.072
  581   1HB   ASP  69          HB2       ASP  69   4.567 -23.744   1.314
  582   2HB   ASP  69          HB1       ASP  69   3.439 -24.672   0.323
  583    H    LYS  70           HN       LYS  70   3.030 -22.705   3.364
  584    HA   LYS  70           HA       LYS  70   1.246 -24.799   4.075
  585   1HB   LYS  70          HB2       LYS  70   2.214 -22.384   5.627
  586   2HB   LYS  70          HB1       LYS  70   1.271 -23.683   6.356
  587   1HG   LYS  70          HG2       LYS  70   3.009 -25.316   5.656
  588   2HG   LYS  70          HG1       LYS  70   3.946 -23.992   4.967
  589   1HD   LYS  70          HD2       LYS  70   4.115 -22.930   7.178
  590   2HD   LYS  70          HD1       LYS  70   3.169 -24.240   7.887
  591   1HE   LYS  70          HE2       LYS  70   4.875 -25.841   7.460
  592   2HE   LYS  70          HE1       LYS  70   5.736 -24.753   6.371
  593   1HZ   LYS  70          HZ1       LYS  70   5.299 -24.130   9.233
  594   2HZ   LYS  70          HZ2       LYS  70   6.388 -23.395   8.157
  595   3HZ   LYS  70          HZ3       LYS  70   6.658 -24.986   8.691
  596    H    LYS  71           HN       LYS  71   0.708 -21.298   3.757
  597    HA   LYS  71           HA       LYS  71  -2.144 -21.617   4.461
  598   1HB   LYS  71          HB2       LYS  71  -0.561 -19.179   3.593
  599   2HB   LYS  71          HB1       LYS  71  -2.231 -19.159   4.159
  600   1HG   LYS  71          HG2       LYS  71  -1.625 -19.767   6.356
  601   2HG   LYS  71          HG1       LYS  71  -0.040 -20.355   5.854
  602   1HD   LYS  71          HD2       LYS  71   0.665 -18.063   5.323
  603   2HD   LYS  71          HD1       LYS  71  -0.929 -17.456   5.773
  604   1HE   LYS  71          HE2       LYS  71   0.607 -19.086   7.779
  605   2HE   LYS  71          HE1       LYS  71   1.062 -17.403   7.521
  606   1HZ   LYS  71          HZ1       LYS  71  -1.751 -18.178   7.978
  607   2HZ   LYS  71          HZ2       LYS  71  -1.025 -16.652   8.162
  608   3HZ   LYS  71          HZ3       LYS  71  -0.692 -17.894   9.274
  609    HA   PRO  72           HA       PRO  72  -3.310 -21.951   0.145
  610   1HB   PRO  72          HB2       PRO  72  -5.911 -21.158   0.244
  611   2HB   PRO  72          HB1       PRO  72  -5.369 -22.694   0.949
  612   1HG   PRO  72          HG2       PRO  72  -5.910 -20.086   2.305
  613   2HG   PRO  72          HG1       PRO  72  -6.359 -21.726   2.805
  614   1HD   PRO  72          HD2       PRO  72  -4.193 -20.407   3.847
  615   2HD   PRO  72          HD1       PRO  72  -4.262 -22.177   3.693
  616    H    GLY  73           HN       GLY  73  -2.916 -20.552  -1.550
  617   1HA   GLY  73          HA2       GLY  73  -2.340 -17.827  -1.221
  618   2HA   GLY  73          HA1       GLY  73  -2.735 -18.560  -2.771
  619    H    LYS  74           HN       LYS  74  -4.226 -17.107   0.125
  620    HA   LYS  74           HA       LYS  74  -6.839 -16.868  -1.083
  621   1HB   LYS  74          HB2       LYS  74  -5.566 -15.460   1.272
  622   2HB   LYS  74          HB1       LYS  74  -7.238 -15.197   0.776
  623   1HG   LYS  74          HG2       LYS  74  -7.778 -17.531   1.137
  624   2HG   LYS  74          HG1       LYS  74  -6.089 -17.918   1.439
  625   1HD   LYS  74          HD2       LYS  74  -7.330 -17.729   3.559
  626   2HD   LYS  74          HD1       LYS  74  -6.096 -16.475   3.433
  627   1HE   LYS  74          HE2       LYS  74  -8.491 -15.796   4.211
  628   2HE   LYS  74          HE1       LYS  74  -7.673 -14.784   3.024
  629   1HZ   LYS  74          HZ1       LYS  74  -9.385 -17.016   2.148
  630   2HZ   LYS  74          HZ2       LYS  74  -8.961 -15.598   1.312
  631   3HZ   LYS  74          HZ3       LYS  74 -10.083 -15.533   2.588
  632    H    GLY  75           HN       GLY  75  -4.064 -14.793  -0.775
  633   1HA   GLY  75          HA2       GLY  75  -4.533 -13.363  -3.193
  634   2HA   GLY  75          HA1       GLY  75  -5.155 -12.398  -1.853
  635    H    SER  76           HN       SER  76  -3.246 -11.047  -2.906
  636    HA   SER  76           HA       SER  76  -0.610 -11.844  -1.766
  637   1HB   SER  76          HB2       SER  76   0.163  -9.794  -3.080
  638   2HB   SER  76          HB1       SER  76  -0.453 -11.132  -4.045
  639    HG   SER  76           HG       SER  76  -1.742  -8.718  -3.319
  640    H    TYR  77           HN       TYR  77   0.349 -10.669  -0.107
  641    HA   TYR  77           HA       TYR  77  -1.404  -8.787   1.339
  642   1HB   TYR  77          HB2       TYR  77   1.221 -10.139   1.965
  643   2HB   TYR  77          HB1       TYR  77   0.640  -8.806   2.958
  644    HD1  TYR  77           HD1      TYR  77   0.739 -12.261   2.784
  645    HD2  TYR  77           HD2      TYR  77  -2.053  -9.074   3.502
  646    HE1  TYR  77           HE1      TYR  77  -0.718 -13.816   4.041
  647    HE2  TYR  77           HE2      TYR  77  -3.512 -10.636   4.749
  648    HH   TYR  77           HH       TYR  77  -2.547 -14.017   5.296
  649    H    TRP  78           HN       TRP  78  -0.925  -6.607   1.668
  650    HA   TRP  78           HA       TRP  78   1.261  -5.463  -0.047
  651   1HB   TRP  78          HB2       TRP  78  -1.416  -4.305   0.790
  652   2HB   TRP  78          HB1       TRP  78  -0.171  -3.406  -0.079
  653    HD1  TRP  78           HD1      TRP  78  -2.642  -6.288  -0.495
  654    HE1  TRP  78           HE1      TRP  78  -2.901  -6.807  -3.005
  655    HE3  TRP  78           HE3      TRP  78   0.978  -3.237  -2.406
  656    HZ2  TRP  78           HZ2      TRP  78  -1.726  -6.032  -5.498
  657    HZ3  TRP  78           HZ3      TRP  78   1.385  -3.144  -4.847
  658    HH2  TRP  78           HH2      TRP  78   0.039  -4.533  -6.395
  659    H    THR  79           HN       THR  79   2.818  -4.320   1.017
  660    HA   THR  79           HA       THR  79   2.236  -2.954   3.547
  661    HB   THR  79           HB       THR  79   2.670  -5.344   4.210
  662    HG1  THR  79           HG1      THR  79   3.982  -3.101   5.039
  663   1HG2  THR  79          HG21      THR  79   4.403  -5.597   2.294
  664   2HG2  THR  79          HG22      THR  79   4.760  -6.366   3.840
  665   3HG2  THR  79          HG23      THR  79   5.533  -4.838   3.417
  666    H    LEU  80           HN       LEU  80   3.985  -1.506   4.148
  667    HA   LEU  80           HA       LEU  80   5.752  -0.846   1.847
  668   1HB   LEU  80          HB2       LEU  80   5.031   0.635   4.392
  669   2HB   LEU  80          HB1       LEU  80   6.201   1.237   3.221
  670    HG   LEU  80           HG       LEU  80   3.404   0.471   2.367
  671   1HD1  LEU  80          HD11      LEU  80   4.362   3.076   3.573
  672   2HD1  LEU  80          HD12      LEU  80   3.002   2.082   4.093
  673   3HD1  LEU  80          HD13      LEU  80   2.916   2.967   2.570
  674   1HD2  LEU  80          HD21      LEU  80   5.562   2.312   1.279
  675   2HD2  LEU  80          HD22      LEU  80   3.919   2.263   0.646
  676   3HD2  LEU  80          HD23      LEU  80   4.943   0.838   0.536
  677    H    ASP  81           HN       ASP  81   7.516  -2.228   1.982
  678    HA   ASP  81           HA       ASP  81   9.251  -1.889   4.374
  679   1HB   ASP  81          HB2       ASP  81   8.355  -4.528   3.209
  680   2HB   ASP  81          HB1       ASP  81   9.807  -4.374   4.197
  681    HA   PRO  82           HA       PRO  82  11.427  -1.213   0.324
  682   1HB   PRO  82          HB2       PRO  82  12.892   0.731   2.055
  683   2HB   PRO  82          HB1       PRO  82  12.178   0.969   0.448
  684   1HG   PRO  82          HG2       PRO  82  11.042   2.003   2.619
  685   2HG   PRO  82          HG1       PRO  82  10.058   1.331   1.304
  686   1HD   PRO  82          HD2       PRO  82  10.750   0.089   3.957
  687   2HD   PRO  82          HD1       PRO  82   9.199   0.079   3.082
  688    H    ASP  83           HN       ASP  83  14.204  -0.278   1.130
  689    HA   ASP  83           HA       ASP  83  15.313  -2.977   1.658
  690   1HB   ASP  83          HB2       ASP  83  17.442  -2.011   0.959
  691   2HB   ASP  83          HB1       ASP  83  16.201  -1.586  -0.221
  692    H    SER  84           HN       SER  84  14.005  -1.423   3.807
  693    HA   SER  84           HA       SER  84  15.718  -0.059   5.535
  694   1HB   SER  84          HB2       SER  84  13.535  -0.156   6.337
  695   2HB   SER  84          HB1       SER  84  13.366  -1.867   5.953
  696    HG   SER  84           HG       SER  84  14.653  -2.360   7.708
  697    H    TYR  85           HN       TYR  85  17.840  -0.996   5.328
  698    HA   TYR  85           HA       TYR  85  18.461  -3.730   5.837
  699   1HB   TYR  85          HB2       TYR  85  19.979  -1.999   4.792
  700   2HB   TYR  85          HB1       TYR  85  20.244  -1.350   6.409
  701    HD1  TYR  85           HD1      TYR  85  20.417  -4.532   4.451
  702    HD2  TYR  85           HD2      TYR  85  21.908  -2.285   7.795
  703    HE1  TYR  85           HE1      TYR  85  22.143  -6.269   4.849
  704    HE2  TYR  85           HE2      TYR  85  23.632  -4.022   8.193
  705    HH   TYR  85           HH       TYR  85  24.787  -5.912   6.399
  706    H    ASN  86           HN       ASN  86  18.586  -0.905   8.029
  707    HA   ASN  86           HA       ASN  86  18.024  -2.711  10.316
  708   1HB   ASN  86          HB2       ASN  86  20.540  -1.110   9.913
  709   2HB   ASN  86          HB1       ASN  86  19.918  -1.327  11.548
  710   1HD2  ASN  86          HD21      ASN  86  20.535  -3.370   8.626
  711   2HD2  ASN  86          HD22      ASN  86  21.150  -4.686   9.504
  712    H    MET  87           HN       MET  87  16.735  -0.456   8.761
  713    HA   MET  87           HA       MET  87  16.680   1.865  10.478
  714   1HB   MET  87          HB2       MET  87  14.543   0.932   8.535
  715   2HB   MET  87          HB1       MET  87  14.784   2.573   9.133
  716   1HG   MET  87          HG2       MET  87  16.800   1.014   7.490
  717   2HG   MET  87          HG1       MET  87  15.730   2.262   6.853
  718   1HE   MET  87          HE1       MET  87  19.723   3.215   7.492
  719   2HE   MET  87          HE2       MET  87  18.635   2.623   6.239
  720   3HE   MET  87          HE3       MET  87  19.078   1.572   7.582
  721    H    PHE  88           HN       PHE  88  15.767   1.943  12.471
  722    HA   PHE  88           HA       PHE  88  13.755  -0.115  13.230
  723   1HB   PHE  88          HB2       PHE  88  15.271   1.919  14.892
  724   2HB   PHE  88          HB1       PHE  88  14.160   0.710  15.536
  725    HD1  PHE  88           HD1      PHE  88  14.723  -1.677  15.490
  726    HD2  PHE  88           HD2      PHE  88  17.453   1.291  14.015
  727    HE1  PHE  88           HE1      PHE  88  16.553  -3.350  15.513
  728    HE2  PHE  88           HE2      PHE  88  19.284  -0.382  14.035
  729    HZ   PHE  88           HZ       PHE  88  18.833  -2.703  14.785
  730    H    GLU  89           HN       GLU  89  14.099   3.318  12.658
  731    HA   GLU  89           HA       GLU  89  11.154   3.633  12.984
  732   1HB   GLU  89          HB2       GLU  89  13.253   5.456  14.207
  733   2HB   GLU  89          HB1       GLU  89  11.524   5.799  14.151
  734   1HG   GLU  89          HG2       GLU  89  11.064   3.754  15.443
  735   2HG   GLU  89          HG1       GLU  89  12.791   3.400  15.506
  736    H    ASN  90           HN       ASN  90  10.538   5.899  12.059
  737    HA   ASN  90           HA       ASN  90  11.086   6.061   9.351
  738   1HB   ASN  90          HB2       ASN  90  10.512   8.309  11.298
  739   2HB   ASN  90          HB1       ASN  90  10.541   8.534   9.550
  740   1HD2  ASN  90          HD21      ASN  90   9.430   5.528   9.541
  741   2HD2  ASN  90          HD22      ASN  90   7.766   5.779   9.750
  742    H    GLY  91           HN       GLY  91  12.375   7.768   8.158
  743   1HA   GLY  91          HA2       GLY  91  15.151   7.515   8.802
  744   2HA   GLY  91          HA1       GLY  91  14.489   8.587   7.570
  745    H    SER  92           HN       SER  92  14.134   8.510  11.134
  746    HA   SER  92           HA       SER  92  14.291  11.398  11.315
  747   1HB   SER  92          HB2       SER  92  13.075  10.063  12.995
  748   2HB   SER  92          HB1       SER  92  14.575   9.264  13.456
  749    HG   SER  92           HG       SER  92  14.289  10.934  14.869
  750    H    PHE  93           HN       PHE  93  16.587   8.923  10.984
  751    HA   PHE  93           HA       PHE  93  18.782   9.837  12.502
  752   1HB   PHE  93          HB2       PHE  93  18.414   8.182  10.054
  753   2HB   PHE  93          HB1       PHE  93  20.026   8.856  10.270
  754    HD1  PHE  93           HD1      PHE  93  18.015   6.086  11.029
  755    HD2  PHE  93           HD2      PHE  93  20.897   8.734  12.801
  756    HE1  PHE  93           HE1      PHE  93  18.543   4.364  12.736
  757    HE2  PHE  93           HE2      PHE  93  21.428   7.009  14.509
  758    HZ   PHE  93           HZ       PHE  93  20.249   4.826  14.475
  759    H    LEU  94           HN       LEU  94  20.823  10.784  11.440
  760    HA   LEU  94           HA       LEU  94  20.198  13.452  10.572
  761   1HB   LEU  94          HB2       LEU  94  22.756  11.872  10.827
  762   2HB   LEU  94          HB1       LEU  94  22.758  13.499  10.148
  763    HG   LEU  94           HG       LEU  94  21.780  14.404  12.181
  764   1HD1  LEU  94          HD11      LEU  94  21.553  12.773  14.163
  765   2HD1  LEU  94          HD12      LEU  94  21.591  11.489  12.955
  766   3HD1  LEU  94          HD13      LEU  94  20.306  12.698  12.921
  767   1HD2  LEU  94          HD21      LEU  94  24.192  14.228  12.219
  768   2HD2  LEU  94          HD22      LEU  94  24.110  12.525  12.667
  769   3HD2  LEU  94          HD23      LEU  94  23.601  13.763  13.814
  Start of MODEL   19
    1   1H    MET   1          HT1       MET   1 -23.386  16.234   6.689
    2   2H    MET   1          HT2       MET   1 -22.469  15.201   5.701
    3   3H    MET   1          HT3       MET   1 -23.454  16.396   5.003
    4    HA   MET   1           HA       MET   1 -21.904  17.954   5.190
    5   1HB   MET   1          HB2       MET   1 -22.525  17.840   7.706
    6   2HB   MET   1          HB1       MET   1 -21.043  16.904   7.886
    7   1HG   MET   1          HG2       MET   1 -19.742  18.757   6.910
    8   2HG   MET   1          HG1       MET   1 -21.223  19.683   6.677
    9   1HE   MET   1          HE1       MET   1 -18.283  18.970   8.951
   10   2HE   MET   1          HE2       MET   1 -19.306  17.573   9.269
   11   3HE   MET   1          HE3       MET   1 -18.992  18.735  10.553
   12    H    LEU   2           HN       LEU   2 -21.476  14.963   4.561
   13    HA   LEU   2           HA       LEU   2 -18.602  14.585   5.013
   14   1HB   LEU   2          HB2       LEU   2 -20.550  13.053   3.261
   15   2HB   LEU   2          HB1       LEU   2 -18.913  12.539   3.662
   16    HG   LEU   2           HG       LEU   2 -21.105  13.042   5.698
   17   1HD1  LEU   2          HD11      LEU   2 -21.147  10.562   5.899
   18   2HD1  LEU   2          HD12      LEU   2 -20.028  10.454   4.539
   19   3HD1  LEU   2          HD13      LEU   2 -21.647  11.110   4.298
   20   1HD2  LEU   2          HD21      LEU   2 -18.230  12.138   5.855
   21   2HD2  LEU   2          HD22      LEU   2 -19.389  11.569   7.055
   22   3HD2  LEU   2          HD23      LEU   2 -19.091  13.294   6.872
   23    H    VAL   3           HN       VAL   3 -16.981  14.850   3.457
   24    HA   VAL   3           HA       VAL   3 -17.750  15.699   0.718
   25    HB   VAL   3           HB       VAL   3 -16.146  17.639   0.879
   26   1HG1  VAL   3          HG11      VAL   3 -18.465  17.780   2.827
   27   2HG1  VAL   3          HG12      VAL   3 -18.645  17.852   1.075
   28   3HG1  VAL   3          HG13      VAL   3 -17.756  19.118   1.922
   29   1HG2  VAL   3          HG21      VAL   3 -15.485  18.436   3.070
   30   2HG2  VAL   3          HG22      VAL   3 -14.983  16.750   2.933
   31   3HG2  VAL   3          HG23      VAL   3 -16.422  17.169   3.864
   32    H    LYS   4           HN       LYS   4 -16.003  15.444  -0.801
   33    HA   LYS   4           HA       LYS   4 -14.387  13.209  -0.576
   34   1HB   LYS   4          HB2       LYS   4 -13.655  15.753  -2.047
   35   2HB   LYS   4          HB1       LYS   4 -13.034  14.137  -2.386
   36   1HG   LYS   4          HG2       LYS   4 -15.322  13.361  -2.902
   37   2HG   LYS   4          HG1       LYS   4 -15.945  14.970  -2.554
   38   1HD   LYS   4          HD2       LYS   4 -15.719  14.904  -4.919
   39   2HD   LYS   4          HD1       LYS   4 -14.335  15.833  -4.349
   40   1HE   LYS   4          HE2       LYS   4 -12.837  14.032  -4.702
   41   2HE   LYS   4          HE1       LYS   4 -14.142  12.850  -4.804
   42   1HZ   LYS   4          HZ1       LYS   4 -13.125  13.546  -6.970
   43   2HZ   LYS   4          HZ2       LYS   4 -13.833  15.073  -6.736
   44   3HZ   LYS   4          HZ3       LYS   4 -14.813  13.692  -6.880
   45    HA   PRO   5           HA       PRO   5 -11.799  14.718   2.897
   46   1HB   PRO   5          HB2       PRO   5 -10.315  12.211   2.172
   47   2HB   PRO   5          HB1       PRO   5 -10.810  12.806   3.770
   48   1HG   PRO   5          HG2       PRO   5 -12.134  10.840   2.571
   49   2HG   PRO   5          HG1       PRO   5 -12.987  12.080   3.509
   50   1HD   PRO   5          HD2       PRO   5 -12.821  11.752   0.537
   51   2HD   PRO   5          HD1       PRO   5 -14.149  12.382   1.536
   52    HA   PRO   6           HA       PRO   6  -8.431  16.507   0.539
   53   1HB   PRO   6          HB2       PRO   6  -6.775  17.303   2.551
   54   2HB   PRO   6          HB1       PRO   6  -8.332  18.095   2.240
   55   1HG   PRO   6          HG2       PRO   6  -7.648  16.022   4.282
   56   2HG   PRO   6          HG1       PRO   6  -8.609  17.501   4.463
   57   1HD   PRO   6          HD2       PRO   6  -9.758  15.041   4.137
   58   2HD   PRO   6          HD1       PRO   6 -10.514  16.538   3.546
   59    H    TYR   7           HN       TYR   7  -8.331  13.517   1.588
   60    HA   TYR   7           HA       TYR   7  -5.368  13.148   1.564
   61   1HB   TYR   7          HB2       TYR   7  -7.510  11.064   2.058
   62   2HB   TYR   7          HB1       TYR   7  -5.791  10.951   2.435
   63    HD1  TYR   7           HD1      TYR   7  -8.897  11.472   3.893
   64    HD2  TYR   7           HD2      TYR   7  -4.934  13.130   3.865
   65    HE1  TYR   7           HE1      TYR   7  -9.312  12.494   6.111
   66    HE2  TYR   7           HE2      TYR   7  -5.346  14.151   6.086
   67    HH   TYR   7           HH       TYR   7  -8.028  13.307   8.027
   68    H    SER   8           HN       SER   8  -4.370  12.183  -0.161
   69    HA   SER   8           HA       SER   8  -5.931  11.758  -2.600
   70   1HB   SER   8          HB2       SER   8  -3.756  11.304  -3.641
   71   2HB   SER   8          HB1       SER   8  -3.658  12.763  -2.659
   72    HG   SER   8           HG       SER   8  -3.069  10.255  -1.533
   73    H    TYR   9           HN       TYR   9  -5.477   9.655  -3.870
   74    HA   TYR   9           HA       TYR   9  -6.456   7.427  -2.389
   75   1HB   TYR   9          HB2       TYR   9  -4.931   7.471  -5.012
   76   2HB   TYR   9          HB1       TYR   9  -5.840   6.092  -4.389
   77    HD1  TYR   9           HD1      TYR   9  -6.049   9.393  -5.947
   78    HD2  TYR   9           HD2      TYR   9  -8.302   6.213  -4.142
   79    HE1  TYR   9           HE1      TYR   9  -8.140  10.343  -6.885
   80    HE2  TYR   9           HE2      TYR   9 -10.391   7.159  -5.078
   81    HH   TYR   9           HH       TYR   9 -11.160   9.524  -5.838
   82    H    ILE  10           HN       ILE  10  -3.160   8.374  -3.320
   83    HA   ILE  10           HA       ILE  10  -1.885   6.005  -2.297
   84    HB   ILE  10           HB       ILE  10  -0.774   8.822  -2.546
   85   1HG1  ILE  10          HG12      ILE  10  -1.616   8.095  -4.703
   86   2HG1  ILE  10          HG11      ILE  10   0.140   7.974  -4.724
   87   1HG2  ILE  10          HG21      ILE  10   1.392   7.455  -2.844
   88   2HG2  ILE  10          HG22      ILE  10   0.485   6.107  -2.161
   89   3HG2  ILE  10          HG23      ILE  10   0.731   7.572  -1.213
   90   1HD1  ILE  10          HD11      ILE  10  -0.295   5.492  -3.963
   91   2HD1  ILE  10          HD12      ILE  10  -0.494   5.932  -5.658
   92   3HD1  ILE  10          HD13      ILE  10  -1.908   5.777  -4.619
   93    H    ALA  11           HN       ALA  11  -2.703   9.149  -0.863
   94    HA   ALA  11           HA       ALA  11  -1.430   8.649   1.672
   95   1HB   ALA  11          HB1       ALA  11  -3.736  10.467   0.903
   96   2HB   ALA  11          HB2       ALA  11  -2.039  10.920   1.059
   97   3HB   ALA  11          HB3       ALA  11  -2.968  10.471   2.490
   98    H    LEU  12           HN       LEU  12  -4.812   8.241   0.561
   99    HA   LEU  12           HA       LEU  12  -5.821   7.247   3.038
  100   1HB   LEU  12          HB2       LEU  12  -6.660   6.668   0.181
  101   2HB   LEU  12          HB1       LEU  12  -7.577   6.143   1.592
  102    HG   LEU  12           HG       LEU  12  -6.843   9.028   1.021
  103   1HD1  LEU  12          HD11      LEU  12  -8.340   8.292  -0.718
  104   2HD1  LEU  12          HD12      LEU  12  -9.282   9.243   0.430
  105   3HD1  LEU  12          HD13      LEU  12  -9.384   7.482   0.452
  106   1HD2  LEU  12          HD21      LEU  12  -8.932   9.217   2.671
  107   2HD2  LEU  12          HD22      LEU  12  -7.303   9.000   3.298
  108   3HD2  LEU  12          HD23      LEU  12  -8.391   7.618   3.178
  109    H    ILE  13           HN       ILE  13  -4.275   5.629   0.290
  110    HA   ILE  13           HA       ILE  13  -4.533   2.966   1.388
  111    HB   ILE  13           HB       ILE  13  -2.668   4.147  -0.689
  112   1HG1  ILE  13          HG12      ILE  13  -5.009   2.255  -1.024
  113   2HG1  ILE  13          HG11      ILE  13  -5.187   4.006  -1.113
  114   1HG2  ILE  13          HG21      ILE  13  -2.339   1.698  -1.307
  115   2HG2  ILE  13          HG22      ILE  13  -3.051   1.296   0.255
  116   3HG2  ILE  13          HG23      ILE  13  -1.546   2.213   0.180
  117   1HD1  ILE  13          HD11      ILE  13  -4.899   3.272  -3.366
  118   2HD1  ILE  13          HD12      ILE  13  -3.563   2.210  -2.926
  119   3HD1  ILE  13          HD13      ILE  13  -3.346   3.960  -2.894
  120    H    THR  14           HN       THR  14  -1.976   5.450   1.457
  121    HA   THR  14           HA       THR  14  -0.039   3.864   2.833
  122    HB   THR  14           HB       THR  14  -0.450   6.863   2.932
  123    HG1  THR  14           HG1      THR  14   1.604   5.994   1.454
  124   1HG2  THR  14          HG21      THR  14   1.880   5.084   3.681
  125   2HG2  THR  14          HG22      THR  14   0.989   6.179   4.739
  126   3HG2  THR  14          HG23      THR  14   2.018   6.829   3.462
  127    H    MET  15           HN       MET  15  -2.668   5.945   4.000
  128    HA   MET  15           HA       MET  15  -2.018   5.672   6.799
  129   1HB   MET  15          HB2       MET  15  -4.610   6.335   5.375
  130   2HB   MET  15          HB1       MET  15  -4.433   6.358   7.127
  131   1HG   MET  15          HG2       MET  15  -2.651   8.043   6.936
  132   2HG   MET  15          HG1       MET  15  -2.807   8.020   5.180
  133   1HE   MET  15          HE1       MET  15  -3.268  10.545   4.951
  134   2HE   MET  15          HE2       MET  15  -2.913  10.637   6.675
  135   3HE   MET  15          HE3       MET  15  -4.337  11.450   6.029
  136    H    ALA  16           HN       ALA  16  -4.113   3.907   4.562
  137    HA   ALA  16           HA       ALA  16  -5.377   2.192   6.431
  138   1HB   ALA  16          HB1       ALA  16  -4.616   1.830   3.527
  139   2HB   ALA  16          HB2       ALA  16  -6.193   2.266   4.182
  140   3HB   ALA  16          HB3       ALA  16  -5.561   0.634   4.415
  141    H    ILE  17           HN       ILE  17  -2.382   1.644   4.536
  142    HA   ILE  17           HA       ILE  17  -1.789  -0.929   5.600
  143    HB   ILE  17           HB       ILE  17   0.147   1.245   4.733
  144   1HG1  ILE  17          HG12      ILE  17  -0.957  -1.069   3.121
  145   2HG1  ILE  17          HG11      ILE  17  -1.659   0.549   3.088
  146   1HG2  ILE  17          HG21      ILE  17   0.413  -1.717   5.266
  147   2HG2  ILE  17          HG22      ILE  17   1.436  -0.399   5.837
  148   3HG2  ILE  17          HG23      ILE  17   1.503  -0.900   4.148
  149   1HD1  ILE  17          HD11      ILE  17   0.048   0.061   1.255
  150   2HD1  ILE  17          HD12      ILE  17   1.270   0.035   2.528
  151   3HD1  ILE  17          HD13      ILE  17   0.352   1.510   2.215
  152    H    GLN  18           HN       GLN  18  -0.659   2.281   6.596
  153    HA   GLN  18           HA       GLN  18   0.835   1.385   8.870
  154   1HB   GLN  18          HB2       GLN  18  -0.404   4.076   8.229
  155   2HB   GLN  18          HB1       GLN  18   0.697   3.794   9.580
  156   1HG   GLN  18          HG2       GLN  18   2.423   2.989   8.010
  157   2HG   GLN  18          HG1       GLN  18   1.326   3.273   6.661
  158   1HE2  GLN  18          HE21      GLN  18   3.908   4.604   6.997
  159   2HE2  GLN  18          HE22      GLN  18   3.594   6.263   7.174
  160    H    ASN  19           HN       ASN  19  -2.529   2.481   8.530
  161    HA   ASN  19           HA       ASN  19  -3.028   2.284  11.404
  162   1HB   ASN  19          HB2       ASN  19  -4.843   2.684   9.013
  163   2HB   ASN  19          HB1       ASN  19  -5.430   2.631  10.676
  164   1HD2  ASN  19          HD21      ASN  19  -4.113   4.703   8.284
  165   2HD2  ASN  19          HD22      ASN  19  -3.764   6.025   9.290
  166    H    ALA  20           HN       ALA  20  -2.459  -0.081   9.226
  167    HA   ALA  20           HA       ALA  20  -4.710  -1.835   9.780
  168   1HB   ALA  20          HB1       ALA  20  -2.050  -2.855   8.810
  169   2HB   ALA  20          HB2       ALA  20  -3.018  -1.824   7.759
  170   3HB   ALA  20          HB3       ALA  20  -3.676  -3.354   8.338
  171    HA   PRO  21           HA       PRO  21  -3.837  -3.645  13.739
  172   1HB   PRO  21          HB2       PRO  21  -3.538  -6.168  12.111
  173   2HB   PRO  21          HB1       PRO  21  -4.348  -5.936  13.672
  174   1HG   PRO  21          HG2       PRO  21  -5.731  -6.007  11.392
  175   2HG   PRO  21          HG1       PRO  21  -6.187  -4.924  12.717
  176   1HD   PRO  21          HD2       PRO  21  -5.024  -4.235  10.080
  177   2HD   PRO  21          HD1       PRO  21  -5.896  -3.198  11.230
  178    H    GLU  22           HN       GLU  22  -1.864  -5.937  11.876
  179    HA   GLU  22           HA       GLU  22   0.491  -5.075  13.442
  180   1HB   GLU  22          HB2       GLU  22  -0.059  -7.508  13.179
  181   2HB   GLU  22          HB1       GLU  22   0.232  -7.349  11.447
  182   1HG   GLU  22          HG2       GLU  22   2.246  -8.208  12.522
  183   2HG   GLU  22          HG1       GLU  22   2.552  -6.569  11.947
  184    H    LYS  23           HN       LYS  23   0.424  -6.167  10.038
  185    HA   LYS  23           HA       LYS  23   1.191  -3.513   9.089
  186   1HB   LYS  23          HB2       LYS  23   3.317  -4.439  10.077
  187   2HB   LYS  23          HB1       LYS  23   3.228  -5.749   8.905
  188   1HG   LYS  23          HG2       LYS  23   4.688  -4.141   7.934
  189   2HG   LYS  23          HG1       LYS  23   3.156  -3.940   7.093
  190   1HD   LYS  23          HD2       LYS  23   2.626  -1.961   8.334
  191   2HD   LYS  23          HD1       LYS  23   3.913  -2.265   9.501
  192   1HE   LYS  23          HE2       LYS  23   4.324  -1.669   6.556
  193   2HE   LYS  23          HE1       LYS  23   4.538  -0.509   7.868
  194   1HZ   LYS  23          HZ1       LYS  23   6.658  -1.353   7.447
  195   2HZ   LYS  23          HZ2       LYS  23   6.103  -2.953   7.310
  196   3HZ   LYS  23          HZ3       LYS  23   6.143  -2.192   8.828
  197    H    LYS  24           HN       LYS  24   0.771  -6.963   8.427
  198    HA   LYS  24           HA       LYS  24   0.677  -6.534   5.530
  199   1HB   LYS  24          HB2       LYS  24  -0.036  -8.925   7.249
  200   2HB   LYS  24          HB1       LYS  24  -0.065  -8.931   5.486
  201   1HG   LYS  24          HG2       LYS  24   2.330  -8.330   5.444
  202   2HG   LYS  24          HG1       LYS  24   2.360  -8.332   7.208
  203   1HD   LYS  24          HD2       LYS  24   1.588 -10.730   7.146
  204   2HD   LYS  24          HD1       LYS  24   1.798 -10.694   5.395
  205   1HE   LYS  24          HE2       LYS  24   3.823 -11.607   6.324
  206   2HE   LYS  24          HE1       LYS  24   4.193  -9.963   5.799
  207   1HZ   LYS  24          HZ1       LYS  24   3.247 -10.380   8.541
  208   2HZ   LYS  24          HZ2       LYS  24   4.308  -9.203   7.930
  209   3HZ   LYS  24          HZ3       LYS  24   4.851 -10.794   8.175
  210    H    ILE  25           HN       ILE  25  -1.098  -6.016   4.372
  211    HA   ILE  25           HA       ILE  25  -3.801  -6.414   5.593
  212    HB   ILE  25           HB       ILE  25  -3.032  -4.002   5.720
  213   1HG1  ILE  25          HG12      ILE  25  -5.377  -4.475   3.857
  214   2HG1  ILE  25          HG11      ILE  25  -5.442  -4.770   5.590
  215   1HG2  ILE  25          HG21      ILE  25  -2.820  -2.716   3.710
  216   2HG2  ILE  25          HG22      ILE  25  -3.385  -4.056   2.714
  217   3HG2  ILE  25          HG23      ILE  25  -1.804  -4.141   3.491
  218   1HD1  ILE  25          HD11      ILE  25  -4.518  -2.089   4.578
  219   2HD1  ILE  25          HD12      ILE  25  -5.252  -2.505   6.127
  220   3HD1  ILE  25          HD13      ILE  25  -6.240  -2.455   4.668
  221    H    THR  26           HN       THR  26  -5.311  -7.225   4.162
  222    HA   THR  26           HA       THR  26  -4.290  -8.230   1.612
  223    HB   THR  26           HB       THR  26  -6.459  -9.327   1.421
  224    HG1  THR  26           HG1      THR  26  -8.092  -8.835   2.880
  225   1HG2  THR  26          HG21      THR  26  -5.408  -9.321   4.264
  226   2HG2  THR  26          HG22      THR  26  -4.864 -10.366   2.951
  227   3HG2  THR  26          HG23      THR  26  -6.496 -10.538   3.598
  228    H    LEU  27           HN       LEU  27  -5.477  -7.858  -0.427
  229    HA   LEU  27           HA       LEU  27  -5.686  -5.100  -1.075
  230   1HB   LEU  27          HB2       LEU  27  -5.242  -6.943  -2.694
  231   2HB   LEU  27          HB1       LEU  27  -6.900  -7.496  -2.494
  232    HG   LEU  27           HG       LEU  27  -7.722  -5.322  -3.370
  233   1HD1  LEU  27          HD11      LEU  27  -6.152  -3.693  -2.865
  234   2HD1  LEU  27          HD12      LEU  27  -5.776  -3.971  -4.560
  235   3HD1  LEU  27          HD13      LEU  27  -4.782  -4.710  -3.311
  236   1HD2  LEU  27          HD21      LEU  27  -6.513  -7.420  -4.822
  237   2HD2  LEU  27          HD22      LEU  27  -5.899  -5.950  -5.569
  238   3HD2  LEU  27          HD23      LEU  27  -7.636  -6.217  -5.439
  239    H    ASN  28           HN       ASN  28  -8.200  -7.547  -0.475
  240    HA   ASN  28           HA       ASN  28 -10.459  -5.831  -0.808
  241   1HB   ASN  28          HB2       ASN  28 -10.063  -8.328   0.861
  242   2HB   ASN  28          HB1       ASN  28 -11.627  -7.543   0.638
  243   1HD2  ASN  28          HD21      ASN  28 -10.061 -10.146  -0.472
  244   2HD2  ASN  28          HD22      ASN  28 -10.561 -10.162  -2.094
  245    H    GLY  29           HN       GLY  29  -8.478  -6.615   2.037
  246   1HA   GLY  29          HA2       GLY  29 -10.054  -5.357   4.013
  247   2HA   GLY  29          HA1       GLY  29  -8.304  -5.542   4.111
  248    H    ILE  30           HN       ILE  30  -7.600  -3.936   1.851
  249    HA   ILE  30           HA       ILE  30  -7.546  -1.357   3.050
  250    HB   ILE  30           HB       ILE  30  -7.153  -2.177   0.156
  251   1HG1  ILE  30          HG12      ILE  30  -5.074  -1.422   2.222
  252   2HG1  ILE  30          HG11      ILE  30  -5.628  -3.083   2.025
  253   1HG2  ILE  30          HG21      ILE  30  -5.867   0.035   0.099
  254   2HG2  ILE  30          HG22      ILE  30  -6.681   0.436   1.610
  255   3HG2  ILE  30          HG23      ILE  30  -7.624   0.170   0.144
  256   1HD1  ILE  30          HD11      ILE  30  -4.348  -1.354  -0.107
  257   2HD1  ILE  30          HD12      ILE  30  -5.008  -2.965  -0.388
  258   3HD1  ILE  30          HD13      ILE  30  -3.625  -2.753   0.684
  259    H    TYR  31           HN       TYR  31  -9.707  -2.728   0.566
  260    HA   TYR  31           HA       TYR  31 -11.122  -0.321  -0.021
  261   1HB   TYR  31          HB2       TYR  31 -11.835  -3.239  -0.150
  262   2HB   TYR  31          HB1       TYR  31 -13.062  -2.030  -0.483
  263    HD1  TYR  31           HD1      TYR  31 -12.710  -0.371  -2.313
  264    HD2  TYR  31           HD2      TYR  31 -10.097  -3.729  -1.742
  265    HE1  TYR  31           HE1      TYR  31 -11.847  -0.102  -4.616
  266    HE2  TYR  31           HE2      TYR  31  -9.242  -3.457  -4.055
  267    HH   TYR  31           HH       TYR  31 -10.793  -1.461  -6.347
  268    H    GLN  32           HN       GLN  32 -11.855  -2.862   2.390
  269    HA   GLN  32           HA       GLN  32 -14.187  -1.621   3.448
  270   1HB   GLN  32          HB2       GLN  32 -12.148  -3.459   4.725
  271   2HB   GLN  32          HB1       GLN  32 -13.619  -2.945   5.545
  272   1HG   GLN  32          HG2       GLN  32 -14.236  -4.999   4.583
  273   2HG   GLN  32          HG1       GLN  32 -14.852  -3.824   3.425
  274   1HE2  GLN  32          HE21      GLN  32 -14.006  -3.894   1.300
  275   2HE2  GLN  32          HE22      GLN  32 -12.759  -4.938   0.815
  276    H    PHE  33           HN       PHE  33 -10.764  -1.189   4.215
  277    HA   PHE  33           HA       PHE  33 -11.072   0.405   6.544
  278   1HB   PHE  33          HB2       PHE  33  -8.912  -0.546   5.661
  279   2HB   PHE  33          HB1       PHE  33  -8.930   0.706   4.419
  280    HD1  PHE  33           HD1      PHE  33  -8.598   3.068   4.995
  281    HD2  PHE  33           HD2      PHE  33  -8.510   0.001   8.001
  282    HE1  PHE  33           HE1      PHE  33  -7.568   4.662   6.593
  283    HE2  PHE  33           HE2      PHE  33  -7.483   1.595   9.599
  284    HZ   PHE  33           HZ       PHE  33  -7.011   3.925   8.894
  285    H    ILE  34           HN       ILE  34 -10.745   1.437   3.122
  286    HA   ILE  34           HA       ILE  34 -11.048   4.225   3.671
  287    HB   ILE  34           HB       ILE  34 -11.629   2.627   1.165
  288   1HG1  ILE  34          HG12      ILE  34  -9.298   4.433   1.869
  289   2HG1  ILE  34          HG11      ILE  34  -9.273   2.685   2.099
  290   1HG2  ILE  34          HG21      ILE  34 -11.611   5.603   1.708
  291   2HG2  ILE  34          HG22      ILE  34 -12.861   4.650   0.908
  292   3HG2  ILE  34          HG23      ILE  34 -11.327   4.954   0.094
  293   1HD1  ILE  34          HD11      ILE  34  -9.879   4.000  -0.559
  294   2HD1  ILE  34          HD12      ILE  34  -9.566   2.291  -0.256
  295   3HD1  ILE  34          HD13      ILE  34  -8.265   3.471  -0.083
  296    H    MET  35           HN       MET  35 -13.495   1.834   2.563
  297    HA   MET  35           HA       MET  35 -15.648   3.714   2.582
  298   1HB   MET  35          HB2       MET  35 -15.607   0.701   2.803
  299   2HB   MET  35          HB1       MET  35 -17.101   1.635   2.730
  300   1HG   MET  35          HG2       MET  35 -16.334   2.646   0.591
  301   2HG   MET  35          HG1       MET  35 -14.896   1.630   0.646
  302   1HE   MET  35          HE1       MET  35 -15.070  -0.913  -0.775
  303   2HE   MET  35          HE2       MET  35 -15.984  -1.872   0.386
  304   3HE   MET  35          HE3       MET  35 -14.838  -0.666   0.961
  305    H    ASP  36           HN       ASP  36 -14.529   1.420   5.089
  306    HA   ASP  36           HA       ASP  36 -16.624   2.020   6.946
  307   1HB   ASP  36          HB2       ASP  36 -13.820   0.952   7.343
  308   2HB   ASP  36          HB1       ASP  36 -14.996   1.091   8.651
  309    H    ARG  37           HN       ARG  37 -13.330   3.377   6.615
  310    HA   ARG  37           HA       ARG  37 -13.629   5.163   8.864
  311   1HB   ARG  37          HB2       ARG  37 -11.769   5.286   6.478
  312   2HB   ARG  37          HB1       ARG  37 -11.635   6.310   7.899
  313   1HG   ARG  37          HG2       ARG  37 -11.571   3.283   8.006
  314   2HG   ARG  37          HG1       ARG  37 -10.122   4.267   7.888
  315   1HD   ARG  37          HD2       ARG  37 -12.107   4.131  10.164
  316   2HD   ARG  37          HD1       ARG  37 -10.393   3.770  10.204
  317    HE   ARG  37           HE       ARG  37 -11.600   6.326  10.658
  318   1HH1  ARG  37          HH21      ARG  37  -8.934   4.897   8.986
  319   2HH1  ARG  37          HH22      ARG  37  -8.085   6.395   8.819
  320   1HH2  ARG  37          HH11      ARG  37 -10.498   8.261  10.456
  321   2HH2  ARG  37          HH12      ARG  37  -8.963   8.294   9.652
  322    H    PHE  38           HN       PHE  38 -14.140   5.564   5.371
  323    HA   PHE  38           HA       PHE  38 -15.450   8.207   5.954
  324   1HB   PHE  38          HB2       PHE  38 -13.981   7.422   3.420
  325   2HB   PHE  38          HB1       PHE  38 -14.687   8.993   3.792
  326    HD1  PHE  38           HD1      PHE  38 -11.879   6.728   4.372
  327    HD2  PHE  38           HD2      PHE  38 -13.708  10.427   5.565
  328    HE1  PHE  38           HE1      PHE  38  -9.772   7.409   5.490
  329    HE2  PHE  38           HE2      PHE  38 -11.600  11.108   6.682
  330    HZ   PHE  38           HZ       PHE  38  -9.633   9.598   6.645
  331    HA   PRO  39           HA       PRO  39 -18.667   5.194   4.400
  332   1HB   PRO  39          HB2       PRO  39 -20.254   7.452   5.588
  333   2HB   PRO  39          HB1       PRO  39 -20.530   5.702   5.702
  334   1HG   PRO  39          HG2       PRO  39 -19.485   7.033   7.741
  335   2HG   PRO  39          HG1       PRO  39 -18.896   5.416   7.317
  336   1HD   PRO  39          HD2       PRO  39 -17.599   8.075   6.848
  337   2HD   PRO  39          HD1       PRO  39 -16.846   6.501   7.196
  338    H    PHE  40           HN       PHE  40 -17.638   8.297   3.601
  339    HA   PHE  40           HA       PHE  40 -19.651   9.252   1.839
  340   1HB   PHE  40          HB2       PHE  40 -17.874  10.721   2.461
  341   2HB   PHE  40          HB1       PHE  40 -16.645   9.581   1.922
  342    HD1  PHE  40           HD1      PHE  40 -19.505  11.649   0.665
  343    HD2  PHE  40           HD2      PHE  40 -15.772   9.725  -0.256
  344    HE1  PHE  40           HE1      PHE  40 -19.516  12.701  -1.580
  345    HE2  PHE  40           HE2      PHE  40 -15.788  10.776  -2.503
  346    HZ   PHE  40           HZ       PHE  40 -17.659  12.263  -3.165
  347    H    TYR  41           HN       TYR  41 -16.897   7.079   1.257
  348    HA   TYR  41           HA       TYR  41 -17.362   6.818  -1.570
  349   1HB   TYR  41          HB2       TYR  41 -15.854   5.096   0.405
  350   2HB   TYR  41          HB1       TYR  41 -15.833   4.839  -1.343
  351    HD1  TYR  41           HD1      TYR  41 -14.606   6.302  -2.808
  352    HD2  TYR  41           HD2      TYR  41 -15.004   7.222   1.359
  353    HE1  TYR  41           HE1      TYR  41 -12.897   8.081  -3.047
  354    HE2  TYR  41           HE2      TYR  41 -13.302   9.005   1.136
  355    HH   TYR  41           HH       TYR  41 -12.180  10.299  -0.409
  356    H    ARG  42           HN       ARG  42 -18.828   5.295   1.199
  357    HA   ARG  42           HA       ARG  42 -19.667   2.859  -0.008
  358   1HB   ARG  42          HB2       ARG  42 -20.966   4.555   2.137
  359   2HB   ARG  42          HB1       ARG  42 -21.567   2.966   1.664
  360   1HG   ARG  42          HG2       ARG  42 -19.346   1.991   2.191
  361   2HG   ARG  42          HG1       ARG  42 -18.794   3.576   2.731
  362   1HD   ARG  42          HD2       ARG  42 -19.490   2.349   4.691
  363   2HD   ARG  42          HD1       ARG  42 -20.718   3.580   4.378
  364    HE   ARG  42           HE       ARG  42 -21.662   1.376   3.009
  365   1HH1  ARG  42          HH21      ARG  42 -20.561   2.010   6.218
  366   2HH1  ARG  42          HH22      ARG  42 -21.600   0.831   6.946
  367   1HH2  ARG  42          HH11      ARG  42 -23.017  -0.165   3.942
  368   2HH2  ARG  42          HH12      ARG  42 -22.990  -0.399   5.658
  369    H    GLU  43           HN       GLU  43 -21.137   6.101  -0.067
  370    HA   GLU  43           HA       GLU  43 -23.380   5.116  -1.697
  371   1HB   GLU  43          HB2       GLU  43 -22.593   7.919  -0.845
  372   2HB   GLU  43          HB1       GLU  43 -24.067   7.514  -1.725
  373   1HG   GLU  43          HG2       GLU  43 -24.768   6.034   0.122
  374   2HG   GLU  43          HG1       GLU  43 -23.296   6.438   1.004
  375    H    ASN  44           HN       ASN  44 -20.255   5.658  -2.371
  376    HA   ASN  44           HA       ASN  44 -20.854   6.423  -5.206
  377   1HB   ASN  44          HB2       ASN  44 -18.506   7.412  -3.560
  378   2HB   ASN  44          HB1       ASN  44 -18.781   7.749  -5.268
  379   1HD2  ASN  44          HD21      ASN  44 -18.938   9.367  -2.502
  380   2HD2  ASN  44          HD22      ASN  44 -20.338  10.298  -2.731
  381    H    LYS  45           HN       LYS  45 -20.310   4.697  -6.405
  382    HA   LYS  45           HA       LYS  45 -17.960   3.015  -5.600
  383   1HB   LYS  45          HB2       LYS  45 -20.396   2.404  -7.299
  384   2HB   LYS  45          HB1       LYS  45 -19.046   1.294  -7.063
  385   1HG   LYS  45          HG2       LYS  45 -19.441   1.327  -4.624
  386   2HG   LYS  45          HG1       LYS  45 -20.797   2.429  -4.862
  387   1HD   LYS  45          HD2       LYS  45 -21.943   0.733  -6.235
  388   2HD   LYS  45          HD1       LYS  45 -20.590  -0.375  -6.001
  389   1HE   LYS  45          HE2       LYS  45 -22.521  -0.777  -4.433
  390   2HE   LYS  45          HE1       LYS  45 -20.990  -0.462  -3.617
  391   1HZ   LYS  45          HZ1       LYS  45 -22.655   1.849  -4.227
  392   2HZ   LYS  45          HZ2       LYS  45 -21.687   1.531  -2.867
  393   3HZ   LYS  45          HZ3       LYS  45 -23.219   0.809  -3.010
  394    H    GLN  46           HN       GLN  46 -18.439   5.581  -7.328
  395    HA   GLN  46           HA       GLN  46 -17.970   5.201 -10.026
  396   1HB   GLN  46          HB2       GLN  46 -16.806   7.283  -8.168
  397   2HB   GLN  46          HB1       GLN  46 -16.651   7.360  -9.923
  398   1HG   GLN  46          HG2       GLN  46 -19.053   7.443 -10.198
  399   2HG   GLN  46          HG1       GLN  46 -19.306   7.150  -8.477
  400   1HE2  GLN  46          HE21      GLN  46 -20.528   9.403  -9.124
  401   2HE2  GLN  46          HE22      GLN  46 -19.619  10.793  -8.772
  402    H    GLY  47           HN       GLY  47 -15.716   5.969 -11.024
  403   1HA   GLY  47          HA2       GLY  47 -14.000   3.801 -11.112
  404   2HA   GLY  47          HA1       GLY  47 -13.482   5.440 -11.492
  405    H    TRP  48           HN       TRP  48 -14.378   5.829  -8.402
  406    HA   TRP  48           HA       TRP  48 -11.702   5.911  -7.410
  407   1HB   TRP  48          HB2       TRP  48 -12.637   6.636  -5.408
  408   2HB   TRP  48          HB1       TRP  48 -14.014   6.909  -6.468
  409    HD1  TRP  48           HD1      TRP  48 -16.167   5.538  -6.025
  410    HE1  TRP  48           HE1      TRP  48 -16.840   3.749  -4.293
  411    HE3  TRP  48           HE3      TRP  48 -11.606   4.553  -3.951
  412    HZ2  TRP  48           HZ2      TRP  48 -15.603   2.115  -2.282
  413    HZ3  TRP  48           HZ3      TRP  48 -11.382   2.884  -2.133
  414    HH2  TRP  48           HH2      TRP  48 -13.364   1.650  -1.305
  415    H    GLN  49           HN       GLN  49 -14.243   3.482  -7.209
  416    HA   GLN  49           HA       GLN  49 -12.981   1.659  -5.467
  417   1HB   GLN  49          HB2       GLN  49 -15.336   1.502  -6.104
  418   2HB   GLN  49          HB1       GLN  49 -14.883   1.136  -7.766
  419   1HG   GLN  49          HG2       GLN  49 -13.820  -0.948  -7.061
  420   2HG   GLN  49          HG1       GLN  49 -14.126  -0.563  -5.366
  421   1HE2  GLN  49          HE21      GLN  49 -15.170  -2.949  -6.565
  422   2HE2  GLN  49          HE22      GLN  49 -16.861  -2.815  -6.639
  423    H    ASN  50           HN       ASN  50 -12.937   1.678  -9.054
  424    HA   ASN  50           HA       ASN  50 -11.114  -0.570  -9.194
  425   1HB   ASN  50          HB2       ASN  50 -11.979   1.511 -11.219
  426   2HB   ASN  50          HB1       ASN  50 -10.915   0.159 -11.612
  427   1HD2  ASN  50          HD21      ASN  50 -13.753   0.686 -12.528
  428   2HD2  ASN  50          HD22      ASN  50 -14.625  -0.699 -12.079
  429    H    SER  51           HN       SER  51 -10.691   2.954  -9.408
  430    HA   SER  51           HA       SER  51  -8.030   3.076 -10.255
  431   1HB   SER  51          HB2       SER  51  -7.904   5.232  -9.100
  432   2HB   SER  51          HB1       SER  51  -9.478   5.054  -9.869
  433    HG   SER  51           HG       SER  51  -9.645   5.786  -7.705
  434    H    ILE  52           HN       ILE  52  -9.251   2.161  -7.076
  435    HA   ILE  52           HA       ILE  52  -6.836   2.475  -5.613
  436    HB   ILE  52           HB       ILE  52  -9.126   0.517  -5.311
  437   1HG1  ILE  52          HG12      ILE  52  -9.385   3.098  -5.030
  438   2HG1  ILE  52          HG11      ILE  52 -10.042   2.036  -3.794
  439   1HG2  ILE  52          HG21      ILE  52  -6.690   0.959  -3.591
  440   2HG2  ILE  52          HG22      ILE  52  -7.376  -0.562  -4.164
  441   3HG2  ILE  52          HG23      ILE  52  -8.200   0.357  -2.904
  442   1HD1  ILE  52          HD11      ILE  52  -8.599   4.111  -3.083
  443   2HD1  ILE  52          HD12      ILE  52  -7.235   3.074  -3.489
  444   3HD1  ILE  52          HD13      ILE  52  -8.379   2.574  -2.253
  445    H    ARG  53           HN       ARG  53  -8.082  -0.474  -7.234
  446    HA   ARG  53           HA       ARG  53  -5.678  -1.980  -6.690
  447   1HB   ARG  53          HB2       ARG  53  -7.996  -2.346  -8.600
  448   2HB   ARG  53          HB1       ARG  53  -6.653  -3.488  -8.534
  449   1HG   ARG  53          HG2       ARG  53  -7.159  -4.171  -6.371
  450   2HG   ARG  53          HG1       ARG  53  -8.027  -2.697  -5.978
  451   1HD   ARG  53          HD2       ARG  53  -9.575  -4.585  -6.239
  452   2HD   ARG  53          HD1       ARG  53  -9.853  -3.378  -7.503
  453    HE   ARG  53           HE       ARG  53  -8.104  -5.111  -8.713
  454   1HH1  ARG  53          HH21      ARG  53 -11.008  -5.483  -6.893
  455   2HH1  ARG  53          HH22      ARG  53 -11.547  -6.868  -7.781
  456   1HH2  ARG  53          HH11      ARG  53  -8.794  -6.918  -9.888
  457   2HH2  ARG  53          HH12      ARG  53 -10.295  -7.679  -9.478
  458    H    HIS  54           HN       HIS  54  -6.805  -0.120  -9.516
  459    HA   HIS  54           HA       HIS  54  -4.602  -0.842 -11.203
  460   1HB   HIS  54          HB2       HIS  54  -6.494   1.514 -11.157
  461   2HB   HIS  54          HB1       HIS  54  -5.178   1.423 -12.329
  462    HD1  HIS  54           HD1      HIS  54  -8.393  -0.280 -11.346
  463    HD2  HIS  54           HD2      HIS  54  -5.503  -0.557 -14.337
  464    HE1  HIS  54           HE1      HIS  54  -9.333  -1.837 -13.107
  465    H    ASN  55           HN       ASN  55  -5.057   1.763  -8.827
  466    HA   ASN  55           HA       ASN  55  -2.563   3.089  -9.348
  467   1HB   ASN  55          HB2       ASN  55  -4.244   2.889  -6.829
  468   2HB   ASN  55          HB1       ASN  55  -2.820   3.920  -6.971
  469   1HD2  ASN  55          HD21      ASN  55  -5.458   4.990  -6.516
  470   2HD2  ASN  55          HD22      ASN  55  -5.904   5.888  -7.886
  471    H    LEU  56           HN       LEU  56  -3.508   0.413  -7.218
  472    HA   LEU  56           HA       LEU  56  -0.933   0.104  -5.968
  473   1HB   LEU  56          HB2       LEU  56  -3.261  -1.786  -6.339
  474   2HB   LEU  56          HB1       LEU  56  -1.819  -2.216  -5.424
  475    HG   LEU  56           HG       LEU  56  -3.515   0.230  -4.840
  476   1HD1  LEU  56          HD11      LEU  56  -4.354  -1.133  -2.900
  477   2HD1  LEU  56          HD12      LEU  56  -3.565  -2.541  -3.613
  478   3HD1  LEU  56          HD13      LEU  56  -4.881  -1.739  -4.470
  479   1HD2  LEU  56          HD21      LEU  56  -1.097  -1.040  -3.584
  480   2HD2  LEU  56          HD22      LEU  56  -2.277  -0.275  -2.527
  481   3HD2  LEU  56          HD23      LEU  56  -1.491   0.665  -3.789
  482    H    SER  57           HN       SER  57  -2.446  -1.392  -8.821
  483    HA   SER  57           HA       SER  57  -0.246  -3.197  -9.317
  484   1HB   SER  57          HB2       SER  57  -2.471  -3.606 -10.274
  485   2HB   SER  57          HB1       SER  57  -2.358  -2.117 -11.207
  486    HG   SER  57           HG       SER  57  -0.314  -4.024 -11.406
  487    H    LEU  58           HN       LEU  58  -1.123   0.010 -10.610
  488    HA   LEU  58           HA       LEU  58   1.164   0.167 -12.363
  489   1HB   LEU  58          HB2       LEU  58  -0.592   2.335 -11.181
  490   2HB   LEU  58          HB1       LEU  58   0.634   2.620 -12.413
  491    HG   LEU  58           HG       LEU  58  -1.573   0.589 -12.792
  492   1HD1  LEU  58          HD11      LEU  58  -1.570   3.525 -13.563
  493   2HD1  LEU  58          HD12      LEU  58  -2.632   2.765 -12.379
  494   3HD1  LEU  58          HD13      LEU  58  -2.770   2.343 -14.086
  495   1HD2  LEU  58          HD21      LEU  58   0.378   2.018 -14.618
  496   2HD2  LEU  58          HD22      LEU  58  -1.067   1.225 -15.236
  497   3HD2  LEU  58          HD23      LEU  58   0.160   0.281 -14.404
  498    H    ASN  59           HN       ASN  59   0.514   1.252  -9.046
  499    HA   ASN  59           HA       ASN  59   3.104   2.548  -8.778
  500   1HB   ASN  59          HB2       ASN  59   1.136   1.624  -6.661
  501   2HB   ASN  59          HB1       ASN  59   2.527   2.668  -6.372
  502   1HD2  ASN  59          HD21      ASN  59   2.224   4.180  -8.899
  503   2HD2  ASN  59          HD22      ASN  59   0.852   5.162  -8.706
  504    H    GLU  60           HN       GLU  60   4.858   1.236  -8.996
  505    HA   GLU  60           HA       GLU  60   4.850  -1.491  -7.846
  506   1HB   GLU  60          HB2       GLU  60   6.880   0.081  -9.465
  507   2HB   GLU  60          HB1       GLU  60   7.162  -1.556  -8.870
  508   1HG   GLU  60          HG2       GLU  60   5.182  -2.355 -10.098
  509   2HG   GLU  60          HG1       GLU  60   4.877  -0.721 -10.685
  510    H    CYS  61           HN       CYS  61   5.307   1.564  -6.747
  511    HA   CYS  61           HA       CYS  61   7.703   1.463  -5.214
  512   1HB   CYS  61          HB2       CYS  61   5.082   2.899  -4.684
  513   2HB   CYS  61          HB1       CYS  61   6.576   3.196  -3.794
  514    HG   CYS  61           HG       CYS  61   6.751   3.509  -6.869
  515    H    PHE  62           HN       PHE  62   4.462   0.211  -4.620
  516    HA   PHE  62           HA       PHE  62   5.027  -0.524  -1.849
  517   1HB   PHE  62          HB2       PHE  62   2.815  -1.450  -3.714
  518   2HB   PHE  62          HB1       PHE  62   2.856  -1.677  -1.965
  519    HD1  PHE  62           HD1      PHE  62   2.158   0.632  -4.683
  520    HD2  PHE  62           HD2      PHE  62   2.803   0.325  -0.445
  521    HE1  PHE  62           HE1      PHE  62   1.170   2.883  -4.369
  522    HE2  PHE  62           HE2      PHE  62   1.809   2.576  -0.133
  523    HZ   PHE  62           HZ       PHE  62   0.994   3.851  -2.095
  524    H    VAL  63           HN       VAL  63   5.208  -2.755  -1.114
  525    HA   VAL  63           HA       VAL  63   6.419  -4.577  -3.172
  526    HB   VAL  63           HB       VAL  63   6.864  -4.467  -0.172
  527   1HG1  VAL  63          HG11      VAL  63   8.699  -6.066  -0.671
  528   2HG1  VAL  63          HG12      VAL  63   8.173  -6.124  -2.352
  529   3HG1  VAL  63          HG13      VAL  63   7.120  -6.738  -1.078
  530   1HG2  VAL  63          HG21      VAL  63   8.577  -3.593  -2.519
  531   2HG2  VAL  63          HG22      VAL  63   9.144  -3.688  -0.852
  532   3HG2  VAL  63          HG23      VAL  63   7.871  -2.547  -1.287
  533    H    LYS  64           HN       LYS  64   5.278  -6.385  -3.602
  534    HA   LYS  64           HA       LYS  64   2.856  -7.014  -2.108
  535   1HB   LYS  64          HB2       LYS  64   4.291  -8.551  -4.300
  536   2HB   LYS  64          HB1       LYS  64   2.677  -8.914  -3.691
  537   1HG   LYS  64          HG2       LYS  64   1.899  -6.686  -4.398
  538   2HG   LYS  64          HG1       LYS  64   3.512  -6.319  -5.013
  539   1HD   LYS  64          HD2       LYS  64   3.364  -8.200  -6.584
  540   2HD   LYS  64          HD1       LYS  64   1.768  -8.613  -5.959
  541   1HE   LYS  64          HE2       LYS  64   0.790  -6.654  -6.835
  542   2HE   LYS  64          HE1       LYS  64   2.352  -5.869  -7.075
  543   1HZ   LYS  64          HZ1       LYS  64   2.458  -8.212  -8.516
  544   2HZ   LYS  64          HZ2       LYS  64   2.291  -6.639  -9.137
  545   3HZ   LYS  64          HZ3       LYS  64   0.912  -7.583  -8.821
  546    H    VAL  65           HN       VAL  65   2.499  -9.032  -0.965
  547    HA   VAL  65           HA       VAL  65   5.004 -10.328   0.078
  548    HB   VAL  65           HB       VAL  65   2.418  -9.960   1.597
  549   1HG1  VAL  65          HG11      VAL  65   5.216 -10.482   2.620
  550   2HG1  VAL  65          HG12      VAL  65   4.097 -11.784   2.216
  551   3HG1  VAL  65          HG13      VAL  65   3.695 -10.641   3.498
  552   1HG2  VAL  65          HG21      VAL  65   4.891  -8.223   1.456
  553   2HG2  VAL  65          HG22      VAL  65   3.798  -8.188   2.839
  554   3HG2  VAL  65          HG23      VAL  65   3.208  -7.737   1.240
  555    HA   PRO  66           HA       PRO  66   2.602 -13.565  -2.245
  556   1HB   PRO  66          HB2       PRO  66   5.077 -15.003  -1.323
  557   2HB   PRO  66          HB1       PRO  66   4.238 -15.095  -2.886
  558   1HG   PRO  66          HG2       PRO  66   6.459 -13.671  -2.636
  559   2HG   PRO  66          HG1       PRO  66   5.111 -13.080  -3.625
  560   1HD   PRO  66          HD2       PRO  66   6.016 -12.149  -0.932
  561   2HD   PRO  66          HD1       PRO  66   5.236 -11.226  -2.238
  562    H    ARG  67           HN       ARG  67   1.464 -15.397  -1.490
  563    HA   ARG  67           HA       ARG  67   1.553 -15.849   1.476
  564   1HB   ARG  67          HB2       ARG  67  -0.544 -14.803   0.579
  565   2HB   ARG  67          HB1       ARG  67  -0.785 -16.241  -0.415
  566   1HG   ARG  67          HG2       ARG  67  -0.930 -17.648   1.556
  567   2HG   ARG  67          HG1       ARG  67  -0.510 -16.293   2.605
  568   1HD   ARG  67          HD2       ARG  67  -2.569 -15.118   1.884
  569   2HD   ARG  67          HD1       ARG  67  -2.990 -16.498   0.871
  570    HE   ARG  67           HE       ARG  67  -2.630 -17.571   3.420
  571   1HH1  ARG  67          HH21      ARG  67  -4.517 -15.104   1.929
  572   2HH1  ARG  67          HH22      ARG  67  -5.823 -15.232   3.058
  573   1HH2  ARG  67          HH11      ARG  67  -4.324 -17.753   4.910
  574   2HH2  ARG  67          HH12      ARG  67  -5.714 -16.733   4.747
  575    H    ASP  68           HN       ASP  68   1.079 -18.065   2.146
  576    HA   ASP  68           HA       ASP  68   2.622 -20.030   0.866
  577   1HB   ASP  68          HB2       ASP  68   0.242 -20.309   2.716
  578   2HB   ASP  68          HB1       ASP  68   1.246 -21.672   2.220
  579    H    ASP  69           HN       ASP  69   1.776 -22.114  -0.092
  580    HA   ASP  69           HA       ASP  69   0.202 -21.548  -2.437
  581   1HB   ASP  69          HB2       ASP  69   1.166 -24.137  -1.193
  582   2HB   ASP  69          HB1       ASP  69   0.320 -24.063  -2.739
  583    H    LYS  70           HN       LYS  70  -0.573 -22.751   0.750
  584    HA   LYS  70           HA       LYS  70  -3.114 -23.942   0.069
  585   1HB   LYS  70          HB2       LYS  70  -2.044 -22.846   2.684
  586   2HB   LYS  70          HB1       LYS  70  -3.549 -23.755   2.533
  587   1HG   LYS  70          HG2       LYS  70  -2.214 -25.624   1.486
  588   2HG   LYS  70          HG1       LYS  70  -0.750 -24.736   1.905
  589   1HD   LYS  70          HD2       LYS  70  -2.865 -25.518   3.930
  590   2HD   LYS  70          HD1       LYS  70  -1.439 -26.496   3.592
  591   1HE   LYS  70          HE2       LYS  70  -0.066 -24.379   4.097
  592   2HE   LYS  70          HE1       LYS  70  -1.554 -23.718   4.775
  593   1HZ   LYS  70          HZ1       LYS  70   0.115 -25.054   6.249
  594   2HZ   LYS  70          HZ2       LYS  70  -0.709 -26.394   5.608
  595   3HZ   LYS  70          HZ3       LYS  70  -1.559 -25.205   6.476
  596    H    LYS  71           HN       LYS  71  -3.030 -21.540  -1.276
  597    HA   LYS  71           HA       LYS  71  -4.632 -19.590   0.295
  598   1HB   LYS  71          HB2       LYS  71  -4.359 -18.317  -2.011
  599   2HB   LYS  71          HB1       LYS  71  -3.012 -18.411  -0.880
  600   1HG   LYS  71          HG2       LYS  71  -1.913 -20.074  -2.115
  601   2HG   LYS  71          HG1       LYS  71  -3.374 -20.547  -2.975
  602   1HD   LYS  71          HD2       LYS  71  -2.341 -17.743  -3.334
  603   2HD   LYS  71          HD1       LYS  71  -1.515 -19.057  -4.165
  604   1HE   LYS  71          HE2       LYS  71  -3.710 -19.764  -5.137
  605   2HE   LYS  71          HE1       LYS  71  -4.456 -18.351  -4.390
  606   1HZ   LYS  71          HZ1       LYS  71  -3.697 -18.124  -6.779
  607   2HZ   LYS  71          HZ2       LYS  71  -2.110 -18.128  -6.176
  608   3HZ   LYS  71          HZ3       LYS  71  -3.196 -16.909  -5.706
  609    HA   PRO  72           HA       PRO  72  -8.101 -21.436  -2.044
  610   1HB   PRO  72          HB2       PRO  72 -10.114 -20.732  -0.394
  611   2HB   PRO  72          HB1       PRO  72  -8.987 -22.035   0.029
  612   1HG   PRO  72          HG2       PRO  72  -9.074 -19.220   1.001
  613   2HG   PRO  72          HG1       PRO  72  -8.695 -20.705   1.888
  614   1HD   PRO  72          HD2       PRO  72  -6.790 -18.922   0.872
  615   2HD   PRO  72          HD1       PRO  72  -6.466 -20.612   1.313
  616    H    GLY  73           HN       GLY  73  -7.046 -18.431  -1.888
  617   1HA   GLY  73          HA2       GLY  73  -8.570 -17.349  -3.992
  618   2HA   GLY  73          HA1       GLY  73  -9.325 -16.783  -2.501
  619    H    LYS  74           HN       LYS  74  -7.878 -15.644  -0.941
  620    HA   LYS  74           HA       LYS  74  -6.370 -13.568  -2.184
  621   1HB   LYS  74          HB2       LYS  74  -6.311 -14.600   0.670
  622   2HB   LYS  74          HB1       LYS  74  -5.573 -13.086   0.141
  623   1HG   LYS  74          HG2       LYS  74  -7.776 -12.282  -0.633
  624   2HG   LYS  74          HG1       LYS  74  -8.514 -13.792  -0.099
  625   1HD   LYS  74          HD2       LYS  74  -7.803 -13.325   2.217
  626   2HD   LYS  74          HD1       LYS  74  -7.067 -11.813   1.685
  627   1HE   LYS  74          HE2       LYS  74  -9.338 -11.464   2.648
  628   2HE   LYS  74          HE1       LYS  74  -9.247 -10.971   0.957
  629   1HZ   LYS  74          HZ1       LYS  74 -11.161 -12.520   1.840
  630   2HZ   LYS  74          HZ2       LYS  74 -10.011 -13.733   1.535
  631   3HZ   LYS  74          HZ3       LYS  74 -10.520 -12.706   0.280
  632    H    GLY  75           HN       GLY  75  -4.133 -13.380  -2.582
  633   1HA   GLY  75          HA2       GLY  75  -2.472 -15.817  -1.996
  634   2HA   GLY  75          HA1       GLY  75  -2.422 -15.002  -3.552
  635    H    SER  76           HN       SER  76  -2.632 -12.348  -1.763
  636    HA   SER  76           HA       SER  76   0.042 -12.399  -0.545
  637   1HB   SER  76          HB2       SER  76  -0.428 -10.652  -2.972
  638   2HB   SER  76          HB1       SER  76   1.057 -10.779  -2.034
  639    HG   SER  76           HG       SER  76   0.434 -12.188  -4.104
  640    H    TYR  77           HN       TYR  77   0.573 -10.483   0.596
  641    HA   TYR  77           HA       TYR  77  -1.759  -8.685   1.170
  642   1HB   TYR  77          HB2       TYR  77   0.662  -9.196   2.925
  643   2HB   TYR  77          HB1       TYR  77  -0.816  -8.342   3.362
  644    HD1  TYR  77           HD1      TYR  77   0.470 -11.670   2.266
  645    HD2  TYR  77           HD2      TYR  77  -2.652  -9.514   4.272
  646    HE1  TYR  77           HE1      TYR  77  -0.545 -13.815   2.986
  647    HE2  TYR  77           HE2      TYR  77  -3.672 -11.658   4.991
  648    HH   TYR  77           HH       TYR  77  -2.212 -14.783   4.071
  649    H    TRP  78           HN       TRP  78  -1.076  -6.408   1.701
  650    HA   TRP  78           HA       TRP  78   1.262  -5.585   0.007
  651   1HB   TRP  78          HB2       TRP  78  -1.312  -4.161   0.732
  652   2HB   TRP  78          HB1       TRP  78   0.034  -3.390  -0.111
  653    HD1  TRP  78           HD1      TRP  78  -2.514  -6.242  -0.531
  654    HE1  TRP  78           HE1      TRP  78  -2.744  -6.760  -3.048
  655    HE3  TRP  78           HE3      TRP  78   1.120  -3.180  -2.405
  656    HZ2  TRP  78           HZ2      TRP  78  -1.536  -5.984  -5.528
  657    HZ3  TRP  78           HZ3      TRP  78   1.555  -3.085  -4.840
  658    HH2  TRP  78           HH2      TRP  78   0.228  -4.468  -6.403
  659    H    THR  79           HN       THR  79   2.953  -4.686   1.067
  660    HA   THR  79           HA       THR  79   2.481  -3.278   3.650
  661    HB   THR  79           HB       THR  79   3.125  -5.654   4.135
  662    HG1  THR  79           HG1      THR  79   3.817  -3.653   5.337
  663   1HG2  THR  79          HG21      THR  79   4.586  -5.805   2.047
  664   2HG2  THR  79          HG22      THR  79   5.270  -6.490   3.520
  665   3HG2  THR  79          HG23      THR  79   5.805  -4.908   2.954
  666    H    LEU  80           HN       LEU  80   4.300  -1.882   4.238
  667    HA   LEU  80           HA       LEU  80   5.447  -0.566   1.911
  668   1HB   LEU  80          HB2       LEU  80   5.956  -0.125   4.867
  669   2HB   LEU  80          HB1       LEU  80   6.457   0.960   3.574
  670    HG   LEU  80           HG       LEU  80   3.575   0.181   4.105
  671   1HD1  LEU  80          HD11      LEU  80   4.950   2.787   4.809
  672   2HD1  LEU  80          HD12      LEU  80   4.679   1.488   5.972
  673   3HD1  LEU  80          HD13      LEU  80   3.306   2.299   5.219
  674   1HD2  LEU  80          HD21      LEU  80   4.954   2.103   2.227
  675   2HD2  LEU  80          HD22      LEU  80   3.295   2.400   2.745
  676   3HD2  LEU  80          HD23      LEU  80   3.691   0.925   1.871
  677    H    ASP  81           HN       ASP  81   7.872   0.029   2.034
  678    HA   ASP  81           HA       ASP  81   9.465  -2.199   1.546
  679   1HB   ASP  81          HB2       ASP  81  10.709   0.233   2.819
  680   2HB   ASP  81          HB1       ASP  81  11.263  -0.700   1.429
  681    HA   PRO  82           HA       PRO  82  10.631  -3.950   5.433
  682   1HB   PRO  82          HB2       PRO  82  13.544  -3.443   5.168
  683   2HB   PRO  82          HB1       PRO  82  12.672  -4.985   5.175
  684   1HG   PRO  82          HG2       PRO  82  13.789  -3.998   2.948
  685   2HG   PRO  82          HG1       PRO  82  12.275  -4.919   2.906
  686   1HD   PRO  82          HD2       PRO  82  12.671  -1.939   2.775
  687   2HD   PRO  82          HD1       PRO  82  11.576  -2.973   1.819
  688    H    ASP  83           HN       ASP  83  13.148  -3.124   6.955
  689    HA   ASP  83           HA       ASP  83  11.891  -0.861   8.383
  690   1HB   ASP  83          HB2       ASP  83  14.347  -2.540   8.972
  691   2HB   ASP  83          HB1       ASP  83  13.790  -1.211   9.991
  692    H    SER  84           HN       SER  84  13.716  -1.044   5.702
  693    HA   SER  84           HA       SER  84  15.963   0.612   6.101
  694   1HB   SER  84          HB2       SER  84  15.560   1.321   3.682
  695   2HB   SER  84          HB1       SER  84  15.700  -0.411   3.960
  696    HG   SER  84           HG       SER  84  13.448   1.151   3.368
  697    H    TYR  85           HN       TYR  85  15.223   2.162   7.725
  698    HA   TYR  85           HA       TYR  85  13.124   4.059   7.013
  699   1HB   TYR  85          HB2       TYR  85  13.920   3.222   9.389
  700   2HB   TYR  85          HB1       TYR  85  15.093   4.530   9.246
  701    HD1  TYR  85           HD1      TYR  85  14.360   6.877   9.159
  702    HD2  TYR  85           HD2      TYR  85  11.539   3.659   9.526
  703    HE1  TYR  85           HE1      TYR  85  12.590   8.502   9.776
  704    HE2  TYR  85           HE2      TYR  85   9.768   5.284  10.145
  705    HH   TYR  85           HH       TYR  85   9.543   7.506  11.034
  706    H    ASN  86           HN       ASN  86  16.536   4.657   7.911
  707    HA   ASN  86           HA       ASN  86  16.571   6.922   5.949
  708   1HB   ASN  86          HB2       ASN  86  18.433   7.791   7.303
  709   2HB   ASN  86          HB1       ASN  86  16.990   7.559   8.288
  710   1HD2  ASN  86          HD21      ASN  86  17.812   4.469   7.844
  711   2HD2  ASN  86          HD22      ASN  86  18.908   4.232   9.117
  712    H    MET  87           HN       MET  87  17.163   3.913   5.699
  713    HA   MET  87           HA       MET  87  20.014   3.859   4.998
  714   1HB   MET  87          HB2       MET  87  17.801   1.823   4.625
  715   2HB   MET  87          HB1       MET  87  19.494   1.529   4.246
  716   1HG   MET  87          HG2       MET  87  19.172   2.592   6.967
  717   2HG   MET  87          HG1       MET  87  18.261   1.105   6.736
  718   1HE   MET  87          HE1       MET  87  22.765   1.773   6.303
  719   2HE   MET  87          HE2       MET  87  21.494   2.965   6.563
  720   3HE   MET  87          HE3       MET  87  21.696   2.234   4.972
  721    H    PHE  88           HN       PHE  88  20.781   4.467   3.062
  722    HA   PHE  88           HA       PHE  88  19.092   4.130   0.627
  723   1HB   PHE  88          HB2       PHE  88  20.418   6.674   1.583
  724   2HB   PHE  88          HB1       PHE  88  20.048   6.411  -0.122
  725    HD1  PHE  88           HD1      PHE  88  17.673   5.971  -0.825
  726    HD2  PHE  88           HD2      PHE  88  18.700   7.224   3.152
  727    HE1  PHE  88           HE1      PHE  88  15.316   6.629  -0.426
  728    HE2  PHE  88           HE2      PHE  88  16.342   7.883   3.553
  729    HZ   PHE  88           HZ       PHE  88  14.650   7.584   1.764
  730    H    GLU  89           HN       GLU  89  21.918   3.521   2.201
  731    HA   GLU  89           HA       GLU  89  23.302   2.821  -0.314
  732   1HB   GLU  89          HB2       GLU  89  25.380   3.930   0.407
  733   2HB   GLU  89          HB1       GLU  89  24.079   5.107   0.231
  734   1HG   GLU  89          HG2       GLU  89  23.653   4.959   2.682
  735   2HG   GLU  89          HG1       GLU  89  25.035   3.873   2.832
  736    H    ASN  90           HN       ASN  90  25.356   1.527   0.285
  737    HA   ASN  90           HA       ASN  90  24.719  -0.708   1.838
  738   1HB   ASN  90          HB2       ASN  90  27.234  -1.045   2.001
  739   2HB   ASN  90          HB1       ASN  90  26.622  -0.792   0.365
  740   1HD2  ASN  90          HD21      ASN  90  26.469   2.094   2.183
  741   2HD2  ASN  90          HD22      ASN  90  27.892   2.815   1.603
  742    H    GLY  91           HN       GLY  91  24.971  -1.249   4.015
  743   1HA   GLY  91          HA2       GLY  91  25.091   0.991   5.886
  744   2HA   GLY  91          HA1       GLY  91  24.829  -0.699   6.312
  745    H    SER  92           HN       SER  92  27.487  -0.598   4.313
  746    HA   SER  92           HA       SER  92  29.322  -1.345   6.360
  747   1HB   SER  92          HB2       SER  92  31.070  -1.016   4.632
  748   2HB   SER  92          HB1       SER  92  29.692  -1.907   3.994
  749    HG   SER  92           HG       SER  92  30.026  -0.352   2.520
  750    H    PHE  93           HN       PHE  93  28.625   1.786   4.848
  751    HA   PHE  93           HA       PHE  93  30.749   3.252   6.080
  752   1HB   PHE  93          HB2       PHE  93  29.482   4.245   4.261
  753   2HB   PHE  93          HB1       PHE  93  27.984   4.123   5.183
  754    HD1  PHE  93           HD1      PHE  93  27.378   5.782   6.780
  755    HD2  PHE  93           HD2      PHE  93  31.332   5.756   5.102
  756    HE1  PHE  93           HE1      PHE  93  27.832   7.987   7.815
  757    HE2  PHE  93           HE2      PHE  93  31.787   7.961   6.142
  758    HZ   PHE  93           HZ       PHE  93  30.037   9.076   7.501
  759    H    LEU  94           HN       LEU  94  30.973   3.976   8.166
  760    HA   LEU  94           HA       LEU  94  28.874   3.208  10.106
  761   1HB   LEU  94          HB2       LEU  94  31.180   2.621  10.653
  762   2HB   LEU  94          HB1       LEU  94  31.683   4.299  10.469
  763    HG   LEU  94           HG       LEU  94  30.319   4.966  12.376
  764   1HD1  LEU  94          HD11      LEU  94  28.403   3.609  12.348
  765   2HD1  LEU  94          HD12      LEU  94  29.291   2.966  13.727
  766   3HD1  LEU  94          HD13      LEU  94  29.335   2.122  12.180
  767   1HD2  LEU  94          HD21      LEU  94  31.598   3.925  14.102
  768   2HD2  LEU  94          HD22      LEU  94  32.633   3.907  12.675
  769   3HD2  LEU  94          HD23      LEU  94  31.785   2.441  13.167
  Start of MODEL   20
    1   1H    MET   1          HT1       MET   1 -22.529  19.469   5.667
    2   2H    MET   1          HT2       MET   1 -23.432  18.030   5.680
    3   3H    MET   1          HT3       MET   1 -24.108  19.455   5.048
    4    HA   MET   1           HA       MET   1 -23.462  18.037   3.240
    5   1HB   MET   1          HB2       MET   1 -23.134  20.538   3.105
    6   2HB   MET   1          HB1       MET   1 -21.444  20.277   3.538
    7   1HG   MET   1          HG2       MET   1 -21.151  18.824   1.578
    8   2HG   MET   1          HG1       MET   1 -22.844  19.047   1.145
    9   1HE   MET   1          HE1       MET   1 -23.219  22.450  -0.249
   10   2HE   MET   1          HE2       MET   1 -23.578  22.101   1.440
   11   3HE   MET   1          HE3       MET   1 -23.894  20.882   0.207
   12    H    LEU   2           HN       LEU   2 -21.948  16.622   2.323
   13    HA   LEU   2           HA       LEU   2 -19.598  15.925   4.056
   14   1HB   LEU   2          HB2       LEU   2 -20.977  14.172   2.006
   15   2HB   LEU   2          HB1       LEU   2 -19.770  13.687   3.195
   16    HG   LEU   2           HG       LEU   2 -22.575  14.675   3.782
   17   1HD1  LEU   2          HD11      LEU   2 -22.979  12.418   4.551
   18   2HD1  LEU   2          HD12      LEU   2 -21.282  11.987   4.331
   19   3HD1  LEU   2          HD13      LEU   2 -22.298  12.317   2.928
   20   1HD2  LEU   2          HD21      LEU   2 -21.293  15.480   5.590
   21   2HD2  LEU   2          HD22      LEU   2 -20.194  14.103   5.550
   22   3HD2  LEU   2          HD23      LEU   2 -21.835  13.906   6.165
   23    H    VAL   3           HN       VAL   3 -17.588  15.842   3.129
   24    HA   VAL   3           HA       VAL   3 -17.343  16.262   0.176
   25    HB   VAL   3           HB       VAL   3 -15.498  17.882   0.623
   26   1HG1  VAL   3          HG11      VAL   3 -17.013  19.745   1.467
   27   2HG1  VAL   3          HG12      VAL   3 -18.257  18.518   1.694
   28   3HG1  VAL   3          HG13      VAL   3 -17.623  18.844   0.080
   29   1HG2  VAL   3          HG21      VAL   3 -15.424  18.877   2.934
   30   2HG2  VAL   3          HG22      VAL   3 -14.873  17.202   2.864
   31   3HG2  VAL   3          HG23      VAL   3 -16.485  17.576   3.473
   32    H    LYS   4           HN       LYS   4 -15.173  15.633  -0.632
   33    HA   LYS   4           HA       LYS   4 -14.241  13.201   0.618
   34   1HB   LYS   4          HB2       LYS   4 -13.269  14.886  -1.689
   35   2HB   LYS   4          HB1       LYS   4 -12.314  13.522  -1.112
   36   1HG   LYS   4          HG2       LYS   4 -13.798  12.845  -2.962
   37   2HG   LYS   4          HG1       LYS   4 -14.230  12.017  -1.466
   38   1HD   LYS   4          HD2       LYS   4 -16.126  13.397  -1.117
   39   2HD   LYS   4          HD1       LYS   4 -15.574  14.593  -2.289
   40   1HE   LYS   4          HE2       LYS   4 -16.305  11.747  -3.025
   41   2HE   LYS   4          HE1       LYS   4 -17.430  13.102  -3.130
   42   1HZ   LYS   4          HZ1       LYS   4 -14.967  12.618  -4.675
   43   2HZ   LYS   4          HZ2       LYS   4 -15.563  14.197  -4.485
   44   3HZ   LYS   4          HZ3       LYS   4 -16.519  13.010  -5.236
   45    HA   PRO   5           HA       PRO   5 -11.299  15.146   3.327
   46   1HB   PRO   5          HB2       PRO   5  -9.708  13.112   4.003
   47   2HB   PRO   5          HB1       PRO   5 -11.434  13.083   4.410
   48   1HG   PRO   5          HG2       PRO   5 -10.030  11.786   2.108
   49   2HG   PRO   5          HG1       PRO   5 -11.205  11.082   3.236
   50   1HD   PRO   5          HD2       PRO   5 -11.916  12.029   0.757
   51   2HD   PRO   5          HD1       PRO   5 -13.020  12.042   2.152
   52    HA   PRO   6           HA       PRO   6  -7.992  16.797   0.723
   53   1HB   PRO   6          HB2       PRO   6  -6.510  16.640   3.339
   54   2HB   PRO   6          HB1       PRO   6  -6.540  17.953   2.144
   55   1HG   PRO   6          HG2       PRO   6  -8.007  18.077   4.363
   56   2HG   PRO   6          HG1       PRO   6  -8.614  18.699   2.819
   57   1HD   PRO   6          HD2       PRO   6  -9.463  16.274   4.313
   58   2HD   PRO   6          HD1       PRO   6 -10.352  17.225   3.104
   59    H    TYR   7           HN       TYR   7  -7.669  13.852   2.577
   60    HA   TYR   7           HA       TYR   7  -4.997  13.173   1.748
   61   1HB   TYR   7          HB2       TYR   7  -7.145  11.132   2.316
   62   2HB   TYR   7          HB1       TYR   7  -5.416  11.025   2.644
   63    HD1  TYR   7           HD1      TYR   7  -8.319  11.146   4.335
   64    HD2  TYR   7           HD2      TYR   7  -4.721  13.474   4.002
   65    HE1  TYR   7           HE1      TYR   7  -8.719  12.090   6.587
   66    HE2  TYR   7           HE2      TYR   7  -5.123  14.414   6.256
   67    HH   TYR   7           HH       TYR   7  -6.670  13.321   8.457
   68    H    SER   8           HN       SER   8  -4.272  12.444  -0.174
   69    HA   SER   8           HA       SER   8  -6.169  12.080  -2.383
   70   1HB   SER   8          HB2       SER   8  -4.136  11.784  -3.757
   71   2HB   SER   8          HB1       SER   8  -4.026  13.237  -2.767
   72    HG   SER   8           HG       SER   8  -2.757  10.738  -2.446
   73    H    TYR   9           HN       TYR   9  -5.554  10.058  -3.874
   74    HA   TYR   9           HA       TYR   9  -6.375   7.717  -2.480
   75   1HB   TYR   9          HB2       TYR   9  -4.902   7.961  -5.119
   76   2HB   TYR   9          HB1       TYR   9  -5.733   6.514  -4.551
   77    HD1  TYR   9           HD1      TYR   9  -8.174   6.433  -4.395
   78    HD2  TYR   9           HD2      TYR   9  -6.147   9.936  -5.833
   79    HE1  TYR   9           HE1      TYR   9 -10.317   7.308  -5.280
   80    HE2  TYR   9           HE2      TYR   9  -8.291  10.813  -6.720
   81    HH   TYR   9           HH       TYR   9 -11.018   8.936  -7.121
   82    H    ILE  10           HN       ILE  10  -3.130   8.822  -3.456
   83    HA   ILE  10           HA       ILE  10  -1.711   6.492  -2.619
   84    HB   ILE  10           HB       ILE  10  -0.803   9.386  -2.619
   85   1HG1  ILE  10          HG12      ILE  10  -1.569   8.699  -4.830
   86   2HG1  ILE  10          HG11      ILE  10   0.188   8.799  -4.828
   87   1HG2  ILE  10          HG21      ILE  10   0.664   6.768  -2.331
   88   2HG2  ILE  10          HG22      ILE  10   0.789   8.220  -1.337
   89   3HG2  ILE  10          HG23      ILE  10   1.475   8.203  -2.962
   90   1HD1  ILE  10          HD11      ILE  10  -1.576   6.382  -4.972
   91   2HD1  ILE  10          HD12      ILE  10   0.003   6.215  -4.206
   92   3HD1  ILE  10          HD13      ILE  10  -0.111   6.754  -5.878
   93    H    ALA  11           HN       ALA  11  -2.463   9.503  -0.844
   94    HA   ALA  11           HA       ALA  11  -1.194   8.669   1.592
   95   1HB   ALA  11          HB1       ALA  11  -1.593  10.986   1.403
   96   2HB   ALA  11          HB2       ALA  11  -2.785  10.461   2.591
   97   3HB   ALA  11          HB3       ALA  11  -3.272  10.749   0.922
   98    H    LEU  12           HN       LEU  12  -4.580   8.416   0.465
   99    HA   LEU  12           HA       LEU  12  -5.644   7.376   2.896
  100   1HB   LEU  12          HB2       LEU  12  -6.446   6.913   0.012
  101   2HB   LEU  12          HB1       LEU  12  -7.383   6.320   1.380
  102    HG   LEU  12           HG       LEU  12  -6.639   9.235   0.995
  103   1HD1  LEU  12          HD11      LEU  12  -9.242   7.819   0.337
  104   2HD1  LEU  12          HD12      LEU  12  -8.081   8.415  -0.849
  105   3HD1  LEU  12          HD13      LEU  12  -8.939   9.551   0.191
  106   1HD2  LEU  12          HD21      LEU  12  -8.343   7.697   2.953
  107   2HD2  LEU  12          HD22      LEU  12  -8.775   9.357   2.556
  108   3HD2  LEU  12          HD23      LEU  12  -7.202   9.005   3.259
  109    H    ILE  13           HN       ILE  13  -4.233   5.697   0.082
  110    HA   ILE  13           HA       ILE  13  -4.563   3.056   1.137
  111    HB   ILE  13           HB       ILE  13  -2.530   4.228  -0.783
  112   1HG1  ILE  13          HG12      ILE  13  -4.872   2.380  -1.314
  113   2HG1  ILE  13          HG11      ILE  13  -5.015   4.136  -1.379
  114   1HG2  ILE  13          HG21      ILE  13  -2.961   1.398   0.180
  115   2HG2  ILE  13          HG22      ILE  13  -1.448   2.291   0.031
  116   3HG2  ILE  13          HG23      ILE  13  -2.280   1.722  -1.415
  117   1HD1  ILE  13          HD11      ILE  13  -3.242   2.374  -3.089
  118   2HD1  ILE  13          HD12      ILE  13  -3.100   4.131  -3.042
  119   3HD1  ILE  13          HD13      ILE  13  -4.586   3.382  -3.624
  120    H    THR  14           HN       THR  14  -2.012   5.484   1.447
  121    HA   THR  14           HA       THR  14  -0.143   3.906   2.917
  122    HB   THR  14           HB       THR  14  -0.650   6.892   3.036
  123    HG1  THR  14           HG1      THR  14   0.791   7.001   1.397
  124   1HG2  THR  14          HG21      THR  14   1.848   6.846   3.651
  125   2HG2  THR  14          HG22      THR  14   1.606   5.134   3.999
  126   3HG2  THR  14          HG23      THR  14   0.706   6.354   4.902
  127    H    MET  15           HN       MET  15  -2.887   5.909   3.955
  128    HA   MET  15           HA       MET  15  -2.403   5.657   6.774
  129   1HB   MET  15          HB2       MET  15  -4.931   6.207   5.201
  130   2HB   MET  15          HB1       MET  15  -4.868   6.226   6.964
  131   1HG   MET  15          HG2       MET  15  -3.128   7.975   6.886
  132   2HG   MET  15          HG1       MET  15  -3.191   7.959   5.125
  133   1HE   MET  15          HE1       MET  15  -3.819  10.749   5.187
  134   2HE   MET  15          HE2       MET  15  -3.352  10.344   6.836
  135   3HE   MET  15          HE3       MET  15  -4.812  11.285   6.547
  136    H    ALA  16           HN       ALA  16  -4.293   3.733   4.472
  137    HA   ALA  16           HA       ALA  16  -5.552   2.008   6.345
  138   1HB   ALA  16          HB1       ALA  16  -4.723   1.723   3.463
  139   2HB   ALA  16          HB2       ALA  16  -6.347   1.874   4.133
  140   3HB   ALA  16          HB3       ALA  16  -5.455   0.364   4.320
  141    H    ILE  17           HN       ILE  17  -2.423   1.655   4.650
  142    HA   ILE  17           HA       ILE  17  -1.723  -0.878   5.750
  143    HB   ILE  17           HB       ILE  17   0.108   1.442   5.040
  144   1HG1  ILE  17          HG12      ILE  17  -0.757  -0.904   3.326
  145   2HG1  ILE  17          HG11      ILE  17  -1.511   0.689   3.254
  146   1HG2  ILE  17          HG21      ILE  17   1.499  -0.076   6.145
  147   2HG2  ILE  17          HG22      ILE  17   1.599  -0.680   4.494
  148   3HG2  ILE  17          HG23      ILE  17   0.543  -1.474   5.655
  149   1HD1  ILE  17          HD11      ILE  17   0.766   1.665   2.794
  150   2HD1  ILE  17          HD12      ILE  17   0.177   0.598   1.520
  151   3HD1  ILE  17          HD13      ILE  17   1.386   0.019   2.664
  152    H    GLN  18           HN       GLN  18  -0.931   2.409   6.813
  153    HA   GLN  18           HA       GLN  18   0.426   1.655   9.222
  154   1HB   GLN  18          HB2       GLN  18  -0.973   4.207   8.387
  155   2HB   GLN  18          HB1       GLN  18  -0.056   4.055   9.888
  156   1HG   GLN  18          HG2       GLN  18   1.947   3.411   8.601
  157   2HG   GLN  18          HG1       GLN  18   1.033   3.569   7.101
  158   1HE2  GLN  18          HE21      GLN  18  -0.334   5.967   8.766
  159   2HE2  GLN  18          HE22      GLN  18   0.730   7.247   8.440
  160    H    ASN  19           HN       ASN  19  -2.968   2.473   8.558
  161    HA   ASN  19           HA       ASN  19  -3.710   2.207  11.382
  162   1HB   ASN  19          HB2       ASN  19  -5.411   2.505   8.890
  163   2HB   ASN  19          HB1       ASN  19  -6.005   2.610  10.549
  164   1HD2  ASN  19          HD21      ASN  19  -3.591   4.005  11.556
  165   2HD2  ASN  19          HD22      ASN  19  -3.660   5.586  10.944
  166    H    ALA  20           HN       ALA  20  -2.945  -0.052   9.095
  167    HA   ALA  20           HA       ALA  20  -5.135  -1.922   9.552
  168   1HB   ALA  20          HB1       ALA  20  -3.803  -2.035   7.481
  169   2HB   ALA  20          HB2       ALA  20  -3.656  -3.544   8.379
  170   3HB   ALA  20          HB3       ALA  20  -2.345  -2.364   8.422
  171    HA   PRO  21           HA       PRO  21  -3.653  -3.517  13.440
  172   1HB   PRO  21          HB2       PRO  21  -4.377  -6.187  13.215
  173   2HB   PRO  21          HB1       PRO  21  -5.508  -4.887  13.633
  174   1HG   PRO  21          HG2       PRO  21  -5.032  -6.199  10.996
  175   2HG   PRO  21          HG1       PRO  21  -6.559  -5.696  11.744
  176   1HD   PRO  21          HD2       PRO  21  -5.384  -4.227   9.796
  177   2HD   PRO  21          HD1       PRO  21  -6.282  -3.460  11.125
  178    H    GLU  22           HN       GLU  22  -2.751  -4.891  10.405
  179    HA   GLU  22           HA       GLU  22  -0.071  -5.619  11.486
  180   1HB   GLU  22          HB2       GLU  22  -1.844  -7.341   9.725
  181   2HB   GLU  22          HB1       GLU  22  -0.119  -7.629   9.947
  182   1HG   GLU  22          HG2       GLU  22  -0.467  -7.860  12.379
  183   2HG   GLU  22          HG1       GLU  22  -2.193  -7.574  12.159
  184    H    LYS  23           HN       LYS  23   1.597  -5.294   9.905
  185    HA   LYS  23           HA       LYS  23   1.073  -3.250   7.978
  186   1HB   LYS  23          HB2       LYS  23   3.393  -5.208   8.148
  187   2HB   LYS  23          HB1       LYS  23   3.368  -3.777   7.123
  188   1HG   LYS  23          HG2       LYS  23   2.893  -3.569  10.097
  189   2HG   LYS  23          HG1       LYS  23   4.526  -3.596   9.439
  190   1HD   LYS  23          HD2       LYS  23   3.865  -1.661   7.948
  191   2HD   LYS  23          HD1       LYS  23   2.350  -1.570   8.845
  192   1HE   LYS  23          HE2       LYS  23   3.993   0.007   9.768
  193   2HE   LYS  23          HE1       LYS  23   3.606  -1.250  10.943
  194   1HZ   LYS  23          HZ1       LYS  23   5.994  -0.839  10.780
  195   2HZ   LYS  23          HZ2       LYS  23   5.963  -1.267   9.136
  196   3HZ   LYS  23          HZ3       LYS  23   5.602  -2.426  10.325
  197    H    LYS  24           HN       LYS  24   1.221  -6.773   7.743
  198    HA   LYS  24           HA       LYS  24   0.795  -6.710   4.831
  199   1HB   LYS  24          HB2       LYS  24   0.786  -8.988   6.839
  200   2HB   LYS  24          HB1       LYS  24   0.616  -9.193   5.095
  201   1HG   LYS  24          HG2       LYS  24   2.807  -8.115   4.750
  202   2HG   LYS  24          HG1       LYS  24   2.982  -7.912   6.493
  203   1HD   LYS  24          HD2       LYS  24   2.879 -10.356   6.796
  204   2HD   LYS  24          HD1       LYS  24   2.706 -10.567   5.052
  205   1HE   LYS  24          HE2       LYS  24   4.900  -9.291   4.811
  206   2HE   LYS  24          HE1       LYS  24   5.089  -9.462   6.556
  207   1HZ   LYS  24          HZ1       LYS  24   5.750 -11.547   6.300
  208   2HZ   LYS  24          HZ2       LYS  24   5.758 -11.307   4.617
  209   3HZ   LYS  24          HZ3       LYS  24   4.379 -11.940   5.381
  210    H    ILE  25           HN       ILE  25  -1.206  -6.345   4.030
  211    HA   ILE  25           HA       ILE  25  -3.578  -7.439   5.479
  212    HB   ILE  25           HB       ILE  25  -3.406  -5.056   6.085
  213   1HG1  ILE  25          HG12      ILE  25  -5.562  -5.422   3.988
  214   2HG1  ILE  25          HG11      ILE  25  -5.639  -6.164   5.586
  215   1HG2  ILE  25          HG21      ILE  25  -3.349  -3.320   4.441
  216   2HG2  ILE  25          HG22      ILE  25  -3.655  -4.458   3.129
  217   3HG2  ILE  25          HG23      ILE  25  -2.104  -4.475   3.967
  218   1HD1  ILE  25          HD11      ILE  25  -6.846  -3.945   5.392
  219   2HD1  ILE  25          HD12      ILE  25  -5.270  -3.189   5.153
  220   3HD1  ILE  25          HD13      ILE  25  -5.632  -4.015   6.669
  221    H    THR  26           HN       THR  26  -5.367  -7.872   4.070
  222    HA   THR  26           HA       THR  26  -4.529  -8.534   1.347
  223    HB   THR  26           HB       THR  26  -6.751  -9.543   1.147
  224    HG1  THR  26           HG1      THR  26  -8.091  -8.187   2.165
  225   1HG2  THR  26          HG21      THR  26  -6.490 -11.234   2.768
  226   2HG2  THR  26          HG22      THR  26  -5.854 -10.108   3.969
  227   3HG2  THR  26          HG23      THR  26  -4.858 -10.583   2.593
  228    H    LEU  27           HN       LEU  27  -5.572  -7.721  -0.559
  229    HA   LEU  27           HA       LEU  27  -5.923  -4.907  -0.611
  230   1HB   LEU  27          HB2       LEU  27  -5.282  -6.259  -2.567
  231   2HB   LEU  27          HB1       LEU  27  -6.866  -7.024  -2.572
  232    HG   LEU  27           HG       LEU  27  -7.950  -4.937  -3.133
  233   1HD1  LEU  27          HD11      LEU  27  -6.813  -3.251  -1.953
  234   2HD1  LEU  27          HD12      LEU  27  -6.364  -2.927  -3.623
  235   3HD1  LEU  27          HD13      LEU  27  -5.235  -3.761  -2.554
  236   1HD2  LEU  27          HD21      LEU  27  -7.157  -6.050  -5.072
  237   2HD2  LEU  27          HD22      LEU  27  -5.484  -5.589  -4.757
  238   3HD2  LEU  27          HD23      LEU  27  -6.647  -4.377  -5.279
  239    H    ASN  28           HN       ASN  28  -8.253  -7.560  -0.451
  240    HA   ASN  28           HA       ASN  28 -10.657  -6.052  -0.673
  241   1HB   ASN  28          HB2       ASN  28 -10.010  -8.605   0.811
  242   2HB   ASN  28          HB1       ASN  28 -11.647  -7.970   0.652
  243   1HD2  ASN  28          HD21      ASN  28 -10.671  -6.930  -2.174
  244   2HD2  ASN  28          HD22      ASN  28 -10.834  -8.310  -3.145
  245    H    GLY  29           HN       GLY  29  -8.639  -6.827   2.138
  246   1HA   GLY  29          HA2       GLY  29 -10.371  -5.758   4.134
  247   2HA   GLY  29          HA1       GLY  29  -8.629  -5.954   4.309
  248    H    ILE  30           HN       ILE  30  -7.845  -4.209   2.165
  249    HA   ILE  30           HA       ILE  30  -7.781  -1.726   3.541
  250    HB   ILE  30           HB       ILE  30  -7.309  -2.388   0.622
  251   1HG1  ILE  30          HG12      ILE  30  -5.363  -1.764   2.864
  252   2HG1  ILE  30          HG11      ILE  30  -5.819  -3.400   2.394
  253   1HG2  ILE  30          HG21      ILE  30  -6.054  -0.178   0.640
  254   2HG2  ILE  30          HG22      ILE  30  -6.858   0.180   2.168
  255   3HG2  ILE  30          HG23      ILE  30  -7.810  -0.035   0.697
  256   1HD1  ILE  30          HD11      ILE  30  -5.069  -2.834   0.044
  257   2HD1  ILE  30          HD12      ILE  30  -3.772  -2.877   1.240
  258   3HD1  ILE  30          HD13      ILE  30  -4.414  -1.330   0.691
  259    H    TYR  31           HN       TYR  31  -9.926  -2.846   0.920
  260    HA   TYR  31           HA       TYR  31 -11.229  -0.360   0.458
  261   1HB   TYR  31          HB2       TYR  31 -12.081  -3.238   0.156
  262   2HB   TYR  31          HB1       TYR  31 -13.213  -1.934  -0.182
  263    HD1  TYR  31           HD1      TYR  31 -10.830  -4.029  -1.653
  264    HD2  TYR  31           HD2      TYR  31 -12.114   0.060  -1.643
  265    HE1  TYR  31           HE1      TYR  31  -9.802  -3.707  -3.878
  266    HE2  TYR  31           HE2      TYR  31 -11.084   0.386  -3.869
  267    HH   TYR  31           HH       TYR  31 -10.335  -0.813  -5.729
  268    H    GLN  32           HN       GLN  32 -11.953  -2.938   2.797
  269    HA   GLN  32           HA       GLN  32 -14.383  -1.861   3.796
  270   1HB   GLN  32          HB2       GLN  32 -12.224  -3.482   5.165
  271   2HB   GLN  32          HB1       GLN  32 -13.819  -3.181   5.855
  272   1HG   GLN  32          HG2       GLN  32 -14.891  -4.304   3.980
  273   2HG   GLN  32          HG1       GLN  32 -13.336  -4.500   3.170
  274   1HE2  GLN  32          HE21      GLN  32 -14.183  -6.906   3.372
  275   2HE2  GLN  32          HE22      GLN  32 -13.702  -7.741   4.770
  276    H    PHE  33           HN       PHE  33 -11.025  -1.240   4.733
  277    HA   PHE  33           HA       PHE  33 -11.530   0.370   7.012
  278   1HB   PHE  33          HB2       PHE  33  -9.315  -0.562   6.384
  279   2HB   PHE  33          HB1       PHE  33  -9.229   0.596   5.057
  280    HD1  PHE  33           HD1      PHE  33  -8.742   2.923   5.448
  281    HD2  PHE  33           HD2      PHE  33  -9.324   0.225   8.739
  282    HE1  PHE  33           HE1      PHE  33  -7.868   4.639   7.010
  283    HE2  PHE  33           HE2      PHE  33  -8.449   1.940  10.302
  284    HZ   PHE  33           HZ       PHE  33  -7.720   4.147   9.437
  285    H    ILE  34           HN       ILE  34 -10.977   1.410   3.629
  286    HA   ILE  34           HA       ILE  34 -11.196   4.191   4.113
  287    HB   ILE  34           HB       ILE  34 -11.787   2.541   1.648
  288   1HG1  ILE  34          HG12      ILE  34  -9.473   4.381   2.317
  289   2HG1  ILE  34          HG11      ILE  34  -9.448   2.645   2.623
  290   1HG2  ILE  34          HG21      ILE  34 -11.793   5.535   2.072
  291   2HG2  ILE  34          HG22      ILE  34 -13.014   4.546   1.274
  292   3HG2  ILE  34          HG23      ILE  34 -11.460   4.828   0.491
  293   1HD1  ILE  34          HD11      ILE  34  -9.962   3.879  -0.097
  294   2HD1  ILE  34          HD12      ILE  34  -9.738   2.167   0.261
  295   3HD1  ILE  34          HD13      ILE  34  -8.390   3.290   0.440
  296    H    MET  35           HN       MET  35 -13.804   1.948   3.045
  297    HA   MET  35           HA       MET  35 -15.819   3.941   2.924
  298   1HB   MET  35          HB2       MET  35 -15.991   0.972   3.458
  299   2HB   MET  35          HB1       MET  35 -17.418   1.996   3.286
  300   1HG   MET  35          HG2       MET  35 -16.629   2.710   1.053
  301   2HG   MET  35          HG1       MET  35 -15.220   1.666   1.221
  302   1HE   MET  35          HE1       MET  35 -15.064  -0.538   0.421
  303   2HE   MET  35          HE2       MET  35 -16.286  -1.793   0.605
  304   3HE   MET  35          HE3       MET  35 -15.643  -0.984   2.032
  305    H    ASP  36           HN       ASP  36 -14.775   1.961   5.713
  306    HA   ASP  36           HA       ASP  36 -16.883   2.889   7.434
  307   1HB   ASP  36          HB2       ASP  36 -14.154   1.727   8.023
  308   2HB   ASP  36          HB1       ASP  36 -15.336   2.105   9.278
  309    H    ARG  37           HN       ARG  37 -13.492   4.006   7.052
  310    HA   ARG  37           HA       ARG  37 -13.781   6.064   9.053
  311   1HB   ARG  37          HB2       ARG  37 -11.814   5.707   6.778
  312   2HB   ARG  37          HB1       ARG  37 -11.690   7.007   7.959
  313   1HG   ARG  37          HG2       ARG  37 -11.986   4.215   9.017
  314   2HG   ARG  37          HG1       ARG  37 -10.438   4.645   8.300
  315   1HD   ARG  37          HD2       ARG  37 -10.856   5.059  10.870
  316   2HD   ARG  37          HD1       ARG  37  -9.975   6.254   9.919
  317    HE   ARG  37           HE       ARG  37 -12.567   7.132   9.719
  318   1HH1  ARG  37          HH21      ARG  37 -10.492   6.153  12.287
  319   2HH1  ARG  37          HH22      ARG  37 -11.204   7.219  13.452
  320   1HH2  ARG  37          HH11      ARG  37 -13.523   8.525  11.228
  321   2HH2  ARG  37          HH12      ARG  37 -12.922   8.562  12.852
  322    H    PHE  38           HN       PHE  38 -14.115   6.022   5.531
  323    HA   PHE  38           HA       PHE  38 -15.297   8.774   5.658
  324   1HB   PHE  38          HB2       PHE  38 -13.863   7.500   3.314
  325   2HB   PHE  38          HB1       PHE  38 -14.421   9.171   3.440
  326    HD1  PHE  38           HD1      PHE  38 -11.761   6.842   4.202
  327    HD2  PHE  38           HD2      PHE  38 -13.429  10.660   5.253
  328    HE1  PHE  38           HE1      PHE  38  -9.632   7.468   5.309
  329    HE2  PHE  38           HE2      PHE  38 -11.298  11.285   6.359
  330    HZ   PHE  38           HZ       PHE  38  -9.402   9.688   6.388
  331    HA   PRO  39           HA       PRO  39 -18.669   6.088   4.154
  332   1HB   PRO  39          HB2       PRO  39 -20.765   7.679   4.784
  333   2HB   PRO  39          HB1       PRO  39 -19.862   6.781   6.022
  334   1HG   PRO  39          HG2       PRO  39 -19.678   9.661   5.266
  335   2HG   PRO  39          HG1       PRO  39 -19.637   8.915   6.873
  336   1HD   PRO  39          HD2       PRO  39 -17.380   9.727   5.474
  337   2HD   PRO  39          HD1       PRO  39 -17.368   8.492   6.752
  338    H    PHE  40           HN       PHE  40 -17.722   9.178   3.002
  339    HA   PHE  40           HA       PHE  40 -19.738   9.745   1.086
  340   1HB   PHE  40          HB2       PHE  40 -16.872  10.220   0.331
  341   2HB   PHE  40          HB1       PHE  40 -18.253  11.310   0.232
  342    HD1  PHE  40           HD1      PHE  40 -15.245  11.198   1.707
  343    HD2  PHE  40           HD2      PHE  40 -19.376  11.329   2.885
  344    HE1  PHE  40           HE1      PHE  40 -14.600  12.241   3.865
  345    HE2  PHE  40           HE2      PHE  40 -18.727  12.364   5.041
  346    HZ   PHE  40           HZ       PHE  40 -16.341  12.824   5.530
  347    H    TYR  41           HN       TYR  41 -16.990   7.556   0.992
  348    HA   TYR  41           HA       TYR  41 -17.123   6.894  -1.791
  349   1HB   TYR  41          HB2       TYR  41 -16.016   5.415   0.605
  350   2HB   TYR  41          HB1       TYR  41 -15.771   4.901  -1.068
  351    HD1  TYR  41           HD1      TYR  41 -15.124   7.578   1.392
  352    HD2  TYR  41           HD2      TYR  41 -14.310   6.114  -2.550
  353    HE1  TYR  41           HE1      TYR  41 -13.281   9.221   1.172
  354    HE2  TYR  41           HE2      TYR  41 -12.463   7.738  -2.794
  355    HH   TYR  41           HH       TYR  41 -11.514   9.840  -0.076
  356    H    ARG  42           HN       ARG  42 -18.862   5.683   1.027
  357    HA   ARG  42           HA       ARG  42 -19.775   3.229  -0.078
  358   1HB   ARG  42          HB2       ARG  42 -21.074   5.126   1.892
  359   2HB   ARG  42          HB1       ARG  42 -21.735   3.540   1.499
  360   1HG   ARG  42          HG2       ARG  42 -19.620   2.482   2.220
  361   2HG   ARG  42          HG1       ARG  42 -18.971   4.071   2.631
  362   1HD   ARG  42          HD2       ARG  42 -19.851   2.995   4.649
  363   2HD   ARG  42          HD1       ARG  42 -20.846   4.393   4.236
  364    HE   ARG  42           HE       ARG  42 -22.084   2.259   2.952
  365   1HH1  ARG  42          HH21      ARG  42 -21.075   3.043   6.152
  366   2HH1  ARG  42          HH22      ARG  42 -22.315   2.107   6.916
  367   1HH2  ARG  42          HH11      ARG  42 -23.710   1.035   3.924
  368   2HH2  ARG  42          HH12      ARG  42 -23.812   0.970   5.651
  369    H    GLU  43           HN       GLU  43 -21.079   6.535  -0.364
  370    HA   GLU  43           HA       GLU  43 -23.421   5.755  -1.831
  371   1HB   GLU  43          HB2       GLU  43 -21.910   8.378  -1.737
  372   2HB   GLU  43          HB1       GLU  43 -23.443   8.166  -2.578
  373   1HG   GLU  43          HG2       GLU  43 -24.040   9.007  -0.438
  374   2HG   GLU  43          HG1       GLU  43 -24.366   7.277  -0.349
  375    H    ASN  44           HN       ASN  44 -20.197   6.693  -2.764
  376    HA   ASN  44           HA       ASN  44 -20.807   6.065  -5.629
  377   1HB   ASN  44          HB2       ASN  44 -18.517   7.577  -4.335
  378   2HB   ASN  44          HB1       ASN  44 -18.633   7.236  -6.061
  379   1HD2  ASN  44          HD21      ASN  44 -18.643   9.924  -4.906
  380   2HD2  ASN  44          HD22      ASN  44 -20.147  10.620  -5.274
  381    H    LYS  45           HN       LYS  45 -20.433   3.876  -5.913
  382    HA   LYS  45           HA       LYS  45 -18.073   2.632  -4.585
  383   1HB   LYS  45          HB2       LYS  45 -20.410   1.458  -6.120
  384   2HB   LYS  45          HB1       LYS  45 -19.087   0.507  -5.447
  385   1HG   LYS  45          HG2       LYS  45 -19.623   1.343  -3.192
  386   2HG   LYS  45          HG1       LYS  45 -20.950   2.296  -3.858
  387   1HD   LYS  45          HD2       LYS  45 -22.024   0.223  -4.674
  388   2HD   LYS  45          HD1       LYS  45 -20.702  -0.723  -3.991
  389   1HE   LYS  45          HE2       LYS  45 -22.289   1.168  -2.259
  390   2HE   LYS  45          HE1       LYS  45 -22.873  -0.462  -2.585
  391   1HZ   LYS  45          HZ1       LYS  45 -21.601  -0.991  -0.839
  392   2HZ   LYS  45          HZ2       LYS  45 -20.652   0.414  -0.956
  393   3HZ   LYS  45          HZ3       LYS  45 -20.318  -0.927  -1.945
  394    H    GLN  46           HN       GLN  46 -19.488   3.107  -7.819
  395    HA   GLN  46           HA       GLN  46 -17.224   1.844  -9.150
  396   1HB   GLN  46          HB2       GLN  46 -19.529   3.531 -10.162
  397   2HB   GLN  46          HB1       GLN  46 -18.320   2.798 -11.216
  398   1HG   GLN  46          HG2       GLN  46 -19.907   1.176  -9.220
  399   2HG   GLN  46          HG1       GLN  46 -20.478   1.459 -10.865
  400   1HE2  GLN  46          HE21      GLN  46 -18.399   1.100 -12.512
  401   2HE2  GLN  46          HE22      GLN  46 -17.629  -0.394 -12.280
  402    H    GLY  47           HN       GLY  47 -15.459   2.857 -10.078
  403   1HA   GLY  47          HA2       GLY  47 -14.416   4.868 -11.051
  404   2HA   GLY  47          HA1       GLY  47 -15.280   5.842  -9.868
  405    H    TRP  48           HN       TRP  48 -14.751   4.890  -7.470
  406    HA   TRP  48           HA       TRP  48 -11.821   5.195  -7.246
  407   1HB   TRP  48          HB2       TRP  48 -12.190   5.725  -4.986
  408   2HB   TRP  48          HB1       TRP  48 -13.576   6.418  -5.818
  409    HD1  TRP  48           HD1      TRP  48 -15.932   5.097  -5.586
  410    HE1  TRP  48           HE1      TRP  48 -16.794   3.541  -3.724
  411    HE3  TRP  48           HE3      TRP  48 -11.522   3.946  -3.293
  412    HZ2  TRP  48           HZ2      TRP  48 -15.750   2.005  -1.546
  413    HZ3  TRP  48           HZ3      TRP  48 -11.482   2.437  -1.330
  414    HH2  TRP  48           HH2      TRP  48 -13.588   1.465  -0.454
  415    H    GLN  49           HN       GLN  49 -14.095   2.624  -7.255
  416    HA   GLN  49           HA       GLN  49 -12.746   0.863  -5.420
  417   1HB   GLN  49          HB2       GLN  49 -15.124   0.629  -6.241
  418   2HB   GLN  49          HB1       GLN  49 -14.473   0.067  -7.776
  419   1HG   GLN  49          HG2       GLN  49 -14.881  -1.933  -6.612
  420   2HG   GLN  49          HG1       GLN  49 -13.164  -1.662  -6.328
  421   1HE2  GLN  49          HE21      GLN  49 -16.194  -2.121  -4.767
  422   2HE2  GLN  49          HE22      GLN  49 -15.696  -1.731  -3.192
  423    H    ASN  50           HN       ASN  50 -12.837   0.713  -9.016
  424    HA   ASN  50           HA       ASN  50 -10.654  -1.184  -9.083
  425   1HB   ASN  50          HB2       ASN  50 -11.801   0.552 -11.290
  426   2HB   ASN  50          HB1       ASN  50 -10.695  -0.801 -11.529
  427   1HD2  ASN  50          HD21      ASN  50 -13.747  -0.301 -12.147
  428   2HD2  ASN  50          HD22      ASN  50 -14.476  -1.732 -11.596
  429    H    SER  51           HN       SER  51 -10.809   2.329  -9.203
  430    HA   SER  51           HA       SER  51  -8.261   2.837 -10.355
  431   1HB   SER  51          HB2       SER  51  -9.848   4.394  -8.298
  432   2HB   SER  51          HB1       SER  51  -8.366   4.996  -9.036
  433    HG   SER  51           HG       SER  51  -9.541   5.540 -10.679
  434    H    ILE  52           HN       ILE  52  -9.182   2.126  -7.006
  435    HA   ILE  52           HA       ILE  52  -6.679   2.666  -5.781
  436    HB   ILE  52           HB       ILE  52  -8.846   0.657  -5.129
  437   1HG1  ILE  52          HG12      ILE  52  -9.178   3.266  -5.060
  438   2HG1  ILE  52          HG11      ILE  52  -9.761   2.283  -3.727
  439   1HG2  ILE  52          HG21      ILE  52  -6.953  -0.227  -4.034
  440   2HG2  ILE  52          HG22      ILE  52  -7.752   0.744  -2.798
  441   3HG2  ILE  52          HG23      ILE  52  -6.330   1.373  -3.630
  442   1HD1  ILE  52          HD11      ILE  52  -6.982   3.424  -3.626
  443   2HD1  ILE  52          HD12      ILE  52  -8.041   2.950  -2.301
  444   3HD1  ILE  52          HD13      ILE  52  -8.370   4.426  -3.206
  445    H    ARG  53           HN       ARG  53  -7.899  -0.376  -7.240
  446    HA   ARG  53           HA       ARG  53  -5.532  -1.895  -6.603
  447   1HB   ARG  53          HB2       ARG  53  -7.320  -2.473  -8.973
  448   2HB   ARG  53          HB1       ARG  53  -6.490  -3.612  -7.912
  449   1HG   ARG  53          HG2       ARG  53  -7.970  -2.633  -6.030
  450   2HG   ARG  53          HG1       ARG  53  -8.935  -1.949  -7.339
  451   1HD   ARG  53          HD2       ARG  53  -8.504  -4.834  -6.614
  452   2HD   ARG  53          HD1       ARG  53 -10.006  -3.989  -7.004
  453    HE   ARG  53           HE       ARG  53  -8.629  -3.861  -9.371
  454   1HH1  ARG  53          HH21      ARG  53  -9.380  -6.364  -7.122
  455   2HH1  ARG  53          HH22      ARG  53  -9.487  -7.599  -8.331
  456   1HH2  ARG  53          HH11      ARG  53  -8.773  -5.462 -10.962
  457   2HH2  ARG  53          HH12      ARG  53  -9.147  -7.088 -10.503
  458    H    HIS  54           HN       HIS  54  -6.549  -0.185  -9.591
  459    HA   HIS  54           HA       HIS  54  -4.313  -0.970 -11.165
  460   1HB   HIS  54          HB2       HIS  54  -6.052   1.505 -11.239
  461   2HB   HIS  54          HB1       HIS  54  -4.787   1.197 -12.429
  462    HD1  HIS  54           HD1      HIS  54  -8.265   0.791 -12.127
  463    HD2  HIS  54           HD2      HIS  54  -5.224  -1.757 -13.406
  464    HE1  HIS  54           HE1      HIS  54  -9.375  -1.001 -13.531
  465    H    ASN  55           HN       ASN  55  -4.746   1.786  -8.953
  466    HA   ASN  55           HA       ASN  55  -2.211   3.005  -9.474
  467   1HB   ASN  55          HB2       ASN  55  -4.004   4.141  -8.207
  468   2HB   ASN  55          HB1       ASN  55  -3.815   2.975  -6.896
  469   1HD2  ASN  55          HD21      ASN  55  -1.754   5.241  -8.822
  470   2HD2  ASN  55          HD22      ASN  55  -0.790   5.706  -7.505
  471    H    LEU  56           HN       LEU  56  -3.227   0.502  -7.161
  472    HA   LEU  56           HA       LEU  56  -0.739   0.225  -5.826
  473   1HB   LEU  56          HB2       LEU  56  -3.036  -1.656  -6.307
  474   2HB   LEU  56          HB1       LEU  56  -1.597  -2.200  -5.451
  475    HG   LEU  56           HG       LEU  56  -3.149   0.283  -4.668
  476   1HD1  LEU  56          HD11      LEU  56  -4.717  -1.460  -4.372
  477   2HD1  LEU  56          HD12      LEU  56  -3.983  -1.263  -2.781
  478   3HD1  LEU  56          HD13      LEU  56  -3.484  -2.596  -3.822
  479   1HD2  LEU  56          HD21      LEU  56  -0.840  -1.262  -3.508
  480   2HD2  LEU  56          HD22      LEU  56  -1.971  -0.498  -2.396
  481   3HD2  LEU  56          HD23      LEU  56  -1.105   0.479  -3.573
  482    H    SER  57           HN       SER  57  -1.992  -1.488  -8.699
  483    HA   SER  57           HA       SER  57   0.417  -3.043  -9.045
  484   1HB   SER  57          HB2       SER  57  -1.800  -3.666 -10.026
  485   2HB   SER  57          HB1       SER  57  -1.657  -2.302 -11.131
  486    HG   SER  57           HG       SER  57  -0.887  -4.470 -11.851
  487    H    LEU  58           HN       LEU  58  -0.760   0.001 -10.476
  488    HA   LEU  58           HA       LEU  58   1.435   0.319 -12.292
  489   1HB   LEU  58          HB2       LEU  58  -0.448   2.323 -11.040
  490   2HB   LEU  58          HB1       LEU  58   0.750   2.756 -12.257
  491    HG   LEU  58           HG       LEU  58  -1.344   0.602 -12.648
  492   1HD1  LEU  58          HD11      LEU  58  -2.541   2.665 -12.409
  493   2HD1  LEU  58          HD12      LEU  58  -2.426   2.357 -14.141
  494   3HD1  LEU  58          HD13      LEU  58  -1.359   3.539 -13.382
  495   1HD2  LEU  58          HD21      LEU  58  -0.704   1.336 -15.137
  496   2HD2  LEU  58          HD22      LEU  58   0.255   0.146 -14.268
  497   3HD2  LEU  58          HD23      LEU  58   0.803   1.818 -14.364
  498    H    ASN  59           HN       ASN  59   0.927   1.418  -8.946
  499    HA   ASN  59           HA       ASN  59   3.430   2.896  -8.875
  500   1HB   ASN  59          HB2       ASN  59   1.609   1.883  -6.669
  501   2HB   ASN  59          HB1       ASN  59   3.027   2.894  -6.388
  502   1HD2  ASN  59          HD21      ASN  59   0.496   3.885  -5.653
  503   2HD2  ASN  59          HD22      ASN  59   0.053   5.143  -6.704
  504    H    GLU  60           HN       GLU  60   5.400   1.928  -8.815
  505    HA   GLU  60           HA       GLU  60   5.599  -0.917  -8.022
  506   1HB   GLU  60          HB2       GLU  60   7.684   1.012  -9.096
  507   2HB   GLU  60          HB1       GLU  60   7.926  -0.716  -8.837
  508   1HG   GLU  60          HG2       GLU  60   6.112  -1.214 -10.437
  509   2HG   GLU  60          HG1       GLU  60   5.871   0.514 -10.701
  510    H    CYS  61           HN       CYS  61   5.640   2.014  -6.488
  511    HA   CYS  61           HA       CYS  61   7.880   1.819  -4.724
  512   1HB   CYS  61          HB2       CYS  61   5.155   3.105  -4.396
  513   2HB   CYS  61          HB1       CYS  61   6.453   3.278  -3.215
  514    HG   CYS  61           HG       CYS  61   6.641   4.333  -6.156
  515    H    PHE  62           HN       PHE  62   4.573   0.534  -4.524
  516    HA   PHE  62           HA       PHE  62   5.034  -0.640  -1.881
  517   1HB   PHE  62          HB2       PHE  62   2.799  -1.127  -3.875
  518   2HB   PHE  62          HB1       PHE  62   2.802  -1.615  -2.179
  519    HD1  PHE  62           HD1      PHE  62   3.042   0.212  -0.391
  520    HD2  PHE  62           HD2      PHE  62   2.109   1.048  -4.500
  521    HE1  PHE  62           HE1      PHE  62   2.183   2.447   0.258
  522    HE2  PHE  62           HE2      PHE  62   1.251   3.282  -3.851
  523    HZ   PHE  62           HZ       PHE  62   1.288   3.981  -1.472
  524    H    VAL  63           HN       VAL  63   5.157  -2.926  -1.475
  525    HA   VAL  63           HA       VAL  63   5.964  -4.609  -3.829
  526    HB   VAL  63           HB       VAL  63   7.204  -4.526  -1.060
  527   1HG1  VAL  63          HG11      VAL  63   7.207  -6.806  -1.824
  528   2HG1  VAL  63          HG12      VAL  63   8.821  -6.166  -2.130
  529   3HG1  VAL  63          HG13      VAL  63   7.668  -6.321  -3.456
  530   1HG2  VAL  63          HG21      VAL  63   7.895  -2.667  -2.526
  531   2HG2  VAL  63          HG22      VAL  63   8.299  -3.818  -3.801
  532   3HG2  VAL  63          HG23      VAL  63   9.222  -3.806  -2.299
  533    H    LYS  64           HN       LYS  64   4.787  -6.459  -3.967
  534    HA   LYS  64           HA       LYS  64   2.915  -7.136  -1.801
  535   1HB   LYS  64          HB2       LYS  64   3.387  -8.170  -4.594
  536   2HB   LYS  64          HB1       LYS  64   2.386  -9.081  -3.467
  537   1HG   LYS  64          HG2       LYS  64   0.983  -7.054  -3.122
  538   2HG   LYS  64          HG1       LYS  64   1.945  -6.208  -4.334
  539   1HD   LYS  64          HD2       LYS  64   0.697  -8.859  -5.046
  540   2HD   LYS  64          HD1       LYS  64  -0.311  -7.419  -5.030
  541   1HE   LYS  64          HE2       LYS  64   1.164  -6.313  -6.624
  542   2HE   LYS  64          HE1       LYS  64   2.275  -7.682  -6.588
  543   1HZ   LYS  64          HZ1       LYS  64   0.562  -7.557  -8.465
  544   2HZ   LYS  64          HZ2       LYS  64  -0.563  -8.054  -7.294
  545   3HZ   LYS  64          HZ3       LYS  64   0.768  -9.041  -7.671
  546    H    VAL  65           HN       VAL  65   2.924  -9.123  -0.678
  547    HA   VAL  65           HA       VAL  65   5.421 -10.757  -0.857
  548    HB   VAL  65           HB       VAL  65   4.661 -10.822   1.862
  549   1HG1  VAL  65          HG11      VAL  65   6.752  -9.503   2.201
  550   2HG1  VAL  65          HG12      VAL  65   6.818  -9.223   0.461
  551   3HG1  VAL  65          HG13      VAL  65   6.960 -10.862   1.096
  552   1HG2  VAL  65          HG21      VAL  65   4.530  -8.499   2.553
  553   2HG2  VAL  65          HG22      VAL  65   3.240  -8.805   1.391
  554   3HG2  VAL  65          HG23      VAL  65   4.696  -7.951   0.885
  555    HA   PRO  66           HA       PRO  66   1.545 -13.280  -1.558
  556   1HB   PRO  66          HB2       PRO  66   3.848 -15.036  -2.378
  557   2HB   PRO  66          HB1       PRO  66   2.247 -14.865  -3.127
  558   1HG   PRO  66          HG2       PRO  66   4.356 -13.668  -4.188
  559   2HG   PRO  66          HG1       PRO  66   2.787 -12.845  -4.126
  560   1HD   PRO  66          HD2       PRO  66   5.236 -12.345  -2.493
  561   2HD   PRO  66          HD1       PRO  66   3.964 -11.205  -2.987
  562    H    ARG  67           HN       ARG  67   0.909 -15.338  -0.529
  563    HA   ARG  67           HA       ARG  67   2.074 -15.610   2.129
  564   1HB   ARG  67          HB2       ARG  67   0.019 -17.359   0.738
  565   2HB   ARG  67          HB1       ARG  67   0.395 -17.368   2.460
  566   1HG   ARG  67          HG2       ARG  67  -0.176 -14.800   2.310
  567   2HG   ARG  67          HG1       ARG  67  -1.024 -15.264   0.845
  568   1HD   ARG  67          HD2       ARG  67  -2.582 -15.330   2.715
  569   2HD   ARG  67          HD1       ARG  67  -2.281 -16.978   2.159
  570    HE   ARG  67           HE       ARG  67  -0.404 -16.630   4.150
  571   1HH1  ARG  67          HH21      ARG  67  -3.815 -16.197   3.855
  572   2HH1  ARG  67          HH22      ARG  67  -4.135 -16.560   5.518
  573   1HH2  ARG  67          HH11      ARG  67  -0.806 -17.108   6.317
  574   2HH2  ARG  67          HH12      ARG  67  -2.434 -17.080   6.911
  575    H    ASP  68           HN       ASP  68   2.945 -17.690   2.933
  576    HA   ASP  68           HA       ASP  68   4.944 -18.769   1.167
  577   1HB   ASP  68          HB2       ASP  68   3.880 -19.714   3.846
  578   2HB   ASP  68          HB1       ASP  68   5.250 -20.462   3.023
  579    H    ASP  69           HN       ASP  69   5.032 -20.989   0.351
  580    HA   ASP  69           HA       ASP  69   2.619 -21.849  -0.906
  581   1HB   ASP  69          HB2       ASP  69   5.231 -23.287  -0.370
  582   2HB   ASP  69          HB1       ASP  69   3.934 -23.975  -1.348
  583    H    LYS  70           HN       LYS  70   3.850 -22.363   2.261
  584    HA   LYS  70           HA       LYS  70   2.444 -24.845   2.804
  585   1HB   LYS  70          HB2       LYS  70   3.659 -22.734   4.607
  586   2HB   LYS  70          HB1       LYS  70   2.958 -24.242   5.200
  587   1HG   LYS  70          HG2       LYS  70   4.557 -25.559   3.971
  588   2HG   LYS  70          HG1       LYS  70   5.149 -24.138   3.112
  589   1HD   LYS  70          HD2       LYS  70   6.731 -24.642   4.865
  590   2HD   LYS  70          HD1       LYS  70   5.860 -23.182   5.329
  591   1HE   LYS  70          HE2       LYS  70   4.546 -24.329   6.924
  592   2HE   LYS  70          HE1       LYS  70   4.930 -25.907   6.236
  593   1HZ   LYS  70          HZ1       LYS  70   7.353 -25.150   6.830
  594   2HZ   LYS  70          HZ2       LYS  70   6.350 -25.879   7.991
  595   3HZ   LYS  70          HZ3       LYS  70   6.544 -24.192   7.971
  596    H    LYS  71           HN       LYS  71   1.425 -21.662   2.366
  597    HA   LYS  71           HA       LYS  71  -1.165 -22.221   3.776
  598   1HB   LYS  71          HB2       LYS  71   0.283 -19.563   3.579
  599   2HB   LYS  71          HB1       LYS  71  -1.312 -19.806   4.286
  600   1HG   LYS  71          HG2       LYS  71   1.231 -21.141   5.261
  601   2HG   LYS  71          HG1       LYS  71   0.496 -19.720   5.998
  602   1HD   LYS  71          HD2       LYS  71  -1.663 -21.255   6.090
  603   2HD   LYS  71          HD1       LYS  71  -0.489 -22.563   5.963
  604   1HE   LYS  71          HE2       LYS  71  -0.657 -20.442   8.110
  605   2HE   LYS  71          HE1       LYS  71  -0.818 -22.187   8.301
  606   1HZ   LYS  71          HZ1       LYS  71   1.601 -21.860   7.084
  607   2HZ   LYS  71          HZ2       LYS  71   1.347 -22.183   8.733
  608   3HZ   LYS  71          HZ3       LYS  71   1.546 -20.583   8.198
  609    HA   PRO  72           HA       PRO  72  -1.780 -21.560  -0.810
  610   1HB   PRO  72          HB2       PRO  72  -4.168 -23.205  -0.062
  611   2HB   PRO  72          HB1       PRO  72  -3.075 -23.373  -1.449
  612   1HG   PRO  72          HG2       PRO  72  -2.944 -25.049   0.612
  613   2HG   PRO  72          HG1       PRO  72  -1.477 -24.502  -0.221
  614   1HD   PRO  72          HD2       PRO  72  -2.564 -23.641   2.439
  615   2HD   PRO  72          HD1       PRO  72  -0.874 -23.839   1.924
  616    H    GLY  73           HN       GLY  73  -4.747 -21.644  -1.241
  617   1HA   GLY  73          HA2       GLY  73  -6.553 -20.151  -1.212
  618   2HA   GLY  73          HA1       GLY  73  -6.075 -19.759   0.439
  619    H    LYS  74           HN       LYS  74  -5.771 -17.612   0.640
  620    HA   LYS  74           HA       LYS  74  -5.373 -15.809  -1.527
  621   1HB   LYS  74          HB2       LYS  74  -4.742 -15.479   1.421
  622   2HB   LYS  74          HB1       LYS  74  -4.769 -14.160   0.255
  623   1HG   LYS  74          HG2       LYS  74  -7.160 -15.970   0.626
  624   2HG   LYS  74          HG1       LYS  74  -6.905 -14.575   1.669
  625   1HD   LYS  74          HD2       LYS  74  -6.743 -13.157  -0.431
  626   2HD   LYS  74          HD1       LYS  74  -7.277 -14.572  -1.338
  627   1HE   LYS  74          HE2       LYS  74  -9.174 -13.093  -0.765
  628   2HE   LYS  74          HE1       LYS  74  -9.334 -14.678  -0.007
  629   1HZ   LYS  74          HZ1       LYS  74  -7.875 -12.759   1.572
  630   2HZ   LYS  74          HZ2       LYS  74  -9.130 -13.811   2.024
  631   3HZ   LYS  74          HZ3       LYS  74  -9.490 -12.322   1.291
  632    H    GLY  75           HN       GLY  75  -3.534 -14.940  -2.438
  633   1HA   GLY  75          HA2       GLY  75  -0.876 -15.840  -1.385
  634   2HA   GLY  75          HA1       GLY  75  -1.266 -15.992  -3.094
  635    H    SER  76           HN       SER  76  -2.102 -13.268  -0.931
  636    HA   SER  76           HA       SER  76  -0.040 -11.587  -2.207
  637   1HB   SER  76          HB2       SER  76  -2.999 -11.140  -2.661
  638   2HB   SER  76          HB1       SER  76  -1.763  -9.931  -2.993
  639    HG   SER  76           HG       SER  76  -1.726 -12.563  -4.052
  640    H    TYR  77           HN       TYR  77   0.669 -10.125  -0.769
  641    HA   TYR  77           HA       TYR  77  -1.174  -9.094   1.340
  642   1HB   TYR  77          HB2       TYR  77   1.532 -10.355   1.686
  643   2HB   TYR  77          HB1       TYR  77   1.110  -9.016   2.738
  644    HD1  TYR  77           HD1      TYR  77   1.347 -12.377   2.814
  645    HD2  TYR  77           HD2      TYR  77  -1.661  -9.364   3.480
  646    HE1  TYR  77           HE1      TYR  77   0.143 -13.902   4.350
  647    HE2  TYR  77           HE2      TYR  77  -2.865 -10.909   4.980
  648    HH   TYR  77           HH       TYR  77  -2.834 -12.870   6.009
  649    H    TRP  78           HN       TRP  78  -0.457  -6.927   2.111
  650    HA   TRP  78           HA       TRP  78   1.316  -5.533   0.123
  651   1HB   TRP  78          HB2       TRP  78  -1.281  -4.633   1.388
  652   2HB   TRP  78          HB1       TRP  78  -0.162  -3.515   0.603
  653    HD1  TRP  78           HD1      TRP  78  -2.823  -6.053  -0.134
  654    HE1  TRP  78           HE1      TRP  78  -3.100  -6.306  -2.687
  655    HE3  TRP  78           HE3      TRP  78   1.264  -3.438  -1.732
  656    HZ2  TRP  78           HZ2      TRP  78  -1.754  -5.515  -5.088
  657    HZ3  TRP  78           HZ3      TRP  78   1.740  -3.205  -4.154
  658    HH2  TRP  78           HH2      TRP  78   0.237  -4.236  -5.829
  659    H    THR  79           HN       THR  79   2.916  -4.308   0.955
  660    HA   THR  79           HA       THR  79   2.796  -3.337   3.736
  661    HB   THR  79           HB       THR  79   3.715  -5.676   3.867
  662    HG1  THR  79           HG1      THR  79   4.654  -3.436   4.881
  663   1HG2  THR  79          HG21      THR  79   5.774  -6.247   2.852
  664   2HG2  THR  79          HG22      THR  79   6.143  -4.567   2.461
  665   3HG2  THR  79          HG23      THR  79   4.876  -5.420   1.580
  666    H    LEU  80           HN       LEU  80   4.640  -1.834   4.174
  667    HA   LEU  80           HA       LEU  80   5.256  -0.275   1.775
  668   1HB   LEU  80          HB2       LEU  80   6.117   0.083   4.661
  669   2HB   LEU  80          HB1       LEU  80   6.417   1.246   3.372
  670    HG   LEU  80           HG       LEU  80   3.667   0.287   4.202
  671   1HD1  LEU  80          HD11      LEU  80   4.570   1.542   6.034
  672   2HD1  LEU  80          HD12      LEU  80   3.494   2.631   5.157
  673   3HD1  LEU  80          HD13      LEU  80   5.241   2.759   4.948
  674   1HD2  LEU  80          HD21      LEU  80   4.700   2.258   2.171
  675   2HD2  LEU  80          HD22      LEU  80   3.140   2.550   2.938
  676   3HD2  LEU  80          HD23      LEU  80   3.402   1.075   2.016
  677    H    ASP  81           HN       ASP  81   7.488   0.338   1.209
  678    HA   ASP  81           HA       ASP  81   9.150  -1.870   0.741
  679   1HB   ASP  81          HB2       ASP  81  10.490   0.793   1.070
  680   2HB   ASP  81          HB1       ASP  81  10.603  -0.362  -0.257
  681    HA   PRO  82           HA       PRO  82  11.495  -2.641   4.413
  682   1HB   PRO  82          HB2       PRO  82  14.104  -1.888   3.172
  683   2HB   PRO  82          HB1       PRO  82  13.587  -3.446   3.844
  684   1HG   PRO  82          HG2       PRO  82  13.828  -3.091   1.220
  685   2HG   PRO  82          HG1       PRO  82  12.510  -4.070   1.894
  686   1HD   PRO  82          HD2       PRO  82  12.422  -1.237   0.877
  687   2HD   PRO  82          HD1       PRO  82  11.264  -2.564   0.615
  688    H    ASP  83           HN       ASP  83  14.178  -1.254   4.916
  689    HA   ASP  83           HA       ASP  83  13.059   1.057   6.340
  690   1HB   ASP  83          HB2       ASP  83  15.283   1.279   7.300
  691   2HB   ASP  83          HB1       ASP  83  14.835  -0.427   7.328
  692    H    SER  84           HN       SER  84  13.670   0.665   3.227
  693    HA   SER  84           HA       SER  84  15.518   2.663   2.424
  694   1HB   SER  84          HB2       SER  84  14.401   2.612   0.285
  695   2HB   SER  84          HB1       SER  84  14.404   0.971   0.930
  696    HG   SER  84           HG       SER  84  12.259   2.467   1.737
  697    H    TYR  85           HN       TYR  85  14.955   4.322   4.183
  698    HA   TYR  85           HA       TYR  85  12.469   5.743   4.108
  699   1HB   TYR  85          HB2       TYR  85  13.831   7.606   5.189
  700   2HB   TYR  85          HB1       TYR  85  13.853   6.060   6.032
  701    HD1  TYR  85           HD1      TYR  85  15.791   8.442   4.020
  702    HD2  TYR  85           HD2      TYR  85  15.863   4.655   6.034
  703    HE1  TYR  85           HE1      TYR  85  18.267   8.396   3.844
  704    HE2  TYR  85           HE2      TYR  85  18.335   4.604   5.860
  705    HH   TYR  85           HH       TYR  85  20.158   5.724   5.255
  706    H    ASN  86           HN       ASN  86  15.606   6.397   2.587
  707    HA   ASN  86           HA       ASN  86  14.252   7.586   0.271
  708   1HB   ASN  86          HB2       ASN  86  16.208   9.234   1.900
  709   2HB   ASN  86          HB1       ASN  86  15.527   9.683   0.340
  710   1HD2  ASN  86          HD21      ASN  86  12.959   9.547   0.345
  711   2HD2  ASN  86          HD22      ASN  86  12.200  10.203   1.715
  712    H    MET  87           HN       MET  87  15.265   5.677  -0.614
  713    HA   MET  87           HA       MET  87  18.143   5.342  -0.543
  714   1HB   MET  87          HB2       MET  87  17.730   3.605  -2.268
  715   2HB   MET  87          HB1       MET  87  16.642   3.430  -0.888
  716   1HG   MET  87          HG2       MET  87  15.138   3.238  -2.657
  717   2HG   MET  87          HG1       MET  87  15.049   4.971  -2.349
  718   1HE   MET  87          HE1       MET  87  14.955   5.742  -5.933
  719   2HE   MET  87          HE2       MET  87  14.889   6.455  -4.323
  720   3HE   MET  87          HE3       MET  87  13.944   5.012  -4.680
  721    H    PHE  88           HN       PHE  88  19.649   6.236  -1.905
  722    HA   PHE  88           HA       PHE  88  18.760   8.304  -3.771
  723   1HB   PHE  88          HB2       PHE  88  21.537   7.245  -3.162
  724   2HB   PHE  88          HB1       PHE  88  21.184   8.667  -4.143
  725    HD1  PHE  88           HD1      PHE  88  20.256  10.708  -3.130
  726    HD2  PHE  88           HD2      PHE  88  21.253   7.275  -0.749
  727    HE1  PHE  88           HE1      PHE  88  20.130  12.095  -1.078
  728    HE2  PHE  88           HE2      PHE  88  21.127   8.660   1.302
  729    HZ   PHE  88           HZ       PHE  88  20.565  11.071   1.138
  730    H    GLU  89           HN       GLU  89  20.280   5.105  -4.026
  731    HA   GLU  89           HA       GLU  89  19.856   5.208  -7.002
  732   1HB   GLU  89          HB2       GLU  89  21.892   3.615  -5.418
  733   2HB   GLU  89          HB1       GLU  89  21.732   3.639  -7.173
  734   1HG   GLU  89          HG2       GLU  89  22.347   6.063  -5.458
  735   2HG   GLU  89          HG1       GLU  89  23.542   5.150  -6.379
  736    H    ASN  90           HN       ASN  90  19.291   3.124  -7.982
  737    HA   ASN  90           HA       ASN  90  17.384   1.638  -6.320
  738   1HB   ASN  90          HB2       ASN  90  16.967   2.268  -8.745
  739   2HB   ASN  90          HB1       ASN  90  18.189   1.074  -9.187
  740   1HD2  ASN  90          HD21      ASN  90  16.245   0.003 -10.307
  741   2HD2  ASN  90          HD22      ASN  90  15.263  -1.020  -9.374
  742    H    GLY  91           HN       GLY  91  20.600   1.522  -6.606
  743   1HA   GLY  91          HA2       GLY  91  20.706  -1.365  -5.875
  744   2HA   GLY  91          HA1       GLY  91  21.775  -0.783  -7.153
  745    H    SER  92           HN       SER  92  23.389   0.845  -6.577
  746    HA   SER  92           HA       SER  92  24.395   0.452  -3.834
  747   1HB   SER  92          HB2       SER  92  25.877   0.458  -5.900
  748   2HB   SER  92          HB1       SER  92  25.565   2.186  -6.025
  749    HG   SER  92           HG       SER  92  27.094   0.759  -4.209
  750    H    PHE  93           HN       PHE  93  22.537   1.629  -2.843
  751    HA   PHE  93           HA       PHE  93  22.464   4.549  -3.304
  752   1HB   PHE  93          HB2       PHE  93  20.599   4.492  -1.640
  753   2HB   PHE  93          HB1       PHE  93  20.320   3.452  -3.034
  754    HD1  PHE  93           HD1      PHE  93  21.101   3.551   0.562
  755    HD2  PHE  93           HD2      PHE  93  20.405   1.021  -2.840
  756    HE1  PHE  93           HE1      PHE  93  20.829   1.599   2.068
  757    HE2  PHE  93           HE2      PHE  93  20.135  -0.930  -1.334
  758    HZ   PHE  93           HZ       PHE  93  20.346  -0.642   1.120
  759    H    LEU  94           HN       LEU  94  24.401   2.539  -1.560
  760    HA   LEU  94           HA       LEU  94  24.498   4.099   0.932
  761   1HB   LEU  94          HB2       LEU  94  26.418   2.009  -0.152
  762   2HB   LEU  94          HB1       LEU  94  26.399   2.637   1.493
  763    HG   LEU  94           HG       LEU  94  24.070   1.184   0.204
  764   1HD1  LEU  94          HD11      LEU  94  25.845  -0.407   0.407
  765   2HD1  LEU  94          HD12      LEU  94  24.803  -0.663   1.808
  766   3HD1  LEU  94          HD13      LEU  94  26.318   0.222   1.986
  767   1HD2  LEU  94          HD21      LEU  94  23.208   2.489   1.978
  768   2HD2  LEU  94          HD22      LEU  94  24.646   2.257   2.971
  769   3HD2  LEU  94          HD23      LEU  94  23.512   0.928   2.735
  Start of MODEL   21
    1   1H    MET   1          HT1       MET   1 -23.370  19.939   2.554
    2   2H    MET   1          HT2       MET   1 -21.713  19.846   2.915
    3   3H    MET   1          HT3       MET   1 -22.768  18.622   3.438
    4    HA   MET   1           HA       MET   1 -23.214  17.992   1.146
    5   1HB   MET   1          HB2       MET   1 -21.235  20.224   0.613
    6   2HB   MET   1          HB1       MET   1 -21.670  19.008  -0.590
    7   1HG   MET   1          HG2       MET   1 -24.041  19.654  -0.390
    8   2HG   MET   1          HG1       MET   1 -23.609  20.872   0.810
    9   1HE   MET   1          HE1       MET   1 -25.293  21.393  -1.480
   10   2HE   MET   1          HE2       MET   1 -24.669  22.669  -2.523
   11   3HE   MET   1          HE3       MET   1 -24.743  22.922  -0.781
   12    H    LEU   2           HN       LEU   2 -22.002  16.214   0.432
   13    HA   LEU   2           HA       LEU   2 -19.668  15.540   2.107
   14   1HB   LEU   2          HB2       LEU   2 -20.955  13.906  -0.097
   15   2HB   LEU   2          HB1       LEU   2 -19.866  13.325   1.162
   16    HG   LEU   2           HG       LEU   2 -22.646  14.463   1.574
   17   1HD1  LEU   2          HD11      LEU   2 -23.306  12.251   2.137
   18   2HD1  LEU   2          HD12      LEU   2 -21.636  11.694   2.239
   19   3HD1  LEU   2          HD13      LEU   2 -22.343  12.078   0.669
   20   1HD2  LEU   2          HD21      LEU   2 -22.122  13.564   3.980
   21   2HD2  LEU   2          HD22      LEU   2 -21.484  15.135   3.501
   22   3HD2  LEU   2          HD23      LEU   2 -20.436  13.716   3.486
   23    H    VAL   3           HN       VAL   3 -17.588  15.371   1.368
   24    HA   VAL   3           HA       VAL   3 -17.024  15.701  -1.531
   25    HB   VAL   3           HB       VAL   3 -15.368  17.502  -1.025
   26   1HG1  VAL   3          HG11      VAL   3 -17.706  18.000  -1.791
   27   2HG1  VAL   3          HG12      VAL   3 -16.998  19.290  -0.820
   28   3HG1  VAL   3          HG13      VAL   3 -18.173  18.189  -0.101
   29   1HG2  VAL   3          HG21      VAL   3 -14.969  17.041   1.329
   30   2HG2  VAL   3          HG22      VAL   3 -16.664  17.337   1.714
   31   3HG2  VAL   3          HG23      VAL   3 -15.633  18.669   1.189
   32    H    LYS   4           HN       LYS   4 -14.809  15.055  -2.057
   33    HA   LYS   4           HA       LYS   4 -13.869  12.878  -0.413
   34   1HB   LYS   4          HB2       LYS   4 -12.312  14.286  -2.597
   35   2HB   LYS   4          HB1       LYS   4 -12.118  12.624  -2.045
   36   1HG   LYS   4          HG2       LYS   4 -14.491  13.790  -3.523
   37   2HG   LYS   4          HG1       LYS   4 -13.356  12.579  -4.120
   38   1HD   LYS   4          HD2       LYS   4 -14.117  11.167  -2.074
   39   2HD   LYS   4          HD1       LYS   4 -15.483  12.279  -2.001
   40   1HE   LYS   4          HE2       LYS   4 -15.806  11.760  -4.508
   41   2HE   LYS   4          HE1       LYS   4 -14.723  10.396  -4.234
   42   1HZ   LYS   4          HZ1       LYS   4 -16.488   9.292  -3.518
   43   2HZ   LYS   4          HZ2       LYS   4 -17.463  10.685  -3.535
   44   3HZ   LYS   4          HZ3       LYS   4 -16.525  10.316  -2.166
   45    HA   PRO   5           HA       PRO   5 -11.244  15.374   2.198
   46   1HB   PRO   5          HB2       PRO   5  -9.661  13.526   3.312
   47   2HB   PRO   5          HB1       PRO   5 -11.407  13.533   3.622
   48   1HG   PRO   5          HG2       PRO   5  -9.858  11.875   1.671
   49   2HG   PRO   5          HG1       PRO   5 -11.096  11.362   2.832
   50   1HD   PRO   5          HD2       PRO   5 -11.666  11.830   0.194
   51   2HD   PRO   5          HD1       PRO   5 -12.849  12.099   1.496
   52    HA   PRO   6           HA       PRO   6  -7.753  16.694  -0.303
   53   1HB   PRO   6          HB2       PRO   6  -6.330  16.696   2.349
   54   2HB   PRO   6          HB1       PRO   6  -6.303  17.918   1.061
   55   1HG   PRO   6          HG2       PRO   6  -7.809  18.241   3.237
   56   2HG   PRO   6          HG1       PRO   6  -8.365  18.770   1.639
   57   1HD   PRO   6          HD2       PRO   6  -9.316  16.481   3.282
   58   2HD   PRO   6          HD1       PRO   6 -10.155  17.371   1.992
   59    H    TYR   7           HN       TYR   7  -7.454  13.985   1.928
   60    HA   TYR   7           HA       TYR   7  -4.856  13.089   1.190
   61   1HB   TYR   7          HB2       TYR   7  -7.152  11.229   1.821
   62   2HB   TYR   7          HB1       TYR   7  -5.442  11.006   2.181
   63    HD1  TYR   7           HD1      TYR   7  -4.493  13.338   3.466
   64    HD2  TYR   7           HD2      TYR   7  -8.414  11.602   3.743
   65    HE1  TYR   7           HE1      TYR   7  -4.832  14.447   5.655
   66    HE2  TYR   7           HE2      TYR   7  -8.757  12.717   5.924
   67    HH   TYR   7           HH       TYR   7  -6.547  15.117   7.130
   68    H    SER   8           HN       SER   8  -4.105  12.112  -0.628
   69    HA   SER   8           HA       SER   8  -5.936  11.738  -2.893
   70   1HB   SER   8          HB2       SER   8  -3.638  12.652  -3.213
   71   2HB   SER   8          HB1       SER   8  -2.973  11.117  -2.660
   72    HG   SER   8           HG       SER   8  -4.536  11.654  -4.962
   73    H    TYR   9           HN       TYR   9  -5.724   9.570  -4.135
   74    HA   TYR   9           HA       TYR   9  -6.614   7.458  -2.450
   75   1HB   TYR   9          HB2       TYR   9  -5.421   7.301  -5.236
   76   2HB   TYR   9          HB1       TYR   9  -6.346   6.020  -4.448
   77    HD1  TYR   9           HD1      TYR   9  -8.752   6.241  -4.067
   78    HD2  TYR   9           HD2      TYR   9  -6.502   9.370  -5.970
   79    HE1  TYR   9           HE1      TYR   9 -10.855   7.323  -4.780
   80    HE2  TYR   9           HE2      TYR   9  -8.616  10.449  -6.691
   81    HH   TYR   9           HH       TYR   9 -11.612   9.651  -5.409
   82    H    ILE  10           HN       ILE  10  -3.392   8.159  -3.800
   83    HA   ILE  10           HA       ILE  10  -2.123   5.769  -2.883
   84    HB   ILE  10           HB       ILE  10  -0.993   8.561  -3.260
   85   1HG1  ILE  10          HG12      ILE  10  -0.759   6.127  -5.047
   86   2HG1  ILE  10          HG11      ILE  10  -2.024   7.339  -5.252
   87   1HG2  ILE  10          HG21      ILE  10   0.547   7.401  -1.860
   88   2HG2  ILE  10          HG22      ILE  10   1.181   7.211  -3.494
   89   3HG2  ILE  10          HG23      ILE  10   0.310   5.884  -2.726
   90   1HD1  ILE  10          HD11      ILE  10  -0.289   9.093  -5.485
   91   2HD1  ILE  10          HD12      ILE  10  -0.115   7.843  -6.717
   92   3HD1  ILE  10          HD13      ILE  10   0.963   7.862  -5.322
   93    H    ALA  11           HN       ALA  11  -2.597   8.939  -1.334
   94    HA   ALA  11           HA       ALA  11  -1.196   8.265   1.088
   95   1HB   ALA  11          HB1       ALA  11  -3.479  10.245   0.912
   96   2HB   ALA  11          HB2       ALA  11  -1.893  10.601   0.227
   97   3HB   ALA  11          HB3       ALA  11  -2.059  10.303   1.956
   98    H    LEU  12           HN       LEU  12  -4.637   8.052   0.151
   99    HA   LEU  12           HA       LEU  12  -5.600   7.265   2.714
  100   1HB   LEU  12          HB2       LEU  12  -6.596   6.609  -0.070
  101   2HB   LEU  12          HB1       LEU  12  -7.467   6.161   1.395
  102    HG   LEU  12           HG       LEU  12  -6.655   8.998   0.688
  103   1HD1  LEU  12          HD11      LEU  12  -9.106   9.289   0.222
  104   2HD1  LEU  12          HD12      LEU  12  -9.295   7.541   0.366
  105   3HD1  LEU  12          HD13      LEU  12  -8.295   8.217  -0.920
  106   1HD2  LEU  12          HD21      LEU  12  -8.647   9.301   2.457
  107   2HD2  LEU  12          HD22      LEU  12  -6.982   9.096   2.979
  108   3HD2  LEU  12          HD23      LEU  12  -8.085   7.721   3.001
  109    H    ILE  13           HN       ILE  13  -4.219   5.351   0.047
  110    HA   ILE  13           HA       ILE  13  -4.664   2.790   1.275
  111    HB   ILE  13           HB       ILE  13  -2.478   3.693  -0.634
  112   1HG1  ILE  13          HG12      ILE  13  -4.989   2.087  -1.191
  113   2HG1  ILE  13          HG11      ILE  13  -4.897   3.834  -1.411
  114   1HG2  ILE  13          HG21      ILE  13  -2.388   1.183  -1.109
  115   2HG2  ILE  13          HG22      ILE  13  -3.319   0.965   0.371
  116   3HG2  ILE  13          HG23      ILE  13  -1.714   1.694   0.438
  117   1HD1  ILE  13          HD11      ILE  13  -3.052   3.557  -3.007
  118   2HD1  ILE  13          HD12      ILE  13  -4.446   2.612  -3.528
  119   3HD1  ILE  13          HD13      ILE  13  -3.078   1.812  -2.755
  120    H    THR  14           HN       THR  14  -1.954   5.085   1.368
  121    HA   THR  14           HA       THR  14  -0.205   3.560   3.001
  122    HB   THR  14           HB       THR  14  -0.524   6.566   2.856
  123    HG1  THR  14           HG1      THR  14   1.463   6.050   1.490
  124   1HG2  THR  14          HG21      THR  14   1.953   6.432   3.497
  125   2HG2  THR  14          HG22      THR  14   1.628   4.763   3.965
  126   3HG2  THR  14          HG23      THR  14   0.789   6.085   4.776
  127    H    MET  15           HN       MET  15  -2.809   5.812   3.872
  128    HA   MET  15           HA       MET  15  -2.275   5.803   6.694
  129   1HB   MET  15          HB2       MET  15  -4.778   6.393   5.092
  130   2HB   MET  15          HB1       MET  15  -4.677   6.609   6.839
  131   1HG   MET  15          HG2       MET  15  -2.779   8.155   6.541
  132   2HG   MET  15          HG1       MET  15  -2.877   7.943   4.794
  133   1HE   MET  15          HE1       MET  15  -3.301  10.659   4.292
  134   2HE   MET  15          HE2       MET  15  -2.699  10.527   5.943
  135   3HE   MET  15          HE3       MET  15  -4.081  11.564   5.596
  136    H    ALA  16           HN       ALA  16  -4.365   3.815   4.629
  137    HA   ALA  16           HA       ALA  16  -5.688   2.366   6.686
  138   1HB   ALA  16          HB1       ALA  16  -5.963   0.605   4.905
  139   2HB   ALA  16          HB2       ALA  16  -4.897   1.563   3.875
  140   3HB   ALA  16          HB3       ALA  16  -6.446   2.223   4.396
  141    H    ILE  17           HN       ILE  17  -2.634   1.666   4.975
  142    HA   ILE  17           HA       ILE  17  -2.080  -0.817   6.278
  143    HB   ILE  17           HB       ILE  17  -0.103   1.259   5.277
  144   1HG1  ILE  17          HG12      ILE  17  -1.260  -1.128   3.812
  145   2HG1  ILE  17          HG11      ILE  17  -1.887   0.509   3.639
  146   1HG2  ILE  17          HG21      ILE  17   1.323  -0.788   4.937
  147   2HG2  ILE  17          HG22      ILE  17   0.096  -1.726   5.788
  148   3HG2  ILE  17          HG23      ILE  17   0.974  -0.451   6.633
  149   1HD1  ILE  17          HD11      ILE  17   0.516   1.201   3.046
  150   2HD1  ILE  17          HD12      ILE  17  -0.351   0.251   1.842
  151   3HD1  ILE  17          HD13      ILE  17   0.848  -0.524   2.876
  152    H    GLN  18           HN       GLN  18  -1.101   2.507   7.022
  153    HA   GLN  18           HA       GLN  18   0.456   1.943   9.333
  154   1HB   GLN  18          HB2       GLN  18  -1.176   4.376   8.567
  155   2HB   GLN  18          HB1       GLN  18  -0.105   4.332   9.969
  156   1HG   GLN  18          HG2       GLN  18   0.809   3.673   7.159
  157   2HG   GLN  18          HG1       GLN  18   0.943   5.281   7.868
  158   1HE2  GLN  18          HE21      GLN  18   1.804   4.840  10.435
  159   2HE2  GLN  18          HE22      GLN  18   3.271   3.987  10.451
  160    H    ASN  19           HN       ASN  19  -3.029   2.526   8.964
  161    HA   ASN  19           HA       ASN  19  -3.495   2.275  11.853
  162   1HB   ASN  19          HB2       ASN  19  -5.386   2.464   9.488
  163   2HB   ASN  19          HB1       ASN  19  -5.905   2.428  11.173
  164   1HD2  ASN  19          HD21      ASN  19  -5.296   4.576   8.714
  165   2HD2  ASN  19          HD22      ASN  19  -4.856   5.937   9.630
  166    H    ALA  20           HN       ALA  20  -2.848   0.094   9.424
  167    HA   ALA  20           HA       ALA  20  -4.771  -1.973  10.150
  168   1HB   ALA  20          HB1       ALA  20  -2.158  -2.340   8.665
  169   2HB   ALA  20          HB2       ALA  20  -3.628  -1.737   7.892
  170   3HB   ALA  20          HB3       ALA  20  -3.597  -3.359   8.585
  171    HA   PRO  21           HA       PRO  21  -2.578  -3.190  13.948
  172   1HB   PRO  21          HB2       PRO  21  -3.609  -5.876  13.055
  173   2HB   PRO  21          HB1       PRO  21  -3.625  -5.150  14.676
  174   1HG   PRO  21          HG2       PRO  21  -5.818  -5.192  13.168
  175   2HG   PRO  21          HG1       PRO  21  -5.438  -3.803  14.201
  176   1HD   PRO  21          HD2       PRO  21  -5.296  -4.022  11.231
  177   2HD   PRO  21          HD1       PRO  21  -5.535  -2.584  12.246
  178    H    GLU  22           HN       GLU  22  -2.466  -5.574  11.279
  179    HA   GLU  22           HA       GLU  22   0.456  -5.934  11.756
  180   1HB   GLU  22          HB2       GLU  22  -1.131  -7.931  11.507
  181   2HB   GLU  22          HB1       GLU  22  -1.294  -7.465   9.812
  182   1HG   GLU  22          HG2       GLU  22   1.153  -7.636   9.527
  183   2HG   GLU  22          HG1       GLU  22   1.316  -8.105  11.218
  184    H    LYS  23           HN       LYS  23   1.945  -5.315  10.163
  185    HA   LYS  23           HA       LYS  23   1.215  -3.217   8.392
  186   1HB   LYS  23          HB2       LYS  23   3.626  -5.056   8.349
  187   2HB   LYS  23          HB1       LYS  23   3.477  -3.606   7.361
  188   1HG   LYS  23          HG2       LYS  23   3.252  -3.587  10.382
  189   2HG   LYS  23          HG1       LYS  23   4.769  -3.313   9.529
  190   1HD   LYS  23          HD2       LYS  23   3.457  -1.463   8.244
  191   2HD   LYS  23          HD1       LYS  23   2.286  -1.594   9.555
  192   1HE   LYS  23          HE2       LYS  23   4.101  -1.186  11.196
  193   2HE   LYS  23          HE1       LYS  23   5.233  -0.974   9.862
  194   1HZ   LYS  23          HZ1       LYS  23   3.529   0.925  10.977
  195   2HZ   LYS  23          HZ2       LYS  23   2.964   0.618   9.406
  196   3HZ   LYS  23          HZ3       LYS  23   4.570   1.112   9.651
  197    H    LYS  24           HN       LYS  24   1.451  -6.722   7.814
  198    HA   LYS  24           HA       LYS  24   1.061  -6.392   4.936
  199   1HB   LYS  24          HB2       LYS  24   0.717  -8.831   6.712
  200   2HB   LYS  24          HB1       LYS  24   0.639  -8.846   4.953
  201   1HG   LYS  24          HG2       LYS  24   2.956  -8.038   4.829
  202   2HG   LYS  24          HG1       LYS  24   3.047  -8.016   6.594
  203   1HD   LYS  24          HD2       LYS  24   2.569 -10.436   6.647
  204   2HD   LYS  24          HD1       LYS  24   2.481 -10.458   4.886
  205   1HE   LYS  24          HE2       LYS  24   4.924  -9.664   6.509
  206   2HE   LYS  24          HE1       LYS  24   4.700 -11.214   5.697
  207   1HZ   LYS  24          HZ1       LYS  24   4.545  -8.639   4.248
  208   2HZ   LYS  24          HZ2       LYS  24   4.739 -10.199   3.605
  209   3HZ   LYS  24          HZ3       LYS  24   6.009  -9.466   4.463
  210    H    ILE  25           HN       ILE  25  -0.879  -6.134   3.927
  211    HA   ILE  25           HA       ILE  25  -3.378  -6.917   5.352
  212    HB   ILE  25           HB       ILE  25  -2.897  -4.472   5.740
  213   1HG1  ILE  25          HG12      ILE  25  -5.306  -4.938   3.963
  214   2HG1  ILE  25          HG11      ILE  25  -5.218  -5.507   5.630
  215   1HG2  ILE  25          HG21      ILE  25  -1.834  -4.195   3.438
  216   2HG2  ILE  25          HG22      ILE  25  -2.965  -2.928   3.916
  217   3HG2  ILE  25          HG23      ILE  25  -3.473  -4.181   2.784
  218   1HD1  ILE  25          HD11      ILE  25  -5.070  -3.293   6.489
  219   2HD1  ILE  25          HD12      ILE  25  -6.334  -3.227   5.260
  220   3HD1  ILE  25          HD13      ILE  25  -4.720  -2.618   4.897
  221    H    THR  26           HN       THR  26  -5.075  -7.464   3.959
  222    HA   THR  26           HA       THR  26  -4.251  -8.222   1.249
  223    HB   THR  26           HB       THR  26  -6.523  -9.241   1.158
  224    HG1  THR  26           HG1      THR  26  -7.943  -8.860   2.715
  225   1HG2  THR  26          HG21      THR  26  -6.171 -10.613   3.414
  226   2HG2  THR  26          HG22      THR  26  -4.625  -9.771   3.423
  227   3HG2  THR  26          HG23      THR  26  -5.059 -10.801   2.059
  228    H    LEU  27           HN       LEU  27  -5.263  -7.427  -0.679
  229    HA   LEU  27           HA       LEU  27  -5.816  -4.639  -0.726
  230   1HB   LEU  27          HB2       LEU  27  -5.056  -5.915  -2.698
  231   2HB   LEU  27          HB1       LEU  27  -6.585  -6.785  -2.733
  232    HG   LEU  27           HG       LEU  27  -7.793  -4.695  -3.181
  233   1HD1  LEU  27          HD11      LEU  27  -5.065  -3.503  -2.731
  234   2HD1  LEU  27          HD12      LEU  27  -6.627  -2.966  -2.116
  235   3HD1  LEU  27          HD13      LEU  27  -6.207  -2.689  -3.802
  236   1HD2  LEU  27          HD21      LEU  27  -6.581  -4.131  -5.405
  237   2HD2  LEU  27          HD22      LEU  27  -7.145  -5.785  -5.169
  238   3HD2  LEU  27          HD23      LEU  27  -5.441  -5.392  -4.941
  239    H    ASN  28           HN       ASN  28  -7.956  -7.456  -0.668
  240    HA   ASN  28           HA       ASN  28 -10.443  -6.103  -0.911
  241   1HB   ASN  28          HB2       ASN  28  -9.734  -8.638   0.582
  242   2HB   ASN  28          HB1       ASN  28 -11.380  -8.116   0.220
  243   1HD2  ASN  28          HD21      ASN  28 -11.259  -7.243  -2.386
  244   2HD2  ASN  28          HD22      ASN  28 -10.723  -8.480  -3.417
  245    H    GLY  29           HN       GLY  29  -8.488  -6.869   1.954
  246   1HA   GLY  29          HA2       GLY  29 -10.329  -5.964   3.926
  247   2HA   GLY  29          HA1       GLY  29  -8.583  -6.043   4.143
  248    H    ILE  30           HN       ILE  30  -7.853  -4.197   2.089
  249    HA   ILE  30           HA       ILE  30  -8.015  -1.751   3.519
  250    HB   ILE  30           HB       ILE  30  -7.334  -2.309   0.620
  251   1HG1  ILE  30          HG12      ILE  30  -5.593  -1.528   2.980
  252   2HG1  ILE  30          HG11      ILE  30  -5.873  -3.199   2.491
  253   1HG2  ILE  30          HG21      ILE  30  -6.256   0.029   0.823
  254   2HG2  ILE  30          HG22      ILE  30  -7.315   0.262   2.212
  255   3HG2  ILE  30          HG23      ILE  30  -8.007  -0.027   0.616
  256   1HD1  ILE  30          HD11      ILE  30  -4.869  -1.152   0.512
  257   2HD1  ILE  30          HD12      ILE  30  -4.762  -2.910   0.428
  258   3HD1  ILE  30          HD13      ILE  30  -3.759  -2.019   1.572
  259    H    TYR  31           HN       TYR  31 -10.006  -2.936   0.789
  260    HA   TYR  31           HA       TYR  31 -11.391  -0.491   0.349
  261   1HB   TYR  31          HB2       TYR  31 -12.170  -3.384  -0.034
  262   2HB   TYR  31          HB1       TYR  31 -13.324  -2.099  -0.368
  263    HD1  TYR  31           HD1      TYR  31 -11.064  -4.178  -1.920
  264    HD2  TYR  31           HD2      TYR  31 -12.078  -0.011  -1.733
  265    HE1  TYR  31           HE1      TYR  31 -10.023  -3.828  -4.135
  266    HE2  TYR  31           HE2      TYR  31 -11.023   0.337  -3.940
  267    HH   TYR  31           HH       TYR  31 -10.540  -1.719  -6.081
  268    H    GLN  32           HN       GLN  32 -12.071  -3.148   2.612
  269    HA   GLN  32           HA       GLN  32 -14.539  -2.110   3.603
  270   1HB   GLN  32          HB2       GLN  32 -12.399  -3.811   4.895
  271   2HB   GLN  32          HB1       GLN  32 -13.950  -3.466   5.660
  272   1HG   GLN  32          HG2       GLN  32 -15.134  -4.485   3.768
  273   2HG   GLN  32          HG1       GLN  32 -13.598  -4.785   2.952
  274   1HE2  GLN  32          HE21      GLN  32 -15.782  -6.624   4.289
  275   2HE2  GLN  32          HE22      GLN  32 -14.848  -7.693   5.220
  276    H    PHE  33           HN       PHE  33 -11.184  -1.538   4.596
  277    HA   PHE  33           HA       PHE  33 -11.714   0.015   6.912
  278   1HB   PHE  33          HB2       PHE  33  -9.499  -0.909   6.320
  279   2HB   PHE  33          HB1       PHE  33  -9.384   0.242   4.989
  280    HD1  PHE  33           HD1      PHE  33  -9.349  -0.179   8.642
  281    HD2  PHE  33           HD2      PHE  33  -9.050   2.630   5.407
  282    HE1  PHE  33           HE1      PHE  33  -8.456   1.526  10.206
  283    HE2  PHE  33           HE2      PHE  33  -8.162   4.337   6.973
  284    HZ   PHE  33           HZ       PHE  33  -7.865   3.784   9.371
  285    H    ILE  34           HN       ILE  34 -11.088   1.146   3.562
  286    HA   ILE  34           HA       ILE  34 -11.332   3.915   4.130
  287    HB   ILE  34           HB       ILE  34 -11.868   2.351   1.596
  288   1HG1  ILE  34          HG12      ILE  34  -9.592   4.201   2.363
  289   2HG1  ILE  34          HG11      ILE  34  -9.541   2.453   2.596
  290   1HG2  ILE  34          HG21      ILE  34 -11.577   4.680   0.526
  291   2HG2  ILE  34          HG22      ILE  34 -11.913   5.331   2.130
  292   3HG2  ILE  34          HG23      ILE  34 -13.127   4.357   1.301
  293   1HD1  ILE  34          HD11      ILE  34 -10.110   3.732  -0.087
  294   2HD1  ILE  34          HD12      ILE  34  -9.720   2.045   0.241
  295   3HD1  ILE  34          HD13      ILE  34  -8.486   3.288   0.439
  296    H    MET  35           HN       MET  35 -13.853   1.593   3.099
  297    HA   MET  35           HA       MET  35 -15.951   3.500   2.892
  298   1HB   MET  35          HB2       MET  35 -15.990   0.561   3.623
  299   2HB   MET  35          HB1       MET  35 -17.454   1.506   3.346
  300   1HG   MET  35          HG2       MET  35 -16.664   2.071   1.080
  301   2HG   MET  35          HG1       MET  35 -15.196   1.135   1.352
  302   1HE   MET  35          HE1       MET  35 -15.076  -1.525   1.264
  303   2HE   MET  35          HE2       MET  35 -15.126  -0.585  -0.226
  304   3HE   MET  35          HE3       MET  35 -16.051  -2.079  -0.103
  305    H    ASP  36           HN       ASP  36 -14.790   1.629   5.686
  306    HA   ASP  36           HA       ASP  36 -16.795   2.636   7.505
  307   1HB   ASP  36          HB2       ASP  36 -14.074   1.383   7.944
  308   2HB   ASP  36          HB1       ASP  36 -15.166   1.814   9.262
  309    H    ARG  37           HN       ARG  37 -13.476   3.664   6.710
  310    HA   ARG  37           HA       ARG  37 -13.312   5.667   8.760
  311   1HB   ARG  37          HB2       ARG  37 -11.379   4.678   7.448
  312   2HB   ARG  37          HB1       ARG  37 -11.880   5.686   6.097
  313   1HG   ARG  37          HG2       ARG  37 -10.214   6.965   7.187
  314   2HG   ARG  37          HG1       ARG  37 -11.734   7.678   7.710
  315   1HD   ARG  37          HD2       ARG  37 -10.530   5.492   9.390
  316   2HD   ARG  37          HD1       ARG  37  -9.843   7.109   9.474
  317    HE   ARG  37           HE       ARG  37 -12.560   7.541   9.773
  318   1HH1  ARG  37          HH21      ARG  37 -10.163   5.540  11.233
  319   2HH1  ARG  37          HH22      ARG  37 -10.921   5.538  12.790
  320   1HH2  ARG  37          HH11      ARG  37 -13.566   7.550  11.802
  321   2HH2  ARG  37          HH12      ARG  37 -12.846   6.675  13.112
  322    H    PHE  38           HN       PHE  38 -13.761   6.126   5.229
  323    HA   PHE  38           HA       PHE  38 -15.014   8.770   5.817
  324   1HB   PHE  38          HB2       PHE  38 -13.836   7.630   3.273
  325   2HB   PHE  38          HB1       PHE  38 -14.575   9.227   3.407
  326    HD1  PHE  38           HD1      PHE  38 -11.646   7.184   4.123
  327    HD2  PHE  38           HD2      PHE  38 -13.551  10.951   4.915
  328    HE1  PHE  38           HE1      PHE  38  -9.502   8.085   4.982
  329    HE2  PHE  38           HE2      PHE  38 -11.404  11.854   5.774
  330    HZ   PHE  38           HZ       PHE  38  -9.382  10.421   5.808
  331    HA   PRO  39           HA       PRO  39 -18.807   6.611   4.607
  332   1HB   PRO  39          HB2       PRO  39 -20.603   8.551   5.111
  333   2HB   PRO  39          HB1       PRO  39 -19.715   7.755   6.427
  334   1HG   PRO  39          HG2       PRO  39 -19.172  10.390   5.118
  335   2HG   PRO  39          HG1       PRO  39 -19.205   9.984   6.844
  336   1HD   PRO  39          HD2       PRO  39 -16.875  10.138   5.387
  337   2HD   PRO  39          HD1       PRO  39 -17.067   9.092   6.812
  338    H    PHE  40           HN       PHE  40 -17.613   9.488   3.055
  339    HA   PHE  40           HA       PHE  40 -19.684   9.965   1.172
  340   1HB   PHE  40          HB2       PHE  40 -16.825  10.272   0.312
  341   2HB   PHE  40          HB1       PHE  40 -18.183  11.378   0.104
  342    HD1  PHE  40           HD1      PHE  40 -15.173  11.406   1.530
  343    HD2  PHE  40           HD2      PHE  40 -19.277  11.664   2.786
  344    HE1  PHE  40           HE1      PHE  40 -14.477  12.642   3.563
  345    HE2  PHE  40           HE2      PHE  40 -18.577  12.898   4.819
  346    HZ   PHE  40           HZ       PHE  40 -16.177  13.388   5.207
  347    H    TYR  41           HN       TYR  41 -16.948   7.720   1.057
  348    HA   TYR  41           HA       TYR  41 -17.342   6.855  -1.643
  349   1HB   TYR  41          HB2       TYR  41 -16.047   5.461   0.708
  350   2HB   TYR  41          HB1       TYR  41 -15.908   4.945  -0.976
  351    HD1  TYR  41           HD1      TYR  41 -14.527   6.139  -2.544
  352    HD2  TYR  41           HD2      TYR  41 -15.159   7.659   1.412
  353    HE1  TYR  41           HE1      TYR  41 -12.739   7.812  -2.910
  354    HE2  TYR  41           HE2      TYR  41 -13.360   9.331   1.071
  355    HH   TYR  41           HH       TYR  41 -11.178   9.363  -0.599
  356    H    ARG  42           HN       ARG  42 -19.087   6.137   1.246
  357    HA   ARG  42           HA       ARG  42 -19.974   3.495   0.667
  358   1HB   ARG  42          HB2       ARG  42 -21.531   5.741   1.993
  359   2HB   ARG  42          HB1       ARG  42 -21.889   4.022   2.125
  360   1HG   ARG  42          HG2       ARG  42 -19.177   5.075   2.907
  361   2HG   ARG  42          HG1       ARG  42 -20.530   5.165   4.033
  362   1HD   ARG  42          HD2       ARG  42 -19.475   2.635   2.732
  363   2HD   ARG  42          HD1       ARG  42 -19.229   3.120   4.408
  364    HE   ARG  42           HE       ARG  42 -21.971   3.117   4.164
  365   1HH1  ARG  42          HH21      ARG  42 -19.423   0.914   3.425
  366   2HH1  ARG  42          HH22      ARG  42 -20.378  -0.500   3.724
  367   1HH2  ARG  42          HH11      ARG  42 -23.233   1.282   4.564
  368   2HH2  ARG  42          HH12      ARG  42 -22.536  -0.291   4.369
  369    H    GLU  43           HN       GLU  43 -21.429   6.642  -0.191
  370    HA   GLU  43           HA       GLU  43 -23.549   5.479  -1.748
  371   1HB   GLU  43          HB2       GLU  43 -22.369   8.258  -1.664
  372   2HB   GLU  43          HB1       GLU  43 -23.773   7.835  -2.644
  373   1HG   GLU  43          HG2       GLU  43 -25.038   7.197  -0.693
  374   2HG   GLU  43          HG1       GLU  43 -23.617   7.349   0.340
  375    H    ASN  44           HN       ASN  44 -20.394   6.763  -2.544
  376    HA   ASN  44           HA       ASN  44 -20.776   6.123  -5.421
  377   1HB   ASN  44          HB2       ASN  44 -19.666   8.272  -4.638
  378   2HB   ASN  44          HB1       ASN  44 -18.320   7.281  -4.077
  379   1HD2  ASN  44          HD21      ASN  44 -20.275   7.814  -7.063
  380   2HD2  ASN  44          HD22      ASN  44 -18.979   7.574  -8.131
  381    H    LYS  45           HN       LYS  45 -20.631   3.890  -5.611
  382    HA   LYS  45           HA       LYS  45 -18.364   2.480  -4.301
  383   1HB   LYS  45          HB2       LYS  45 -20.800   1.501  -5.810
  384   2HB   LYS  45          HB1       LYS  45 -19.541   0.440  -5.186
  385   1HG   LYS  45          HG2       LYS  45 -19.971   1.262  -2.900
  386   2HG   LYS  45          HG1       LYS  45 -21.237   2.323  -3.522
  387   1HD   LYS  45          HD2       LYS  45 -22.470   0.362  -4.371
  388   2HD   LYS  45          HD1       LYS  45 -21.210  -0.701  -3.748
  389   1HE   LYS  45          HE2       LYS  45 -22.971  -0.689  -2.115
  390   2HE   LYS  45          HE1       LYS  45 -21.660   0.289  -1.455
  391   1HZ   LYS  45          HZ1       LYS  45 -24.014   1.366  -2.911
  392   2HZ   LYS  45          HZ2       LYS  45 -22.780   2.274  -2.177
  393   3HZ   LYS  45          HZ3       LYS  45 -23.842   1.353  -1.223
  394    H    GLN  46           HN       GLN  46 -19.710   3.141  -7.517
  395    HA   GLN  46           HA       GLN  46 -17.516   1.680  -8.830
  396   1HB   GLN  46          HB2       GLN  46 -19.868   3.279  -9.866
  397   2HB   GLN  46          HB1       GLN  46 -18.674   2.520 -10.920
  398   1HG   GLN  46          HG2       GLN  46 -19.188   0.320  -9.914
  399   2HG   GLN  46          HG1       GLN  46 -20.382   1.084  -8.866
  400   1HE2  GLN  46          HE21      GLN  46 -20.793   2.921 -11.475
  401   2HE2  GLN  46          HE22      GLN  46 -21.914   2.004 -12.357
  402    H    GLY  47           HN       GLY  47 -15.777   2.626  -9.853
  403   1HA   GLY  47          HA2       GLY  47 -14.744   4.550 -10.985
  404   2HA   GLY  47          HA1       GLY  47 -15.609   5.618  -9.886
  405    H    TRP  48           HN       TRP  48 -15.058   4.849  -7.408
  406    HA   TRP  48           HA       TRP  48 -12.169   5.309  -7.219
  407   1HB   TRP  48          HB2       TRP  48 -12.526   5.753  -4.930
  408   2HB   TRP  48          HB1       TRP  48 -13.961   6.379  -5.731
  409    HD1  TRP  48           HD1      TRP  48 -16.241   4.955  -5.441
  410    HE1  TRP  48           HE1      TRP  48 -16.970   3.314  -3.602
  411    HE3  TRP  48           HE3      TRP  48 -11.714   3.951  -3.295
  412    HZ2  TRP  48           HZ2      TRP  48 -15.805   1.773  -1.499
  413    HZ3  TRP  48           HZ3      TRP  48 -11.557   2.397  -1.373
  414    HH2  TRP  48           HH2      TRP  48 -13.593   1.307  -0.472
  415    H    GLN  49           HN       GLN  49 -14.156   2.539  -7.302
  416    HA   GLN  49           HA       GLN  49 -12.642   0.884  -5.494
  417   1HB   GLN  49          HB2       GLN  49 -14.951   0.345  -6.267
  418   2HB   GLN  49          HB1       GLN  49 -14.304   0.016  -7.875
  419   1HG   GLN  49          HG2       GLN  49 -12.862  -1.750  -6.950
  420   2HG   GLN  49          HG1       GLN  49 -13.473  -1.410  -5.331
  421   1HE2  GLN  49          HE21      GLN  49 -14.983  -2.964  -4.746
  422   2HE2  GLN  49          HE22      GLN  49 -16.138  -3.646  -5.786
  423    H    ASN  50           HN       ASN  50 -12.606   1.031  -9.086
  424    HA   ASN  50           HA       ASN  50 -10.346  -0.750  -9.285
  425   1HB   ASN  50          HB2       ASN  50 -11.557   1.231 -11.230
  426   2HB   ASN  50          HB1       ASN  50 -10.226   0.155 -11.653
  427   1HD2  ASN  50          HD21      ASN  50 -11.958  -1.576  -9.431
  428   2HD2  ASN  50          HD22      ASN  50 -13.011  -2.409 -10.468
  429    H    SER  51           HN       SER  51 -10.610   2.723  -8.821
  430    HA   SER  51           HA       SER  51  -8.054   3.509  -9.781
  431   1HB   SER  51          HB2       SER  51  -8.315   5.474  -8.385
  432   2HB   SER  51          HB1       SER  51  -9.893   5.055  -9.044
  433    HG   SER  51           HG       SER  51  -9.191   5.293  -6.511
  434    H    ILE  52           HN       ILE  52  -9.034   2.226  -6.624
  435    HA   ILE  52           HA       ILE  52  -6.556   2.576  -5.276
  436    HB   ILE  52           HB       ILE  52  -8.687   0.451  -4.954
  437   1HG1  ILE  52          HG12      ILE  52  -9.538   2.733  -4.675
  438   2HG1  ILE  52          HG11      ILE  52  -9.495   1.907  -3.123
  439   1HG2  ILE  52          HG21      ILE  52  -7.775   0.282  -2.617
  440   2HG2  ILE  52          HG22      ILE  52  -6.398   1.249  -3.145
  441   3HG2  ILE  52          HG23      ILE  52  -6.694  -0.335  -3.865
  442   1HD1  ILE  52          HD11      ILE  52  -7.790   4.150  -4.134
  443   2HD1  ILE  52          HD12      ILE  52  -7.109   3.048  -2.939
  444   3HD1  ILE  52          HD13      ILE  52  -8.570   3.960  -2.569
  445    H    ARG  53           HN       ARG  53  -7.741  -0.260  -7.115
  446    HA   ARG  53           HA       ARG  53  -5.323  -1.782  -6.697
  447   1HB   ARG  53          HB2       ARG  53  -7.061  -2.209  -9.110
  448   2HB   ARG  53          HB1       ARG  53  -6.336  -3.408  -8.036
  449   1HG   ARG  53          HG2       ARG  53  -7.913  -2.350  -6.233
  450   2HG   ARG  53          HG1       ARG  53  -8.807  -1.739  -7.621
  451   1HD   ARG  53          HD2       ARG  53  -8.519  -4.531  -6.620
  452   2HD   ARG  53          HD1       ARG  53  -9.905  -3.743  -7.357
  453    HE   ARG  53           HE       ARG  53  -8.005  -5.436  -8.668
  454   1HH1  ARG  53          HH21      ARG  53  -9.543  -2.378  -9.113
  455   2HH1  ARG  53          HH22      ARG  53  -9.395  -2.420 -10.837
  456   1HH2  ARG  53          HH11      ARG  53  -7.814  -5.504 -10.896
  457   2HH2  ARG  53          HH12      ARG  53  -8.420  -4.188 -11.846
  458    H    HIS  54           HN       HIS  54  -6.447   0.272  -9.397
  459    HA   HIS  54           HA       HIS  54  -4.282  -0.304 -11.142
  460   1HB   HIS  54          HB2       HIS  54  -6.534   1.379 -11.176
  461   2HB   HIS  54          HB1       HIS  54  -5.184   2.494 -11.324
  462    HD1  HIS  54           HD1      HIS  54  -7.311   1.477 -13.607
  463    HD2  HIS  54           HD2      HIS  54  -3.293   0.433 -13.234
  464    HE1  HIS  54           HE1      HIS  54  -6.554   0.713 -15.899
  465    H    ASN  55           HN       ASN  55  -4.622   2.216  -8.643
  466    HA   ASN  55           HA       ASN  55  -2.111   3.469  -9.096
  467   1HB   ASN  55          HB2       ASN  55  -3.755   3.140  -6.571
  468   2HB   ASN  55          HB1       ASN  55  -2.307   4.144  -6.660
  469   1HD2  ASN  55          HD21      ASN  55  -5.175   4.996  -6.265
  470   2HD2  ASN  55          HD22      ASN  55  -5.496   6.088  -7.523
  471    H    LEU  56           HN       LEU  56  -2.985   0.645  -7.099
  472    HA   LEU  56           HA       LEU  56  -0.439   0.307  -5.883
  473   1HB   LEU  56          HB2       LEU  56  -2.579  -1.707  -6.561
  474   2HB   LEU  56          HB1       LEU  56  -1.123  -2.123  -5.661
  475    HG   LEU  56           HG       LEU  56  -3.062   0.063  -4.838
  476   1HD1  LEU  56          HD11      LEU  56  -4.065  -2.238  -4.801
  477   2HD1  LEU  56          HD12      LEU  56  -3.937  -1.502  -3.203
  478   3HD1  LEU  56          HD13      LEU  56  -2.778  -2.733  -3.703
  479   1HD2  LEU  56          HD21      LEU  56  -1.087   0.581  -3.709
  480   2HD2  LEU  56          HD22      LEU  56  -0.539  -1.094  -3.670
  481   3HD2  LEU  56          HD23      LEU  56  -1.801  -0.552  -2.569
  482    H    SER  57           HN       SER  57  -1.704  -0.958  -8.954
  483    HA   SER  57           HA       SER  57   0.606  -2.551  -9.550
  484   1HB   SER  57          HB2       SER  57  -0.272  -2.498 -11.887
  485   2HB   SER  57          HB1       SER  57  -1.498  -2.928 -10.697
  486    HG   SER  57           HG       SER  57  -1.848  -1.152 -12.410
  487    H    LEU  58           HN       LEU  58  -0.274   0.779 -10.575
  488    HA   LEU  58           HA       LEU  58   2.160   1.124 -12.091
  489   1HB   LEU  58          HB2       LEU  58   0.049   3.006 -11.050
  490   2HB   LEU  58          HB1       LEU  58   1.529   3.648 -11.758
  491    HG   LEU  58           HG       LEU  58   1.042   2.177 -13.793
  492   1HD1  LEU  58          HD11      LEU  58  -0.577   0.655 -12.749
  493   2HD1  LEU  58          HD12      LEU  58  -1.341   1.530 -14.072
  494   3HD1  LEU  58          HD13      LEU  58  -1.650   2.011 -12.405
  495   1HD2  LEU  58          HD21      LEU  58  -0.951   4.340 -13.053
  496   2HD2  LEU  58          HD22      LEU  58  -0.600   3.788 -14.691
  497   3HD2  LEU  58          HD23      LEU  58   0.645   4.612 -13.753
  498    H    ASN  59           HN       ASN  59   1.232   1.971  -8.761
  499    HA   ASN  59           HA       ASN  59   3.772   3.308  -8.248
  500   1HB   ASN  59          HB2       ASN  59   1.645   2.295  -6.335
  501   2HB   ASN  59          HB1       ASN  59   2.993   3.345  -5.897
  502   1HD2  ASN  59          HD21      ASN  59  -0.238   3.489  -6.636
  503   2HD2  ASN  59          HD22      ASN  59  -0.312   5.054  -7.287
  504    H    GLU  60           HN       GLU  60   5.637   2.214  -8.004
  505    HA   GLU  60           HA       GLU  60   5.588  -0.658  -7.312
  506   1HB   GLU  60          HB2       GLU  60   7.876   1.179  -8.067
  507   2HB   GLU  60          HB1       GLU  60   7.983  -0.573  -7.881
  508   1HG   GLU  60          HG2       GLU  60   6.305  -0.870  -9.666
  509   2HG   GLU  60          HG1       GLU  60   6.196   0.880  -9.858
  510    H    CYS  61           HN       CYS  61   5.662   2.195  -5.591
  511    HA   CYS  61           HA       CYS  61   7.709   1.719  -3.656
  512   1HB   CYS  61          HB2       CYS  61   6.296   3.169  -2.162
  513   2HB   CYS  61          HB1       CYS  61   6.612   3.881  -3.744
  514    HG   CYS  61           HG       CYS  61   4.178   3.047  -4.465
  515    H    PHE  62           HN       PHE  62   4.447   0.471  -4.022
  516    HA   PHE  62           HA       PHE  62   4.413  -0.800  -1.394
  517   1HB   PHE  62          HB2       PHE  62   2.643  -1.225  -3.823
  518   2HB   PHE  62          HB1       PHE  62   2.323  -1.841  -2.200
  519    HD1  PHE  62           HD1      PHE  62   2.427   1.151  -4.336
  520    HD2  PHE  62           HD2      PHE  62   1.728  -0.327  -0.365
  521    HE1  PHE  62           HE1      PHE  62   1.406   3.323  -3.706
  522    HE2  PHE  62           HE2      PHE  62   0.705   1.843   0.264
  523    HZ   PHE  62           HZ       PHE  62   0.544   3.668  -1.407
  524    H    VAL  63           HN       VAL  63   4.617  -3.066  -1.018
  525    HA   VAL  63           HA       VAL  63   6.174  -4.529  -3.124
  526    HB   VAL  63           HB       VAL  63   6.056  -4.976  -0.125
  527   1HG1  VAL  63          HG11      VAL  63   8.042  -6.428  -0.596
  528   2HG1  VAL  63          HG12      VAL  63   7.756  -6.195  -2.320
  529   3HG1  VAL  63          HG13      VAL  63   6.556  -7.029  -1.334
  530   1HG2  VAL  63          HG21      VAL  63   8.254  -3.958  -0.053
  531   2HG2  VAL  63          HG22      VAL  63   7.163  -2.837  -0.867
  532   3HG2  VAL  63          HG23      VAL  63   8.293  -3.809  -1.810
  533    H    LYS  64           HN       LYS  64   5.069  -6.135  -4.108
  534    HA   LYS  64           HA       LYS  64   2.481  -7.008  -3.068
  535   1HB   LYS  64          HB2       LYS  64   2.951  -6.690  -5.503
  536   2HB   LYS  64          HB1       LYS  64   4.058  -8.060  -5.435
  537   1HG   LYS  64          HG2       LYS  64   2.177  -9.493  -4.629
  538   2HG   LYS  64          HG1       LYS  64   1.086  -8.123  -4.825
  539   1HD   LYS  64          HD2       LYS  64   2.793  -9.074  -7.124
  540   2HD   LYS  64          HD1       LYS  64   1.259  -9.858  -6.759
  541   1HE   LYS  64          HE2       LYS  64   0.144  -7.613  -6.902
  542   2HE   LYS  64          HE1       LYS  64   1.682  -6.931  -7.434
  543   1HZ   LYS  64          HZ1       LYS  64  -0.234  -8.179  -8.991
  544   2HZ   LYS  64          HZ2       LYS  64   1.079  -9.254  -8.922
  545   3HZ   LYS  64          HZ3       LYS  64   1.308  -7.663  -9.473
  546    H    VAL  65           HN       VAL  65   2.451  -8.456  -1.425
  547    HA   VAL  65           HA       VAL  65   4.514 -10.614  -1.327
  548    HB   VAL  65           HB       VAL  65   2.560  -9.613   0.765
  549   1HG1  VAL  65          HG11      VAL  65   4.600 -11.847   0.781
  550   2HG1  VAL  65          HG12      VAL  65   2.881 -11.950   1.162
  551   3HG1  VAL  65          HG13      VAL  65   3.979 -11.119   2.262
  552   1HG2  VAL  65          HG21      VAL  65   4.559  -8.776   1.887
  553   2HG2  VAL  65          HG22      VAL  65   4.495  -8.119   0.251
  554   3HG2  VAL  65          HG23      VAL  65   5.586  -9.454   0.622
  555    HA   PRO  66           HA       PRO  66   0.889 -12.955  -2.805
  556   1HB   PRO  66          HB2       PRO  66   2.151 -15.184  -3.664
  557   2HB   PRO  66          HB1       PRO  66   2.264 -13.650  -4.549
  558   1HG   PRO  66          HG2       PRO  66   4.227 -14.897  -2.676
  559   2HG   PRO  66          HG1       PRO  66   4.514 -14.078  -4.221
  560   1HD   PRO  66          HD2       PRO  66   4.837 -12.864  -1.753
  561   2HD   PRO  66          HD1       PRO  66   4.495 -11.974  -3.254
  562    H    ARG  67           HN       ARG  67  -0.431 -14.497  -1.840
  563    HA   ARG  67           HA       ARG  67   0.271 -15.406   0.820
  564   1HB   ARG  67          HB2       ARG  67  -1.919 -16.517   0.783
  565   2HB   ARG  67          HB1       ARG  67  -2.065 -14.877   0.149
  566   1HG   ARG  67          HG2       ARG  67  -1.828 -15.825  -2.169
  567   2HG   ARG  67          HG1       ARG  67  -1.905 -17.439  -1.461
  568   1HD   ARG  67          HD2       ARG  67  -4.114 -17.007  -0.566
  569   2HD   ARG  67          HD1       ARG  67  -4.042 -15.324  -1.096
  570    HE   ARG  67           HE       ARG  67  -3.670 -16.727  -3.438
  571   1HH1  ARG  67          HH21      ARG  67  -5.949 -16.834  -0.855
  572   2HH1  ARG  67          HH22      ARG  67  -7.270 -17.316  -1.867
  573   1HH2  ARG  67          HH11      ARG  67  -5.378 -17.351  -4.772
  574   2HH2  ARG  67          HH12      ARG  67  -6.948 -17.608  -4.085
  575    H    ASP  68           HN       ASP  68   0.871 -17.491   1.461
  576    HA   ASP  68           HA       ASP  68   2.037 -19.181  -0.640
  577   1HB   ASP  68          HB2       ASP  68   1.936 -19.405   2.380
  578   2HB   ASP  68          HB1       ASP  68   2.734 -20.588   1.345
  579    H    ASP  69           HN       ASP  69   1.363 -21.351  -1.075
  580    HA   ASP  69           HA       ASP  69  -1.444 -21.812  -1.073
  581   1HB   ASP  69          HB2       ASP  69   0.890 -23.717  -1.388
  582   2HB   ASP  69          HB1       ASP  69  -0.791 -24.198  -1.624
  583    H    LYS  70           HN       LYS  70   1.095 -22.928   1.150
  584    HA   LYS  70           HA       LYS  70  -0.594 -24.657   2.694
  585   1HB   LYS  70          HB2       LYS  70   1.947 -23.163   3.400
  586   2HB   LYS  70          HB1       LYS  70   1.166 -24.317   4.484
  587   1HG   LYS  70          HG2       LYS  70   1.356 -26.072   2.759
  588   2HG   LYS  70          HG1       LYS  70   2.141 -24.924   1.676
  589   1HD   LYS  70          HD2       LYS  70   3.974 -24.634   3.306
  590   2HD   LYS  70          HD1       LYS  70   3.190 -25.789   4.386
  591   1HE   LYS  70          HE2       LYS  70   4.978 -26.862   3.041
  592   2HE   LYS  70          HE1       LYS  70   3.393 -27.551   2.693
  593   1HZ   LYS  70          HZ1       LYS  70   5.015 -26.770   0.789
  594   2HZ   LYS  70          HZ2       LYS  70   4.264 -25.274   1.083
  595   3HZ   LYS  70          HZ3       LYS  70   3.331 -26.623   0.639
  596    H    LYS  71           HN       LYS  71  -0.178 -21.197   2.623
  597    HA   LYS  71           HA       LYS  71  -1.994 -20.920   4.992
  598   1HB   LYS  71          HB2       LYS  71   0.114 -19.932   5.516
  599   2HB   LYS  71          HB1       LYS  71   0.229 -19.166   3.934
  600   1HG   LYS  71          HG2       LYS  71  -1.387 -17.550   4.448
  601   2HG   LYS  71          HG1       LYS  71  -2.075 -18.510   5.756
  602   1HD   LYS  71          HD2       LYS  71  -0.006 -18.160   7.077
  603   2HD   LYS  71          HD1       LYS  71   0.649 -17.173   5.770
  604   1HE   LYS  71          HE2       LYS  71  -0.378 -15.793   7.572
  605   2HE   LYS  71          HE1       LYS  71  -1.179 -15.571   6.017
  606   1HZ   LYS  71          HZ1       LYS  71  -2.145 -17.591   7.935
  607   2HZ   LYS  71          HZ2       LYS  71  -2.986 -16.832   6.670
  608   3HZ   LYS  71          HZ3       LYS  71  -2.613 -15.968   8.085
  609    HA   PRO  72           HA       PRO  72  -4.424 -19.560   1.277
  610   1HB   PRO  72          HB2       PRO  72  -6.629 -19.989   3.249
  611   2HB   PRO  72          HB1       PRO  72  -6.492 -20.559   1.575
  612   1HG   PRO  72          HG2       PRO  72  -6.186 -22.230   3.625
  613   2HG   PRO  72          HG1       PRO  72  -5.193 -22.379   2.163
  614   1HD   PRO  72          HD2       PRO  72  -4.443 -21.228   4.837
  615   2HD   PRO  72          HD1       PRO  72  -3.473 -22.223   3.726
  616    H    GLY  73           HN       GLY  73  -5.090 -17.429   0.924
  617   1HA   GLY  73          HA2       GLY  73  -5.863 -15.750   3.245
  618   2HA   GLY  73          HA1       GLY  73  -4.431 -15.254   2.341
  619    H    LYS  74           HN       LYS  74  -6.193 -13.367   2.223
  620    HA   LYS  74           HA       LYS  74  -8.031 -13.794  -0.080
  621   1HB   LYS  74          HB2       LYS  74  -7.674 -11.521   1.885
  622   2HB   LYS  74          HB1       LYS  74  -8.784 -11.455   0.516
  623   1HG   LYS  74          HG2       LYS  74  -9.765 -13.662   1.444
  624   2HG   LYS  74          HG1       LYS  74  -8.879 -13.280   2.918
  625   1HD   LYS  74          HD2       LYS  74 -10.896 -12.237   3.395
  626   2HD   LYS  74          HD1       LYS  74 -10.048 -10.905   2.614
  627   1HE   LYS  74          HE2       LYS  74 -12.041 -10.859   1.426
  628   2HE   LYS  74          HE1       LYS  74 -11.128 -11.977   0.415
  629   1HZ   LYS  74          HZ1       LYS  74 -12.817 -13.362   0.766
  630   2HZ   LYS  74          HZ2       LYS  74 -13.427 -12.455   2.067
  631   3HZ   LYS  74          HZ3       LYS  74 -12.182 -13.583   2.323
  632    H    GLY  75           HN       GLY  75  -7.709 -12.823  -2.032
  633   1HA   GLY  75          HA2       GLY  75  -6.366 -11.972  -3.784
  634   2HA   GLY  75          HA1       GLY  75  -6.325 -10.548  -2.742
  635    H    SER  76           HN       SER  76  -4.274  -9.868  -2.519
  636    HA   SER  76           HA       SER  76  -2.131 -11.884  -1.938
  637   1HB   SER  76          HB2       SER  76  -0.568 -10.535  -3.263
  638   2HB   SER  76          HB1       SER  76  -1.926 -11.031  -4.270
  639    HG   SER  76           HG       SER  76  -2.748  -8.838  -3.268
  640    H    TYR  77           HN       TYR  77  -0.813 -11.296  -0.211
  641    HA   TYR  77           HA       TYR  77  -1.716  -9.180   1.524
  642   1HB   TYR  77          HB2       TYR  77   0.769 -10.910   1.495
  643   2HB   TYR  77          HB1       TYR  77   0.476  -9.700   2.746
  644    HD1  TYR  77           HD1      TYR  77  -1.278  -9.995   4.398
  645    HD2  TYR  77           HD2      TYR  77  -0.711 -12.872   1.261
  646    HE1  TYR  77           HE1      TYR  77  -2.798 -11.568   5.566
  647    HE2  TYR  77           HE2      TYR  77  -2.223 -14.450   2.439
  648    HH   TYR  77           HH       TYR  77  -4.228 -14.108   4.195
  649    H    TRP  78           HN       TRP  78  -0.982  -7.085   1.720
  650    HA   TRP  78           HA       TRP  78   1.154  -6.188  -0.199
  651   1HB   TRP  78          HB2       TRP  78  -1.367  -4.795   0.747
  652   2HB   TRP  78          HB1       TRP  78  -0.079  -3.987  -0.144
  653    HD1  TRP  78           HD1      TRP  78  -2.940  -6.421  -0.549
  654    HE1  TRP  78           HE1      TRP  78  -3.288  -6.923  -3.052
  655    HE3  TRP  78           HE3      TRP  78   1.218  -4.173  -2.481
  656    HZ2  TRP  78           HZ2      TRP  78  -1.974  -6.431  -5.549
  657    HZ3  TRP  78           HZ3      TRP  78   1.644  -4.205  -4.922
  658    HH2  TRP  78           HH2      TRP  78   0.056  -5.322  -6.454
  659    H    THR  79           HN       THR  79   2.769  -4.879   0.639
  660    HA   THR  79           HA       THR  79   2.455  -3.668   3.309
  661    HB   THR  79           HB       THR  79   3.233  -6.014   3.728
  662    HG1  THR  79           HG1      THR  79   4.370  -3.695   4.513
  663   1HG2  THR  79          HG21      THR  79   4.612  -6.003   1.535
  664   2HG2  THR  79          HG22      THR  79   5.320  -6.788   2.947
  665   3HG2  THR  79          HG23      THR  79   5.845  -5.170   2.483
  666    H    LEU  80           HN       LEU  80   4.089  -2.082   3.737
  667    HA   LEU  80           HA       LEU  80   5.194  -0.828   1.347
  668   1HB   LEU  80          HB2       LEU  80   5.730  -0.199   4.268
  669   2HB   LEU  80          HB1       LEU  80   6.025   0.866   2.894
  670    HG   LEU  80           HG       LEU  80   3.311  -0.155   3.784
  671   1HD1  LEU  80          HD11      LEU  80   4.540   2.618   3.915
  672   2HD1  LEU  80          HD12      LEU  80   4.319   1.539   5.293
  673   3HD1  LEU  80          HD13      LEU  80   2.915   2.179   4.440
  674   1HD2  LEU  80          HD21      LEU  80   4.248   1.515   1.449
  675   2HD2  LEU  80          HD22      LEU  80   2.627   1.737   2.105
  676   3HD2  LEU  80          HD23      LEU  80   3.107   0.172   1.459
  677    H    ASP  81           HN       ASP  81   7.583  -0.112   3.250
  678    HA   ASP  81           HA       ASP  81   9.187  -2.607   2.933
  679   1HB   ASP  81          HB2       ASP  81   9.592  -1.212   0.917
  680   2HB   ASP  81          HB1       ASP  81  10.059   0.133   1.957
  681    HA   PRO  82           HA       PRO  82   9.838  -0.291   6.931
  682   1HB   PRO  82          HB2       PRO  82   9.115  -2.784   8.310
  683   2HB   PRO  82          HB1       PRO  82   8.331  -1.201   8.398
  684   1HG   PRO  82          HG2       PRO  82   7.191  -3.368   7.226
  685   2HG   PRO  82          HG1       PRO  82   6.852  -1.702   6.724
  686   1HD   PRO  82          HD2       PRO  82   8.700  -3.709   5.451
  687   2HD   PRO  82          HD1       PRO  82   7.557  -2.582   4.686
  688    H    ASP  83           HN       ASP  83  10.715  -2.265   8.980
  689    HA   ASP  83           HA       ASP  83  13.523  -2.390   8.282
  690   1HB   ASP  83          HB2       ASP  83  13.699  -3.607  10.481
  691   2HB   ASP  83          HB1       ASP  83  12.890  -2.044  10.607
  692    H    SER  84           HN       SER  84  13.060  -3.641   6.288
  693    HA   SER  84           HA       SER  84  12.004  -6.213   6.112
  694   1HB   SER  84          HB2       SER  84  13.051  -6.294   4.037
  695   2HB   SER  84          HB1       SER  84  13.090  -4.562   4.373
  696    HG   SER  84           HG       SER  84  15.132  -6.323   4.106
  697    H    TYR  85           HN       TYR  85  14.613  -5.297   8.051
  698    HA   TYR  85           HA       TYR  85  16.309  -7.588   7.861
  699   1HB   TYR  85          HB2       TYR  85  16.964  -5.566   9.106
  700   2HB   TYR  85          HB1       TYR  85  15.693  -5.879  10.291
  701    HD1  TYR  85           HD1      TYR  85  18.959  -6.991   8.987
  702    HD2  TYR  85           HD2      TYR  85  15.868  -7.722  11.879
  703    HE1  TYR  85           HE1      TYR  85  20.480  -8.503  10.234
  704    HE2  TYR  85           HE2      TYR  85  17.386  -9.236  13.122
  705    HH   TYR  85           HH       TYR  85  19.355 -10.543  12.789
  706    H    ASN  86           HN       ASN  86  13.330  -6.997   9.684
  707    HA   ASN  86           HA       ASN  86  13.444  -9.440  11.189
  708   1HB   ASN  86          HB2       ASN  86  11.161  -7.582  10.505
  709   2HB   ASN  86          HB1       ASN  86  10.979  -8.981  11.563
  710   1HD2  ASN  86          HD21      ASN  86  13.339  -8.908  13.061
  711   2HD2  ASN  86          HD22      ASN  86  13.413  -7.464  13.949
  712    H    MET  87           HN       MET  87  12.615  -8.783   7.951
  713    HA   MET  87           HA       MET  87  10.705 -10.847   7.500
  714   1HB   MET  87          HB2       MET  87  12.743  -9.589   5.651
  715   2HB   MET  87          HB1       MET  87  11.563 -10.775   5.102
  716   1HG   MET  87          HG2       MET  87   9.727  -9.361   5.812
  717   2HG   MET  87          HG1       MET  87  10.845  -8.199   6.525
  718   1HE   MET  87          HE1       MET  87   9.117  -6.562   3.475
  719   2HE   MET  87          HE2       MET  87  10.042  -5.940   4.840
  720   3HE   MET  87          HE3       MET  87   8.842  -7.203   5.100
  721    H    PHE  88           HN       PHE  88  12.102 -12.428   5.437
  722    HA   PHE  88           HA       PHE  88  13.119 -14.494   7.155
  723   1HB   PHE  88          HB2       PHE  88  13.365 -14.235   4.143
  724   2HB   PHE  88          HB1       PHE  88  13.522 -15.718   5.088
  725    HD1  PHE  88           HD1      PHE  88  11.207 -13.285   3.653
  726    HD2  PHE  88           HD2      PHE  88  11.549 -16.681   6.262
  727    HE1  PHE  88           HE1      PHE  88   8.751 -13.608   3.552
  728    HE2  PHE  88           HE2      PHE  88   9.092 -17.006   6.157
  729    HZ   PHE  88           HZ       PHE  88   7.693 -15.470   4.804
  730    H    GLU  89           HN       GLU  89  15.273 -15.276   5.319
  731    HA   GLU  89           HA       GLU  89  17.415 -13.441   6.333
  732   1HB   GLU  89          HB2       GLU  89  17.455 -16.386   5.626
  733   2HB   GLU  89          HB1       GLU  89  18.905 -15.450   5.987
  734   1HG   GLU  89          HG2       GLU  89  16.543 -15.640   7.870
  735   2HG   GLU  89          HG1       GLU  89  17.944 -16.708   7.962
  736    H    ASN  90           HN       ASN  90  15.735 -13.575   3.685
  737    HA   ASN  90           HA       ASN  90  18.020 -12.850   1.963
  738   1HB   ASN  90          HB2       ASN  90  17.674 -15.343   1.697
  739   2HB   ASN  90          HB1       ASN  90  16.067 -14.984   1.064
  740   1HD2  ASN  90          HD21      ASN  90  19.530 -14.160   0.483
  741   2HD2  ASN  90          HD22      ASN  90  19.352 -13.964  -1.194
  742    H    GLY  91           HN       GLY  91  17.354 -11.594   0.131
  743   1HA   GLY  91          HA2       GLY  91  15.881 -10.254  -1.134
  744   2HA   GLY  91          HA1       GLY  91  14.529 -11.112  -0.391
  745    H    SER  92           HN       SER  92  16.928  -9.745   1.698
  746    HA   SER  92           HA       SER  92  14.923  -7.901   2.807
  747   1HB   SER  92          HB2       SER  92  16.393  -9.287   4.290
  748   2HB   SER  92          HB1       SER  92  17.786  -8.405   3.675
  749    HG   SER  92           HG       SER  92  16.884  -6.509   4.501
  750    H    PHE  93           HN       PHE  93  14.730  -6.119   1.554
  751    HA   PHE  93           HA       PHE  93  16.744  -4.912  -0.041
  752   1HB   PHE  93          HB2       PHE  93  14.264  -4.435  -0.157
  753   2HB   PHE  93          HB1       PHE  93  14.442  -3.471   1.309
  754    HD1  PHE  93           HD1      PHE  93  15.188  -3.685  -2.283
  755    HD2  PHE  93           HD2      PHE  93  15.716  -1.370   1.298
  756    HE1  PHE  93           HE1      PHE  93  15.942  -1.753  -3.643
  757    HE2  PHE  93           HE2      PHE  93  16.469   0.562  -0.063
  758    HZ   PHE  93           HZ       PHE  93  16.581   0.370  -2.534
  759    H    LEU  94           HN       LEU  94  18.428  -3.583   0.473
  760    HA   LEU  94           HA       LEU  94  18.702  -2.689   3.327
  761   1HB   LEU  94          HB2       LEU  94  20.819  -3.182   1.212
  762   2HB   LEU  94          HB1       LEU  94  21.133  -2.645   2.858
  763    HG   LEU  94           HG       LEU  94  19.664  -5.217   2.220
  764   1HD1  LEU  94          HD11      LEU  94  22.615  -4.801   2.795
  765   2HD1  LEU  94          HD12      LEU  94  21.928  -5.299   1.249
  766   3HD1  LEU  94          HD13      LEU  94  21.811  -6.364   2.651
  767   1HD2  LEU  94          HD21      LEU  94  20.881  -3.985   4.703
  768   2HD2  LEU  94          HD22      LEU  94  20.618  -5.723   4.586
  769   3HD2  LEU  94          HD23      LEU  94  19.252  -4.620   4.477
  Start of MODEL   22
    1   1H    MET   1          HT1       MET   1 -24.487  13.766   8.146
    2   2H    MET   1          HT2       MET   1 -23.475  14.317   9.394
    3   3H    MET   1          HT3       MET   1 -22.961  13.060   8.373
    4    HA   MET   1           HA       MET   1 -23.598  15.169   6.700
    5   1HB   MET   1          HB2       MET   1 -22.016  15.978   9.156
    6   2HB   MET   1          HB1       MET   1 -21.996  16.884   7.642
    7   1HG   MET   1          HG2       MET   1 -24.441  17.165   7.772
    8   2HG   MET   1          HG1       MET   1 -24.466  16.257   9.283
    9   1HE   MET   1          HE1       MET   1 -21.686  19.132   8.190
   10   2HE   MET   1          HE2       MET   1 -22.866  20.421   8.402
   11   3HE   MET   1          HE3       MET   1 -23.212  19.096   7.295
   12    H    LEU   2           HN       LEU   2 -22.492  13.988   5.168
   13    HA   LEU   2           HA       LEU   2 -19.702  13.103   5.777
   14   1HB   LEU   2          HB2       LEU   2 -21.441  12.406   3.395
   15   2HB   LEU   2          HB1       LEU   2 -19.919  11.644   3.862
   16    HG   LEU   2           HG       LEU   2 -22.496  11.611   5.462
   17   1HD1  LEU   2          HD11      LEU   2 -22.403   9.167   4.989
   18   2HD1  LEU   2          HD12      LEU   2 -21.010   9.447   3.945
   19   3HD1  LEU   2          HD13      LEU   2 -22.578  10.133   3.523
   20   1HD2  LEU   2          HD21      LEU   2 -19.687  10.694   6.062
   21   2HD2  LEU   2          HD22      LEU   2 -21.059   9.840   6.767
   22   3HD2  LEU   2          HD23      LEU   2 -20.822  11.554   7.103
   23    H    VAL   3           HN       VAL   3 -17.984  13.906   4.633
   24    HA   VAL   3           HA       VAL   3 -18.521  15.851   2.421
   25    HB   VAL   3           HB       VAL   3 -16.689  17.284   3.380
   26   1HG1  VAL   3          HG11      VAL   3 -18.984  16.895   5.315
   27   2HG1  VAL   3          HG12      VAL   3 -19.173  17.675   3.745
   28   3HG1  VAL   3          HG13      VAL   3 -18.115  18.389   4.962
   29   1HG2  VAL   3          HG21      VAL   3 -16.035  16.940   5.707
   30   2HG2  VAL   3          HG22      VAL   3 -15.687  15.476   4.788
   31   3HG2  VAL   3          HG23      VAL   3 -17.107  15.545   5.832
   32    H    LYS   4           HN       LYS   4 -16.851  15.946   0.860
   33    HA   LYS   4           HA       LYS   4 -15.323  13.528   0.532
   34   1HB   LYS   4          HB2       LYS   4 -14.843  16.134  -0.923
   35   2HB   LYS   4          HB1       LYS   4 -14.589  14.492  -1.520
   36   1HG   LYS   4          HG2       LYS   4 -17.076  14.110  -1.253
   37   2HG   LYS   4          HG1       LYS   4 -17.238  15.834  -0.921
   38   1HD   LYS   4          HD2       LYS   4 -16.043  14.652  -3.446
   39   2HD   LYS   4          HD1       LYS   4 -17.672  15.311  -3.306
   40   1HE   LYS   4          HE2       LYS   4 -16.525  17.161  -4.133
   41   2HE   LYS   4          HE1       LYS   4 -16.388  17.452  -2.400
   42   1HZ   LYS   4          HZ1       LYS   4 -14.333  17.124  -4.234
   43   2HZ   LYS   4          HZ2       LYS   4 -14.315  15.739  -3.251
   44   3HZ   LYS   4          HZ3       LYS   4 -14.200  17.283  -2.551
   45    HA   PRO   5           HA       PRO   5 -11.891  15.199   2.956
   46   1HB   PRO   5          HB2       PRO   5 -10.325  13.055   3.131
   47   2HB   PRO   5          HB1       PRO   5 -11.924  13.064   3.903
   48   1HG   PRO   5          HG2       PRO   5 -11.107  11.868   1.286
   49   2HG   PRO   5          HG1       PRO   5 -12.092  11.160   2.579
   50   1HD   PRO   5          HD2       PRO   5 -13.165  12.364   0.326
   51   2HD   PRO   5          HD1       PRO   5 -14.014  12.241   1.885
   52    HA   PRO   6           HA       PRO   6  -8.928  16.251  -0.260
   53   1HB   PRO   6          HB2       PRO   6  -7.027  17.509   1.165
   54   2HB   PRO   6          HB1       PRO   6  -8.673  18.168   1.047
   55   1HG   PRO   6          HG2       PRO   6  -7.435  16.581   3.261
   56   2HG   PRO   6          HG1       PRO   6  -8.429  18.045   3.353
   57   1HD   PRO   6          HD2       PRO   6  -9.440  15.502   3.731
   58   2HD   PRO   6          HD1       PRO   6 -10.407  16.877   3.151
   59    H    TYR   7           HN       TYR   7  -8.306  13.702   1.837
   60    HA   TYR   7           HA       TYR   7  -5.474  13.378   1.574
   61   1HB   TYR   7          HB2       TYR   7  -7.537  11.163   1.745
   62   2HB   TYR   7          HB1       TYR   7  -5.833  11.049   2.175
   63    HD1  TYR   7           HD1      TYR   7  -8.963  11.265   3.578
   64    HD2  TYR   7           HD2      TYR   7  -5.121  13.172   3.844
   65    HE1  TYR   7           HE1      TYR   7  -9.512  12.055   5.859
   66    HE2  TYR   7           HE2      TYR   7  -5.668  13.951   6.130
   67    HH   TYR   7           HH       TYR   7  -7.271  14.137   7.674
   68    H    SER   8           HN       SER   8  -4.236  12.431  -0.035
   69    HA   SER   8           HA       SER   8  -5.404  12.287  -2.694
   70   1HB   SER   8          HB2       SER   8  -2.658  11.537  -1.647
   71   2HB   SER   8          HB1       SER   8  -3.106  11.508  -3.350
   72    HG   SER   8           HG       SER   8  -2.728  13.662  -1.614
   73    H    TYR   9           HN       TYR   9  -5.150  10.271  -4.056
   74    HA   TYR   9           HA       TYR   9  -6.466   8.047  -2.846
   75   1HB   TYR   9          HB2       TYR   9  -4.922   8.394  -5.420
   76   2HB   TYR   9          HB1       TYR   9  -5.581   6.824  -4.960
   77    HD1  TYR   9           HD1      TYR   9  -6.292   9.792  -6.712
   78    HD2  TYR   9           HD2      TYR   9  -8.114   6.933  -4.074
   79    HE1  TYR   9           HE1      TYR   9  -8.537  10.483  -7.509
   80    HE2  TYR   9           HE2      TYR   9 -10.351   7.616  -4.873
   81    HH   TYR   9           HH       TYR   9 -10.915   9.243  -7.611
   82    H    ILE  10           HN       ILE  10  -3.032   8.697  -3.482
   83    HA   ILE  10           HA       ILE  10  -2.106   6.118  -2.548
   84    HB   ILE  10           HB       ILE  10  -0.624   8.769  -2.581
   85   1HG1  ILE  10          HG12      ILE  10  -1.412   8.353  -4.824
   86   2HG1  ILE  10          HG11      ILE  10   0.290   7.906  -4.772
   87   1HG2  ILE  10          HG21      ILE  10   0.574   7.170  -1.271
   88   2HG2  ILE  10          HG22      ILE  10   1.354   7.187  -2.854
   89   3HG2  ILE  10          HG23      ILE  10   0.250   5.879  -2.427
   90   1HD1  ILE  10          HD11      ILE  10  -0.591   5.512  -4.240
   91   2HD1  ILE  10          HD12      ILE  10  -0.699   6.099  -5.899
   92   3HD1  ILE  10          HD13      ILE  10  -2.127   6.113  -4.868
   93    H    ALA  11           HN       ALA  11  -2.576   9.289  -1.015
   94    HA   ALA  11           HA       ALA  11  -1.411   8.656   1.503
   95   1HB   ALA  11          HB1       ALA  11  -3.799  10.469   1.010
   96   2HB   ALA  11          HB2       ALA  11  -2.121  10.953   0.764
   97   3HB   ALA  11          HB3       ALA  11  -2.690  10.535   2.380
   98    H    LEU  12           HN       LEU  12  -4.755   8.206   0.326
   99    HA   LEU  12           HA       LEU  12  -5.824   7.232   2.785
  100   1HB   LEU  12          HB2       LEU  12  -6.539   6.587  -0.091
  101   2HB   LEU  12          HB1       LEU  12  -7.487   6.041   1.291
  102    HG   LEU  12           HG       LEU  12  -6.851   8.946   0.693
  103   1HD1  LEU  12          HD11      LEU  12  -9.295   9.031   0.058
  104   2HD1  LEU  12          HD12      LEU  12  -9.306   7.268   0.112
  105   3HD1  LEU  12          HD13      LEU  12  -8.285   8.107  -1.055
  106   1HD2  LEU  12          HD21      LEU  12  -7.356   8.951   2.958
  107   2HD2  LEU  12          HD22      LEU  12  -8.370   7.513   2.855
  108   3HD2  LEU  12          HD23      LEU  12  -8.983   9.069   2.301
  109    H    ILE  13           HN       ILE  13  -4.201   5.571   0.093
  110    HA   ILE  13           HA       ILE  13  -4.427   2.925   1.172
  111    HB   ILE  13           HB       ILE  13  -2.352   4.157  -0.670
  112   1HG1  ILE  13          HG12      ILE  13  -4.676   2.313  -1.293
  113   2HG1  ILE  13          HG11      ILE  13  -4.776   4.067  -1.421
  114   1HG2  ILE  13          HG21      ILE  13  -1.360   2.194   0.306
  115   2HG2  ILE  13          HG22      ILE  13  -1.945   1.728  -1.290
  116   3HG2  ILE  13          HG23      ILE  13  -2.864   1.285   0.149
  117   1HD1  ILE  13          HD11      ILE  13  -3.321   4.156  -3.235
  118   2HD1  ILE  13          HD12      ILE  13  -4.137   2.623  -3.537
  119   3HD1  ILE  13          HD13      ILE  13  -2.529   2.636  -2.817
  120    H    THR  14           HN       THR  14  -1.877   5.405   1.430
  121    HA   THR  14           HA       THR  14  -0.090   3.883   3.029
  122    HB   THR  14           HB       THR  14  -0.522   6.877   3.016
  123    HG1  THR  14           HG1      THR  14   1.076   5.107   1.506
  124   1HG2  THR  14          HG21      THR  14   0.786   6.469   4.922
  125   2HG2  THR  14          HG22      THR  14   1.997   6.733   3.669
  126   3HG2  THR  14          HG23      THR  14   1.606   5.092   4.184
  127    H    MET  15           HN       MET  15  -2.829   5.960   3.944
  128    HA   MET  15           HA       MET  15  -2.365   5.765   6.780
  129   1HB   MET  15          HB2       MET  15  -4.872   6.350   5.181
  130   2HB   MET  15          HB1       MET  15  -4.806   6.418   6.942
  131   1HG   MET  15          HG2       MET  15  -3.010   8.110   6.810
  132   2HG   MET  15          HG1       MET  15  -3.086   8.049   5.050
  133   1HE   MET  15          HE1       MET  15  -3.114  10.558   6.332
  134   2HE   MET  15          HE2       MET  15  -4.577  11.493   6.026
  135   3HE   MET  15          HE3       MET  15  -3.745  10.709   4.686
  136    H    ALA  16           HN       ALA  16  -4.281   3.875   4.475
  137    HA   ALA  16           HA       ALA  16  -5.595   2.181   6.340
  138   1HB   ALA  16          HB1       ALA  16  -5.627   0.546   4.380
  139   2HB   ALA  16          HB2       ALA  16  -4.689   1.746   3.489
  140   3HB   ALA  16          HB3       ALA  16  -6.311   2.140   4.057
  141    H    ILE  17           HN       ILE  17  -2.500   1.688   4.606
  142    HA   ILE  17           HA       ILE  17  -1.858  -0.822   5.798
  143    HB   ILE  17           HB       ILE  17   0.031   1.395   4.919
  144   1HG1  ILE  17          HG12      ILE  17  -0.920  -1.021   3.359
  145   2HG1  ILE  17          HG11      ILE  17  -1.684   0.565   3.233
  146   1HG2  ILE  17          HG21      ILE  17   1.520  -0.655   4.495
  147   2HG2  ILE  17          HG22      ILE  17   0.381  -1.558   5.490
  148   3HG2  ILE  17          HG23      ILE  17   1.276  -0.204   6.182
  149   1HD1  ILE  17          HD11      ILE  17   1.240  -0.030   2.672
  150   2HD1  ILE  17          HD12      ILE  17   0.474   1.555   2.554
  151   3HD1  ILE  17          HD13      ILE  17   0.001   0.262   1.452
  152    H    GLN  18           HN       GLN  18  -0.933   2.487   6.698
  153    HA   GLN  18           HA       GLN  18   0.475   1.835   9.089
  154   1HB   GLN  18          HB2       GLN  18  -1.067   4.317   8.291
  155   2HB   GLN  18          HB1       GLN  18  -0.094   4.213   9.759
  156   1HG   GLN  18          HG2       GLN  18   1.896   3.675   8.402
  157   2HG   GLN  18          HG1       GLN  18   0.925   3.784   6.933
  158   1HE2  GLN  18          HE21      GLN  18  -0.574   6.102   8.510
  159   2HE2  GLN  18          HE22      GLN  18   0.426   7.440   8.216
  160    H    ASN  19           HN       ASN  19  -2.960   2.493   8.492
  161    HA   ASN  19           HA       ASN  19  -3.641   2.184  11.332
  162   1HB   ASN  19          HB2       ASN  19  -5.334   2.491   8.836
  163   2HB   ASN  19          HB1       ASN  19  -5.995   2.388  10.468
  164   1HD2  ASN  19          HD21      ASN  19  -3.220   3.919  11.122
  165   2HD2  ASN  19          HD22      ASN  19  -3.674   5.535  10.879
  166    H    ALA  20           HN       ALA  20  -2.828   0.015   8.963
  167    HA   ALA  20           HA       ALA  20  -4.899  -1.978   9.442
  168   1HB   ALA  20          HB1       ALA  20  -3.622  -1.912   7.319
  169   2HB   ALA  20          HB2       ALA  20  -3.448  -3.470   8.127
  170   3HB   ALA  20          HB3       ALA  20  -2.142  -2.289   8.207
  171    HA   PRO  21           HA       PRO  21  -3.368  -3.289  13.504
  172   1HB   PRO  21          HB2       PRO  21  -4.114  -5.952  12.301
  173   2HB   PRO  21          HB1       PRO  21  -4.410  -5.344  13.945
  174   1HG   PRO  21          HG2       PRO  21  -6.340  -5.320  12.117
  175   2HG   PRO  21          HG1       PRO  21  -6.158  -3.989  13.275
  176   1HD   PRO  21          HD2       PRO  21  -5.583  -4.015  10.356
  177   2HD   PRO  21          HD1       PRO  21  -5.957  -2.640  11.417
  178    H    GLU  22           HN       GLU  22  -2.396  -4.681  10.447
  179    HA   GLU  22           HA       GLU  22   0.380  -4.941  11.442
  180   1HB   GLU  22          HB2       GLU  22   0.579  -7.198  10.359
  181   2HB   GLU  22          HB1       GLU  22  -0.477  -7.194  11.772
  182   1HG   GLU  22          HG2       GLU  22  -2.451  -7.115  10.366
  183   2HG   GLU  22          HG1       GLU  22  -1.464  -6.930   8.918
  184    H    LYS  23           HN       LYS  23   1.909  -4.935   9.649
  185    HA   LYS  23           HA       LYS  23   1.172  -3.178   7.542
  186   1HB   LYS  23          HB2       LYS  23   3.497  -5.118   7.744
  187   2HB   LYS  23          HB1       LYS  23   3.365  -3.857   6.520
  188   1HG   LYS  23          HG2       LYS  23   3.177  -3.188   9.458
  189   2HG   LYS  23          HG1       LYS  23   4.742  -3.350   8.669
  190   1HD   LYS  23          HD2       LYS  23   3.959  -1.654   6.961
  191   2HD   LYS  23          HD1       LYS  23   2.534  -1.393   7.968
  192   1HE   LYS  23          HE2       LYS  23   5.412  -0.772   8.578
  193   2HE   LYS  23          HE1       LYS  23   3.993   0.264   8.745
  194   1HZ   LYS  23          HZ1       LYS  23   4.922  -1.910  10.495
  195   2HZ   LYS  23          HZ2       LYS  23   3.267  -1.526  10.444
  196   3HZ   LYS  23          HZ3       LYS  23   4.402  -0.350  10.906
  197    H    LYS  24           HN       LYS  24   1.338  -6.725   7.646
  198    HA   LYS  24           HA       LYS  24   0.738  -6.973   4.799
  199   1HB   LYS  24          HB2       LYS  24   0.654  -9.012   7.047
  200   2HB   LYS  24          HB1       LYS  24   0.504  -9.399   5.332
  201   1HG   LYS  24          HG2       LYS  24   2.737  -8.436   4.918
  202   2HG   LYS  24          HG1       LYS  24   2.893  -8.059   6.635
  203   1HD   LYS  24          HD2       LYS  24   2.680 -10.455   7.183
  204   2HD   LYS  24          HD1       LYS  24   2.527 -10.835   5.468
  205   1HE   LYS  24          HE2       LYS  24   4.816 -11.217   5.959
  206   2HE   LYS  24          HE1       LYS  24   4.790  -9.634   5.182
  207   1HZ   LYS  24          HZ1       LYS  24   5.100 -10.280   8.045
  208   2HZ   LYS  24          HZ2       LYS  24   4.565  -8.745   7.552
  209   3HZ   LYS  24          HZ3       LYS  24   6.088  -9.315   7.061
  210    H    ILE  25           HN       ILE  25  -1.245  -6.283   4.144
  211    HA   ILE  25           HA       ILE  25  -3.648  -7.361   5.561
  212    HB   ILE  25           HB       ILE  25  -3.377  -4.978   6.183
  213   1HG1  ILE  25          HG12      ILE  25  -5.634  -5.356   4.196
  214   2HG1  ILE  25          HG11      ILE  25  -5.633  -6.047   5.819
  215   1HG2  ILE  25          HG21      ILE  25  -3.550  -3.239   4.461
  216   2HG2  ILE  25          HG22      ILE  25  -3.613  -4.468   3.199
  217   3HG2  ILE  25          HG23      ILE  25  -2.145  -4.257   4.155
  218   1HD1  ILE  25          HD11      ILE  25  -5.318  -3.732   6.738
  219   2HD1  ILE  25          HD12      ILE  25  -6.847  -3.948   5.888
  220   3HD1  ILE  25          HD13      ILE  25  -5.513  -3.104   5.102
  221    H    THR  26           HN       THR  26  -5.479  -7.670   4.143
  222    HA   THR  26           HA       THR  26  -4.663  -8.401   1.432
  223    HB   THR  26           HB       THR  26  -7.011  -9.193   1.226
  224    HG1  THR  26           HG1      THR  26  -7.201  -7.664   3.529
  225   1HG2  THR  26          HG21      THR  26  -5.406 -10.724   2.183
  226   2HG2  THR  26          HG22      THR  26  -6.894 -10.849   3.120
  227   3HG2  THR  26          HG23      THR  26  -5.525  -9.939   3.757
  228    H    LEU  27           HN       LEU  27  -5.694  -7.599  -0.495
  229    HA   LEU  27           HA       LEU  27  -5.902  -4.768  -0.656
  230   1HB   LEU  27          HB2       LEU  27  -5.348  -6.200  -2.574
  231   2HB   LEU  27          HB1       LEU  27  -6.943  -6.933  -2.513
  232    HG   LEU  27           HG       LEU  27  -8.003  -4.858  -3.167
  233   1HD1  LEU  27          HD11      LEU  27  -6.444  -2.886  -3.743
  234   2HD1  LEU  27          HD12      LEU  27  -5.254  -3.693  -2.720
  235   3HD1  LEU  27          HD13      LEU  27  -6.794  -3.163  -2.041
  236   1HD2  LEU  27          HD21      LEU  27  -7.222  -6.088  -5.049
  237   2HD2  LEU  27          HD22      LEU  27  -5.553  -5.587  -4.783
  238   3HD2  LEU  27          HD23      LEU  27  -6.741  -4.419  -5.348
  239    H    ASN  28           HN       ASN  28  -8.376  -7.307  -0.465
  240    HA   ASN  28           HA       ASN  28 -10.670  -5.623  -0.646
  241   1HB   ASN  28          HB2       ASN  28 -10.193  -8.298   0.668
  242   2HB   ASN  28          HB1       ASN  28 -11.774  -7.517   0.689
  243   1HD2  ASN  28          HD21      ASN  28 -12.107  -6.483  -1.806
  244   2HD2  ASN  28          HD22      ASN  28 -11.967  -7.680  -3.002
  245    H    GLY  29           HN       GLY  29  -8.699  -6.627   2.124
  246   1HA   GLY  29          HA2       GLY  29 -10.323  -5.537   4.183
  247   2HA   GLY  29          HA1       GLY  29  -8.584  -5.789   4.306
  248    H    ILE  30           HN       ILE  30  -7.776  -4.012   2.212
  249    HA   ILE  30           HA       ILE  30  -7.644  -1.572   3.657
  250    HB   ILE  30           HB       ILE  30  -7.156  -2.176   0.729
  251   1HG1  ILE  30          HG12      ILE  30  -5.255  -1.603   3.025
  252   2HG1  ILE  30          HG11      ILE  30  -5.687  -3.225   2.487
  253   1HG2  ILE  30          HG21      ILE  30  -7.642   0.177   0.819
  254   2HG2  ILE  30          HG22      ILE  30  -5.886   0.038   0.807
  255   3HG2  ILE  30          HG23      ILE  30  -6.733   0.371   2.317
  256   1HD1  ILE  30          HD11      ILE  30  -4.359  -1.091   0.788
  257   2HD1  ILE  30          HD12      ILE  30  -4.812  -2.702   0.230
  258   3HD1  ILE  30          HD13      ILE  30  -3.565  -2.513   1.464
  259    H    TYR  31           HN       TYR  31  -9.830  -2.537   0.997
  260    HA   TYR  31           HA       TYR  31 -11.067   0.026   0.710
  261   1HB   TYR  31          HB2       TYR  31 -12.060  -2.775   0.153
  262   2HB   TYR  31          HB1       TYR  31 -13.048  -1.350  -0.169
  263    HD1  TYR  31           HD1      TYR  31 -11.715   0.619  -1.428
  264    HD2  TYR  31           HD2      TYR  31 -10.737  -3.555  -1.609
  265    HE1  TYR  31           HE1      TYR  31 -10.513   0.993  -3.556
  266    HE2  TYR  31           HE2      TYR  31  -9.535  -3.183  -3.740
  267    HH   TYR  31           HH       TYR  31  -9.903  -1.002  -5.680
  268    H    GLN  32           HN       GLN  32 -11.760  -2.682   2.891
  269    HA   GLN  32           HA       GLN  32 -14.222  -1.737   3.925
  270   1HB   GLN  32          HB2       GLN  32 -13.277  -3.960   4.459
  271   2HB   GLN  32          HB1       GLN  32 -11.996  -3.189   5.393
  272   1HG   GLN  32          HG2       GLN  32 -13.615  -2.269   6.953
  273   2HG   GLN  32          HG1       GLN  32 -14.953  -2.880   5.980
  274   1HE2  GLN  32          HE21      GLN  32 -14.565  -3.663   8.734
  275   2HE2  GLN  32          HE22      GLN  32 -14.197  -5.320   8.757
  276    H    PHE  33           HN       PHE  33 -10.881  -1.004   4.930
  277    HA   PHE  33           HA       PHE  33 -11.546   0.708   7.105
  278   1HB   PHE  33          HB2       PHE  33  -9.254  -0.105   6.699
  279   2HB   PHE  33          HB1       PHE  33  -9.167   0.869   5.231
  280    HD1  PHE  33           HD1      PHE  33  -9.222   0.943   8.916
  281    HD2  PHE  33           HD2      PHE  33  -9.027   3.307   5.334
  282    HE1  PHE  33           HE1      PHE  33  -8.531   2.914  10.253
  283    HE2  PHE  33           HE2      PHE  33  -8.334   5.277   6.671
  284    HZ   PHE  33           HZ       PHE  33  -8.087   5.080   9.131
  285    H    ILE  34           HN       ILE  34 -10.940   1.506   3.664
  286    HA   ILE  34           HA       ILE  34 -11.266   4.310   3.920
  287    HB   ILE  34           HB       ILE  34 -11.789   2.446   1.593
  288   1HG1  ILE  34          HG12      ILE  34  -9.542   4.413   2.111
  289   2HG1  ILE  34          HG11      ILE  34  -9.456   2.706   2.544
  290   1HG2  ILE  34          HG21      ILE  34 -11.600   4.577   0.217
  291   2HG2  ILE  34          HG22      ILE  34 -11.809   5.476   1.718
  292   3HG2  ILE  34          HG23      ILE  34 -13.097   4.421   1.134
  293   1HD1  ILE  34          HD11      ILE  34  -9.735   3.898  -0.222
  294   2HD1  ILE  34          HD12      ILE  34 -10.008   2.188   0.110
  295   3HD1  ILE  34          HD13      ILE  34  -8.420   2.899   0.394
  296    H    MET  35           HN       MET  35 -13.756   1.872   3.009
  297    HA   MET  35           HA       MET  35 -15.842   3.843   2.868
  298   1HB   MET  35          HB2       MET  35 -15.911   0.842   3.232
  299   2HB   MET  35          HB1       MET  35 -17.375   1.821   3.116
  300   1HG   MET  35          HG2       MET  35 -16.600   2.702   0.932
  301   2HG   MET  35          HG1       MET  35 -15.166   1.685   1.037
  302   1HE   MET  35          HE1       MET  35 -15.444  -1.139  -0.110
  303   2HE   MET  35          HE2       MET  35 -16.382  -1.799   1.225
  304   3HE   MET  35          HE3       MET  35 -15.150  -0.584   1.542
  305    H    ASP  36           HN       ASP  36 -14.705   1.739   5.509
  306    HA   ASP  36           HA       ASP  36 -16.788   2.558   7.332
  307   1HB   ASP  36          HB2       ASP  36 -14.076   1.292   7.768
  308   2HB   ASP  36          HB1       ASP  36 -15.208   1.620   9.082
  309    H    ARG  37           HN       ARG  37 -13.424   3.687   6.838
  310    HA   ARG  37           HA       ARG  37 -13.575   5.589   9.003
  311   1HB   ARG  37          HB2       ARG  37 -11.502   4.608   7.608
  312   2HB   ARG  37          HB1       ARG  37 -11.725   6.098   6.698
  313   1HG   ARG  37          HG2       ARG  37 -11.292   5.868   9.692
  314   2HG   ARG  37          HG1       ARG  37 -10.123   6.460   8.514
  315   1HD   ARG  37          HD2       ARG  37 -11.949   8.202   7.895
  316   2HD   ARG  37          HD1       ARG  37 -12.686   7.750   9.433
  317    HE   ARG  37           HE       ARG  37 -10.039   8.277  10.082
  318   1HH1  ARG  37          HH21      ARG  37 -12.619   9.904   8.477
  319   2HH1  ARG  37          HH22      ARG  37 -12.086  11.487   8.938
  320   1HH2  ARG  37          HH11      ARG  37  -9.325  10.334  10.692
  321   2HH2  ARG  37          HH12      ARG  37 -10.219  11.729  10.189
  322    H    PHE  38           HN       PHE  38 -14.170   5.809   5.506
  323    HA   PHE  38           HA       PHE  38 -15.461   8.479   5.978
  324   1HB   PHE  38          HB2       PHE  38 -13.976   7.661   3.460
  325   2HB   PHE  38          HB1       PHE  38 -14.671   9.238   3.824
  326    HD1  PHE  38           HD1      PHE  38 -11.843   7.000   4.348
  327    HD2  PHE  38           HD2      PHE  38 -13.696  10.655   5.634
  328    HE1  PHE  38           HE1      PHE  38  -9.727   7.686   5.445
  329    HE2  PHE  38           HE2      PHE  38 -11.581  11.341   6.731
  330    HZ   PHE  38           HZ       PHE  38  -9.596   9.855   6.639
  331    HA   PRO  39           HA       PRO  39 -18.570   5.299   4.473
  332   1HB   PRO  39          HB2       PRO  39 -20.185   7.521   5.695
  333   2HB   PRO  39          HB1       PRO  39 -20.448   5.767   5.774
  334   1HG   PRO  39          HG2       PRO  39 -19.399   7.050   7.834
  335   2HG   PRO  39          HG1       PRO  39 -18.777   5.459   7.354
  336   1HD   PRO  39          HD2       PRO  39 -17.543   8.159   6.959
  337   2HD   PRO  39          HD1       PRO  39 -16.753   6.589   7.235
  338    H    PHE  40           HN       PHE  40 -17.684   8.454   3.634
  339    HA   PHE  40           HA       PHE  40 -19.788   9.267   1.898
  340   1HB   PHE  40          HB2       PHE  40 -18.115  10.871   2.440
  341   2HB   PHE  40          HB1       PHE  40 -16.812   9.799   1.941
  342    HD1  PHE  40           HD1      PHE  40 -19.834  11.560   0.584
  343    HD2  PHE  40           HD2      PHE  40 -15.911   9.996  -0.218
  344    HE1  PHE  40           HE1      PHE  40 -19.909  12.538  -1.693
  345    HE2  PHE  40           HE2      PHE  40 -15.991  10.973  -2.496
  346    HZ   PHE  40           HZ       PHE  40 -17.989  12.244  -3.234
  347    H    TYR  41           HN       TYR  41 -16.991   7.165   1.372
  348    HA   TYR  41           HA       TYR  41 -17.403   6.846  -1.458
  349   1HB   TYR  41          HB2       TYR  41 -15.883   5.216   0.588
  350   2HB   TYR  41          HB1       TYR  41 -15.842   4.887  -1.148
  351    HD1  TYR  41           HD1      TYR  41 -14.593   6.278  -2.647
  352    HD2  TYR  41           HD2      TYR  41 -15.133   7.454   1.438
  353    HE1  TYR  41           HE1      TYR  41 -12.948   8.103  -2.965
  354    HE2  TYR  41           HE2      TYR  41 -13.500   9.285   1.137
  355    HH   TYR  41           HH       TYR  41 -11.321   9.454  -1.075
  356    H    ARG  42           HN       ARG  42 -18.948   5.385   1.302
  357    HA   ARG  42           HA       ARG  42 -19.760   2.922   0.105
  358   1HB   ARG  42          HB2       ARG  42 -21.093   4.679   2.178
  359   2HB   ARG  42          HB1       ARG  42 -21.779   3.142   1.662
  360   1HG   ARG  42          HG2       ARG  42 -19.703   1.987   2.334
  361   2HG   ARG  42          HG1       ARG  42 -19.023   3.526   2.867
  362   1HD   ARG  42          HD2       ARG  42 -20.854   3.781   4.496
  363   2HD   ARG  42          HD1       ARG  42 -21.557   2.259   3.954
  364    HE   ARG  42           HE       ARG  42 -18.949   1.607   4.689
  365   1HH1  ARG  42          HH21      ARG  42 -21.680   3.146   6.126
  366   2HH1  ARG  42          HH22      ARG  42 -21.296   2.624   7.732
  367   1HH2  ARG  42          HH11      ARG  42 -18.436   0.912   6.775
  368   2HH2  ARG  42          HH12      ARG  42 -19.459   1.358   8.100
  369    H    GLU  43           HN       GLU  43 -21.141   6.190  -0.036
  370    HA   GLU  43           HA       GLU  43 -23.399   5.335  -1.660
  371   1HB   GLU  43          HB2       GLU  43 -22.289   8.081  -1.020
  372   2HB   GLU  43          HB1       GLU  43 -23.758   7.810  -1.955
  373   1HG   GLU  43          HG2       GLU  43 -24.515   8.156   0.267
  374   2HG   GLU  43          HG1       GLU  43 -24.580   6.409   0.037
  375    H    ASN  44           HN       ASN  44 -20.159   5.857  -2.297
  376    HA   ASN  44           HA       ASN  44 -20.712   6.168  -5.233
  377   1HB   ASN  44          HB2       ASN  44 -18.420   7.389  -3.667
  378   2HB   ASN  44          HB1       ASN  44 -18.638   7.490  -5.414
  379   1HD2  ASN  44          HD21      ASN  44 -18.862   9.507  -2.960
  380   2HD2  ASN  44          HD22      ASN  44 -20.280  10.364  -3.334
  381    H    LYS  45           HN       LYS  45 -20.114   4.328  -6.221
  382    HA   LYS  45           HA       LYS  45 -17.795   2.754  -5.151
  383   1HB   LYS  45          HB2       LYS  45 -20.123   1.946  -6.919
  384   2HB   LYS  45          HB1       LYS  45 -18.806   0.877  -6.439
  385   1HG   LYS  45          HG2       LYS  45 -19.407   1.199  -4.066
  386   2HG   LYS  45          HG1       LYS  45 -20.730   2.262  -4.548
  387   1HD   LYS  45          HD2       LYS  45 -21.758   0.412  -5.818
  388   2HD   LYS  45          HD1       LYS  45 -20.439  -0.654  -5.331
  389   1HE   LYS  45          HE2       LYS  45 -22.194   0.788  -3.333
  390   2HE   LYS  45          HE1       LYS  45 -22.557  -0.832  -3.929
  391   1HZ   LYS  45          HZ1       LYS  45 -21.269  -1.457  -2.222
  392   2HZ   LYS  45          HZ2       LYS  45 -20.493   0.050  -2.099
  393   3HZ   LYS  45          HZ3       LYS  45 -19.984  -1.079  -3.263
  394    H    GLN  46           HN       GLN  46 -18.241   5.105  -7.228
  395    HA   GLN  46           HA       GLN  46 -17.631   4.331  -9.811
  396   1HB   GLN  46          HB2       GLN  46 -16.608   6.727  -8.275
  397   2HB   GLN  46          HB1       GLN  46 -16.437   6.536 -10.021
  398   1HG   GLN  46          HG2       GLN  46 -19.099   6.407  -8.583
  399   2HG   GLN  46          HG1       GLN  46 -18.459   7.880  -9.313
  400   1HE2  GLN  46          HE21      GLN  46 -20.742   5.761 -10.013
  401   2HE2  GLN  46          HE22      GLN  46 -20.534   5.561 -11.686
  402    H    GLY  47           HN       GLY  47 -15.428   4.920 -10.885
  403   1HA   GLY  47          HA2       GLY  47 -13.635   2.872 -10.601
  404   2HA   GLY  47          HA1       GLY  47 -13.149   4.458 -11.189
  405    H    TRP  48           HN       TRP  48 -14.017   5.409  -8.272
  406    HA   TRP  48           HA       TRP  48 -11.414   5.641  -7.226
  407   1HB   TRP  48          HB2       TRP  48 -12.379   6.457  -5.267
  408   2HB   TRP  48          HB1       TRP  48 -13.692   6.694  -6.413
  409    HD1  TRP  48           HD1      TRP  48 -15.900   5.390  -6.016
  410    HE1  TRP  48           HE1      TRP  48 -16.726   3.798  -4.170
  411    HE3  TRP  48           HE3      TRP  48 -11.497   4.490  -3.574
  412    HZ2  TRP  48           HZ2      TRP  48 -15.671   2.331  -1.952
  413    HZ3  TRP  48           HZ3      TRP  48 -11.442   2.989  -1.605
  414    HH2  TRP  48           HH2      TRP  48 -13.523   1.913  -0.791
  415    H    GLN  49           HN       GLN  49 -13.508   2.939  -7.370
  416    HA   GLN  49           HA       GLN  49 -12.102   1.400  -5.290
  417   1HB   GLN  49          HB2       GLN  49 -14.537   1.124  -5.675
  418   2HB   GLN  49          HB1       GLN  49 -14.212   0.590  -7.322
  419   1HG   GLN  49          HG2       GLN  49 -12.918  -1.327  -6.444
  420   2HG   GLN  49          HG1       GLN  49 -13.246  -0.790  -4.795
  421   1HE2  GLN  49          HE21      GLN  49 -14.699  -2.258  -7.670
  422   2HE2  GLN  49          HE22      GLN  49 -16.158  -2.702  -6.925
  423    H    ASN  50           HN       ASN  50 -12.660   1.010  -8.805
  424    HA   ASN  50           HA       ASN  50 -10.607  -0.998  -9.107
  425   1HB   ASN  50          HB2       ASN  50 -11.976   0.797 -11.137
  426   2HB   ASN  50          HB1       ASN  50 -10.918  -0.552 -11.552
  427   1HD2  ASN  50          HD21      ASN  50 -13.731  -0.459 -12.269
  428   2HD2  ASN  50          HD22      ASN  50 -14.514  -1.717 -11.441
  429    H    SER  51           HN       SER  51 -10.674   2.524  -9.422
  430    HA   SER  51           HA       SER  51  -8.178   2.874 -10.742
  431   1HB   SER  51          HB2       SER  51  -9.570   4.619  -8.688
  432   2HB   SER  51          HB1       SER  51  -8.176   5.129  -9.636
  433    HG   SER  51           HG       SER  51  -9.458   5.445 -11.265
  434    H    ILE  52           HN       ILE  52  -8.992   2.486  -7.320
  435    HA   ILE  52           HA       ILE  52  -6.406   2.941  -6.223
  436    HB   ILE  52           HB       ILE  52  -8.811   1.346  -5.376
  437   1HG1  ILE  52          HG12      ILE  52  -8.786   3.851  -5.346
  438   2HG1  ILE  52          HG11      ILE  52  -9.113   3.111  -3.785
  439   1HG2  ILE  52          HG21      ILE  52  -7.618   1.230  -3.089
  440   2HG2  ILE  52          HG22      ILE  52  -6.130   1.471  -4.006
  441   3HG2  ILE  52          HG23      ILE  52  -7.143   0.061  -4.321
  442   1HD1  ILE  52          HD11      ILE  52  -7.428   4.321  -2.927
  443   2HD1  ILE  52          HD12      ILE  52  -7.026   4.943  -4.523
  444   3HD1  ILE  52          HD13      ILE  52  -6.282   3.460  -3.950
  445    H    ARG  53           HN       ARG  53  -7.950  -0.151  -7.225
  446    HA   ARG  53           HA       ARG  53  -5.674  -1.784  -6.639
  447   1HB   ARG  53          HB2       ARG  53  -7.629  -2.293  -8.899
  448   2HB   ARG  53          HB1       ARG  53  -6.747  -3.484  -7.942
  449   1HG   ARG  53          HG2       ARG  53  -7.997  -2.546  -5.910
  450   2HG   ARG  53          HG1       ARG  53  -9.030  -1.718  -7.074
  451   1HD   ARG  53          HD2       ARG  53  -9.311  -4.063  -8.161
  452   2HD   ARG  53          HD1       ARG  53  -8.719  -4.672  -6.607
  453    HE   ARG  53           HE       ARG  53 -10.723  -2.938  -5.869
  454   1HH1  ARG  53          HH21      ARG  53 -10.408  -5.569  -8.071
  455   2HH1  ARG  53          HH22      ARG  53 -12.068  -6.050  -7.945
  456   1HH2  ARG  53          HH11      ARG  53 -12.896  -3.546  -5.693
  457   2HH2  ARG  53          HH12      ARG  53 -13.477  -4.903  -6.599
  458    H    HIS  54           HN       HIS  54  -6.687  -0.125  -9.632
  459    HA   HIS  54           HA       HIS  54  -4.538  -1.035 -11.269
  460   1HB   HIS  54          HB2       HIS  54  -6.509   0.164 -12.174
  461   2HB   HIS  54          HB1       HIS  54  -5.979   1.636 -11.359
  462    HD1  HIS  54           HD1      HIS  54  -4.084  -0.907 -13.492
  463    HD2  HIS  54           HD2      HIS  54  -4.774   3.200 -13.288
  464    HE1  HIS  54           HE1      HIS  54  -2.693   0.145 -15.327
  465    H    ASN  55           HN       ASN  55  -4.830   1.745  -9.087
  466    HA   ASN  55           HA       ASN  55  -2.282   2.902  -9.682
  467   1HB   ASN  55          HB2       ASN  55  -4.254   3.914  -8.356
  468   2HB   ASN  55          HB1       ASN  55  -3.619   3.024  -6.973
  469   1HD2  ASN  55          HD21      ASN  55  -3.660   5.906  -7.064
  470   2HD2  ASN  55          HD22      ASN  55  -2.053   6.453  -7.099
  471    H    LEU  56           HN       LEU  56  -3.297   0.442  -7.307
  472    HA   LEU  56           HA       LEU  56  -0.813   0.251  -5.948
  473   1HB   LEU  56          HB2       LEU  56  -2.983  -1.783  -6.428
  474   2HB   LEU  56          HB1       LEU  56  -1.565  -2.136  -5.444
  475    HG   LEU  56           HG       LEU  56  -3.418   0.216  -4.952
  476   1HD1  LEU  56          HD11      LEU  56  -3.308  -2.376  -3.394
  477   2HD1  LEU  56          HD12      LEU  56  -4.479  -2.081  -4.677
  478   3HD1  LEU  56          HD13      LEU  56  -4.481  -1.069  -3.234
  479   1HD2  LEU  56          HD21      LEU  56  -2.244  -0.189  -2.585
  480   2HD2  LEU  56          HD22      LEU  56  -1.461   0.781  -3.822
  481   3HD2  LEU  56          HD23      LEU  56  -0.979  -0.897  -3.585
  482    H    SER  57           HN       SER  57  -2.006  -1.574  -8.776
  483    HA   SER  57           HA       SER  57   0.364  -3.140  -9.134
  484   1HB   SER  57          HB2       SER  57  -1.589  -2.128 -11.226
  485   2HB   SER  57          HB1       SER  57  -0.431  -3.436 -11.454
  486    HG   SER  57           HG       SER  57  -2.772  -3.339  -9.912
  487    H    LEU  58           HN       LEU  58  -0.621   0.028 -10.342
  488    HA   LEU  58           HA       LEU  58   1.605   0.447 -12.080
  489   1HB   LEU  58          HB2       LEU  58  -0.685   1.724 -11.774
  490   2HB   LEU  58          HB1       LEU  58   0.238   2.714 -10.651
  491    HG   LEU  58           HG       LEU  58   1.075   2.172 -13.512
  492   1HD1  LEU  58          HD11      LEU  58   0.311   4.533 -13.896
  493   2HD1  LEU  58          HD12      LEU  58  -0.406   4.512 -12.285
  494   3HD1  LEU  58          HD13      LEU  58  -1.005   3.417 -13.529
  495   1HD2  LEU  58          HD21      LEU  58   3.000   2.816 -12.290
  496   2HD2  LEU  58          HD22      LEU  58   2.096   3.946 -11.283
  497   3HD2  LEU  58          HD23      LEU  58   2.422   4.334 -12.972
  498    H    ASN  59           HN       ASN  59   1.034   1.594  -8.722
  499    HA   ASN  59           HA       ASN  59   3.671   2.761  -8.550
  500   1HB   ASN  59          HB2       ASN  59   1.579   2.040  -6.492
  501   2HB   ASN  59          HB1       ASN  59   3.165   2.647  -6.013
  502   1HD2  ASN  59          HD21      ASN  59   0.975   4.255  -5.388
  503   2HD2  ASN  59          HD22      ASN  59   0.946   5.615  -6.401
  504    H    GLU  60           HN       GLU  60   5.480   1.645  -8.525
  505    HA   GLU  60           HA       GLU  60   5.500  -1.213  -7.781
  506   1HB   GLU  60          HB2       GLU  60   7.674   0.621  -8.849
  507   2HB   GLU  60          HB1       GLU  60   7.787  -1.136  -8.701
  508   1HG   GLU  60          HG2       GLU  60   5.928  -1.428 -10.257
  509   2HG   GLU  60          HG1       GLU  60   5.692   0.318 -10.352
  510    H    CYS  61           HN       CYS  61   5.754   1.676  -6.220
  511    HA   CYS  61           HA       CYS  61   7.999   1.393  -4.500
  512   1HB   CYS  61          HB2       CYS  61   5.304   2.708  -4.039
  513   2HB   CYS  61          HB1       CYS  61   6.696   2.899  -2.970
  514    HG   CYS  61           HG       CYS  61   7.294   4.752  -4.520
  515    H    PHE  62           HN       PHE  62   4.689   0.141  -4.269
  516    HA   PHE  62           HA       PHE  62   5.116  -1.041  -1.634
  517   1HB   PHE  62          HB2       PHE  62   2.959  -1.701  -3.659
  518   2HB   PHE  62          HB1       PHE  62   2.908  -1.976  -1.918
  519    HD1  PHE  62           HD1      PHE  62   3.289   0.157  -0.419
  520    HD2  PHE  62           HD2      PHE  62   2.011   0.269  -4.517
  521    HE1  PHE  62           HE1      PHE  62   2.371   2.435  -0.070
  522    HE2  PHE  62           HE2      PHE  62   1.094   2.547  -4.169
  523    HZ   PHE  62           HZ       PHE  62   1.274   3.630  -1.947
  524    H    VAL  63           HN       VAL  63   5.355  -3.298  -1.210
  525    HA   VAL  63           HA       VAL  63   6.445  -4.898  -3.503
  526    HB   VAL  63           HB       VAL  63   6.966  -5.143  -0.524
  527   1HG1  VAL  63          HG11      VAL  63   7.124  -7.320  -1.537
  528   2HG1  VAL  63          HG12      VAL  63   8.773  -6.722  -1.355
  529   3HG1  VAL  63          HG13      VAL  63   7.987  -6.672  -2.933
  530   1HG2  VAL  63          HG21      VAL  63   8.022  -3.161  -1.554
  531   2HG2  VAL  63          HG22      VAL  63   8.719  -4.184  -2.810
  532   3HG2  VAL  63          HG23      VAL  63   9.236  -4.369  -1.134
  533    H    LYS  64           HN       LYS  64   5.240  -6.624  -4.113
  534    HA   LYS  64           HA       LYS  64   2.803  -7.333  -2.712
  535   1HB   LYS  64          HB2       LYS  64   4.226  -9.066  -4.761
  536   2HB   LYS  64          HB1       LYS  64   2.502  -8.999  -4.411
  537   1HG   LYS  64          HG2       LYS  64   3.924  -6.542  -5.423
  538   2HG   LYS  64          HG1       LYS  64   3.435  -7.796  -6.547
  539   1HD   LYS  64          HD2       LYS  64   1.341  -6.931  -4.606
  540   2HD   LYS  64          HD1       LYS  64   1.820  -5.736  -5.807
  541   1HE   LYS  64          HE2       LYS  64  -0.086  -7.153  -6.568
  542   2HE   LYS  64          HE1       LYS  64   1.322  -7.277  -7.621
  543   1HZ   LYS  64          HZ1       LYS  64   0.401  -9.213  -5.578
  544   2HZ   LYS  64          HZ2       LYS  64   1.955  -9.277  -6.263
  545   3HZ   LYS  64          HZ3       LYS  64   0.581  -9.461  -7.247
  546    H    VAL  65           HN       VAL  65   2.489  -9.058  -1.270
  547    HA   VAL  65           HA       VAL  65   4.831 -10.829  -0.679
  548    HB   VAL  65           HB       VAL  65   3.854 -10.567   1.813
  549   1HG1  VAL  65          HG11      VAL  65   6.167 -10.116   1.301
  550   2HG1  VAL  65          HG12      VAL  65   5.536  -8.702   2.145
  551   3HG1  VAL  65          HG13      VAL  65   5.741  -8.664   0.395
  552   1HG2  VAL  65          HG21      VAL  65   3.082  -8.329   2.264
  553   2HG2  VAL  65          HG22      VAL  65   2.079  -8.993   0.976
  554   3HG2  VAL  65          HG23      VAL  65   3.357  -7.840   0.592
  555    HA   PRO  66           HA       PRO  66   0.901 -13.204  -1.520
  556   1HB   PRO  66          HB2       PRO  66   3.048 -15.134  -2.331
  557   2HB   PRO  66          HB1       PRO  66   1.526 -14.733  -3.150
  558   1HG   PRO  66          HG2       PRO  66   3.841 -13.813  -4.065
  559   2HG   PRO  66          HG1       PRO  66   2.387 -12.799  -4.087
  560   1HD   PRO  66          HD2       PRO  66   4.736 -12.680  -2.221
  561   2HD   PRO  66          HD1       PRO  66   3.761 -11.350  -2.889
  562    H    ARG  67           HN       ARG  67   0.375 -15.453  -0.624
  563    HA   ARG  67           HA       ARG  67   1.469 -15.662   2.098
  564   1HB   ARG  67          HB2       ARG  67  -0.506 -17.521   0.755
  565   2HB   ARG  67          HB1       ARG  67  -0.246 -17.292   2.483
  566   1HG   ARG  67          HG2       ARG  67  -0.966 -14.890   2.179
  567   2HG   ARG  67          HG1       ARG  67  -1.444 -15.313   0.533
  568   1HD   ARG  67          HD2       ARG  67  -2.556 -16.378   3.130
  569   2HD   ARG  67          HD1       ARG  67  -3.427 -15.591   1.811
  570    HE   ARG  67           HE       ARG  67  -2.348 -17.856   0.642
  571   1HH1  ARG  67          HH21      ARG  67  -4.286 -17.133   3.400
  572   2HH1  ARG  67          HH22      ARG  67  -5.122 -18.650   3.374
  573   1HH2  ARG  67          HH11      ARG  67  -3.420 -19.838   0.596
  574   2HH2  ARG  67          HH12      ARG  67  -4.630 -20.182   1.785
  575    H    ASP  68           HN       ASP  68   1.917 -18.068   2.810
  576    HA   ASP  68           HA       ASP  68   4.259 -18.965   1.470
  577   1HB   ASP  68          HB2       ASP  68   2.366 -20.410   3.351
  578   2HB   ASP  68          HB1       ASP  68   3.905 -21.083   2.812
  579    H    ASP  69           HN       ASP  69   4.564 -20.791   0.070
  580    HA   ASP  69           HA       ASP  69   2.473 -21.160  -1.881
  581   1HB   ASP  69          HB2       ASP  69   5.092 -22.607  -1.400
  582   2HB   ASP  69          HB1       ASP  69   4.032 -22.954  -2.767
  583    H    LYS  70           HN       LYS  70   3.201 -22.686   1.120
  584    HA   LYS  70           HA       LYS  70   2.135 -25.298   0.636
  585   1HB   LYS  70          HB2       LYS  70   2.202 -23.592   3.145
  586   2HB   LYS  70          HB1       LYS  70   1.688 -25.276   3.131
  587   1HG   LYS  70          HG2       LYS  70   4.366 -24.470   2.002
  588   2HG   LYS  70          HG1       LYS  70   4.162 -24.748   3.728
  589   1HD   LYS  70          HD2       LYS  70   3.236 -27.021   3.191
  590   2HD   LYS  70          HD1       LYS  70   3.651 -26.743   1.500
  591   1HE   LYS  70          HE2       LYS  70   6.012 -26.405   2.138
  592   2HE   LYS  70          HE1       LYS  70   5.594 -26.713   3.824
  593   1HZ   LYS  70          HZ1       LYS  70   6.335 -28.592   2.016
  594   2HZ   LYS  70          HZ2       LYS  70   4.643 -28.740   2.030
  595   3HZ   LYS  70          HZ3       LYS  70   5.524 -28.897   3.474
  596    H    LYS  71           HN       LYS  71   0.643 -22.245   1.592
  597    HA   LYS  71           HA       LYS  71  -2.032 -23.422   1.748
  598   1HB   LYS  71          HB2       LYS  71  -1.423 -20.466   1.593
  599   2HB   LYS  71          HB1       LYS  71  -2.731 -21.278   2.452
  600   1HG   LYS  71          HG2       LYS  71   0.208 -21.346   3.168
  601   2HG   LYS  71          HG1       LYS  71  -1.086 -20.567   4.077
  602   1HD   LYS  71          HD2       LYS  71  -2.168 -22.922   4.169
  603   2HD   LYS  71          HD1       LYS  71  -0.578 -23.517   3.690
  604   1HE   LYS  71          HE2       LYS  71  -0.658 -23.569   6.096
  605   2HE   LYS  71          HE1       LYS  71   0.385 -22.220   5.641
  606   1HZ   LYS  71          HZ1       LYS  71  -1.417 -21.817   7.388
  607   2HZ   LYS  71          HZ2       LYS  71  -2.506 -21.826   6.085
  608   3HZ   LYS  71          HZ3       LYS  71  -1.254 -20.679   6.141
  609    HA   PRO  72           HA       PRO  72  -2.934 -23.012  -2.565
  610   1HB   PRO  72          HB2       PRO  72  -5.620 -22.370  -2.526
  611   2HB   PRO  72          HB1       PRO  72  -4.988 -24.004  -2.252
  612   1HG   PRO  72          HG2       PRO  72  -5.871 -21.961  -0.264
  613   2HG   PRO  72          HG1       PRO  72  -6.140 -23.713  -0.274
  614   1HD   PRO  72          HD2       PRO  72  -4.239 -22.560   1.285
  615   2HD   PRO  72          HD1       PRO  72  -4.021 -24.178   0.584
  616    H    GLY  73           HN       GLY  73  -2.421 -20.486  -0.753
  617   1HA   GLY  73          HA2       GLY  73  -2.230 -18.174  -1.120
  618   2HA   GLY  73          HA1       GLY  73  -2.238 -18.583  -2.835
  619    H    LYS  74           HN       LYS  74  -4.391 -17.954  -0.072
  620    HA   LYS  74           HA       LYS  74  -6.779 -17.830  -1.656
  621   1HB   LYS  74          HB2       LYS  74  -6.105 -16.703   1.063
  622   2HB   LYS  74          HB1       LYS  74  -7.712 -16.585   0.344
  623   1HG   LYS  74          HG2       LYS  74  -7.804 -19.036   0.139
  624   2HG   LYS  74          HG1       LYS  74  -6.206 -19.165   0.859
  625   1HD   LYS  74          HD2       LYS  74  -7.044 -18.104   2.925
  626   2HD   LYS  74          HD1       LYS  74  -8.651 -17.986   2.207
  627   1HE   LYS  74          HE2       LYS  74  -7.133 -20.564   2.705
  628   2HE   LYS  74          HE1       LYS  74  -8.479 -19.966   3.673
  629   1HZ   LYS  74          HZ1       LYS  74  -8.951 -21.656   1.823
  630   2HZ   LYS  74          HZ2       LYS  74  -8.775 -20.343   0.764
  631   3HZ   LYS  74          HZ3       LYS  74  -9.975 -20.313   1.964
  632    H    GLY  75           HN       GLY  75  -4.343 -15.520  -0.815
  633   1HA   GLY  75          HA2       GLY  75  -5.127 -13.752  -2.969
  634   2HA   GLY  75          HA1       GLY  75  -5.564 -13.076  -1.399
  635    H    SER  76           HN       SER  76  -3.966 -11.373  -1.967
  636    HA   SER  76           HA       SER  76  -1.191 -12.209  -1.198
  637   1HB   SER  76          HB2       SER  76  -1.360 -11.797  -3.670
  638   2HB   SER  76          HB1       SER  76  -1.891 -10.155  -3.317
  639    HG   SER  76           HG       SER  76   0.587 -11.389  -2.715
  640    H    TYR  77           HN       TYR  77  -0.595 -11.107   0.601
  641    HA   TYR  77           HA       TYR  77  -2.152  -8.829   1.535
  642   1HB   TYR  77          HB2       TYR  77   0.544  -9.708   2.599
  643   2HB   TYR  77          HB1       TYR  77  -0.723  -8.830   3.452
  644    HD1  TYR  77           HD1      TYR  77  -3.171 -10.337   2.904
  645    HD2  TYR  77           HD2      TYR  77   0.812 -11.787   3.630
  646    HE1  TYR  77           HE1      TYR  77  -4.095 -12.482   3.723
  647    HE2  TYR  77           HE2      TYR  77  -0.120 -13.930   4.444
  648    HH   TYR  77           HH       TYR  77  -3.456 -14.342   5.130
  649    H    TRP  78           HN       TRP  78  -0.710  -6.828   2.300
  650    HA   TRP  78           HA       TRP  78   1.264  -6.112   0.166
  651   1HB   TRP  78          HB2       TRP  78  -1.197  -4.541   0.984
  652   2HB   TRP  78          HB1       TRP  78   0.158  -3.820   0.116
  653    HD1  TRP  78           HD1      TRP  78  -2.328  -6.758  -0.273
  654    HE1  TRP  78           HE1      TRP  78  -2.741  -7.122  -2.792
  655    HE3  TRP  78           HE3      TRP  78   0.898  -3.305  -2.202
  656    HZ2  TRP  78           HZ2      TRP  78  -1.814  -6.086  -5.299
  657    HZ3  TRP  78           HZ3      TRP  78   1.108  -3.008  -4.652
  658    HH2  TRP  78           HH2      TRP  78  -0.246  -4.390  -6.201
  659    H    THR  79           HN       THR  79   2.813  -4.545   0.865
  660    HA   THR  79           HA       THR  79   2.600  -3.398   3.558
  661    HB   THR  79           HB       THR  79   3.429  -5.695   4.010
  662    HG1  THR  79           HG1      THR  79   5.541  -4.877   4.907
  663   1HG2  THR  79          HG21      THR  79   4.579  -5.861   1.738
  664   2HG2  THR  79          HG22      THR  79   5.496  -6.481   3.111
  665   3HG2  THR  79          HG23      THR  79   5.884  -4.899   2.435
  666    H    LEU  80           HN       LEU  80   4.386  -1.904   4.000
  667    HA   LEU  80           HA       LEU  80   5.258  -0.497   1.604
  668   1HB   LEU  80          HB2       LEU  80   5.954  -0.125   4.535
  669   2HB   LEU  80          HB1       LEU  80   6.440   0.981   3.255
  670    HG   LEU  80           HG       LEU  80   3.550   0.252   3.799
  671   1HD1  LEU  80          HD11      LEU  80   4.584   1.332   5.784
  672   2HD1  LEU  80          HD12      LEU  80   3.377   2.366   5.023
  673   3HD1  LEU  80          HD13      LEU  80   5.093   2.678   4.765
  674   1HD2  LEU  80          HD21      LEU  80   3.687   1.187   1.636
  675   2HD2  LEU  80          HD22      LEU  80   4.967   2.309   2.095
  676   3HD2  LEU  80          HD23      LEU  80   3.314   2.580   2.641
  677    H    ASP  81           HN       ASP  81   7.710   0.101   1.465
  678    HA   ASP  81           HA       ASP  81   9.220  -2.170   0.871
  679   1HB   ASP  81          HB2       ASP  81  10.621   0.274   1.944
  680   2HB   ASP  81          HB1       ASP  81  11.031  -0.720   0.545
  681    HA   PRO  82           HA       PRO  82  10.705  -3.898   4.645
  682   1HB   PRO  82          HB2       PRO  82  13.587  -3.379   4.127
  683   2HB   PRO  82          HB1       PRO  82  12.729  -4.926   4.263
  684   1HG   PRO  82          HG2       PRO  82  13.626  -4.020   1.914
  685   2HG   PRO  82          HG1       PRO  82  12.104  -4.921   2.042
  686   1HD   PRO  82          HD2       PRO  82  12.523  -1.951   1.787
  687   2HD   PRO  82          HD1       PRO  82  11.330  -2.994   0.967
  688    H    ASP  83           HN       ASP  83  13.306  -3.130   5.972
  689    HA   ASP  83           HA       ASP  83  12.251  -0.764   7.433
  690   1HB   ASP  83          HB2       ASP  83  14.525  -2.676   8.060
  691   2HB   ASP  83          HB1       ASP  83  14.020  -1.336   9.091
  692    H    SER  84           HN       SER  84  13.442  -0.535   4.743
  693    HA   SER  84           HA       SER  84  16.140   0.392   4.880
  694   1HB   SER  84          HB2       SER  84  15.386   0.005   2.696
  695   2HB   SER  84          HB1       SER  84  13.857   0.837   2.975
  696    HG   SER  84           HG       SER  84  16.160   1.808   2.023
  697    H    TYR  85           HN       TYR  85  15.636   1.543   7.064
  698    HA   TYR  85           HA       TYR  85  14.291   4.127   6.860
  699   1HB   TYR  85          HB2       TYR  85  14.530   2.564   8.943
  700   2HB   TYR  85          HB1       TYR  85  16.115   3.311   9.125
  701    HD1  TYR  85           HD1      TYR  85  12.496   3.800   9.324
  702    HD2  TYR  85           HD2      TYR  85  16.319   5.744   9.564
  703    HE1  TYR  85           HE1      TYR  85  11.426   5.774  10.382
  704    HE2  TYR  85           HE2      TYR  85  15.250   7.717  10.622
  705    HH   TYR  85           HH       TYR  85  11.733   7.937  10.964
  706    H    ASN  86           HN       ASN  86  17.622   3.383   7.939
  707    HA   ASN  86           HA       ASN  86  18.567   5.781   6.400
  708   1HB   ASN  86          HB2       ASN  86  19.331   4.719   9.116
  709   2HB   ASN  86          HB1       ASN  86  20.445   5.733   8.198
  710   1HD2  ASN  86          HD21      ASN  86  18.882   6.367  10.738
  711   2HD2  ASN  86          HD22      ASN  86  18.015   7.777  10.366
  712    H    MET  87           HN       MET  87  18.419   2.768   5.775
  713    HA   MET  87           HA       MET  87  21.256   2.026   5.569
  714   1HB   MET  87          HB2       MET  87  18.756   0.733   4.438
  715   2HB   MET  87          HB1       MET  87  20.375   0.043   4.354
  716   1HG   MET  87          HG2       MET  87  19.584  -1.009   6.267
  717   2HG   MET  87          HG1       MET  87  20.305   0.427   6.991
  718   1HE   MET  87          HE1       MET  87  17.614  -1.789   7.458
  719   2HE   MET  87          HE2       MET  87  16.778  -0.779   8.635
  720   3HE   MET  87          HE3       MET  87  18.526  -0.975   8.737
  721    H    PHE  88           HN       PHE  88  22.223   3.527   4.191
  722    HA   PHE  88           HA       PHE  88  21.083   3.830   1.438
  723   1HB   PHE  88          HB2       PHE  88  23.263   5.454   2.783
  724   2HB   PHE  88          HB1       PHE  88  22.452   5.822   1.261
  725    HD1  PHE  88           HD1      PHE  88  19.812   5.951   1.387
  726    HD2  PHE  88           HD2      PHE  88  22.439   6.431   4.753
  727    HE1  PHE  88           HE1      PHE  88  18.021   7.147   2.615
  728    HE2  PHE  88           HE2      PHE  88  20.647   7.627   5.980
  729    HZ   PHE  88           HZ       PHE  88  18.438   7.985   4.912
  730    H    GLU  89           HN       GLU  89  23.253   1.987   3.102
  731    HA   GLU  89           HA       GLU  89  25.479   2.012   1.220
  732   1HB   GLU  89          HB2       GLU  89  24.680   0.111   3.444
  733   2HB   GLU  89          HB1       GLU  89  26.161  -0.059   2.498
  734   1HG   GLU  89          HG2       GLU  89  26.875   2.195   3.197
  735   2HG   GLU  89          HG1       GLU  89  25.395   2.375   4.138
  736    H    ASN  90           HN       ASN  90  25.856  -0.795   0.862
  737    HA   ASN  90           HA       ASN  90  24.239  -1.221  -1.472
  738   1HB   ASN  90          HB2       ASN  90  26.033  -3.078   0.105
  739   2HB   ASN  90          HB1       ASN  90  25.243  -3.551  -1.398
  740   1HD2  ASN  90          HD21      ASN  90  25.805  -0.314  -1.793
  741   2HD2  ASN  90          HD22      ASN  90  27.332  -0.375  -2.532
  742    H    GLY  91           HN       GLY  91  23.667  -1.721   1.801
  743   1HA   GLY  91          HA2       GLY  91  21.349  -2.225   2.504
  744   2HA   GLY  91          HA1       GLY  91  21.254  -3.398   1.193
  745    H    SER  92           HN       SER  92  22.929  -2.726   4.257
  746    HA   SER  92           HA       SER  92  23.597  -5.629   4.512
  747   1HB   SER  92          HB2       SER  92  25.321  -3.743   4.893
  748   2HB   SER  92          HB1       SER  92  24.443  -3.406   6.380
  749    HG   SER  92           HG       SER  92  25.320  -5.110   7.231
  750    H    PHE  93           HN       PHE  93  21.377  -6.252   4.996
  751    HA   PHE  93           HA       PHE  93  19.792  -5.077   7.044
  752   1HB   PHE  93          HB2       PHE  93  19.045  -6.791   5.317
  753   2HB   PHE  93          HB1       PHE  93  19.799  -8.020   6.334
  754    HD1  PHE  93           HD1      PHE  93  18.695  -8.843   8.285
  755    HD2  PHE  93           HD2      PHE  93  17.264  -5.297   6.328
  756    HE1  PHE  93           HE1      PHE  93  16.680  -8.854   9.733
  757    HE2  PHE  93           HE2      PHE  93  15.250  -5.310   7.773
  758    HZ   PHE  93           HZ       PHE  93  14.958  -7.089   9.476
  759    H    LEU  94           HN       LEU  94  21.997  -7.890   7.211
  760    HA   LEU  94           HA       LEU  94  21.773  -7.923  10.157
  761   1HB   LEU  94          HB2       LEU  94  23.356  -9.623   8.210
  762   2HB   LEU  94          HB1       LEU  94  23.344  -9.871   9.953
  763    HG   LEU  94           HG       LEU  94  20.852  -9.873   8.227
  764   1HD1  LEU  94          HD11      LEU  94  20.951 -12.381   8.658
  765   2HD1  LEU  94          HD12      LEU  94  22.616 -12.136   9.184
  766   3HD1  LEU  94          HD13      LEU  94  22.150 -11.754   7.527
  767   1HD2  LEU  94          HD21      LEU  94  20.081  -9.483  10.390
  768   2HD2  LEU  94          HD22      LEU  94  21.422 -10.341  11.146
  769   3HD2  LEU  94          HD23      LEU  94  20.114 -11.243  10.385
  Start of MODEL   23
    1   1H    MET   1          HT1       MET   1 -24.380  17.085  -0.846
    2   2H    MET   1          HT2       MET   1 -25.197  16.440   0.499
    3   3H    MET   1          HT3       MET   1 -23.699  15.794   0.019
    4    HA   MET   1           HA       MET   1 -23.382  18.546   0.449
    5   1HB   MET   1          HB2       MET   1 -25.472  17.942   1.917
    6   2HB   MET   1          HB1       MET   1 -24.302  17.124   2.948
    7   1HG   MET   1          HG2       MET   1 -24.411  19.292   3.863
    8   2HG   MET   1          HG1       MET   1 -22.972  19.357   2.846
    9   1HE   MET   1          HE1       MET   1 -26.756  19.629   2.853
   10   2HE   MET   1          HE2       MET   1 -27.090  21.209   2.150
   11   3HE   MET   1          HE3       MET   1 -26.270  21.099   3.706
   12    H    LEU   2           HN       LEU   2 -22.359  15.607   0.059
   13    HA   LEU   2           HA       LEU   2 -20.100  15.752   2.033
   14   1HB   LEU   2          HB2       LEU   2 -21.163  13.372   0.478
   15   2HB   LEU   2          HB1       LEU   2 -19.835  13.338   1.636
   16    HG   LEU   2           HG       LEU   2 -22.664  14.200   2.312
   17   1HD1  LEU   2          HD11      LEU   2 -22.801  11.991   3.465
   18   2HD1  LEU   2          HD12      LEU   2 -21.247  11.556   2.754
   19   3HD1  LEU   2          HD13      LEU   2 -22.644  11.836   1.715
   20   1HD2  LEU   2          HD21      LEU   2 -21.688  13.626   4.677
   21   2HD2  LEU   2          HD22      LEU   2 -21.263  15.165   3.939
   22   3HD2  LEU   2          HD23      LEU   2 -20.120  13.822   3.895
   23    H    VAL   3           HN       VAL   3 -18.036  15.815   1.242
   24    HA   VAL   3           HA       VAL   3 -17.631  15.608  -1.719
   25    HB   VAL   3           HB       VAL   3 -16.065  17.502  -1.596
   26   1HG1  VAL   3          HG11      VAL   3 -18.717  18.252  -0.334
   27   2HG1  VAL   3          HG12      VAL   3 -18.533  17.833  -2.038
   28   3HG1  VAL   3          HG13      VAL   3 -17.713  19.252  -1.385
   29   1HG2  VAL   3          HG21      VAL   3 -16.930  17.523   1.310
   30   2HG2  VAL   3          HG22      VAL   3 -16.122  18.886   0.534
   31   3HG2  VAL   3          HG23      VAL   3 -15.293  17.336   0.680
   32    H    LYS   4           HN       LYS   4 -15.368  15.087  -2.294
   33    HA   LYS   4           HA       LYS   4 -14.333  12.973  -0.667
   34   1HB   LYS   4          HB2       LYS   4 -13.098  14.514  -2.963
   35   2HB   LYS   4          HB1       LYS   4 -12.370  13.080  -2.245
   36   1HG   LYS   4          HG2       LYS   4 -14.174  11.691  -2.916
   37   2HG   LYS   4          HG1       LYS   4 -15.203  13.069  -3.296
   38   1HD   LYS   4          HD2       LYS   4 -12.594  12.748  -4.768
   39   2HD   LYS   4          HD1       LYS   4 -13.967  11.751  -5.236
   40   1HE   LYS   4          HE2       LYS   4 -15.339  13.777  -5.558
   41   2HE   LYS   4          HE1       LYS   4 -13.966  14.782  -5.098
   42   1HZ   LYS   4          HZ1       LYS   4 -13.644  12.817  -7.256
   43   2HZ   LYS   4          HZ2       LYS   4 -12.841  14.293  -7.012
   44   3HZ   LYS   4          HZ3       LYS   4 -14.440  14.278  -7.585
   45    HA   PRO   5           HA       PRO   5 -11.708  15.363   2.058
   46   1HB   PRO   5          HB2       PRO   5  -9.981  13.487   2.917
   47   2HB   PRO   5          HB1       PRO   5 -11.703  13.409   3.335
   48   1HG   PRO   5          HG2       PRO   5 -10.232  11.966   1.166
   49   2HG   PRO   5          HG1       PRO   5 -11.387  11.323   2.348
   50   1HD   PRO   5          HD2       PRO   5 -12.123  11.965  -0.203
   51   2HD   PRO   5          HD1       PRO   5 -13.234  12.119   1.178
   52    HA   PRO   6           HA       PRO   6  -8.158  16.632  -0.292
   53   1HB   PRO   6          HB2       PRO   6  -6.506  17.653   1.618
   54   2HB   PRO   6          HB1       PRO   6  -8.038  18.428   1.172
   55   1HG   PRO   6          HG2       PRO   6  -7.440  16.636   3.489
   56   2HG   PRO   6          HG1       PRO   6  -8.359  18.153   3.452
   57   1HD   PRO   6          HD2       PRO   6  -9.579  15.711   3.445
   58   2HD   PRO   6          HD1       PRO   6 -10.281  17.127   2.634
   59    H    TYR   7           HN       TYR   7  -7.977  13.855   1.524
   60    HA   TYR   7           HA       TYR   7  -5.060  13.515   1.462
   61   1HB   TYR   7          HB2       TYR   7  -7.173  11.385   1.883
   62   2HB   TYR   7          HB1       TYR   7  -5.473  11.301   2.338
   63    HD1  TYR   7           HD1      TYR   7  -8.646  11.807   3.634
   64    HD2  TYR   7           HD2      TYR   7  -4.705  13.508   3.778
   65    HE1  TYR   7           HE1      TYR   7  -9.198  12.893   5.787
   66    HE2  TYR   7           HE2      TYR   7  -5.246  14.576   5.948
   67    HH   TYR   7           HH       TYR   7  -8.216  15.081   7.056
   68    H    SER   8           HN       SER   8  -3.913  12.507  -0.159
   69    HA   SER   8           HA       SER   8  -5.219  12.067  -2.710
   70   1HB   SER   8          HB2       SER   8  -2.862  12.815  -2.554
   71   2HB   SER   8          HB1       SER   8  -2.432  11.286  -1.791
   72    HG   SER   8           HG       SER   8  -2.181  10.631  -3.773
   73    H    TYR   9           HN       TYR   9  -5.121   9.908  -3.849
   74    HA   TYR   9           HA       TYR   9  -6.360   7.874  -2.292
   75   1HB   TYR   9          HB2       TYR   9  -4.894   7.680  -4.942
   76   2HB   TYR   9          HB1       TYR   9  -5.861   6.378  -4.248
   77    HD1  TYR   9           HD1      TYR   9  -5.942   9.719  -5.783
   78    HD2  TYR   9           HD2      TYR   9  -8.298   6.560  -4.079
   79    HE1  TYR   9           HE1      TYR   9  -7.997  10.753  -6.710
   80    HE2  TYR   9           HE2      TYR   9 -10.357   7.591  -5.004
   81    HH   TYR   9           HH       TYR   9 -10.841   9.197  -7.056
   82    H    ILE  10           HN       ILE  10  -2.976   8.360  -3.255
   83    HA   ILE  10           HA       ILE  10  -1.997   5.894  -2.150
   84    HB   ILE  10           HB       ILE  10  -0.573   8.549  -2.539
   85   1HG1  ILE  10          HG12      ILE  10  -0.611   6.079  -4.300
   86   2HG1  ILE  10          HG11      ILE  10  -1.616   7.500  -4.584
   87   1HG2  ILE  10          HG21      ILE  10   1.467   7.078  -2.587
   88   2HG2  ILE  10          HG22      ILE  10   0.453   5.737  -2.056
   89   3HG2  ILE  10          HG23      ILE  10   0.679   7.140  -1.012
   90   1HD1  ILE  10          HD11      ILE  10   0.496   7.528  -5.917
   91   2HD1  ILE  10          HD12      ILE  10   1.410   7.554  -4.409
   92   3HD1  ILE  10          HD13      ILE  10   0.357   8.907  -4.825
   93    H    ALA  11           HN       ALA  11  -2.435   9.156  -0.805
   94    HA   ALA  11           HA       ALA  11  -1.184   8.674   1.713
   95   1HB   ALA  11          HB1       ALA  11  -3.562  10.485   1.164
   96   2HB   ALA  11          HB2       ALA  11  -1.883  10.929   0.854
   97   3HB   ALA  11          HB3       ALA  11  -2.423  10.620   2.504
   98    H    LEU  12           HN       LEU  12  -4.619   8.307   0.739
   99    HA   LEU  12           HA       LEU  12  -5.548   7.431   3.290
  100   1HB   LEU  12          HB2       LEU  12  -6.519   6.706   0.510
  101   2HB   LEU  12          HB1       LEU  12  -7.396   6.341   1.993
  102    HG   LEU  12           HG       LEU  12  -6.604   9.128   1.090
  103   1HD1  LEU  12          HD11      LEU  12  -9.394   7.972   1.186
  104   2HD1  LEU  12          HD12      LEU  12  -8.398   7.862  -0.266
  105   3HD1  LEU  12          HD13      LEU  12  -8.846   9.440   0.381
  106   1HD2  LEU  12          HD21      LEU  12  -8.499   9.577   2.913
  107   2HD2  LEU  12          HD22      LEU  12  -6.823   9.349   3.394
  108   3HD2  LEU  12          HD23      LEU  12  -7.966   8.013   3.529
  109    H    ILE  13           HN       ILE  13  -4.182   5.643   0.550
  110    HA   ILE  13           HA       ILE  13  -4.482   3.047   1.779
  111    HB   ILE  13           HB       ILE  13  -2.649   4.052  -0.413
  112   1HG1  ILE  13          HG12      ILE  13  -5.105   2.295  -0.614
  113   2HG1  ILE  13          HG11      ILE  13  -5.190   4.053  -0.733
  114   1HG2  ILE  13          HG21      ILE  13  -2.520   1.555  -0.949
  115   2HG2  ILE  13          HG22      ILE  13  -3.159   1.273   0.670
  116   3HG2  ILE  13          HG23      ILE  13  -1.609   2.088   0.462
  117   1HD1  ILE  13          HD11      ILE  13  -3.531   3.967  -2.595
  118   2HD1  ILE  13          HD12      ILE  13  -5.022   3.105  -2.975
  119   3HD1  ILE  13          HD13      ILE  13  -3.576   2.205  -2.516
  120    H    THR  14           HN       THR  14  -1.802   5.398   1.616
  121    HA   THR  14           HA       THR  14   0.147   3.778   2.898
  122    HB   THR  14           HB       THR  14  -0.163   6.786   3.036
  123    HG1  THR  14           HG1      THR  14   0.259   5.232   0.995
  124   1HG2  THR  14          HG21      THR  14   2.302   6.717   3.413
  125   2HG2  THR  14          HG22      THR  14   2.206   4.960   3.514
  126   3HG2  THR  14          HG23      THR  14   1.397   5.958   4.722
  127    H    MET  15           HN       MET  15  -2.277   5.994   4.244
  128    HA   MET  15           HA       MET  15  -1.447   5.616   6.985
  129   1HB   MET  15          HB2       MET  15  -4.012   6.646   5.752
  130   2HB   MET  15          HB1       MET  15  -3.730   6.602   7.492
  131   1HG   MET  15          HG2       MET  15  -1.626   7.940   7.105
  132   2HG   MET  15          HG1       MET  15  -2.110   8.113   5.421
  133   1HE   MET  15          HE1       MET  15  -5.469   9.647   5.498
  134   2HE   MET  15          HE2       MET  15  -4.219   8.719   4.677
  135   3HE   MET  15          HE3       MET  15  -4.057  10.465   4.818
  136    H    ALA  16           HN       ALA  16  -3.808   4.034   4.889
  137    HA   ALA  16           HA       ALA  16  -5.159   2.494   6.855
  138   1HB   ALA  16          HB1       ALA  16  -6.040   2.536   4.628
  139   2HB   ALA  16          HB2       ALA  16  -5.519   0.873   4.908
  140   3HB   ALA  16          HB3       ALA  16  -4.519   1.963   3.946
  141    H    ILE  17           HN       ILE  17  -2.222   1.748   4.972
  142    HA   ILE  17           HA       ILE  17  -1.770  -0.859   6.037
  143    HB   ILE  17           HB       ILE  17   0.253   1.222   5.126
  144   1HG1  ILE  17          HG12      ILE  17  -0.994  -1.061   3.579
  145   2HG1  ILE  17          HG11      ILE  17  -1.621   0.585   3.535
  146   1HG2  ILE  17          HG21      ILE  17   1.255  -0.671   6.398
  147   2HG2  ILE  17          HG22      ILE  17   1.700  -0.721   4.693
  148   3HG2  ILE  17          HG23      ILE  17   0.452  -1.803   5.309
  149   1HD1  ILE  17          HD11      ILE  17  -0.060   0.099   1.647
  150   2HD1  ILE  17          HD12      ILE  17   1.222  -0.182   2.825
  151   3HD1  ILE  17          HD13      ILE  17   0.498   1.421   2.674
  152    H    GLN  18           HN       GLN  18  -0.511   2.318   7.055
  153    HA   GLN  18           HA       GLN  18   0.886   1.363   9.363
  154   1HB   GLN  18          HB2       GLN  18  -0.340   4.071   8.777
  155   2HB   GLN  18          HB1       GLN  18   0.638   3.738  10.205
  156   1HG   GLN  18          HG2       GLN  18   2.522   3.059   8.760
  157   2HG   GLN  18          HG1       GLN  18   1.545   3.403   7.331
  158   1HE2  GLN  18          HE21      GLN  18   0.369   5.762   9.093
  159   2HE2  GLN  18          HE22      GLN  18   1.530   6.982   8.886
  160    H    ASN  19           HN       ASN  19  -2.454   2.462   8.906
  161    HA   ASN  19           HA       ASN  19  -3.106   2.137  11.737
  162   1HB   ASN  19          HB2       ASN  19  -4.802   2.631   9.274
  163   2HB   ASN  19          HB1       ASN  19  -5.464   2.523  10.905
  164   1HD2  ASN  19          HD21      ASN  19  -2.412   3.814  11.270
  165   2HD2  ASN  19          HD22      ASN  19  -2.802   5.465  11.223
  166    H    ALA  20           HN       ALA  20  -2.422  -0.097   9.453
  167    HA   ALA  20           HA       ALA  20  -4.668  -1.914   9.824
  168   1HB   ALA  20          HB1       ALA  20  -3.331  -3.499   8.541
  169   2HB   ALA  20          HB2       ALA  20  -1.881  -2.526   8.781
  170   3HB   ALA  20          HB3       ALA  20  -3.202  -1.912   7.785
  171    HA   PRO  21           HA       PRO  21  -3.251  -3.683  13.666
  172   1HB   PRO  21          HB2       PRO  21  -4.241  -6.254  13.433
  173   2HB   PRO  21          HB1       PRO  21  -5.241  -4.851  13.850
  174   1HG   PRO  21          HG2       PRO  21  -4.908  -6.219  11.221
  175   2HG   PRO  21          HG1       PRO  21  -6.369  -5.549  11.964
  176   1HD   PRO  21          HD2       PRO  21  -5.002  -4.239  10.002
  177   2HD   PRO  21          HD1       PRO  21  -5.886  -3.378  11.280
  178    H    GLU  22           HN       GLU  22  -2.468  -4.999  10.587
  179    HA   GLU  22           HA       GLU  22   0.149  -5.933  11.610
  180   1HB   GLU  22          HB2       GLU  22  -0.079  -7.989  10.101
  181   2HB   GLU  22          HB1       GLU  22  -1.014  -8.022  11.594
  182   1HG   GLU  22          HG2       GLU  22  -3.013  -7.268  10.368
  183   2HG   GLU  22          HG1       GLU  22  -2.083  -7.222   8.872
  184    H    LYS  23           HN       LYS  23   1.772  -5.811   9.962
  185    HA   LYS  23           HA       LYS  23   1.393  -3.740   8.054
  186   1HB   LYS  23          HB2       LYS  23   3.499  -5.925   8.099
  187   2HB   LYS  23          HB1       LYS  23   3.587  -4.458   7.129
  188   1HG   LYS  23          HG2       LYS  23   3.256  -4.363  10.130
  189   2HG   LYS  23          HG1       LYS  23   4.845  -4.454   9.376
  190   1HD   LYS  23          HD2       LYS  23   4.198  -2.397   8.022
  191   2HD   LYS  23          HD1       LYS  23   2.783  -2.256   9.067
  192   1HE   LYS  23          HE2       LYS  23   5.669  -2.253   9.982
  193   2HE   LYS  23          HE1       LYS  23   4.591  -0.857   9.932
  194   1HZ   LYS  23          HZ1       LYS  23   4.065  -1.424  12.006
  195   2HZ   LYS  23          HZ2       LYS  23   4.765  -2.966  11.870
  196   3HZ   LYS  23          HZ3       LYS  23   3.176  -2.700  11.328
  197    H    LYS  24           HN       LYS  24   1.257  -7.280   7.649
  198    HA   LYS  24           HA       LYS  24   0.863  -7.040   4.764
  199   1HB   LYS  24          HB2       LYS  24   0.428  -9.361   6.670
  200   2HB   LYS  24          HB1       LYS  24   0.281  -9.474   4.917
  201   1HG   LYS  24          HG2       LYS  24   2.629  -8.762   4.668
  202   2HG   LYS  24          HG1       LYS  24   2.779  -8.652   6.423
  203   1HD   LYS  24          HD2       LYS  24   2.243 -11.052   6.624
  204   2HD   LYS  24          HD1       LYS  24   2.096 -11.167   4.869
  205   1HE   LYS  24          HE2       LYS  24   4.474 -10.367   4.686
  206   2HE   LYS  24          HE1       LYS  24   4.593 -10.478   6.444
  207   1HZ   LYS  24          HZ1       LYS  24   5.040 -12.618   6.212
  208   2HZ   LYS  24          HZ2       LYS  24   4.817 -12.534   4.529
  209   3HZ   LYS  24          HZ3       LYS  24   3.499 -12.866   5.549
  210    H    ILE  25           HN       ILE  25  -1.037  -6.530   3.810
  211    HA   ILE  25           HA       ILE  25  -3.592  -7.210   5.190
  212    HB   ILE  25           HB       ILE  25  -2.964  -4.810   5.656
  213   1HG1  ILE  25          HG12      ILE  25  -5.391  -5.090   3.863
  214   2HG1  ILE  25          HG11      ILE  25  -5.339  -5.700   5.518
  215   1HG2  ILE  25          HG21      ILE  25  -3.541  -4.351   2.726
  216   2HG2  ILE  25          HG22      ILE  25  -1.897  -4.559   3.329
  217   3HG2  ILE  25          HG23      ILE  25  -2.881  -3.213   3.902
  218   1HD1  ILE  25          HD11      ILE  25  -6.346  -3.415   5.347
  219   2HD1  ILE  25          HD12      ILE  25  -4.799  -2.819   4.748
  220   3HD1  ILE  25          HD13      ILE  25  -4.921  -3.468   6.384
  221    H    THR  26           HN       THR  26  -5.240  -7.760   3.779
  222    HA   THR  26           HA       THR  26  -4.424  -8.386   1.042
  223    HB   THR  26           HB       THR  26  -6.531  -9.528   0.881
  224    HG1  THR  26           HG1      THR  26  -7.529  -8.757   3.304
  225   1HG2  THR  26          HG21      THR  26  -6.430 -10.993   2.787
  226   2HG2  THR  26          HG22      THR  26  -5.698  -9.735   3.783
  227   3HG2  THR  26          HG23      THR  26  -4.782 -10.457   2.460
  228    H    LEU  27           HN       LEU  27  -5.629  -7.613  -0.846
  229    HA   LEU  27           HA       LEU  27  -5.917  -4.798  -0.903
  230   1HB   LEU  27          HB2       LEU  27  -5.431  -6.170  -2.885
  231   2HB   LEU  27          HB1       LEU  27  -7.027  -6.898  -2.791
  232    HG   LEU  27           HG       LEU  27  -8.110  -4.871  -3.417
  233   1HD1  LEU  27          HD11      LEU  27  -7.041  -3.196  -2.116
  234   2HD1  LEU  27          HD12      LEU  27  -6.694  -2.761  -3.785
  235   3HD1  LEU  27          HD13      LEU  27  -5.459  -3.557  -2.811
  236   1HD2  LEU  27          HD21      LEU  27  -5.565  -5.318  -4.990
  237   2HD2  LEU  27          HD22      LEU  27  -6.803  -4.179  -5.502
  238   3HD2  LEU  27          HD23      LEU  27  -7.192  -5.891  -5.357
  239    H    ASN  28           HN       ASN  28  -8.314  -7.365  -0.561
  240    HA   ASN  28           HA       ASN  28 -10.675  -5.797  -0.685
  241   1HB   ASN  28          HB2       ASN  28 -10.030  -8.324   0.840
  242   2HB   ASN  28          HB1       ASN  28 -11.652  -7.642   0.737
  243   1HD2  ASN  28          HD21      ASN  28 -11.643  -6.760  -1.971
  244   2HD2  ASN  28          HD22      ASN  28 -11.526  -8.116  -2.986
  245    H    GLY  29           HN       GLY  29  -8.588  -6.595   2.087
  246   1HA   GLY  29          HA2       GLY  29 -10.204  -5.421   4.110
  247   2HA   GLY  29          HA1       GLY  29  -8.467  -5.675   4.236
  248    H    ILE  30           HN       ILE  30  -7.700  -3.966   2.044
  249    HA   ILE  30           HA       ILE  30  -7.517  -1.481   3.406
  250    HB   ILE  30           HB       ILE  30  -7.144  -2.156   0.477
  251   1HG1  ILE  30          HG12      ILE  30  -5.126  -1.589   2.669
  252   2HG1  ILE  30          HG11      ILE  30  -5.655  -3.215   2.239
  253   1HG2  ILE  30          HG21      ILE  30  -6.593   0.383   2.037
  254   2HG2  ILE  30          HG22      ILE  30  -7.562   0.211   0.574
  255   3HG2  ILE  30          HG23      ILE  30  -5.811   0.018   0.499
  256   1HD1  ILE  30          HD11      ILE  30  -4.588  -1.342   0.129
  257   2HD1  ILE  30          HD12      ILE  30  -4.676  -3.103   0.103
  258   3HD1  ILE  30          HD13      ILE  30  -3.492  -2.296   1.130
  259    H    TYR  31           HN       TYR  31  -9.780  -2.563   0.884
  260    HA   TYR  31           HA       TYR  31 -11.070  -0.060   0.442
  261   1HB   TYR  31          HB2       TYR  31 -11.977  -2.923   0.222
  262   2HB   TYR  31          HB1       TYR  31 -13.108  -1.612  -0.068
  263    HD1  TYR  31           HD1      TYR  31 -12.127   0.323  -1.633
  264    HD2  TYR  31           HD2      TYR  31 -10.794  -3.749  -1.626
  265    HE1  TYR  31           HE1      TYR  31 -11.265   0.599  -3.934
  266    HE2  TYR  31           HE2      TYR  31  -9.927  -3.475  -3.929
  267    HH   TYR  31           HH       TYR  31 -10.384  -0.418  -5.692
  268    H    GLN  32           HN       GLN  32 -11.654  -2.583   2.865
  269    HA   GLN  32           HA       GLN  32 -14.054  -1.539   3.954
  270   1HB   GLN  32          HB2       GLN  32 -11.791  -3.050   5.276
  271   2HB   GLN  32          HB1       GLN  32 -13.378  -2.794   6.006
  272   1HG   GLN  32          HG2       GLN  32 -12.955  -4.123   3.317
  273   2HG   GLN  32          HG1       GLN  32 -13.131  -5.013   4.830
  274   1HE2  GLN  32          HE21      GLN  32 -15.220  -4.299   6.131
  275   2HE2  GLN  32          HE22      GLN  32 -16.620  -4.072   5.199
  276    H    PHE  33           HN       PHE  33 -10.662  -0.748   4.728
  277    HA   PHE  33           HA       PHE  33 -11.202   0.924   6.969
  278   1HB   PHE  33          HB2       PHE  33  -8.931   0.110   6.244
  279   2HB   PHE  33          HB1       PHE  33  -8.979   1.299   4.943
  280    HD1  PHE  33           HD1      PHE  33  -8.847   3.703   5.419
  281    HD2  PHE  33           HD2      PHE  33  -8.727   0.794   8.578
  282    HE1  PHE  33           HE1      PHE  33  -8.047   5.444   6.992
  283    HE2  PHE  33           HE2      PHE  33  -7.928   2.536  10.151
  284    HZ   PHE  33           HZ       PHE  33  -7.587   4.861   9.358
  285    H    ILE  34           HN       ILE  34 -11.110   1.657   3.486
  286    HA   ILE  34           HA       ILE  34 -11.384   4.487   3.679
  287    HB   ILE  34           HB       ILE  34 -12.579   2.718   1.531
  288   1HG1  ILE  34          HG12      ILE  34 -10.295   2.005   1.821
  289   2HG1  ILE  34          HG11      ILE  34 -10.346   3.037   0.396
  290   1HG2  ILE  34          HG21      ILE  34 -11.420   5.514   1.382
  291   2HG2  ILE  34          HG22      ILE  34 -13.144   5.160   1.496
  292   3HG2  ILE  34          HG23      ILE  34 -12.228   4.636   0.084
  293   1HD1  ILE  34          HD11      ILE  34  -9.756   4.961   2.052
  294   2HD1  ILE  34          HD12      ILE  34  -8.479   3.847   1.563
  295   3HD1  ILE  34          HD13      ILE  34  -9.263   3.656   3.129
  296    H    MET  35           HN       MET  35 -13.969   2.147   2.896
  297    HA   MET  35           HA       MET  35 -16.107   3.983   3.167
  298   1HB   MET  35          HB2       MET  35 -15.985   0.979   3.481
  299   2HB   MET  35          HB1       MET  35 -17.497   1.889   3.479
  300   1HG   MET  35          HG2       MET  35 -17.153   2.663   1.253
  301   2HG   MET  35          HG1       MET  35 -15.465   2.160   1.257
  302   1HE   MET  35          HE1       MET  35 -15.350  -1.455   0.571
  303   2HE   MET  35          HE2       MET  35 -15.017  -0.591   2.068
  304   3HE   MET  35          HE3       MET  35 -14.582   0.139   0.527
  305    H    ASP  36           HN       ASP  36 -14.609   1.832   5.576
  306    HA   ASP  36           HA       ASP  36 -16.481   2.267   7.673
  307   1HB   ASP  36          HB2       ASP  36 -13.521   1.632   7.731
  308   2HB   ASP  36          HB1       ASP  36 -14.534   1.658   9.175
  309    H    ARG  37           HN       ARG  37 -13.567   4.111   6.762
  310    HA   ARG  37           HA       ARG  37 -14.031   6.004   8.983
  311   1HB   ARG  37          HB2       ARG  37 -11.932   5.883   6.801
  312   2HB   ARG  37          HB1       ARG  37 -11.985   7.131   8.044
  313   1HG   ARG  37          HG2       ARG  37 -11.967   4.204   8.789
  314   2HG   ARG  37          HG1       ARG  37 -10.467   5.056   8.443
  315   1HD   ARG  37          HD2       ARG  37 -11.139   6.772  10.179
  316   2HD   ARG  37          HD1       ARG  37 -12.475   5.709  10.617
  317    HE   ARG  37           HE       ARG  37 -10.273   4.053  10.759
  318   1HH1  ARG  37          HH21      ARG  37 -11.155   7.136  12.034
  319   2HH1  ARG  37          HH22      ARG  37 -10.230   6.945  13.487
  320   1HH2  ARG  37          HH11      ARG  37  -9.064   3.790  12.647
  321   2HH2  ARG  37          HH12      ARG  37  -9.044   5.055  13.832
  322    H    PHE  38           HN       PHE  38 -13.761   6.283   5.406
  323    HA   PHE  38           HA       PHE  38 -15.238   8.854   5.573
  324   1HB   PHE  38          HB2       PHE  38 -14.030   7.525   3.127
  325   2HB   PHE  38          HB1       PHE  38 -14.602   9.185   3.263
  326    HD1  PHE  38           HD1      PHE  38 -12.033   6.785   4.477
  327    HD2  PHE  38           HD2      PHE  38 -13.252  10.897   4.232
  328    HE1  PHE  38           HE1      PHE  38  -9.803   7.497   5.299
  329    HE2  PHE  38           HE2      PHE  38 -11.023  11.607   5.053
  330    HZ   PHE  38           HZ       PHE  38  -9.298   9.908   5.586
  331    HA   PRO  39           HA       PRO  39 -18.755   6.186   4.407
  332   1HB   PRO  39          HB2       PRO  39 -20.774   7.854   5.060
  333   2HB   PRO  39          HB1       PRO  39 -19.808   7.035   6.304
  334   1HG   PRO  39          HG2       PRO  39 -19.605   9.842   5.303
  335   2HG   PRO  39          HG1       PRO  39 -19.523   9.235   6.966
  336   1HD   PRO  39          HD2       PRO  39 -17.297   9.860   5.448
  337   2HD   PRO  39          HD1       PRO  39 -17.276   8.694   6.790
  338    H    PHE  40           HN       PHE  40 -17.686   9.087   3.048
  339    HA   PHE  40           HA       PHE  40 -19.744   9.773   1.214
  340   1HB   PHE  40          HB2       PHE  40 -17.963  11.312   1.482
  341   2HB   PHE  40          HB1       PHE  40 -16.739  10.079   1.189
  342    HD1  PHE  40           HD1      PHE  40 -15.913   9.685  -0.988
  343    HD2  PHE  40           HD2      PHE  40 -19.527  11.954  -0.451
  344    HE1  PHE  40           HE1      PHE  40 -15.933  10.240  -3.409
  345    HE2  PHE  40           HE2      PHE  40 -19.537  12.514  -2.866
  346    HZ   PHE  40           HZ       PHE  40 -17.740  11.657  -4.344
  347    H    TYR  41           HN       TYR  41 -17.103   7.415   0.942
  348    HA   TYR  41           HA       TYR  41 -17.626   6.754  -1.811
  349   1HB   TYR  41          HB2       TYR  41 -16.172   5.253   0.378
  350   2HB   TYR  41          HB1       TYR  41 -16.147   4.802  -1.330
  351    HD1  TYR  41           HD1      TYR  41 -14.917   6.108  -2.962
  352    HD2  TYR  41           HD2      TYR  41 -15.206   7.400   1.119
  353    HE1  TYR  41           HE1      TYR  41 -13.169   7.805  -3.387
  354    HE2  TYR  41           HE2      TYR  41 -13.465   9.107   0.706
  355    HH   TYR  41           HH       TYR  41 -12.390  10.265  -1.026
  356    H    ARG  42           HN       ARG  42 -19.288   5.962   1.059
  357    HA   ARG  42           HA       ARG  42 -20.169   3.318   0.523
  358   1HB   ARG  42          HB2       ARG  42 -21.610   5.608   1.894
  359   2HB   ARG  42          HB1       ARG  42 -22.125   3.927   1.961
  360   1HG   ARG  42          HG2       ARG  42 -19.329   4.715   2.760
  361   2HG   ARG  42          HG1       ARG  42 -20.658   4.854   3.907
  362   1HD   ARG  42          HD2       ARG  42 -19.646   2.346   2.543
  363   2HD   ARG  42          HD1       ARG  42 -19.641   2.716   4.265
  364    HE   ARG  42           HE       ARG  42 -22.320   2.814   3.604
  365   1HH1  ARG  42          HH21      ARG  42 -19.728   0.575   3.200
  366   2HH1  ARG  42          HH22      ARG  42 -20.755  -0.821   3.228
  367   1HH2  ARG  42          HH11      ARG  42 -23.673   1.008   3.636
  368   2HH2  ARG  42          HH12      ARG  42 -22.990  -0.575   3.473
  369    H    GLU  43           HN       GLU  43 -21.496   6.442  -0.581
  370    HA   GLU  43           HA       GLU  43 -23.669   5.069  -2.017
  371   1HB   GLU  43          HB2       GLU  43 -22.872   7.977  -1.770
  372   2HB   GLU  43          HB1       GLU  43 -24.218   7.428  -2.770
  373   1HG   GLU  43          HG2       GLU  43 -25.274   6.394  -0.799
  374   2HG   GLU  43          HG1       GLU  43 -23.929   6.931   0.209
  375    H    ASN  44           HN       ASN  44 -20.498   5.490  -2.632
  376    HA   ASN  44           HA       ASN  44 -20.933   5.371  -5.592
  377   1HB   ASN  44          HB2       ASN  44 -18.882   7.021  -4.092
  378   2HB   ASN  44          HB1       ASN  44 -18.743   6.642  -5.810
  379   1HD2  ASN  44          HD21      ASN  44 -19.967   8.954  -3.675
  380   2HD2  ASN  44          HD22      ASN  44 -21.104   9.678  -4.706
  381    H    LYS  45           HN       LYS  45 -20.416   3.280  -5.995
  382    HA   LYS  45           HA       LYS  45 -18.003   2.102  -4.665
  383   1HB   LYS  45          HB2       LYS  45 -20.452   0.811  -5.894
  384   2HB   LYS  45          HB1       LYS  45 -19.072  -0.074  -5.244
  385   1HG   LYS  45          HG2       LYS  45 -19.434   0.973  -3.040
  386   2HG   LYS  45          HG1       LYS  45 -20.816   1.856  -3.686
  387   1HD   LYS  45          HD2       LYS  45 -21.945  -0.275  -4.197
  388   2HD   LYS  45          HD1       LYS  45 -20.567  -1.165  -3.548
  389   1HE   LYS  45          HE2       LYS  45 -22.417  -0.935  -1.890
  390   2HE   LYS  45          HE1       LYS  45 -20.922  -0.176  -1.341
  391   1HZ   LYS  45          HZ1       LYS  45 -23.026   1.164  -1.082
  392   2HZ   LYS  45          HZ2       LYS  45 -23.030   1.332  -2.773
  393   3HZ   LYS  45          HZ3       LYS  45 -21.736   1.945  -1.858
  394    H    GLN  46           HN       GLN  46 -19.564   2.749  -7.752
  395    HA   GLN  46           HA       GLN  46 -17.458   1.282  -9.226
  396   1HB   GLN  46          HB2       GLN  46 -19.900   2.843 -10.110
  397   2HB   GLN  46          HB1       GLN  46 -18.754   2.111 -11.233
  398   1HG   GLN  46          HG2       GLN  46 -19.217  -0.097 -10.394
  399   2HG   GLN  46          HG1       GLN  46 -20.168   0.552  -9.057
  400   1HE2  GLN  46          HE21      GLN  46 -21.261  -1.312 -10.981
  401   2HE2  GLN  46          HE22      GLN  46 -22.470  -0.506 -11.857
  402    H    GLY  47           HN       GLY  47 -15.807   2.272 -10.338
  403   1HA   GLY  47          HA2       GLY  47 -14.825   4.185 -11.489
  404   2HA   GLY  47          HA1       GLY  47 -15.732   5.260 -10.431
  405    H    TRP  48           HN       TRP  48 -15.135   4.788  -7.950
  406    HA   TRP  48           HA       TRP  48 -12.274   5.300  -7.794
  407   1HB   TRP  48          HB2       TRP  48 -12.619   5.868  -5.546
  408   2HB   TRP  48          HB1       TRP  48 -14.101   6.360  -6.350
  409    HD1  TRP  48           HD1      TRP  48 -16.277   4.735  -5.980
  410    HE1  TRP  48           HE1      TRP  48 -16.900   3.293  -3.942
  411    HE3  TRP  48           HE3      TRP  48 -11.713   4.369  -3.732
  412    HZ2  TRP  48           HZ2      TRP  48 -15.636   2.134  -1.639
  413    HZ3  TRP  48           HZ3      TRP  48 -11.443   3.084  -1.637
  414    HH2  TRP  48           HH2      TRP  48 -13.391   1.960  -0.587
  415    H    GLN  49           HN       GLN  49 -14.242   2.478  -7.517
  416    HA   GLN  49           HA       GLN  49 -12.621   0.910  -5.777
  417   1HB   GLN  49          HB2       GLN  49 -14.883   0.241  -6.488
  418   2HB   GLN  49          HB1       GLN  49 -14.304   0.030  -8.139
  419   1HG   GLN  49          HG2       GLN  49 -12.754  -1.738  -7.376
  420   2HG   GLN  49          HG1       GLN  49 -13.327  -1.522  -5.720
  421   1HE2  GLN  49          HE21      GLN  49 -14.090  -3.819  -5.811
  422   2HE2  GLN  49          HE22      GLN  49 -15.539  -4.189  -6.613
  423    H    ASN  50           HN       ASN  50 -12.605   1.044  -9.356
  424    HA   ASN  50           HA       ASN  50 -10.318  -0.686  -9.617
  425   1HB   ASN  50          HB2       ASN  50 -11.568   1.323 -11.512
  426   2HB   ASN  50          HB1       ASN  50 -10.253   0.240 -11.966
  427   1HD2  ASN  50          HD21      ASN  50 -11.054  -2.123 -10.594
  428   2HD2  ASN  50          HD22      ASN  50 -12.513  -2.674 -11.263
  429    H    SER  51           HN       SER  51 -10.682   2.827  -9.373
  430    HA   SER  51           HA       SER  51  -8.054   3.559 -10.159
  431   1HB   SER  51          HB2       SER  51  -9.935   4.841  -8.160
  432   2HB   SER  51          HB1       SER  51  -8.457   5.598  -8.745
  433    HG   SER  51           HG       SER  51 -10.778   4.863 -10.188
  434    H    ILE  52           HN       ILE  52  -9.325   2.554  -6.994
  435    HA   ILE  52           HA       ILE  52  -6.959   3.054  -5.490
  436    HB   ILE  52           HB       ILE  52  -9.195   1.048  -5.149
  437   1HG1  ILE  52          HG12      ILE  52  -9.463   3.658  -4.931
  438   2HG1  ILE  52          HG11      ILE  52 -10.183   2.608  -3.721
  439   1HG2  ILE  52          HG21      ILE  52  -6.794   1.581  -3.405
  440   2HG2  ILE  52          HG22      ILE  52  -7.432   0.032  -3.957
  441   3HG2  ILE  52          HG23      ILE  52  -8.301   0.957  -2.732
  442   1HD1  ILE  52          HD11      ILE  52  -7.406   3.730  -3.347
  443   2HD1  ILE  52          HD12      ILE  52  -8.501   3.074  -2.134
  444   3HD1  ILE  52          HD13      ILE  52  -8.843   4.635  -2.875
  445    H    ARG  53           HN       ARG  53  -8.011   0.091  -7.204
  446    HA   ARG  53           HA       ARG  53  -5.672  -1.425  -6.445
  447   1HB   ARG  53          HB2       ARG  53  -7.287  -1.906  -8.960
  448   2HB   ARG  53          HB1       ARG  53  -6.488  -3.091  -7.923
  449   1HG   ARG  53          HG2       ARG  53  -8.086  -2.312  -6.071
  450   2HG   ARG  53          HG1       ARG  53  -8.976  -1.489  -7.352
  451   1HD   ARG  53          HD2       ARG  53  -8.997  -3.763  -8.560
  452   2HD   ARG  53          HD1       ARG  53  -8.528  -4.450  -7.000
  453    HE   ARG  53           HE       ARG  53 -10.728  -2.870  -6.406
  454   1HH1  ARG  53          HH21      ARG  53  -9.972  -5.413  -8.607
  455   2HH1  ARG  53          HH22      ARG  53 -11.588  -6.032  -8.657
  456   1HH2  ARG  53          HH11      ARG  53 -12.845  -3.661  -6.460
  457   2HH2  ARG  53          HH12      ARG  53 -13.215  -5.040  -7.441
  458    H    HIS  54           HN       HIS  54  -6.469   0.547  -9.324
  459    HA   HIS  54           HA       HIS  54  -4.148  -0.122 -10.839
  460   1HB   HIS  54          HB2       HIS  54  -5.782   2.427 -10.731
  461   2HB   HIS  54          HB1       HIS  54  -4.484   2.161 -11.893
  462    HD1  HIS  54           HD1      HIS  54  -7.742   2.349 -12.346
  463    HD2  HIS  54           HD2      HIS  54  -5.301  -1.019 -12.640
  464    HE1  HIS  54           HE1      HIS  54  -8.953   0.715 -13.852
  465    H    ASN  55           HN       ASN  55  -4.704   2.326  -8.337
  466    HA   ASN  55           HA       ASN  55  -2.151   3.598  -8.521
  467   1HB   ASN  55          HB2       ASN  55  -4.050   3.227  -6.189
  468   2HB   ASN  55          HB1       ASN  55  -2.599   4.227  -6.108
  469   1HD2  ASN  55          HD21      ASN  55  -5.443   5.140  -5.947
  470   2HD2  ASN  55          HD22      ASN  55  -5.648   6.239  -7.223
  471    H    LEU  56           HN       LEU  56  -3.287   0.758  -6.713
  472    HA   LEU  56           HA       LEU  56  -0.793   0.338  -5.339
  473   1HB   LEU  56          HB2       LEU  56  -3.130  -1.476  -5.915
  474   2HB   LEU  56          HB1       LEU  56  -1.720  -2.013  -5.003
  475    HG   LEU  56           HG       LEU  56  -3.375   0.423  -4.284
  476   1HD1  LEU  56          HD11      LEU  56  -4.611  -1.781  -4.141
  477   2HD1  LEU  56          HD12      LEU  56  -4.470  -0.914  -2.614
  478   3HD1  LEU  56          HD13      LEU  56  -3.420  -2.292  -2.945
  479   1HD2  LEU  56          HD21      LEU  56  -0.867  -0.765  -3.250
  480   2HD2  LEU  56          HD22      LEU  56  -2.068  -0.472  -1.999
  481   3HD2  LEU  56          HD23      LEU  56  -1.530   0.852  -3.025
  482    H    SER  57           HN       SER  57  -2.146  -0.929  -8.366
  483    HA   SER  57           HA       SER  57   0.081  -2.729  -8.827
  484   1HB   SER  57          HB2       SER  57  -0.942  -3.175 -10.934
  485   2HB   SER  57          HB1       SER  57  -2.272  -2.907  -9.810
  486    HG   SER  57           HG       SER  57  -2.013  -0.602 -10.566
  487    H    LEU  58           HN       LEU  58  -0.798   0.492 -10.112
  488    HA   LEU  58           HA       LEU  58   1.495   0.679 -11.840
  489   1HB   LEU  58          HB2       LEU  58  -0.208   2.853 -10.605
  490   2HB   LEU  58          HB1       LEU  58   0.967   3.105 -11.894
  491    HG   LEU  58           HG       LEU  58  -1.342   1.158 -12.090
  492   1HD1  LEU  58          HD11      LEU  58  -1.116   4.031 -13.037
  493   2HD1  LEU  58          HD12      LEU  58  -2.263   3.395 -11.859
  494   3HD1  LEU  58          HD13      LEU  58  -2.385   2.919 -13.553
  495   1HD2  LEU  58          HD21      LEU  58   0.775   2.158 -13.988
  496   2HD2  LEU  58          HD22      LEU  58  -0.793   1.663 -14.621
  497   3HD2  LEU  58          HD23      LEU  58   0.197   0.514 -13.729
  498    H    ASN  59           HN       ASN  59   0.882   1.758  -8.511
  499    HA   ASN  59           HA       ASN  59   3.365   3.175  -8.210
  500   1HB   ASN  59          HB2       ASN  59   1.524   1.844  -6.211
  501   2HB   ASN  59          HB1       ASN  59   2.919   2.811  -5.739
  502   1HD2  ASN  59          HD21      ASN  59   0.063   3.459  -5.223
  503   2HD2  ASN  59          HD22      ASN  59  -0.236   4.938  -5.999
  504    H    GLU  60           HN       GLU  60   5.360   2.259  -8.251
  505    HA   GLU  60           HA       GLU  60   5.629  -0.660  -7.933
  506   1HB   GLU  60          HB2       GLU  60   7.833   1.360  -8.414
  507   2HB   GLU  60          HB1       GLU  60   7.837  -0.361  -8.790
  508   1HG   GLU  60          HG2       GLU  60   7.372   0.572 -10.887
  509   2HG   GLU  60          HG1       GLU  60   5.752   0.220 -10.289
  510    H    CYS  61           HN       CYS  61   5.782   2.083  -5.951
  511    HA   CYS  61           HA       CYS  61   7.903   1.369  -4.168
  512   1HB   CYS  61          HB2       CYS  61   5.390   3.010  -3.804
  513   2HB   CYS  61          HB1       CYS  61   6.573   2.794  -2.513
  514    HG   CYS  61           HG       CYS  61   7.503   4.840  -3.680
  515    H    PHE  62           HN       PHE  62   4.443   0.519  -4.209
  516    HA   PHE  62           HA       PHE  62   4.658  -0.975  -1.706
  517   1HB   PHE  62          HB2       PHE  62   2.473  -0.964  -3.810
  518   2HB   PHE  62          HB1       PHE  62   2.346  -1.695  -2.212
  519    HD1  PHE  62           HD1      PHE  62   1.552   1.168  -4.036
  520    HD2  PHE  62           HD2      PHE  62   3.135  -0.011  -0.224
  521    HE1  PHE  62           HE1      PHE  62   0.875   3.352  -3.085
  522    HE2  PHE  62           HE2      PHE  62   2.455   2.176   0.727
  523    HZ   PHE  62           HZ       PHE  62   1.326   3.856  -0.700
  524    H    VAL  63           HN       VAL  63   5.310  -3.044  -1.512
  525    HA   VAL  63           HA       VAL  63   5.506  -4.748  -3.979
  526    HB   VAL  63           HB       VAL  63   7.146  -4.857  -1.427
  527   1HG1  VAL  63          HG11      VAL  63   8.535  -6.446  -2.822
  528   2HG1  VAL  63          HG12      VAL  63   7.228  -6.441  -4.006
  529   3HG1  VAL  63          HG13      VAL  63   6.942  -7.061  -2.380
  530   1HG2  VAL  63          HG21      VAL  63   7.707  -2.895  -2.783
  531   2HG2  VAL  63          HG22      VAL  63   7.837  -3.904  -4.224
  532   3HG2  VAL  63          HG23      VAL  63   8.996  -4.093  -2.908
  533    H    LYS  64           HN       LYS  64   4.134  -6.475  -3.945
  534    HA   LYS  64           HA       LYS  64   2.791  -7.160  -1.390
  535   1HB   LYS  64          HB2       LYS  64   1.419  -8.663  -2.984
  536   2HB   LYS  64          HB1       LYS  64   1.220  -6.918  -3.119
  537   1HG   LYS  64          HG2       LYS  64   2.704  -6.828  -5.027
  538   2HG   LYS  64          HG1       LYS  64   3.125  -8.531  -4.836
  539   1HD   LYS  64          HD2       LYS  64   0.965  -9.258  -5.486
  540   2HD   LYS  64          HD1       LYS  64   0.263  -7.657  -5.253
  541   1HE   LYS  64          HE2       LYS  64   0.557  -8.120  -7.646
  542   2HE   LYS  64          HE1       LYS  64   1.613  -6.802  -7.143
  543   1HZ   LYS  64          HZ1       LYS  64   3.472  -8.122  -7.261
  544   2HZ   LYS  64          HZ2       LYS  64   2.557  -8.731  -8.557
  545   3HZ   LYS  64          HZ3       LYS  64   2.605  -9.570  -7.079
  546    H    VAL  65           HN       VAL  65   2.726  -9.274  -0.577
  547    HA   VAL  65           HA       VAL  65   4.896 -11.104  -1.537
  548    HB   VAL  65           HB       VAL  65   4.304 -11.778   1.150
  549   1HG1  VAL  65          HG11      VAL  65   6.523 -11.885   0.167
  550   2HG1  VAL  65          HG12      VAL  65   6.571 -10.853   1.596
  551   3HG1  VAL  65          HG13      VAL  65   6.563 -10.131  -0.014
  552   1HG2  VAL  65          HG21      VAL  65   4.773  -8.793   0.994
  553   2HG2  VAL  65          HG22      VAL  65   4.415  -9.766   2.420
  554   3HG2  VAL  65          HG23      VAL  65   3.165  -9.477   1.215
  555    HA   PRO  66           HA       PRO  66   0.799 -13.081  -2.541
  556   1HB   PRO  66          HB2       PRO  66   2.893 -14.936  -3.651
  557   2HB   PRO  66          HB1       PRO  66   1.322 -14.474  -4.341
  558   1HG   PRO  66          HG2       PRO  66   3.538 -13.350  -5.229
  559   2HG   PRO  66          HG1       PRO  66   2.076 -12.377  -4.983
  560   1HD   PRO  66          HD2       PRO  66   4.575 -12.466  -3.345
  561   2HD   PRO  66          HD1       PRO  66   3.459 -11.109  -3.616
  562    H    ARG  67           HN       ARG  67  -0.018 -15.299  -2.090
  563    HA   ARG  67           HA       ARG  67   0.906 -16.229   0.547
  564   1HB   ARG  67          HB2       ARG  67  -1.361 -17.153  -1.249
  565   2HB   ARG  67          HB1       ARG  67  -1.084 -17.713   0.399
  566   1HG   ARG  67          HG2       ARG  67  -1.489 -15.515   1.293
  567   2HG   ARG  67          HG1       ARG  67  -1.518 -14.803  -0.322
  568   1HD   ARG  67          HD2       ARG  67  -3.456 -16.930   0.629
  569   2HD   ARG  67          HD1       ARG  67  -3.810 -15.199   0.634
  570    HE   ARG  67           HE       ARG  67  -3.035 -15.655  -1.964
  571   1HH1  ARG  67          HH21      ARG  67  -5.277 -17.111   0.218
  572   2HH1  ARG  67          HH22      ARG  67  -6.383 -17.581  -1.030
  573   1HH2  ARG  67          HH11      ARG  67  -4.463 -16.250  -3.595
  574   2HH2  ARG  67          HH12      ARG  67  -5.924 -17.089  -3.191
  575    H    ASP  68           HN       ASP  68   0.723 -18.837   0.668
  576    HA   ASP  68           HA       ASP  68   2.936 -19.866  -0.851
  577   1HB   ASP  68          HB2       ASP  68   0.764 -21.248   0.755
  578   2HB   ASP  68          HB1       ASP  68   2.131 -22.101   0.036
  579    H    ASP  69           HN       ASP  69   2.863 -21.407  -2.611
  580    HA   ASP  69           HA       ASP  69   0.821 -20.868  -4.555
  581   1HB   ASP  69          HB2       ASP  69   2.933 -23.034  -4.391
  582   2HB   ASP  69          HB1       ASP  69   1.875 -22.818  -5.786
  583    H    LYS  70           HN       LYS  70   1.010 -23.121  -1.942
  584    HA   LYS  70           HA       LYS  70  -1.129 -24.835  -3.084
  585   1HB   LYS  70          HB2       LYS  70   0.535 -25.035  -0.564
  586   2HB   LYS  70          HB1       LYS  70  -0.788 -26.136  -0.947
  587   1HG   LYS  70          HG2       LYS  70   0.317 -26.837  -2.995
  588   2HG   LYS  70          HG1       LYS  70   1.578 -25.629  -2.773
  589   1HD   LYS  70          HD2       LYS  70   2.517 -27.697  -2.029
  590   2HD   LYS  70          HD1       LYS  70   2.135 -26.785  -0.572
  591   1HE   LYS  70          HE2       LYS  70   1.452 -29.219  -0.507
  592   2HE   LYS  70          HE1       LYS  70   0.142 -28.088  -0.188
  593   1HZ   LYS  70          HZ1       LYS  70   0.057 -30.058  -2.011
  594   2HZ   LYS  70          HZ2       LYS  70   0.517 -28.737  -2.976
  595   3HZ   LYS  70          HZ3       LYS  70  -0.912 -28.666  -2.060
  596    H    LYS  71           HN       LYS  71  -1.107 -21.929  -1.513
  597    HA   LYS  71           HA       LYS  71  -3.714 -22.511  -0.163
  598   1HB   LYS  71          HB2       LYS  71  -1.907 -22.205   1.498
  599   2HB   LYS  71          HB1       LYS  71  -1.540 -20.628   0.795
  600   1HG   LYS  71          HG2       LYS  71  -3.725 -19.792   1.351
  601   2HG   LYS  71          HG1       LYS  71  -4.267 -21.392   1.847
  602   1HD   LYS  71          HD2       LYS  71  -2.373 -21.303   3.591
  603   2HD   LYS  71          HD1       LYS  71  -2.276 -19.580   3.224
  604   1HE   LYS  71          HE2       LYS  71  -3.769 -19.712   5.062
  605   2HE   LYS  71          HE1       LYS  71  -4.819 -19.531   3.657
  606   1HZ   LYS  71          HZ1       LYS  71  -4.555 -21.738   5.463
  607   2HZ   LYS  71          HZ2       LYS  71  -4.433 -22.214   3.837
  608   3HZ   LYS  71          HZ3       LYS  71  -5.807 -21.373   4.378
  609    HA   PRO  72           HA       PRO  72  -4.281 -18.949  -3.044
  610   1HB   PRO  72          HB2       PRO  72  -6.078 -20.034  -4.715
  611   2HB   PRO  72          HB1       PRO  72  -4.359 -20.463  -4.827
  612   1HG   PRO  72          HG2       PRO  72  -6.620 -22.013  -3.663
  613   2HG   PRO  72          HG1       PRO  72  -5.207 -22.588  -4.565
  614   1HD   PRO  72          HD2       PRO  72  -5.481 -22.579  -1.742
  615   2HD   PRO  72          HD1       PRO  72  -3.969 -22.829  -2.641
  616    H    GLY  73           HN       GLY  73  -6.820 -18.328  -3.921
  617   1HA   GLY  73          HA2       GLY  73  -9.155 -18.232  -3.185
  618   2HA   GLY  73          HA1       GLY  73  -8.622 -18.552  -1.540
  619    H    LYS  74           HN       LYS  74  -7.547 -16.804  -0.384
  620    HA   LYS  74           HA       LYS  74  -8.810 -14.269  -0.789
  621   1HB   LYS  74          HB2       LYS  74  -6.494 -15.122   0.953
  622   2HB   LYS  74          HB1       LYS  74  -7.195 -13.505   1.001
  623   1HG   LYS  74          HG2       LYS  74  -9.326 -14.336   1.696
  624   2HG   LYS  74          HG1       LYS  74  -8.883 -15.997   1.315
  625   1HD   LYS  74          HD2       LYS  74  -8.677 -15.928   3.650
  626   2HD   LYS  74          HD1       LYS  74  -7.021 -15.674   3.114
  627   1HE   LYS  74          HE2       LYS  74  -7.368 -14.012   4.762
  628   2HE   LYS  74          HE1       LYS  74  -7.565 -13.149   3.241
  629   1HZ   LYS  74          HZ1       LYS  74  -9.962 -14.384   4.307
  630   2HZ   LYS  74          HZ2       LYS  74  -9.751 -12.861   3.583
  631   3HZ   LYS  74          HZ3       LYS  74  -9.346 -13.092   5.217
  632    H    GLY  75           HN       GLY  75  -7.574 -12.176  -0.948
  633   1HA   GLY  75          HA2       GLY  75  -6.041 -12.142  -3.394
  634   2HA   GLY  75          HA1       GLY  75  -6.332 -10.755  -2.345
  635    H    SER  76           HN       SER  76  -3.894 -10.699  -3.286
  636    HA   SER  76           HA       SER  76  -1.995 -12.280  -1.726
  637   1HB   SER  76          HB2       SER  76  -0.291 -11.046  -2.922
  638   2HB   SER  76          HB1       SER  76  -1.560 -11.470  -4.069
  639    HG   SER  76           HG       SER  76  -1.282  -8.996  -2.696
  640    H    TYR  77           HN       TYR  77  -0.222 -11.062  -0.500
  641    HA   TYR  77           HA       TYR  77  -1.521  -9.222   1.418
  642   1HB   TYR  77          HB2       TYR  77   1.174 -10.600   1.368
  643   2HB   TYR  77          HB1       TYR  77   0.694  -9.475   2.632
  644    HD1  TYR  77           HD1      TYR  77   0.919 -12.857   1.874
  645    HD2  TYR  77           HD2      TYR  77  -1.841 -10.021   3.558
  646    HE1  TYR  77           HE1      TYR  77  -0.239 -14.690   3.069
  647    HE2  TYR  77           HE2      TYR  77  -3.002 -11.862   4.741
  648    HH   TYR  77           HH       TYR  77  -3.264 -14.412   4.374
  649    H    TRP  78           HN       TRP  78  -0.820  -7.095   1.762
  650    HA   TRP  78           HA       TRP  78   1.141  -5.990  -0.228
  651   1HB   TRP  78          HB2       TRP  78  -1.438  -4.836   0.851
  652   2HB   TRP  78          HB1       TRP  78  -0.200  -3.827   0.101
  653    HD1  TRP  78           HD1      TRP  78  -2.933  -6.287  -0.703
  654    HE1  TRP  78           HE1      TRP  78  -3.119  -6.558  -3.261
  655    HE3  TRP  78           HE3      TRP  78   1.277  -3.797  -2.159
  656    HZ2  TRP  78           HZ2      TRP  78  -1.665  -5.813  -5.619
  657    HZ3  TRP  78           HZ3      TRP  78   1.853  -3.590  -4.558
  658    HH2  TRP  78           HH2      TRP  78   0.389  -4.593  -6.288
  659    H    THR  79           HN       THR  79   2.738  -4.691   0.578
  660    HA   THR  79           HA       THR  79   2.600  -3.705   3.361
  661    HB   THR  79           HB       THR  79   3.533  -5.961   3.621
  662    HG1  THR  79           HG1      THR  79   5.089  -5.265   4.877
  663   1HG2  THR  79          HG21      THR  79   5.618  -6.585   2.487
  664   2HG2  THR  79          HG22      THR  79   5.641  -5.036   1.647
  665   3HG2  THR  79          HG23      THR  79   4.368  -6.206   1.303
  666    H    LEU  80           HN       LEU  80   4.605  -2.313   3.809
  667    HA   LEU  80           HA       LEU  80   5.021  -0.534   1.561
  668   1HB   LEU  80          HB2       LEU  80   6.425  -0.668   4.249
  669   2HB   LEU  80          HB1       LEU  80   6.576   0.656   3.097
  670    HG   LEU  80           HG       LEU  80   3.975  -0.249   4.369
  671   1HD1  LEU  80          HD11      LEU  80   4.190   2.026   5.510
  672   2HD1  LEU  80          HD12      LEU  80   5.872   2.028   4.975
  673   3HD1  LEU  80          HD13      LEU  80   5.297   0.774   6.075
  674   1HD2  LEU  80          HD21      LEU  80   3.379   2.168   3.443
  675   2HD2  LEU  80          HD22      LEU  80   3.305   0.770   2.380
  676   3HD2  LEU  80          HD23      LEU  80   4.703   1.840   2.326
  677    H    ASP  81           HN       ASP  81   7.321   0.089   0.892
  678    HA   ASP  81           HA       ASP  81   8.570  -2.126  -0.335
  679   1HB   ASP  81          HB2       ASP  81   8.798   0.299  -0.996
  680   2HB   ASP  81          HB1       ASP  81   9.929   0.488   0.345
  681    HA   PRO  82           HA       PRO  82  10.922  -3.460   3.315
  682   1HB   PRO  82          HB2       PRO  82  11.952  -5.742   2.354
  683   2HB   PRO  82          HB1       PRO  82  10.198  -5.577   2.578
  684   1HG   PRO  82          HG2       PRO  82  11.810  -5.279   0.074
  685   2HG   PRO  82          HG1       PRO  82  10.311  -6.190   0.336
  686   1HD   PRO  82          HD2       PRO  82  10.363  -3.649  -0.737
  687   2HD   PRO  82          HD1       PRO  82   8.979  -4.306   0.168
  688    H    ASP  83           HN       ASP  83  13.420  -4.904   2.879
  689    HA   ASP  83           HA       ASP  83  15.199  -2.638   2.445
  690   1HB   ASP  83          HB2       ASP  83  15.707  -5.590   2.935
  691   2HB   ASP  83          HB1       ASP  83  16.995  -4.394   2.777
  692    H    SER  84           HN       SER  84  14.245  -2.362   0.206
  693    HA   SER  84           HA       SER  84  14.796  -4.284  -1.856
  694   1HB   SER  84          HB2       SER  84  13.945  -2.664  -3.344
  695   2HB   SER  84          HB1       SER  84  13.105  -2.333  -1.830
  696    HG   SER  84           HG       SER  84  13.902  -0.402  -2.563
  697    H    TYR  85           HN       TYR  85  16.804  -1.968  -0.267
  698    HA   TYR  85           HA       TYR  85  18.608  -1.390  -2.412
  699   1HB   TYR  85          HB2       TYR  85  19.960  -1.589   0.192
  700   2HB   TYR  85          HB1       TYR  85  19.711  -0.177  -0.827
  701    HD1  TYR  85           HD1      TYR  85  18.523  -2.083   2.027
  702    HD2  TYR  85           HD2      TYR  85  17.572   1.124  -0.669
  703    HE1  TYR  85           HE1      TYR  85  16.789  -1.271   3.605
  704    HE2  TYR  85           HE2      TYR  85  15.834   1.932   0.907
  705    HH   TYR  85           HH       TYR  85  14.404   0.896   2.758
  706    H    ASN  86           HN       ASN  86  18.316  -4.124  -0.221
  707    HA   ASN  86           HA       ASN  86  20.781  -5.358  -1.339
  708   1HB   ASN  86          HB2       ASN  86  18.936  -6.245   0.894
  709   2HB   ASN  86          HB1       ASN  86  20.426  -7.062   0.421
  710   1HD2  ASN  86          HD21      ASN  86  22.174  -4.920   0.014
  711   2HD2  ASN  86          HD22      ASN  86  22.381  -4.057   1.461
  712    H    MET  87           HN       MET  87  18.023  -5.020  -2.661
  713    HA   MET  87           HA       MET  87  16.624  -7.409  -2.975
  714   1HB   MET  87          HB2       MET  87  15.989  -6.608  -5.171
  715   2HB   MET  87          HB1       MET  87  16.115  -5.217  -4.100
  716   1HG   MET  87          HG2       MET  87  18.692  -5.371  -5.062
  717   2HG   MET  87          HG1       MET  87  17.775  -5.938  -6.453
  718   1HE   MET  87          HE1       MET  87  18.930  -3.164  -4.288
  719   2HE   MET  87          HE2       MET  87  18.593  -1.766  -5.308
  720   3HE   MET  87          HE3       MET  87  19.580  -3.086  -5.931
  721    H    PHE  88           HN       PHE  88  16.775  -8.796  -5.110
  722    HA   PHE  88           HA       PHE  88  19.437 -10.038  -5.110
  723   1HB   PHE  88          HB2       PHE  88  17.016 -10.694  -6.820
  724   2HB   PHE  88          HB1       PHE  88  18.416 -11.727  -6.535
  725    HD1  PHE  88           HD1      PHE  88  15.257 -10.486  -5.200
  726    HD2  PHE  88           HD2      PHE  88  18.827 -12.686  -4.265
  727    HE1  PHE  88           HE1      PHE  88  14.165 -11.394  -3.167
  728    HE2  PHE  88           HE2      PHE  88  17.735 -13.593  -2.230
  729    HZ   PHE  88           HZ       PHE  88  15.404 -12.946  -1.681
  730    H    GLU  89           HN       GLU  89  20.398  -7.940  -6.002
  731    HA   GLU  89           HA       GLU  89  19.770  -7.060  -8.656
  732   1HB   GLU  89          HB2       GLU  89  22.008  -5.950  -8.569
  733   2HB   GLU  89          HB1       GLU  89  21.019  -5.617  -7.147
  734   1HG   GLU  89          HG2       GLU  89  22.203  -7.385  -5.901
  735   2HG   GLU  89          HG1       GLU  89  23.191  -7.728  -7.323
  736    H    ASN  90           HN       ASN  90  20.675  -7.617 -10.639
  737    HA   ASN  90           HA       ASN  90  22.025 -10.259 -10.720
  738   1HB   ASN  90          HB2       ASN  90  20.717  -8.539 -12.843
  739   2HB   ASN  90          HB1       ASN  90  21.554 -10.049 -13.200
  740   1HD2  ASN  90          HD21      ASN  90  18.682  -9.600 -13.599
  741   2HD2  ASN  90          HD22      ASN  90  17.866 -10.681 -12.578
  742    H    GLY  91           HN       GLY  91  23.198  -7.370 -10.210
  743   1HA   GLY  91          HA2       GLY  91  25.757  -7.937 -11.432
  744   2HA   GLY  91          HA1       GLY  91  24.934  -6.625 -12.273
  745    H    SER  92           HN       SER  92  25.714  -4.711 -11.590
  746    HA   SER  92           HA       SER  92  26.048  -4.244  -8.651
  747   1HB   SER  92          HB2       SER  92  28.160  -3.190  -8.974
  748   2HB   SER  92          HB1       SER  92  28.250  -4.685  -9.900
  749    HG   SER  92           HG       SER  92  28.607  -2.244 -10.773
  750    H    PHE  93           HN       PHE  93  23.780  -3.500 -10.070
  751    HA   PHE  93           HA       PHE  93  23.854  -0.945 -11.296
  752   1HB   PHE  93          HB2       PHE  93  21.894  -2.407 -11.416
  753   2HB   PHE  93          HB1       PHE  93  21.627  -2.214  -9.683
  754    HD1  PHE  93           HD1      PHE  93  21.503  -0.531 -12.971
  755    HD2  PHE  93           HD2      PHE  93  20.768  -0.143  -8.756
  756    HE1  PHE  93           HE1      PHE  93  20.207   1.544 -13.385
  757    HE2  PHE  93           HE2      PHE  93  19.475   1.931  -9.170
  758    HZ   PHE  93           HZ       PHE  93  19.195   2.775 -11.486
  759    H    LEU  94           HN       LEU  94  23.483  -1.784  -7.834
  760    HA   LEU  94           HA       LEU  94  22.903   0.857  -6.956
  761   1HB   LEU  94          HB2       LEU  94  22.661  -1.118  -5.498
  762   2HB   LEU  94          HB1       LEU  94  24.409  -1.332  -5.491
  763    HG   LEU  94           HG       LEU  94  24.669   0.893  -4.426
  764   1HD1  LEU  94          HD11      LEU  94  21.671   0.906  -4.744
  765   2HD1  LEU  94          HD12      LEU  94  22.829   2.192  -5.087
  766   3HD1  LEU  94          HD13      LEU  94  22.421   1.800  -3.422
  767   1HD2  LEU  94          HD21      LEU  94  22.686  -0.875  -2.963
  768   2HD2  LEU  94          HD22      LEU  94  23.835   0.244  -2.230
  769   3HD2  LEU  94          HD23      LEU  94  24.418  -1.193  -3.070
  Start of MODEL   24
    1   1H    MET   1          HT1       MET   1 -24.951  16.394   3.454
    2   2H    MET   1          HT2       MET   1 -23.991  16.744   2.096
    3   3H    MET   1          HT3       MET   1 -25.123  17.882   2.657
    4    HA   MET   1           HA       MET   1 -23.151  18.723   3.469
    5   1HB   MET   1          HB2       MET   1 -24.994  18.132   5.222
    6   2HB   MET   1          HB1       MET   1 -23.878  16.873   5.742
    7   1HG   MET   1          HG2       MET   1 -23.198  18.620   7.115
    8   2HG   MET   1          HG1       MET   1 -22.133  18.891   5.737
    9   1HE   MET   1          HE1       MET   1 -21.784  20.986   6.845
   10   2HE   MET   1          HE2       MET   1 -22.667  22.464   6.473
   11   3HE   MET   1          HE3       MET   1 -21.853  21.583   5.182
   12    H    LEU   2           HN       LEU   2 -22.821  15.885   2.209
   13    HA   LEU   2           HA       LEU   2 -20.547  14.815   3.751
   14   1HB   LEU   2          HB2       LEU   2 -21.578  13.987   1.020
   15   2HB   LEU   2          HB1       LEU   2 -20.506  13.061   2.068
   16    HG   LEU   2           HG       LEU   2 -23.361  13.845   2.727
   17   1HD1  LEU   2          HD11      LEU   2 -23.299  12.129   1.009
   18   2HD1  LEU   2          HD12      LEU   2 -23.748  11.376   2.540
   19   3HD1  LEU   2          HD13      LEU   2 -22.105  11.207   1.920
   20   1HD2  LEU   2          HD21      LEU   2 -22.268  13.681   4.809
   21   2HD2  LEU   2          HD22      LEU   2 -21.186  12.406   4.249
   22   3HD2  LEU   2          HD23      LEU   2 -22.883  12.048   4.569
   23    H    VAL   3           HN       VAL   3 -18.379  14.850   2.999
   24    HA   VAL   3           HA       VAL   3 -17.793  16.411   0.539
   25    HB   VAL   3           HB       VAL   3 -16.036  17.693   1.894
   26   1HG1  VAL   3          HG11      VAL   3 -17.636  19.402   2.546
   27   2HG1  VAL   3          HG12      VAL   3 -18.942  18.219   2.578
   28   3HG1  VAL   3          HG13      VAL   3 -18.187  18.659   1.046
   29   1HG2  VAL   3          HG21      VAL   3 -17.818  16.746   4.163
   30   2HG2  VAL   3          HG22      VAL   3 -16.518  17.928   4.301
   31   3HG2  VAL   3          HG23      VAL   3 -16.145  16.250   3.906
   32    H    LYS   4           HN       LYS   4 -15.883  15.791  -0.446
   33    HA   LYS   4           HA       LYS   4 -14.734  13.267   0.442
   34   1HB   LYS   4          HB2       LYS   4 -13.692  15.068  -1.758
   35   2HB   LYS   4          HB1       LYS   4 -13.476  13.325  -1.602
   36   1HG   LYS   4          HG2       LYS   4 -16.129  14.729  -2.047
   37   2HG   LYS   4          HG1       LYS   4 -15.206  13.876  -3.284
   38   1HD   LYS   4          HD2       LYS   4 -15.325  11.839  -1.687
   39   2HD   LYS   4          HD1       LYS   4 -16.602  12.734  -0.862
   40   1HE   LYS   4          HE2       LYS   4 -16.565  11.812  -3.745
   41   2HE   LYS   4          HE1       LYS   4 -17.692  11.335  -2.475
   42   1HZ   LYS   4          HZ1       LYS   4 -17.765  13.607  -4.188
   43   2HZ   LYS   4          HZ2       LYS   4 -17.828  14.069  -2.554
   44   3HZ   LYS   4          HZ3       LYS   4 -18.975  12.982  -3.177
   45    HA   PRO   5           HA       PRO   5 -11.521  15.273   2.821
   46   1HB   PRO   5          HB2       PRO   5  -9.817  13.220   3.222
   47   2HB   PRO   5          HB1       PRO   5 -11.425  13.248   3.971
   48   1HG   PRO   5          HG2       PRO   5 -10.539  11.844   1.482
   49   2HG   PRO   5          HG1       PRO   5 -11.494  11.216   2.838
   50   1HD   PRO   5          HD2       PRO   5 -12.660  12.073   0.528
   51   2HD   PRO   5          HD1       PRO   5 -13.455  12.244   2.110
   52    HA   PRO   6           HA       PRO   6  -8.345  16.396  -0.097
   53   1HB   PRO   6          HB2       PRO   6  -6.387  17.350   1.513
   54   2HB   PRO   6          HB1       PRO   6  -7.956  18.168   1.366
   55   1HG   PRO   6          HG2       PRO   6  -6.998  16.305   3.501
   56   2HG   PRO   6          HG1       PRO   6  -7.861  17.846   3.663
   57   1HD   PRO   6          HD2       PRO   6  -9.133  15.420   3.807
   58   2HD   PRO   6          HD1       PRO   6  -9.928  16.894   3.209
   59    H    TYR   7           HN       TYR   7  -7.876  13.754   2.003
   60    HA   TYR   7           HA       TYR   7  -5.103  13.184   1.480
   61   1HB   TYR   7          HB2       TYR   7  -7.264  11.124   1.983
   62   2HB   TYR   7          HB1       TYR   7  -5.548  10.992   2.355
   63    HD1  TYR   7           HD1      TYR   7  -8.581  11.375   3.888
   64    HD2  TYR   7           HD2      TYR   7  -4.737  13.292   3.763
   65    HE1  TYR   7           HE1      TYR   7  -9.013  12.377   6.107
   66    HE2  TYR   7           HE2      TYR   7  -5.164  14.287   5.992
   67    HH   TYR   7           HH       TYR   7  -6.936  13.395   8.097
   68    H    SER   8           HN       SER   8  -4.170  12.318  -0.323
   69    HA   SER   8           HA       SER   8  -5.753  11.987  -2.728
   70   1HB   SER   8          HB2       SER   8  -3.346  12.737  -2.691
   71   2HB   SER   8          HB1       SER   8  -2.896  11.095  -2.236
   72    HG   SER   8           HG       SER   8  -4.586  11.095  -4.341
   73    H    TYR   9           HN       TYR   9  -5.752   9.900  -3.987
   74    HA   TYR   9           HA       TYR   9  -6.792   7.756  -2.425
   75   1HB   TYR   9          HB2       TYR   9  -5.673   7.814  -5.243
   76   2HB   TYR   9          HB1       TYR   9  -6.464   6.400  -4.542
   77    HD1  TYR   9           HD1      TYR   9  -8.846   6.550  -3.788
   78    HD2  TYR   9           HD2      TYR   9  -6.942   9.711  -5.983
   79    HE1  TYR   9           HE1      TYR   9 -11.066   7.513  -4.318
   80    HE2  TYR   9           HE2      TYR   9  -9.163  10.677  -6.516
   81    HH   TYR   9           HH       TYR   9 -11.668   9.556  -6.678
   82    H    ILE  10           HN       ILE  10  -3.542   8.493  -3.569
   83    HA   ILE  10           HA       ILE  10  -2.366   5.952  -2.844
   84    HB   ILE  10           HB       ILE  10  -1.077   8.699  -3.007
   85   1HG1  ILE  10          HG12      ILE  10  -2.148   8.197  -5.125
   86   2HG1  ILE  10          HG11      ILE  10  -0.413   7.960  -5.309
   87   1HG2  ILE  10          HG21      ILE  10   0.437   7.256  -1.902
   88   2HG2  ILE  10          HG22      ILE  10   0.950   7.219  -3.588
   89   3HG2  ILE  10          HG23      ILE  10   0.009   5.884  -2.922
   90   1HD1  ILE  10          HD11      ILE  10  -0.954   5.465  -4.694
   91   2HD1  ILE  10          HD12      ILE  10  -1.284   6.044  -6.325
   92   3HD1  ILE  10          HD13      ILE  10  -2.598   5.900  -5.162
   93    H    ALA  11           HN       ALA  11  -2.815   9.054  -1.184
   94    HA   ALA  11           HA       ALA  11  -1.354   8.379   1.192
   95   1HB   ALA  11          HB1       ALA  11  -3.735  10.245   1.032
   96   2HB   ALA  11          HB2       ALA  11  -2.130  10.694   0.456
   97   3HB   ALA  11          HB3       ALA  11  -2.381  10.320   2.161
   98    H    LEU  12           HN       LEU  12  -4.813   8.073   0.361
   99    HA   LEU  12           HA       LEU  12  -5.678   7.124   2.908
  100   1HB   LEU  12          HB2       LEU  12  -6.707   6.563   0.110
  101   2HB   LEU  12          HB1       LEU  12  -7.544   6.044   1.569
  102    HG   LEU  12           HG       LEU  12  -6.789   8.932   1.027
  103   1HD1  LEU  12          HD11      LEU  12  -8.360   8.012  -0.697
  104   2HD1  LEU  12          HD12      LEU  12  -9.080   9.283   0.291
  105   3HD1  LEU  12          HD13      LEU  12  -9.477   7.592   0.600
  106   1HD2  LEU  12          HD21      LEU  12  -8.807   9.171   2.695
  107   2HD2  LEU  12          HD22      LEU  12  -7.223   8.750   3.331
  108   3HD2  LEU  12          HD23      LEU  12  -8.443   7.497   3.109
  109    H    ILE  13           HN       ILE  13  -4.324   5.451   0.094
  110    HA   ILE  13           HA       ILE  13  -4.588   2.794   1.200
  111    HB   ILE  13           HB       ILE  13  -2.753   3.946  -0.921
  112   1HG1  ILE  13          HG12      ILE  13  -5.185   2.155  -1.191
  113   2HG1  ILE  13          HG11      ILE  13  -5.256   3.910  -1.327
  114   1HG2  ILE  13          HG21      ILE  13  -1.660   1.975  -0.104
  115   2HG2  ILE  13          HG22      ILE  13  -2.502   1.492  -1.575
  116   3HG2  ILE  13          HG23      ILE  13  -3.185   1.094   0.002
  117   1HD1  ILE  13          HD11      ILE  13  -3.759   1.975  -3.108
  118   2HD1  ILE  13          HD12      ILE  13  -3.463   3.714  -3.134
  119   3HD1  ILE  13          HD13      ILE  13  -5.053   3.084  -3.563
  120    H    THR  14           HN       THR  14  -2.015   5.247   1.213
  121    HA   THR  14           HA       THR  14  -0.062   3.597   2.521
  122    HB   THR  14           HB       THR  14  -0.331   6.609   2.468
  123    HG1  THR  14           HG1      THR  14   0.254   6.343   0.491
  124   1HG2  THR  14          HG21      THR  14   1.188   6.152   4.203
  125   2HG2  THR  14          HG22      THR  14   2.228   6.371   2.798
  126   3HG2  THR  14          HG23      THR  14   1.858   4.747   3.374
  127    H    MET  15           HN       MET  15  -2.496   5.877   3.770
  128    HA   MET  15           HA       MET  15  -1.606   5.658   6.510
  129   1HB   MET  15          HB2       MET  15  -4.227   6.565   5.300
  130   2HB   MET  15          HB1       MET  15  -3.892   6.611   7.031
  131   1HG   MET  15          HG2       MET  15  -1.847   7.987   6.528
  132   2HG   MET  15          HG1       MET  15  -2.367   8.055   4.846
  133   1HE   MET  15          HE1       MET  15  -4.449   8.759   4.038
  134   2HE   MET  15          HE2       MET  15  -5.467  10.039   4.690
  135   3HE   MET  15          HE3       MET  15  -5.717   8.373   5.207
  136    H    ALA  16           HN       ALA  16  -3.998   3.938   4.564
  137    HA   ALA  16           HA       ALA  16  -5.286   2.493   6.629
  138   1HB   ALA  16          HB1       ALA  16  -4.648   1.711   3.772
  139   2HB   ALA  16          HB2       ALA  16  -6.143   2.432   4.368
  140   3HB   ALA  16          HB3       ALA  16  -5.716   0.782   4.825
  141    H    ILE  17           HN       ILE  17  -2.313   1.712   4.818
  142    HA   ILE  17           HA       ILE  17  -1.839  -0.841   5.990
  143    HB   ILE  17           HB       ILE  17   0.175   1.238   5.066
  144   1HG1  ILE  17          HG12      ILE  17  -0.999  -1.115   3.567
  145   2HG1  ILE  17          HG11      ILE  17  -1.621   0.527   3.434
  146   1HG2  ILE  17          HG21      ILE  17   0.381  -1.758   5.511
  147   2HG2  ILE  17          HG22      ILE  17   1.262  -0.501   6.381
  148   3HG2  ILE  17          HG23      ILE  17   1.600  -0.796   4.676
  149   1HD1  ILE  17          HD11      ILE  17   1.199  -0.374   2.774
  150   2HD1  ILE  17          HD12      ILE  17   0.635   1.297   2.717
  151   3HD1  ILE  17          HD13      ILE  17  -0.041   0.099   1.613
  152    H    GLN  18           HN       GLN  18  -0.736   2.398   6.941
  153    HA   GLN  18           HA       GLN  18   0.658   1.518   9.305
  154   1HB   GLN  18          HB2       GLN  18  -0.487   4.216   8.533
  155   2HB   GLN  18          HB1       GLN  18   0.510   3.950   9.962
  156   1HG   GLN  18          HG2       GLN  18   1.370   3.279   7.137
  157   2HG   GLN  18          HG1       GLN  18   1.813   4.763   7.980
  158   1HE2  GLN  18          HE21      GLN  18   3.132   1.881   7.190
  159   2HE2  GLN  18          HE22      GLN  18   4.123   1.610   8.541
  160    H    ASN  19           HN       ASN  19  -2.634   2.725   8.740
  161    HA   ASN  19           HA       ASN  19  -3.349   2.712  11.551
  162   1HB   ASN  19          HB2       ASN  19  -4.991   2.856   9.012
  163   2HB   ASN  19          HB1       ASN  19  -5.698   2.943  10.627
  164   1HD2  ASN  19          HD21      ASN  19  -4.588   4.896   8.155
  165   2HD2  ASN  19          HD22      ASN  19  -4.181   6.275   9.056
  166    H    ALA  20           HN       ALA  20  -3.018   0.243   9.218
  167    HA   ALA  20           HA       ALA  20  -5.090  -1.508  10.284
  168   1HB   ALA  20          HB1       ALA  20  -3.867  -3.243   8.877
  169   2HB   ALA  20          HB2       ALA  20  -2.741  -1.965   8.426
  170   3HB   ALA  20          HB3       ALA  20  -4.445  -1.833   7.990
  171    HA   PRO  21           HA       PRO  21  -2.757  -3.141  13.707
  172   1HB   PRO  21          HB2       PRO  21  -3.685  -5.742  13.785
  173   2HB   PRO  21          HB1       PRO  21  -4.616  -4.350  14.372
  174   1HG   PRO  21          HG2       PRO  21  -4.815  -5.786  11.761
  175   2HG   PRO  21          HG1       PRO  21  -6.106  -5.176  12.812
  176   1HD   PRO  21          HD2       PRO  21  -5.328  -3.833  10.588
  177   2HD   PRO  21          HD1       PRO  21  -5.880  -2.982  12.048
  178    H    GLU  22           HN       GLU  22  -2.923  -5.180  10.811
  179    HA   GLU  22           HA       GLU  22  -0.036  -5.912  11.189
  180   1HB   GLU  22          HB2       GLU  22  -0.577  -7.935   9.808
  181   2HB   GLU  22          HB1       GLU  22  -1.423  -7.912  11.354
  182   1HG   GLU  22          HG2       GLU  22  -3.405  -6.907  10.178
  183   2HG   GLU  22          HG1       GLU  22  -2.560  -7.154   8.649
  184    H    LYS  23           HN       LYS  23   1.281  -5.252   9.535
  185    HA   LYS  23           HA       LYS  23   0.229  -3.478   7.531
  186   1HB   LYS  23          HB2       LYS  23   2.951  -4.791   7.788
  187   2HB   LYS  23          HB1       LYS  23   2.567  -3.503   6.643
  188   1HG   LYS  23          HG2       LYS  23   1.921  -2.029   8.518
  189   2HG   LYS  23          HG1       LYS  23   2.312  -3.313   9.661
  190   1HD   LYS  23          HD2       LYS  23   4.654  -3.303   8.861
  191   2HD   LYS  23          HD1       LYS  23   4.255  -2.000   7.741
  192   1HE   LYS  23          HE2       LYS  23   3.894  -1.818  10.744
  193   2HE   LYS  23          HE1       LYS  23   5.300  -1.195   9.880
  194   1HZ   LYS  23          HZ1       LYS  23   3.837   0.604  10.101
  195   2HZ   LYS  23          HZ2       LYS  23   2.482  -0.319   9.659
  196   3HZ   LYS  23          HZ3       LYS  23   3.650   0.091   8.496
  197    H    LYS  24           HN       LYS  24   0.709  -6.911   7.612
  198    HA   LYS  24           HA       LYS  24   0.756  -7.214   4.700
  199   1HB   LYS  24          HB2       LYS  24   0.395  -9.192   6.967
  200   2HB   LYS  24          HB1       LYS  24   0.395  -9.662   5.266
  201   1HG   LYS  24          HG2       LYS  24   2.654  -8.697   5.002
  202   2HG   LYS  24          HG1       LYS  24   2.653  -8.238   6.706
  203   1HD   LYS  24          HD2       LYS  24   2.410 -10.611   7.347
  204   2HD   LYS  24          HD1       LYS  24   2.417 -11.069   5.645
  205   1HE   LYS  24          HE2       LYS  24   4.678 -10.208   5.370
  206   2HE   LYS  24          HE1       LYS  24   4.679  -9.598   7.025
  207   1HZ   LYS  24          HZ1       LYS  24   3.968 -12.283   7.133
  208   2HZ   LYS  24          HZ2       LYS  24   5.406 -11.564   7.684
  209   3HZ   LYS  24          HZ3       LYS  24   5.312 -12.180   6.103
  210    H    ILE  25           HN       ILE  25  -1.463  -5.678   5.830
  211    HA   ILE  25           HA       ILE  25  -3.876  -7.144   6.022
  212    HB   ILE  25           HB       ILE  25  -3.719  -4.747   6.561
  213   1HG1  ILE  25          HG12      ILE  25  -5.640  -5.127   4.251
  214   2HG1  ILE  25          HG11      ILE  25  -5.906  -5.838   5.844
  215   1HG2  ILE  25          HG21      ILE  25  -2.173  -4.156   4.694
  216   2HG2  ILE  25          HG22      ILE  25  -3.565  -3.077   4.786
  217   3HG2  ILE  25          HG23      ILE  25  -3.512  -4.344   3.561
  218   1HD1  ILE  25          HD11      ILE  25  -5.510  -2.878   5.313
  219   2HD1  ILE  25          HD12      ILE  25  -5.858  -3.619   6.874
  220   3HD1  ILE  25          HD13      ILE  25  -7.069  -3.654   5.593
  221    H    THR  26           HN       THR  26  -5.527  -7.540   4.401
  222    HA   THR  26           HA       THR  26  -4.388  -8.408   1.852
  223    HB   THR  26           HB       THR  26  -6.677  -9.236   1.397
  224    HG1  THR  26           HG1      THR  26  -7.601  -7.387   2.615
  225   1HG2  THR  26          HG21      THR  26  -5.500  -9.780   4.126
  226   2HG2  THR  26          HG22      THR  26  -5.320 -10.737   2.655
  227   3HG2  THR  26          HG23      THR  26  -6.871 -10.687   3.491
  228    H    LEU  27           HN       LEU  27  -5.395  -7.796  -0.230
  229    HA   LEU  27           HA       LEU  27  -5.372  -4.985  -0.653
  230   1HB   LEU  27          HB2       LEU  27  -4.952  -6.670  -2.424
  231   2HB   LEU  27          HB1       LEU  27  -6.631  -7.183  -2.332
  232    HG   LEU  27           HG       LEU  27  -7.360  -4.923  -3.061
  233   1HD1  LEU  27          HD11      LEU  27  -5.384  -3.509  -4.048
  234   2HD1  LEU  27          HD12      LEU  27  -4.388  -4.423  -2.918
  235   3HD1  LEU  27          HD13      LEU  27  -5.711  -3.420  -2.321
  236   1HD2  LEU  27          HD21      LEU  27  -6.754  -5.200  -5.348
  237   2HD2  LEU  27          HD22      LEU  27  -6.728  -6.825  -4.663
  238   3HD2  LEU  27          HD23      LEU  27  -5.217  -5.955  -4.928
  239    H    ASN  28           HN       ASN  28  -8.105  -7.281  -0.525
  240    HA   ASN  28           HA       ASN  28 -10.193  -5.370  -0.812
  241   1HB   ASN  28          HB2       ASN  28 -10.109  -8.061   0.572
  242   2HB   ASN  28          HB1       ASN  28 -11.593  -7.133   0.350
  243   1HD2  ASN  28          HD21      ASN  28 -11.910  -6.387  -2.078
  244   2HD2  ASN  28          HD22      ASN  28 -11.548  -7.552  -3.257
  245    H    GLY  29           HN       GLY  29  -8.523  -6.566   2.095
  246   1HA   GLY  29          HA2       GLY  29 -10.173  -5.403   4.057
  247   2HA   GLY  29          HA1       GLY  29  -8.434  -5.633   4.251
  248    H    ILE  30           HN       ILE  30  -7.602  -3.923   2.107
  249    HA   ILE  30           HA       ILE  30  -7.509  -1.414   3.444
  250    HB   ILE  30           HB       ILE  30  -7.057  -2.072   0.517
  251   1HG1  ILE  30          HG12      ILE  30  -5.057  -1.642   2.754
  252   2HG1  ILE  30          HG11      ILE  30  -5.625  -3.236   2.258
  253   1HG2  ILE  30          HG21      ILE  30  -5.676   0.055   0.609
  254   2HG2  ILE  30          HG22      ILE  30  -6.433   0.393   2.165
  255   3HG2  ILE  30          HG23      ILE  30  -7.420   0.304   0.706
  256   1HD1  ILE  30          HD11      ILE  30  -3.523  -2.719   1.115
  257   2HD1  ILE  30          HD12      ILE  30  -4.208  -1.217   0.493
  258   3HD1  ILE  30          HD13      ILE  30  -4.841  -2.769  -0.056
  259    H    TYR  31           HN       TYR  31  -9.599  -2.561   0.792
  260    HA   TYR  31           HA       TYR  31 -10.897  -0.075   0.270
  261   1HB   TYR  31          HB2       TYR  31 -11.807  -2.945  -0.007
  262   2HB   TYR  31          HB1       TYR  31 -12.844  -1.595  -0.470
  263    HD1  TYR  31           HD1      TYR  31  -9.354  -2.825  -0.928
  264    HD2  TYR  31           HD2      TYR  31 -12.676  -0.760  -2.665
  265    HE1  TYR  31           HE1      TYR  31  -8.119  -2.676  -3.070
  266    HE2  TYR  31           HE2      TYR  31 -11.446  -0.604  -4.810
  267    HH   TYR  31           HH       TYR  31  -9.669  -1.566  -5.986
  268    H    GLN  32           HN       GLN  32 -11.709  -2.655   2.588
  269    HA   GLN  32           HA       GLN  32 -14.132  -1.527   3.555
  270   1HB   GLN  32          HB2       GLN  32 -13.325  -3.839   4.053
  271   2HB   GLN  32          HB1       GLN  32 -12.110  -3.147   5.129
  272   1HG   GLN  32          HG2       GLN  32 -13.879  -2.122   6.493
  273   2HG   GLN  32          HG1       GLN  32 -15.106  -2.782   5.412
  274   1HE2  GLN  32          HE21      GLN  32 -12.180  -4.133   7.056
  275   2HE2  GLN  32          HE22      GLN  32 -12.979  -5.504   7.660
  276    H    PHE  33           HN       PHE  33 -10.768  -0.990   4.538
  277    HA   PHE  33           HA       PHE  33 -11.268   0.613   6.829
  278   1HB   PHE  33          HB2       PHE  33  -9.051  -0.291   6.243
  279   2HB   PHE  33          HB1       PHE  33  -8.987   0.764   4.835
  280    HD1  PHE  33           HD1      PHE  33  -8.640   3.165   5.067
  281    HD2  PHE  33           HD2      PHE  33  -8.823   0.608   8.513
  282    HE1  PHE  33           HE1      PHE  33  -7.686   4.980   6.462
  283    HE2  PHE  33           HE2      PHE  33  -7.872   2.424   9.910
  284    HZ   PHE  33           HZ       PHE  33  -7.301   4.609   8.883
  285    H    ILE  34           HN       ILE  34 -10.853   1.571   3.410
  286    HA   ILE  34           HA       ILE  34 -11.132   4.382   3.869
  287    HB   ILE  34           HB       ILE  34 -11.630   2.659   1.433
  288   1HG1  ILE  34          HG12      ILE  34  -9.419   4.656   1.955
  289   2HG1  ILE  34          HG11      ILE  34  -9.290   2.975   2.472
  290   1HG2  ILE  34          HG21      ILE  34 -11.793   5.655   1.800
  291   2HG2  ILE  34          HG22      ILE  34 -12.959   4.585   1.023
  292   3HG2  ILE  34          HG23      ILE  34 -11.423   4.935   0.233
  293   1HD1  ILE  34          HD11      ILE  34  -9.770   3.922  -0.366
  294   2HD1  ILE  34          HD12      ILE  34  -9.688   2.237   0.144
  295   3HD1  ILE  34          HD13      ILE  34  -8.261   3.266   0.264
  296    H    MET  35           HN       MET  35 -13.561   1.966   2.797
  297    HA   MET  35           HA       MET  35 -15.719   3.818   2.673
  298   1HB   MET  35          HB2       MET  35 -15.676   0.827   3.110
  299   2HB   MET  35          HB1       MET  35 -17.166   1.749   2.895
  300   1HG   MET  35          HG2       MET  35 -16.249   2.625   0.733
  301   2HG   MET  35          HG1       MET  35 -14.862   1.558   0.938
  302   1HE   MET  35          HE1       MET  35 -15.828  -1.201   1.963
  303   2HE   MET  35          HE2       MET  35 -14.731  -0.762   0.656
  304   3HE   MET  35          HE3       MET  35 -16.027  -1.919   0.359
  305    H    ASP  36           HN       ASP  36 -14.646   1.728   5.375
  306    HA   ASP  36           HA       ASP  36 -16.819   2.510   7.096
  307   1HB   ASP  36          HB2       ASP  36 -14.115   1.287   7.669
  308   2HB   ASP  36          HB1       ASP  36 -15.327   1.577   8.918
  309    H    ARG  37           HN       ARG  37 -13.489   3.745   6.726
  310    HA   ARG  37           HA       ARG  37 -13.687   5.567   8.956
  311   1HB   ARG  37          HB2       ARG  37 -11.897   5.572   6.509
  312   2HB   ARG  37          HB1       ARG  37 -11.698   6.663   7.878
  313   1HG   ARG  37          HG2       ARG  37 -11.800   3.676   8.291
  314   2HG   ARG  37          HG1       ARG  37 -10.301   4.469   7.830
  315   1HD   ARG  37          HD2       ARG  37 -10.578   5.998   9.815
  316   2HD   ARG  37          HD1       ARG  37 -11.947   5.003  10.319
  317    HE   ARG  37           HE       ARG  37  -9.935   3.157   9.989
  318   1HH1  ARG  37          HH21      ARG  37 -10.265   6.163  11.650
  319   2HH1  ARG  37          HH22      ARG  37  -9.187   5.721  12.931
  320   1HH2  ARG  37          HH11      ARG  37  -8.531   2.566  11.647
  321   2HH2  ARG  37          HH12      ARG  37  -8.201   3.685  12.928
  322    H    PHE  38           HN       PHE  38 -14.267   5.897   5.477
  323    HA   PHE  38           HA       PHE  38 -15.523   8.569   5.999
  324   1HB   PHE  38          HB2       PHE  38 -14.215   7.593   3.441
  325   2HB   PHE  38          HB1       PHE  38 -14.908   9.189   3.716
  326    HD1  PHE  38           HD1      PHE  38 -12.091   6.951   4.397
  327    HD2  PHE  38           HD2      PHE  38 -13.814  10.790   5.251
  328    HE1  PHE  38           HE1      PHE  38  -9.926   7.713   5.339
  329    HE2  PHE  38           HE2      PHE  38 -11.649  11.553   6.192
  330    HZ   PHE  38           HZ       PHE  38  -9.706  10.014   6.236
  331    HA   PRO  39           HA       PRO  39 -18.979   5.989   4.564
  332   1HB   PRO  39          HB2       PRO  39 -21.029   7.649   5.177
  333   2HB   PRO  39          HB1       PRO  39 -20.124   6.775   6.428
  334   1HG   PRO  39          HG2       PRO  39 -19.869   9.618   5.553
  335   2HG   PRO  39          HG1       PRO  39 -19.848   8.942   7.190
  336   1HD   PRO  39          HD2       PRO  39 -17.566   9.625   5.791
  337   2HD   PRO  39          HD1       PRO  39 -17.600   8.395   7.074
  338    H    PHE  40           HN       PHE  40 -17.935   8.963   3.280
  339    HA   PHE  40           HA       PHE  40 -19.978   9.539   1.381
  340   1HB   PHE  40          HB2       PHE  40 -17.088   9.919   0.643
  341   2HB   PHE  40          HB1       PHE  40 -18.451  11.017   0.428
  342    HD1  PHE  40           HD1      PHE  40 -19.614  10.959   3.194
  343    HD2  PHE  40           HD2      PHE  40 -15.540  11.224   1.856
  344    HE1  PHE  40           HE1      PHE  40 -18.998  12.116   5.298
  345    HE2  PHE  40           HE2      PHE  40 -14.927  12.388   3.959
  346    HZ   PHE  40           HZ       PHE  40 -16.655  12.831   5.682
  347    H    TYR  41           HN       TYR  41 -17.215   7.336   1.269
  348    HA   TYR  41           HA       TYR  41 -17.568   6.554  -1.476
  349   1HB   TYR  41          HB2       TYR  41 -16.159   5.196   0.830
  350   2HB   TYR  41          HB1       TYR  41 -16.037   4.686  -0.859
  351    HD1  TYR  41           HD1      TYR  41 -14.739   5.939  -2.454
  352    HD2  TYR  41           HD2      TYR  41 -15.400   7.455   1.499
  353    HE1  TYR  41           HE1      TYR  41 -13.073   7.724  -2.871
  354    HE2  TYR  41           HE2      TYR  41 -13.725   9.238   1.112
  355    HH   TYR  41           HH       TYR  41 -11.485   9.193  -1.138
  356    H    ARG  42           HN       ARG  42 -19.049   5.491   1.522
  357    HA   ARG  42           HA       ARG  42 -19.959   2.933   0.650
  358   1HB   ARG  42          HB2       ARG  42 -21.177   4.921   2.586
  359   2HB   ARG  42          HB1       ARG  42 -21.822   3.299   2.330
  360   1HG   ARG  42          HG2       ARG  42 -19.647   2.329   2.972
  361   2HG   ARG  42          HG1       ARG  42 -19.000   3.949   3.233
  362   1HD   ARG  42          HD2       ARG  42 -19.722   2.915   5.361
  363   2HD   ARG  42          HD1       ARG  42 -20.682   4.348   4.988
  364    HE   ARG  42           HE       ARG  42 -22.183   2.318   3.903
  365   1HH1  ARG  42          HH21      ARG  42 -20.651   2.855   6.947
  366   2HH1  ARG  42          HH22      ARG  42 -21.862   2.011   7.853
  367   1HH2  ARG  42          HH11      ARG  42 -23.775   1.220   5.075
  368   2HH2  ARG  42          HH12      ARG  42 -23.628   1.089   6.795
  369    H    GLU  43           HN       GLU  43 -21.165   6.192   0.066
  370    HA   GLU  43           HA       GLU  43 -23.513   5.128  -1.400
  371   1HB   GLU  43          HB2       GLU  43 -22.615   7.959  -0.792
  372   2HB   GLU  43          HB1       GLU  43 -24.082   7.550  -1.681
  373   1HG   GLU  43          HG2       GLU  43 -24.910   6.276   0.264
  374   2HG   GLU  43          HG1       GLU  43 -23.445   6.687   1.156
  375    H    ASN  44           HN       ASN  44 -20.421   5.266  -2.147
  376    HA   ASN  44           HA       ASN  44 -20.960   5.916  -5.014
  377   1HB   ASN  44          HB2       ASN  44 -19.812   7.852  -3.784
  378   2HB   ASN  44          HB1       ASN  44 -18.417   6.782  -3.627
  379   1HD2  ASN  44          HD21      ASN  44 -17.225   8.307  -5.074
  380   2HD2  ASN  44          HD22      ASN  44 -17.483   8.243  -6.751
  381    H    LYS  45           HN       LYS  45 -20.315   4.267  -6.257
  382    HA   LYS  45           HA       LYS  45 -18.138   2.436  -5.296
  383   1HB   LYS  45          HB2       LYS  45 -20.647   1.803  -6.883
  384   2HB   LYS  45          HB1       LYS  45 -19.391   0.643  -6.461
  385   1HG   LYS  45          HG2       LYS  45 -19.820   1.040  -4.063
  386   2HG   LYS  45          HG1       LYS  45 -21.083   2.198  -4.483
  387   1HD   LYS  45          HD2       LYS  45 -22.332   0.425  -5.649
  388   2HD   LYS  45          HD1       LYS  45 -21.075  -0.741  -5.235
  389   1HE   LYS  45          HE2       LYS  45 -21.542  -0.539  -2.891
  390   2HE   LYS  45          HE1       LYS  45 -22.580   0.862  -3.154
  391   1HZ   LYS  45          HZ1       LYS  45 -23.881  -1.143  -2.824
  392   2HZ   LYS  45          HZ2       LYS  45 -23.100  -1.894  -4.134
  393   3HZ   LYS  45          HZ3       LYS  45 -24.101  -0.546  -4.397
  394    H    GLN  46           HN       GLN  46 -18.529   4.847  -7.261
  395    HA   GLN  46           HA       GLN  46 -18.165   3.932  -9.911
  396   1HB   GLN  46          HB2       GLN  46 -17.265   6.485  -8.561
  397   2HB   GLN  46          HB1       GLN  46 -17.181   6.216 -10.302
  398   1HG   GLN  46          HG2       GLN  46 -19.740   5.904  -8.719
  399   2HG   GLN  46          HG1       GLN  46 -19.272   7.421  -9.488
  400   1HE2  GLN  46          HE21      GLN  46 -21.271   4.904 -10.039
  401   2HE2  GLN  46          HE22      GLN  46 -21.172   4.789 -11.729
  402    H    GLY  47           HN       GLY  47 -15.968   5.025 -10.969
  403   1HA   GLY  47          HA2       GLY  47 -14.026   3.060 -10.901
  404   2HA   GLY  47          HA1       GLY  47 -13.691   4.719 -11.383
  405    H    TRP  48           HN       TRP  48 -14.638   5.190  -8.303
  406    HA   TRP  48           HA       TRP  48 -11.971   5.607  -7.380
  407   1HB   TRP  48          HB2       TRP  48 -12.890   6.302  -5.355
  408   2HB   TRP  48          HB1       TRP  48 -14.238   6.550  -6.454
  409    HD1  TRP  48           HD1      TRP  48 -16.423   5.283  -5.960
  410    HE1  TRP  48           HE1      TRP  48 -17.164   3.584  -4.172
  411    HE3  TRP  48           HE3      TRP  48 -11.901   4.192  -3.855
  412    HZ2  TRP  48           HZ2      TRP  48 -15.992   1.980  -2.102
  413    HZ3  TRP  48           HZ3      TRP  48 -11.746   2.582  -1.979
  414    HH2  TRP  48           HH2      TRP  48 -13.777   1.474  -1.109
  415    H    GLN  49           HN       GLN  49 -14.052   2.826  -7.380
  416    HA   GLN  49           HA       GLN  49 -12.588   1.288  -5.432
  417   1HB   GLN  49          HB2       GLN  49 -14.586   0.641  -7.595
  418   2HB   GLN  49          HB1       GLN  49 -13.774  -0.659  -6.720
  419   1HG   GLN  49          HG2       GLN  49 -14.558   0.288  -4.581
  420   2HG   GLN  49          HG1       GLN  49 -15.376   1.585  -5.453
  421   1HE2  GLN  49          HE21      GLN  49 -15.973  -0.567  -7.651
  422   2HE2  GLN  49          HE22      GLN  49 -17.324  -1.385  -7.029
  423    H    ASN  50           HN       ASN  50 -12.649   0.981  -9.016
  424    HA   ASN  50           HA       ASN  50 -10.484  -0.866  -9.148
  425   1HB   ASN  50          HB2       ASN  50 -11.541   1.120 -11.173
  426   2HB   ASN  50          HB1       ASN  50 -10.295  -0.070 -11.546
  427   1HD2  ASN  50          HD21      ASN  50 -12.049  -1.694  -9.323
  428   2HD2  ASN  50          HD22      ASN  50 -13.205  -2.434 -10.319
  429    H    SER  51           HN       SER  51 -10.485   2.684  -9.287
  430    HA   SER  51           HA       SER  51  -7.793   3.076 -10.026
  431   1HB   SER  51          HB2       SER  51  -9.504   4.875  -9.839
  432   2HB   SER  51          HB1       SER  51  -9.402   4.755  -8.085
  433    HG   SER  51           HG       SER  51  -7.926   6.228  -9.612
  434    H    ILE  52           HN       ILE  52  -9.140   2.240  -6.866
  435    HA   ILE  52           HA       ILE  52  -6.856   2.880  -5.300
  436    HB   ILE  52           HB       ILE  52  -9.048   0.831  -4.957
  437   1HG1  ILE  52          HG12      ILE  52  -9.377   3.432  -4.855
  438   2HG1  ILE  52          HG11      ILE  52 -10.110   2.420  -3.619
  439   1HG2  ILE  52          HG21      ILE  52  -8.237   0.867  -2.500
  440   2HG2  ILE  52          HG22      ILE  52  -6.713   1.462  -3.159
  441   3HG2  ILE  52          HG23      ILE  52  -7.334  -0.114  -3.653
  442   1HD1  ILE  52          HD11      ILE  52  -7.409   3.763  -3.284
  443   2HD1  ILE  52          HD12      ILE  52  -8.367   2.960  -2.044
  444   3HD1  ILE  52          HD13      ILE  52  -8.926   4.474  -2.744
  445    H    ARG  53           HN       ARG  53  -7.768  -0.383  -6.535
  446    HA   ARG  53           HA       ARG  53  -5.078  -1.345  -5.860
  447   1HB   ARG  53          HB2       ARG  53  -5.878  -3.510  -6.716
  448   2HB   ARG  53          HB1       ARG  53  -7.010  -2.817  -5.556
  449   1HG   ARG  53          HG2       ARG  53  -8.329  -1.900  -7.482
  450   2HG   ARG  53          HG1       ARG  53  -7.254  -2.769  -8.574
  451   1HD   ARG  53          HD2       ARG  53  -8.652  -4.244  -6.340
  452   2HD   ARG  53          HD1       ARG  53  -9.492  -3.906  -7.855
  453    HE   ARG  53           HE       ARG  53  -7.058  -5.016  -8.636
  454   1HH1  ARG  53          HH21      ARG  53  -9.704  -5.873  -6.596
  455   2HH1  ARG  53          HH22      ARG  53  -9.503  -7.577  -6.830
  456   1HH2  ARG  53          HH11      ARG  53  -6.779  -7.235  -8.949
  457   2HH2  ARG  53          HH12      ARG  53  -7.844  -8.348  -8.159
  458    H    HIS  54           HN       HIS  54  -6.772  -0.267  -8.737
  459    HA   HIS  54           HA       HIS  54  -5.028  -1.373 -10.697
  460   1HB   HIS  54          HB2       HIS  54  -7.159  -0.270 -11.278
  461   2HB   HIS  54          HB1       HIS  54  -6.492   1.282 -10.766
  462    HD1  HIS  54           HD1      HIS  54  -5.452  -1.521 -13.152
  463    HD2  HIS  54           HD2      HIS  54  -5.372   2.639 -12.887
  464    HE1  HIS  54           HE1      HIS  54  -4.419  -0.687 -15.307
  465    H    ASN  55           HN       ASN  55  -4.807   1.618  -8.795
  466    HA   ASN  55           HA       ASN  55  -2.465   2.617 -10.139
  467   1HB   ASN  55          HB2       ASN  55  -3.656   3.196  -7.416
  468   2HB   ASN  55          HB1       ASN  55  -2.256   4.053  -8.062
  469   1HD2  ASN  55          HD21      ASN  55  -2.984   4.326 -10.773
  470   2HD2  ASN  55          HD22      ASN  55  -4.378   5.287 -10.887
  471    H    LEU  56           HN       LEU  56  -2.909   0.246  -7.602
  472    HA   LEU  56           HA       LEU  56  -0.321   0.406  -6.419
  473   1HB   LEU  56          HB2       LEU  56  -2.183  -1.947  -6.800
  474   2HB   LEU  56          HB1       LEU  56  -0.695  -2.037  -5.860
  475    HG   LEU  56           HG       LEU  56  -2.950  -0.077  -5.325
  476   1HD1  LEU  56          HD11      LEU  56  -3.720  -1.493  -3.611
  477   2HD1  LEU  56          HD12      LEU  56  -2.233  -2.439  -3.590
  478   3HD1  LEU  56          HD13      LEU  56  -3.371  -2.618  -4.923
  479   1HD2  LEU  56          HD21      LEU  56  -1.111   0.940  -4.334
  480   2HD2  LEU  56          HD22      LEU  56  -0.259  -0.583  -4.084
  481   3HD2  LEU  56          HD23      LEU  56  -1.589  -0.129  -3.021
  482    H    SER  57           HN       SER  57  -1.474  -1.336  -9.292
  483    HA   SER  57           HA       SER  57   0.916  -2.791  -9.818
  484   1HB   SER  57          HB2       SER  57  -1.200  -3.253 -10.986
  485   2HB   SER  57          HB1       SER  57  -1.115  -1.682 -11.780
  486    HG   SER  57           HG       SER  57   0.675  -2.354 -12.889
  487    H    LEU  58           HN       LEU  58  -0.118   0.423 -11.027
  488    HA   LEU  58           HA       LEU  58   2.320   0.862 -12.503
  489   1HB   LEU  58          HB2       LEU  58   0.176   2.728 -11.470
  490   2HB   LEU  58          HB1       LEU  58   1.584   3.311 -12.355
  491    HG   LEU  58           HG       LEU  58   0.989   1.719 -14.215
  492   1HD1  LEU  58          HD11      LEU  58  -1.506   1.019 -14.136
  493   2HD1  LEU  58          HD12      LEU  58  -1.380   1.270 -12.396
  494   3HD1  LEU  58          HD13      LEU  58  -0.360   0.072 -13.192
  495   1HD2  LEU  58          HD21      LEU  58  -0.648   3.169 -15.165
  496   2HD2  LEU  58          HD22      LEU  58   0.291   4.186 -14.075
  497   3HD2  LEU  58          HD23      LEU  58  -1.297   3.596 -13.583
  498    H    ASN  59           HN       ASN  59   1.265   1.723  -9.220
  499    HA   ASN  59           HA       ASN  59   3.773   3.124  -8.655
  500   1HB   ASN  59          HB2       ASN  59   1.452   2.250  -6.916
  501   2HB   ASN  59          HB1       ASN  59   2.872   3.080  -6.278
  502   1HD2  ASN  59          HD21      ASN  59   0.013   4.071  -6.502
  503   2HD2  ASN  59          HD22      ASN  59   0.119   5.511  -7.394
  504    H    GLU  60           HN       GLU  60   5.596   1.966  -8.434
  505    HA   GLU  60           HA       GLU  60   5.508  -0.849  -7.540
  506   1HB   GLU  60          HB2       GLU  60   7.819   0.915  -8.414
  507   2HB   GLU  60          HB1       GLU  60   7.907  -0.824  -8.128
  508   1HG   GLU  60          HG2       GLU  60   6.240  -1.207  -9.903
  509   2HG   GLU  60          HG1       GLU  60   6.142   0.529 -10.195
  510    H    CYS  61           HN       CYS  61   5.486   2.062  -6.058
  511    HA   CYS  61           HA       CYS  61   7.544   1.946  -4.101
  512   1HB   CYS  61          HB2       CYS  61   4.758   3.136  -4.015
  513   2HB   CYS  61          HB1       CYS  61   5.948   3.365  -2.734
  514    HG   CYS  61           HG       CYS  61   5.965   4.781  -5.426
  515    H    PHE  62           HN       PHE  62   4.333   0.456  -4.222
  516    HA   PHE  62           HA       PHE  62   4.510  -0.589  -1.502
  517   1HB   PHE  62          HB2       PHE  62   2.661  -1.395  -3.770
  518   2HB   PHE  62          HB1       PHE  62   2.452  -1.790  -2.064
  519    HD1  PHE  62           HD1      PHE  62   2.224   0.830  -4.611
  520    HD2  PHE  62           HD2      PHE  62   1.873  -0.042  -0.421
  521    HE1  PHE  62           HE1      PHE  62   1.048   2.984  -4.263
  522    HE2  PHE  62           HE2      PHE  62   0.697   2.114  -0.071
  523    HZ   PHE  62           HZ       PHE  62   0.283   3.627  -1.993
  524    H    VAL  63           HN       VAL  63   4.509  -2.947  -1.059
  525    HA   VAL  63           HA       VAL  63   6.214  -4.466  -3.013
  526    HB   VAL  63           HB       VAL  63   6.094  -4.730   0.003
  527   1HG1  VAL  63          HG11      VAL  63   8.252  -6.028  -0.478
  528   2HG1  VAL  63          HG12      VAL  63   7.732  -6.053  -2.162
  529   3HG1  VAL  63          HG13      VAL  63   6.741  -6.820  -0.921
  530   1HG2  VAL  63          HG21      VAL  63   7.106  -2.580  -0.865
  531   2HG2  VAL  63          HG22      VAL  63   8.306  -3.561  -1.707
  532   3HG2  VAL  63          HG23      VAL  63   8.212  -3.595   0.053
  533    H    LYS  64           HN       LYS  64   5.345  -6.357  -3.748
  534    HA   LYS  64           HA       LYS  64   2.726  -7.214  -2.694
  535   1HB   LYS  64          HB2       LYS  64   4.440  -8.201  -4.991
  536   2HB   LYS  64          HB1       LYS  64   2.889  -8.914  -4.549
  537   1HG   LYS  64          HG2       LYS  64   1.775  -6.752  -4.901
  538   2HG   LYS  64          HG1       LYS  64   3.323  -6.024  -5.344
  539   1HD   LYS  64          HD2       LYS  64   3.540  -7.504  -7.252
  540   2HD   LYS  64          HD1       LYS  64   2.100  -8.402  -6.773
  541   1HE   LYS  64          HE2       LYS  64   1.878  -6.567  -8.617
  542   2HE   LYS  64          HE1       LYS  64   0.657  -6.650  -7.347
  543   1HZ   LYS  64          HZ1       LYS  64   1.372  -4.391  -7.612
  544   2HZ   LYS  64          HZ2       LYS  64   3.004  -4.831  -7.435
  545   3HZ   LYS  64          HZ3       LYS  64   1.938  -4.963  -6.118
  546    H    VAL  65           HN       VAL  65   2.500  -8.818  -1.223
  547    HA   VAL  65           HA       VAL  65   4.650 -10.883  -0.958
  548    HB   VAL  65           HB       VAL  65   3.928 -10.766   1.597
  549   1HG1  VAL  65          HG11      VAL  65   5.736  -9.023   1.954
  550   2HG1  VAL  65          HG12      VAL  65   5.801  -8.840   0.200
  551   3HG1  VAL  65          HG13      VAL  65   6.207 -10.388   0.942
  552   1HG2  VAL  65          HG21      VAL  65   3.584  -7.865   0.829
  553   2HG2  VAL  65          HG22      VAL  65   3.203  -8.650   2.362
  554   3HG2  VAL  65          HG23      VAL  65   2.204  -8.954   0.945
  555    HA   PRO  66           HA       PRO  66   0.332 -12.560  -1.863
  556   1HB   PRO  66          HB2       PRO  66   2.269 -14.684  -2.753
  557   2HB   PRO  66          HB1       PRO  66   0.742 -14.170  -3.502
  558   1HG   PRO  66          HG2       PRO  66   3.071 -13.374  -4.492
  559   2HG   PRO  66          HG1       PRO  66   1.685 -12.271  -4.430
  560   1HD   PRO  66          HD2       PRO  66   4.150 -12.282  -2.744
  561   2HD   PRO  66          HD1       PRO  66   3.114 -10.917  -3.216
  562    H    ARG  67           HN       ARG  67  -0.394 -14.929  -1.218
  563    HA   ARG  67           HA       ARG  67   0.294 -15.270   1.591
  564   1HB   ARG  67          HB2       ARG  67  -1.322 -17.128  -0.182
  565   2HB   ARG  67          HB1       ARG  67  -1.327 -17.078   1.580
  566   1HG   ARG  67          HG2       ARG  67  -2.028 -14.567   1.240
  567   2HG   ARG  67          HG1       ARG  67  -2.488 -15.103  -0.373
  568   1HD   ARG  67          HD2       ARG  67  -3.974 -16.803   0.588
  569   2HD   ARG  67          HD1       ARG  67  -3.464 -16.357   2.212
  570    HE   ARG  67           HE       ARG  67  -4.410 -13.995   0.991
  571   1HH1  ARG  67          HH21      ARG  67  -5.559 -17.127   1.864
  572   2HH1  ARG  67          HH22      ARG  67  -7.203 -16.615   2.050
  573   1HH2  ARG  67          HH11      ARG  67  -6.543 -13.309   1.236
  574   2HH2  ARG  67          HH12      ARG  67  -7.760 -14.453   1.694
  575    H    ASP  68           HN       ASP  68   1.122 -17.374   2.452
  576    HA   ASP  68           HA       ASP  68   3.553 -18.136   1.207
  577   1HB   ASP  68          HB2       ASP  68   2.732 -18.528   3.654
  578   2HB   ASP  68          HB1       ASP  68   2.039 -20.019   3.016
  579    H    ASP  69           HN       ASP  69   4.034 -20.427   0.431
  580    HA   ASP  69           HA       ASP  69   2.316 -21.037  -1.801
  581   1HB   ASP  69          HB2       ASP  69   4.641 -22.517  -0.552
  582   2HB   ASP  69          HB1       ASP  69   3.798 -23.100  -1.987
  583    H    LYS  70           HN       LYS  70   2.470 -22.171   1.495
  584    HA   LYS  70           HA       LYS  70   1.098 -24.649   1.192
  585   1HB   LYS  70          HB2       LYS  70   1.148 -22.662   3.477
  586   2HB   LYS  70          HB1       LYS  70   0.368 -24.241   3.586
  587   1HG   LYS  70          HG2       LYS  70   2.510 -25.337   3.028
  588   2HG   LYS  70          HG1       LYS  70   3.289 -23.757   2.928
  589   1HD   LYS  70          HD2       LYS  70   2.731 -23.327   5.293
  590   2HD   LYS  70          HD1       LYS  70   1.954 -24.906   5.397
  591   1HE   LYS  70          HE2       LYS  70   4.002 -26.060   5.132
  592   2HE   LYS  70          HE1       LYS  70   4.831 -24.628   4.524
  593   1HZ   LYS  70          HZ1       LYS  70   5.464 -24.239   6.596
  594   2HZ   LYS  70          HZ2       LYS  70   4.494 -25.497   7.199
  595   3HZ   LYS  70          HZ3       LYS  70   3.844 -23.940   7.003
  596    H    LYS  71           HN       LYS  71  -0.135 -21.326   1.538
  597    HA   LYS  71           HA       LYS  71  -2.905 -22.224   1.545
  598   1HB   LYS  71          HB2       LYS  71  -1.734 -19.462   1.123
  599   2HB   LYS  71          HB1       LYS  71  -3.441 -19.813   1.396
  600   1HG   LYS  71          HG2       LYS  71  -1.187 -20.453   3.325
  601   2HG   LYS  71          HG1       LYS  71  -2.310 -19.103   3.480
  602   1HD   LYS  71          HD2       LYS  71  -4.137 -21.039   3.290
  603   2HD   LYS  71          HD1       LYS  71  -2.805 -22.042   3.863
  604   1HE   LYS  71          HE2       LYS  71  -4.163 -19.741   5.247
  605   2HE   LYS  71          HE1       LYS  71  -3.823 -21.358   5.861
  606   1HZ   LYS  71          HZ1       LYS  71  -1.386 -20.680   5.553
  607   2HZ   LYS  71          HZ2       LYS  71  -2.235 -20.047   6.881
  608   3HZ   LYS  71          HZ3       LYS  71  -1.974 -19.090   5.503
  609    HA   PRO  72           HA       PRO  72  -3.446 -22.839  -2.859
  610   1HB   PRO  72          HB2       PRO  72  -5.935 -21.208  -2.469
  611   2HB   PRO  72          HB1       PRO  72  -5.728 -22.754  -3.315
  612   1HG   PRO  72          HG2       PRO  72  -6.785 -22.622  -0.861
  613   2HG   PRO  72          HG1       PRO  72  -5.764 -23.977  -1.369
  614   1HD   PRO  72          HD2       PRO  72  -5.134 -21.774   0.527
  615   2HD   PRO  72          HD1       PRO  72  -4.430 -23.401   0.402
  616    H    GLY  73           HN       GLY  73  -3.162 -19.815  -1.388
  617   1HA   GLY  73          HA2       GLY  73  -2.060 -17.903  -2.301
  618   2HA   GLY  73          HA1       GLY  73  -2.227 -18.604  -3.910
  619    H    LYS  74           HN       LYS  74  -4.628 -17.789  -1.378
  620    HA   LYS  74           HA       LYS  74  -6.386 -16.634  -3.441
  621   1HB   LYS  74          HB2       LYS  74  -6.670 -16.990  -0.450
  622   2HB   LYS  74          HB1       LYS  74  -7.901 -16.226  -1.453
  623   1HG   LYS  74          HG2       LYS  74  -8.054 -18.273  -2.826
  624   2HG   LYS  74          HG1       LYS  74  -6.829 -19.039  -1.815
  625   1HD   LYS  74          HD2       LYS  74  -8.295 -18.790   0.156
  626   2HD   LYS  74          HD1       LYS  74  -9.522 -18.028  -0.856
  627   1HE   LYS  74          HE2       LYS  74  -9.834 -20.038  -2.137
  628   2HE   LYS  74          HE1       LYS  74  -8.430 -20.800  -1.391
  629   1HZ   LYS  74          HZ1       LYS  74  -9.652 -21.453   0.323
  630   2HZ   LYS  74          HZ2       LYS  74 -11.032 -20.957  -0.535
  631   3HZ   LYS  74          HZ3       LYS  74 -10.287 -19.899   0.566
  632    H    GLY  75           HN       GLY  75  -6.906 -14.432  -3.604
  633   1HA   GLY  75          HA2       GLY  75  -6.368 -12.140  -3.548
  634   2HA   GLY  75          HA1       GLY  75  -6.418 -12.371  -1.800
  635    H    SER  76           HN       SER  76  -4.678 -10.712  -1.803
  636    HA   SER  76           HA       SER  76  -2.049 -12.016  -1.765
  637   1HB   SER  76          HB2       SER  76  -1.073 -10.120  -3.198
  638   2HB   SER  76          HB1       SER  76  -1.978 -11.361  -4.059
  639    HG   SER  76           HG       SER  76  -2.623  -9.265  -4.679
  640    H    TYR  77           HN       TYR  77  -0.929 -11.171  -0.057
  641    HA   TYR  77           HA       TYR  77  -2.090  -8.916   1.419
  642   1HB   TYR  77          HB2       TYR  77   0.531 -10.332   1.958
  643   2HB   TYR  77          HB1       TYR  77  -0.411  -9.369   3.085
  644    HD1  TYR  77           HD1      TYR  77  -3.088 -10.897   1.693
  645    HD2  TYR  77           HD2      TYR  77   0.485 -12.025   3.821
  646    HE1  TYR  77           HE1      TYR  77  -4.204 -12.944   2.490
  647    HE2  TYR  77           HE2      TYR  77  -0.649 -14.078   4.610
  648    HH   TYR  77           HH       TYR  77  -4.063 -14.595   4.146
  649    H    TRP  78           HN       TRP  78  -0.782  -7.014   2.011
  650    HA   TRP  78           HA       TRP  78   1.350  -6.334   0.019
  651   1HB   TRP  78          HB2       TRP  78  -1.053  -4.654   0.794
  652   2HB   TRP  78          HB1       TRP  78   0.333  -4.038  -0.107
  653    HD1  TRP  78           HD1      TRP  78  -2.278  -6.878  -0.376
  654    HE1  TRP  78           HE1      TRP  78  -2.740  -7.306  -2.880
  655    HE3  TRP  78           HE3      TRP  78   1.014  -3.579  -2.458
  656    HZ2  TRP  78           HZ2      TRP  78  -1.827  -6.366  -5.430
  657    HZ3  TRP  78           HZ3      TRP  78   1.187  -3.353  -4.917
  658    HH2  TRP  78           HH2      TRP  78  -0.234  -4.733  -6.404
  659    H    THR  79           HN       THR  79   3.013  -5.059   0.860
  660    HA   THR  79           HA       THR  79   2.719  -3.881   3.554
  661    HB   THR  79           HB       THR  79   3.478  -6.298   3.832
  662    HG1  THR  79           HG1      THR  79   5.028  -4.090   4.656
  663   1HG2  THR  79          HG21      THR  79   5.622  -6.969   3.131
  664   2HG2  THR  79          HG22      THR  79   6.144  -5.311   2.836
  665   3HG2  THR  79          HG23      THR  79   5.002  -6.084   1.737
  666    H    LEU  80           HN       LEU  80   4.742  -2.590   4.102
  667    HA   LEU  80           HA       LEU  80   5.778  -1.321   1.603
  668   1HB   LEU  80          HB2       LEU  80   5.805  -0.362   4.480
  669   2HB   LEU  80          HB1       LEU  80   6.340   0.569   3.084
  670    HG   LEU  80           HG       LEU  80   3.540  -0.555   3.332
  671   1HD1  LEU  80          HD11      LEU  80   3.734   0.940   5.178
  672   2HD1  LEU  80          HD12      LEU  80   2.961   1.875   3.900
  673   3HD1  LEU  80          HD13      LEU  80   4.676   2.096   4.238
  674   1HD2  LEU  80          HD21      LEU  80   3.962   0.008   1.071
  675   2HD2  LEU  80          HD22      LEU  80   4.909   1.430   1.507
  676   3HD2  LEU  80          HD23      LEU  80   3.160   1.438   1.713
  677    H    ASP  81           HN       ASP  81   7.807  -1.899   0.994
  678    HA   ASP  81           HA       ASP  81  10.022  -1.857   2.819
  679   1HB   ASP  81          HB2       ASP  81   8.945  -4.066   3.433
  680   2HB   ASP  81          HB1       ASP  81   9.331  -4.622   1.806
  681    HA   PRO  82           HA       PRO  82  10.817  -1.331  -1.757
  682   1HB   PRO  82          HB2       PRO  82  12.477   0.908  -0.694
  683   2HB   PRO  82          HB1       PRO  82  11.294   0.912  -2.014
  684   1HG   PRO  82          HG2       PRO  82  10.755   2.052   0.337
  685   2HG   PRO  82          HG1       PRO  82   9.503   1.202  -0.585
  686   1HD   PRO  82          HD2       PRO  82  11.028   0.260   1.828
  687   2HD   PRO  82          HD1       PRO  82   9.311   0.027   1.422
  688    H    ASP  83           HN       ASP  83  13.587  -0.108  -1.910
  689    HA   ASP  83           HA       ASP  83  15.075  -2.631  -1.500
  690   1HB   ASP  83          HB2       ASP  83  15.938   0.011  -2.723
  691   2HB   ASP  83          HB1       ASP  83  16.905  -1.465  -2.695
  692    H    SER  84           HN       SER  84  14.289  -1.461   0.908
  693    HA   SER  84           HA       SER  84  16.197   0.330   2.045
  694   1HB   SER  84          HB2       SER  84  14.185  -1.608   3.123
  695   2HB   SER  84          HB1       SER  84  15.375  -0.939   4.238
  696    HG   SER  84           HG       SER  84  13.306   0.298   2.841
  697    H    TYR  85           HN       TYR  85  18.108  -0.790   0.950
  698    HA   TYR  85           HA       TYR  85  19.061  -3.333   1.807
  699   1HB   TYR  85          HB2       TYR  85  19.935  -2.108  -0.168
  700   2HB   TYR  85          HB1       TYR  85  20.672  -0.924   0.912
  701    HD1  TYR  85           HD1      TYR  85  22.745  -1.371   2.003
  702    HD2  TYR  85           HD2      TYR  85  20.634  -4.519  -0.015
  703    HE1  TYR  85           HE1      TYR  85  24.706  -2.864   2.288
  704    HE2  TYR  85           HE2      TYR  85  22.595  -6.016   0.269
  705    HH   TYR  85           HH       TYR  85  24.630  -6.236   1.128
  706    H    ASN  86           HN       ASN  86  19.716  -0.061   3.052
  707    HA   ASN  86           HA       ASN  86  20.521  -1.280   5.656
  708   1HB   ASN  86          HB2       ASN  86  22.556  -0.713   4.243
  709   2HB   ASN  86          HB1       ASN  86  22.049   0.974   4.338
  710   1HD2  ASN  86          HD21      ASN  86  24.389   0.845   5.489
  711   2HD2  ASN  86          HD22      ASN  86  24.331   0.669   7.176
  712    H    MET  87           HN       MET  87  18.122   0.120   4.660
  713    HA   MET  87           HA       MET  87  18.241   2.783   5.922
  714   1HB   MET  87          HB2       MET  87  15.888   1.334   4.675
  715   2HB   MET  87          HB1       MET  87  15.963   3.048   5.087
  716   1HG   MET  87          HG2       MET  87  17.790   1.666   3.102
  717   2HG   MET  87          HG1       MET  87  16.386   2.640   2.664
  718   1HE   MET  87          HE1       MET  87  20.132   2.763   2.904
  719   2HE   MET  87          HE2       MET  87  20.086   4.336   2.111
  720   3HE   MET  87          HE3       MET  87  19.068   3.025   1.516
  721    H    PHE  88           HN       PHE  88  17.970  -0.236   7.099
  722    HA   PHE  88           HA       PHE  88  15.694   0.022   8.863
  723   1HB   PHE  88          HB2       PHE  88  16.540  -1.953   9.977
  724   2HB   PHE  88          HB1       PHE  88  16.747  -2.168   8.240
  725    HD1  PHE  88           HD1      PHE  88  18.963  -2.083   7.210
  726    HD2  PHE  88           HD2      PHE  88  18.457  -1.580  11.445
  727    HE1  PHE  88           HE1      PHE  88  21.395  -2.437   7.542
  728    HE2  PHE  88           HE2      PHE  88  20.889  -1.934  11.778
  729    HZ   PHE  88           HZ       PHE  88  22.358  -2.364   9.825
  730    H    GLU  89           HN       GLU  89  18.912   1.268   8.916
  731    HA   GLU  89           HA       GLU  89  19.292   1.569  11.721
  732   1HB   GLU  89          HB2       GLU  89  20.236   3.240   9.386
  733   2HB   GLU  89          HB1       GLU  89  20.769   3.514  11.045
  734   1HG   GLU  89          HG2       GLU  89  21.627   1.204  11.154
  735   2HG   GLU  89          HG1       GLU  89  21.100   0.929   9.492
  736    H    ASN  90           HN       ASN  90  17.664   3.561   9.361
  737    HA   ASN  90           HA       ASN  90  16.224   4.963  11.563
  738   1HB   ASN  90          HB2       ASN  90  17.659   6.306   9.253
  739   2HB   ASN  90          HB1       ASN  90  16.482   7.120  10.284
  740   1HD2  ASN  90          HD21      ASN  90  17.093   6.330  12.828
  741   2HD2  ASN  90          HD22      ASN  90  18.700   6.706  13.224
  742    H    GLY  91           HN       GLY  91  14.109   5.623  10.969
  743   1HA   GLY  91          HA2       GLY  91  13.084   4.328   8.484
  744   2HA   GLY  91          HA1       GLY  91  12.109   4.792   9.878
  745    H    SER  92           HN       SER  92  14.339   7.215   9.107
  746    HA   SER  92           HA       SER  92  12.339   8.667   7.406
  747   1HB   SER  92          HB2       SER  92  13.983  10.001   9.559
  748   2HB   SER  92          HB1       SER  92  12.578  10.635   8.706
  749    HG   SER  92           HG       SER  92  12.484   8.306  10.314
  750    H    PHE  93           HN       PHE  93  13.833   7.923   5.674
  751    HA   PHE  93           HA       PHE  93  16.385   9.493   5.554
  752   1HB   PHE  93          HB2       PHE  93  16.905   7.876   3.660
  753   2HB   PHE  93          HB1       PHE  93  16.806   7.146   5.262
  754    HD1  PHE  93           HD1      PHE  93  14.713   5.951   5.961
  755    HD2  PHE  93           HD2      PHE  93  15.351   7.292   1.930
  756    HE1  PHE  93           HE1      PHE  93  12.911   4.441   5.174
  757    HE2  PHE  93           HE2      PHE  93  13.547   5.783   1.144
  758    HZ   PHE  93           HZ       PHE  93  12.327   4.358   2.766
  759    H    LEU  94           HN       LEU  94  15.624  11.460   4.749
  760    HA   LEU  94           HA       LEU  94  13.625  11.652   2.680
  761   1HB   LEU  94          HB2       LEU  94  14.456  13.418   4.436
  762   2HB   LEU  94          HB1       LEU  94  15.663  13.810   3.218
  763    HG   LEU  94           HG       LEU  94  12.670  13.776   2.719
  764   1HD1  LEU  94          HD11      LEU  94  14.579  16.018   3.403
  765   2HD1  LEU  94          HD12      LEU  94  13.096  15.562   4.242
  766   3HD1  LEU  94          HD13      LEU  94  13.012  16.301   2.643
  767   1HD2  LEU  94          HD21      LEU  94  15.086  14.325   1.024
  768   2HD2  LEU  94          HD22      LEU  94  13.655  15.318   0.755
  769   3HD2  LEU  94          HD23      LEU  94  13.552  13.571   0.592
  Start of MODEL   25
    1   1H    MET   1          HT1       MET   1 -23.814  18.603   7.366
    2   2H    MET   1          HT2       MET   1 -22.250  18.051   7.732
    3   3H    MET   1          HT3       MET   1 -23.555  16.964   7.720
    4    HA   MET   1           HA       MET   1 -23.736  16.976   5.418
    5   1HB   MET   1          HB2       MET   1 -23.590  19.509   5.331
    6   2HB   MET   1          HB1       MET   1 -21.835  19.336   5.357
    7   1HG   MET   1          HG2       MET   1 -22.045  17.830   3.336
    8   2HG   MET   1          HG1       MET   1 -23.746  18.286   3.254
    9   1HE   MET   1          HE1       MET   1 -23.959  21.811   2.268
   10   2HE   MET   1          HE2       MET   1 -23.720  21.568   3.996
   11   3HE   MET   1          HE3       MET   1 -24.665  20.404   3.073
   12    H    LEU   2           HN       LEU   2 -22.295  15.804   4.054
   13    HA   LEU   2           HA       LEU   2 -19.661  15.116   5.316
   14   1HB   LEU   2          HB2       LEU   2 -21.343  13.524   3.354
   15   2HB   LEU   2          HB1       LEU   2 -19.846  12.988   4.115
   16    HG   LEU   2           HG       LEU   2 -22.394  13.704   5.596
   17   1HD1  LEU   2          HD11      LEU   2 -22.644  11.315   5.957
   18   2HD1  LEU   2          HD12      LEU   2 -21.121  10.992   5.126
   19   3HD1  LEU   2          HD13      LEU   2 -22.505  11.609   4.223
   20   1HD2  LEU   2          HD21      LEU   2 -20.660  14.098   7.134
   21   2HD2  LEU   2          HD22      LEU   2 -19.637  12.829   6.458
   22   3HD2  LEU   2          HD23      LEU   2 -21.040  12.405   7.437
   23    H    VAL   3           HN       VAL   3 -17.807  15.194   4.039
   24    HA   VAL   3           HA       VAL   3 -18.092  15.978   1.176
   25    HB   VAL   3           HB       VAL   3 -16.268  17.679   1.529
   26   1HG1  VAL   3          HG11      VAL   3 -18.622  18.365   1.347
   27   2HG1  VAL   3          HG12      VAL   3 -17.775  19.384   2.511
   28   3HG1  VAL   3          HG13      VAL   3 -18.844  18.100   3.077
   29   1HG2  VAL   3          HG21      VAL   3 -15.786  18.436   3.786
   30   2HG2  VAL   3          HG22      VAL   3 -15.497  16.698   3.716
   31   3HG2  VAL   3          HG23      VAL   3 -16.972  17.318   4.458
   32    H    LYS   4           HN       LYS   4 -16.077  15.572  -0.042
   33    HA   LYS   4           HA       LYS   4 -14.816  13.122   0.806
   34   1HB   LYS   4          HB2       LYS   4 -13.338  13.500  -1.198
   35   2HB   LYS   4          HB1       LYS   4 -15.060  13.513  -1.558
   36   1HG   LYS   4          HG2       LYS   4 -13.955  16.183  -0.861
   37   2HG   LYS   4          HG1       LYS   4 -13.275  15.487  -2.328
   38   1HD   LYS   4          HD2       LYS   4 -15.459  15.247  -3.319
   39   2HD   LYS   4          HD1       LYS   4 -16.254  15.687  -1.809
   40   1HE   LYS   4          HE2       LYS   4 -14.432  17.502  -3.417
   41   2HE   LYS   4          HE1       LYS   4 -16.192  17.592  -3.390
   42   1HZ   LYS   4          HZ1       LYS   4 -14.258  18.333  -1.331
   43   2HZ   LYS   4          HZ2       LYS   4 -15.739  17.683  -0.812
   44   3HZ   LYS   4          HZ3       LYS   4 -15.714  19.085  -1.771
   45    HA   PRO   5           HA       PRO   5 -11.542  15.010   3.163
   46   1HB   PRO   5          HB2       PRO   5  -9.748  13.011   3.313
   47   2HB   PRO   5          HB1       PRO   5 -11.332  12.885   4.099
   48   1HG   PRO   5          HG2       PRO   5 -10.451  11.782   1.462
   49   2HG   PRO   5          HG1       PRO   5 -11.340  10.976   2.768
   50   1HD   PRO   5          HD2       PRO   5 -12.600  12.016   0.576
   51   2HD   PRO   5          HD1       PRO   5 -13.366  11.961   2.181
   52    HA   PRO   6           HA       PRO   6  -8.511  16.481   0.220
   53   1HB   PRO   6          HB2       PRO   6  -6.623  17.533   1.828
   54   2HB   PRO   6          HB1       PRO   6  -8.267  18.203   1.784
   55   1HG   PRO   6          HG2       PRO   6  -7.054  16.319   3.767
   56   2HG   PRO   6          HG1       PRO   6  -8.046  17.761   4.055
   57   1HD   PRO   6          HD2       PRO   6  -9.074  15.203   4.074
   58   2HD   PRO   6          HD1       PRO   6 -10.030  16.641   3.647
   59    H    TYR   7           HN       TYR   7  -8.034  13.626   1.740
   60    HA   TYR   7           HA       TYR   7  -5.128  13.379   1.351
   61   1HB   TYR   7          HB2       TYR   7  -7.107  11.153   1.885
   62   2HB   TYR   7          HB1       TYR   7  -5.376  11.147   2.202
   63    HD1  TYR   7           HD1      TYR   7  -8.346  11.220   3.855
   64    HD2  TYR   7           HD2      TYR   7  -4.734  13.536   3.606
   65    HE1  TYR   7           HE1      TYR   7  -8.785  12.142   6.106
   66    HE2  TYR   7           HE2      TYR   7  -5.174  14.456   5.863
   67    HH   TYR   7           HH       TYR   7  -7.540  14.781   7.288
   68    H    SER   8           HN       SER   8  -4.138  12.349  -0.354
   69    HA   SER   8           HA       SER   8  -5.716  11.986  -2.792
   70   1HB   SER   8          HB2       SER   8  -3.541  11.479  -3.836
   71   2HB   SER   8          HB1       SER   8  -3.436  12.951  -2.873
   72    HG   SER   8           HG       SER   8  -1.787  11.129  -2.644
   73    H    TYR   9           HN       TYR   9  -5.296   9.860  -4.078
   74    HA   TYR   9           HA       TYR   9  -6.340   7.670  -2.591
   75   1HB   TYR   9          HB2       TYR   9  -4.866   7.782  -5.234
   76   2HB   TYR   9          HB1       TYR   9  -5.567   6.297  -4.592
   77    HD1  TYR   9           HD1      TYR   9  -6.263   9.589  -6.047
   78    HD2  TYR   9           HD2      TYR   9  -8.002   6.064  -4.318
   79    HE1  TYR   9           HE1      TYR   9  -8.490  10.266  -6.908
   80    HE2  TYR   9           HE2      TYR   9 -10.225   6.740  -5.179
   81    HH   TYR   9           HH       TYR   9 -11.165   8.142  -6.945
   82    H    ILE  10           HN       ILE  10  -3.015   8.507  -3.507
   83    HA   ILE  10           HA       ILE  10  -1.750   6.136  -2.549
   84    HB   ILE  10           HB       ILE  10  -0.672   8.975  -2.569
   85   1HG1  ILE  10          HG12      ILE  10  -1.441   8.387  -4.795
   86   2HG1  ILE  10          HG11      ILE  10   0.317   8.296  -4.770
   87   1HG2  ILE  10          HG21      ILE  10   0.726   7.508  -1.240
   88   2HG2  ILE  10          HG22      ILE  10   1.530   7.795  -2.784
   89   3HG2  ILE  10          HG23      ILE  10   0.692   6.270  -2.498
   90   1HD1  ILE  10          HD11      ILE  10  -1.692   6.064  -4.880
   91   2HD1  ILE  10          HD12      ILE  10  -0.094   5.760  -4.198
   92   3HD1  ILE  10          HD13      ILE  10  -0.251   6.314  -5.863
   93    H    ALA  11           HN       ALA  11  -2.377   9.254  -0.929
   94    HA   ALA  11           HA       ALA  11  -1.254   8.515   1.588
   95   1HB   ALA  11          HB1       ALA  11  -1.685  10.839   1.167
   96   2HB   ALA  11          HB2       ALA  11  -2.766  10.363   2.477
   97   3HB   ALA  11          HB3       ALA  11  -3.390  10.528   0.837
   98    H    LEU  12           HN       LEU  12  -4.611   8.267   0.372
   99    HA   LEU  12           HA       LEU  12  -5.750   7.324   2.806
  100   1HB   LEU  12          HB2       LEU  12  -6.500   6.777  -0.078
  101   2HB   LEU  12          HB1       LEU  12  -7.483   6.266   1.292
  102    HG   LEU  12           HG       LEU  12  -6.651   9.139   0.780
  103   1HD1  LEU  12          HD11      LEU  12  -9.023   9.434   0.043
  104   2HD1  LEU  12          HD12      LEU  12  -9.229   7.684   0.120
  105   3HD1  LEU  12          HD13      LEU  12  -8.094   8.389  -1.030
  106   1HD2  LEU  12          HD21      LEU  12  -8.797   9.382   2.332
  107   2HD2  LEU  12          HD22      LEU  12  -7.217   9.079   3.040
  108   3HD2  LEU  12          HD23      LEU  12  -8.358   7.751   2.836
  109    H    ILE  13           HN       ILE  13  -4.259   5.542   0.106
  110    HA   ILE  13           HA       ILE  13  -4.675   2.943   1.303
  111    HB   ILE  13           HB       ILE  13  -2.683   3.892  -0.778
  112   1HG1  ILE  13          HG12      ILE  13  -5.229   2.289  -1.136
  113   2HG1  ILE  13          HG11      ILE  13  -5.182   4.047  -1.276
  114   1HG2  ILE  13          HG21      ILE  13  -3.412   1.138   0.241
  115   2HG2  ILE  13          HG22      ILE  13  -1.809   1.866   0.138
  116   3HG2  ILE  13          HG23      ILE  13  -2.658   1.391  -1.333
  117   1HD1  ILE  13          HD11      ILE  13  -3.458   3.853  -3.040
  118   2HD1  ILE  13          HD12      ILE  13  -4.937   3.008  -3.492
  119   3HD1  ILE  13          HD13      ILE  13  -3.541   2.096  -2.918
  120    H    THR  14           HN       THR  14  -2.002   5.279   1.307
  121    HA   THR  14           HA       THR  14  -0.105   3.647   2.674
  122    HB   THR  14           HB       THR  14  -0.422   6.657   2.732
  123    HG1  THR  14           HG1      THR  14   0.346   4.902   0.835
  124   1HG2  THR  14          HG21      THR  14   1.062   6.119   4.486
  125   2HG2  THR  14          HG22      THR  14   2.123   6.457   3.119
  126   3HG2  THR  14          HG23      THR  14   1.786   4.789   3.581
  127    H    MET  15           HN       MET  15  -2.610   5.861   3.881
  128    HA   MET  15           HA       MET  15  -1.864   5.563   6.658
  129   1HB   MET  15          HB2       MET  15  -4.432   6.467   5.332
  130   2HB   MET  15          HB1       MET  15  -4.193   6.469   7.078
  131   1HG   MET  15          HG2       MET  15  -2.144   7.895   6.717
  132   2HG   MET  15          HG1       MET  15  -2.598   8.019   5.019
  133   1HE   MET  15          HE1       MET  15  -5.869   8.297   5.079
  134   2HE   MET  15          HE2       MET  15  -4.547   8.912   4.090
  135   3HE   MET  15          HE3       MET  15  -5.692  10.036   4.817
  136    H    ALA  16           HN       ALA  16  -4.096   3.890   4.500
  137    HA   ALA  16           HA       ALA  16  -5.478   2.340   6.432
  138   1HB   ALA  16          HB1       ALA  16  -5.805   0.722   4.524
  139   2HB   ALA  16          HB2       ALA  16  -4.696   1.710   3.573
  140   3HB   ALA  16          HB3       ALA  16  -6.225   2.389   4.129
  141    H    ILE  17           HN       ILE  17  -2.448   1.624   4.667
  142    HA   ILE  17           HA       ILE  17  -1.993  -0.958   5.774
  143    HB   ILE  17           HB       ILE  17   0.025   1.160   4.970
  144   1HG1  ILE  17          HG12      ILE  17  -1.071  -1.161   3.364
  145   2HG1  ILE  17          HG11      ILE  17  -1.703   0.483   3.259
  146   1HG2  ILE  17          HG21      ILE  17   0.237  -1.796   5.556
  147   2HG2  ILE  17          HG22      ILE  17   1.223  -0.473   6.181
  148   3HG2  ILE  17          HG23      ILE  17   1.398  -0.984   4.504
  149   1HD1  ILE  17          HD11      ILE  17   1.233  -0.114   2.869
  150   2HD1  ILE  17          HD12      ILE  17   0.340   1.335   2.406
  151   3HD1  ILE  17          HD13      ILE  17   0.087  -0.175   1.530
  152    H    GLN  18           HN       GLN  18  -0.789   2.215   6.824
  153    HA   GLN  18           HA       GLN  18   0.512   1.197   9.189
  154   1HB   GLN  18          HB2       GLN  18  -0.348   3.982   8.378
  155   2HB   GLN  18          HB1       GLN  18   0.549   3.641   9.859
  156   1HG   GLN  18          HG2       GLN  18   2.350   2.598   8.534
  157   2HG   GLN  18          HG1       GLN  18   1.459   2.939   7.051
  158   1HE2  GLN  18          HE21      GLN  18   4.135   4.028   8.148
  159   2HE2  GLN  18          HE22      GLN  18   3.958   5.713   8.045
  160    H    ASN  19           HN       ASN  19  -2.688   2.600   8.596
  161    HA   ASN  19           HA       ASN  19  -3.394   2.666  11.413
  162   1HB   ASN  19          HB2       ASN  19  -5.045   2.874   8.882
  163   2HB   ASN  19          HB1       ASN  19  -5.721   3.046  10.503
  164   1HD2  ASN  19          HD21      ASN  19  -2.668   4.229  10.853
  165   2HD2  ASN  19          HD22      ASN  19  -2.939   5.866  10.498
  166    H    ALA  20           HN       ALA  20  -2.929   0.099   9.365
  167    HA   ALA  20           HA       ALA  20  -5.232  -1.518  10.113
  168   1HB   ALA  20          HB1       ALA  20  -2.554  -2.436   9.011
  169   2HB   ALA  20          HB2       ALA  20  -3.886  -1.852   8.009
  170   3HB   ALA  20          HB3       ALA  20  -4.079  -3.323   8.961
  171    HA   PRO  21           HA       PRO  21  -3.644  -2.893  14.055
  172   1HB   PRO  21          HB2       PRO  21  -4.767  -5.414  14.202
  173   2HB   PRO  21          HB1       PRO  21  -5.671  -3.919  14.504
  174   1HG   PRO  21          HG2       PRO  21  -5.573  -5.601  12.042
  175   2HG   PRO  21          HG1       PRO  21  -6.954  -4.781  12.792
  176   1HD   PRO  21          HD2       PRO  21  -5.681  -3.769  10.607
  177   2HD   PRO  21          HD1       PRO  21  -6.423  -2.722  11.837
  178    H    GLU  22           HN       GLU  22  -3.131  -4.577  11.112
  179    HA   GLU  22           HA       GLU  22  -0.605  -5.775  12.177
  180   1HB   GLU  22          HB2       GLU  22  -2.362  -7.543  11.810
  181   2HB   GLU  22          HB1       GLU  22  -2.439  -7.052  10.117
  182   1HG   GLU  22          HG2       GLU  22  -0.070  -7.601   9.820
  183   2HG   GLU  22          HG1       GLU  22   0.065  -8.023  11.529
  184    H    LYS  23           HN       LYS  23   1.149  -5.356  10.821
  185    HA   LYS  23           HA       LYS  23   0.925  -3.247   8.938
  186   1HB   LYS  23          HB2       LYS  23   3.046  -3.939  10.090
  187   2HB   LYS  23          HB1       LYS  23   3.091  -5.372   9.073
  188   1HG   LYS  23          HG2       LYS  23   4.542  -3.742   8.065
  189   2HG   LYS  23          HG1       LYS  23   3.102  -3.850   7.056
  190   1HD   LYS  23          HD2       LYS  23   2.265  -1.782   7.797
  191   2HD   LYS  23          HD1       LYS  23   3.249  -1.791   9.259
  192   1HE   LYS  23          HE2       LYS  23   4.193  -0.182   7.726
  193   2HE   LYS  23          HE1       LYS  23   5.286  -1.562   7.790
  194   1HZ   LYS  23          HZ1       LYS  23   3.833  -2.372   5.807
  195   2HZ   LYS  23          HZ2       LYS  23   5.084  -1.251   5.549
  196   3HZ   LYS  23          HZ3       LYS  23   3.472  -0.723   5.641
  197    H    LYS  24           HN       LYS  24   0.977  -6.770   8.480
  198    HA   LYS  24           HA       LYS  24   0.829  -6.519   5.568
  199   1HB   LYS  24          HB2       LYS  24   0.500  -8.866   7.459
  200   2HB   LYS  24          HB1       LYS  24   0.388  -9.016   5.706
  201   1HG   LYS  24          HG2       LYS  24   2.662  -8.078   5.479
  202   2HG   LYS  24          HG1       LYS  24   2.776  -7.940   7.234
  203   1HD   LYS  24          HD2       LYS  24   2.457 -10.399   7.426
  204   2HD   LYS  24          HD1       LYS  24   2.428 -10.512   5.665
  205   1HE   LYS  24          HE2       LYS  24   4.676 -11.011   6.308
  206   2HE   LYS  24          HE1       LYS  24   4.708  -9.359   5.689
  207   1HZ   LYS  24          HZ1       LYS  24   5.861  -9.820   7.897
  208   2HZ   LYS  24          HZ2       LYS  24   4.301  -9.918   8.561
  209   3HZ   LYS  24          HZ3       LYS  24   4.823  -8.480   7.823
  210    H    ILE  25           HN       ILE  25  -1.021  -6.320   4.400
  211    HA   ILE  25           HA       ILE  25  -3.635  -7.007   5.665
  212    HB   ILE  25           HB       ILE  25  -3.115  -4.549   5.960
  213   1HG1  ILE  25          HG12      ILE  25  -5.437  -5.072   4.087
  214   2HG1  ILE  25          HG11      ILE  25  -5.445  -5.539   5.789
  215   1HG2  ILE  25          HG21      ILE  25  -1.915  -4.379   3.731
  216   2HG2  ILE  25          HG22      ILE  25  -3.085  -3.098   4.049
  217   3HG2  ILE  25          HG23      ILE  25  -3.500  -4.421   2.960
  218   1HD1  ILE  25          HD11      ILE  25  -6.518  -3.318   5.395
  219   2HD1  ILE  25          HD12      ILE  25  -4.976  -2.716   4.787
  220   3HD1  ILE  25          HD13      ILE  25  -5.123  -3.221   6.470
  221    H    THR  26           HN       THR  26  -5.249  -7.579   4.146
  222    HA   THR  26           HA       THR  26  -4.188  -8.491   1.565
  223    HB   THR  26           HB       THR  26  -6.405  -9.532   1.294
  224    HG1  THR  26           HG1      THR  26  -8.035  -8.976   2.528
  225   1HG2  THR  26          HG21      THR  26  -4.574 -10.534   2.762
  226   2HG2  THR  26          HG22      THR  26  -6.211 -11.110   3.073
  227   3HG2  THR  26          HG23      THR  26  -5.479  -9.917   4.144
  228    H    LEU  27           HN       LEU  27  -5.519  -8.089  -0.429
  229    HA   LEU  27           HA       LEU  27  -5.676  -5.315  -1.053
  230   1HB   LEU  27          HB2       LEU  27  -5.469  -7.373  -2.600
  231   2HB   LEU  27          HB1       LEU  27  -7.212  -7.529  -2.436
  232    HG   LEU  27           HG       LEU  27  -7.470  -5.203  -3.316
  233   1HD1  LEU  27          HD11      LEU  27  -4.474  -5.378  -3.280
  234   2HD1  LEU  27          HD12      LEU  27  -5.526  -3.998  -2.966
  235   3HD1  LEU  27          HD13      LEU  27  -5.227  -4.516  -4.619
  236   1HD2  LEU  27          HD21      LEU  27  -6.770  -5.838  -5.663
  237   2HD2  LEU  27          HD22      LEU  27  -7.707  -7.071  -4.828
  238   3HD2  LEU  27          HD23      LEU  27  -5.959  -7.241  -4.974
  239    H    ASN  28           HN       ASN  28  -8.204  -7.712  -0.421
  240    HA   ASN  28           HA       ASN  28 -10.462  -5.993  -0.525
  241   1HB   ASN  28          HB2       ASN  28  -9.955  -8.552   1.003
  242   2HB   ASN  28          HB1       ASN  28 -11.527  -7.758   0.954
  243   1HD2  ASN  28          HD21      ASN  28 -11.055 -10.395  -0.149
  244   2HD2  ASN  28          HD22      ASN  28 -11.286 -10.299  -1.827
  245    H    GLY  29           HN       GLY  29  -8.322  -6.846   2.191
  246   1HA   GLY  29          HA2       GLY  29  -9.823  -5.635   4.264
  247   2HA   GLY  29          HA1       GLY  29  -8.073  -5.841   4.295
  248    H    ILE  30           HN       ILE  30  -7.439  -4.192   2.045
  249    HA   ILE  30           HA       ILE  30  -7.300  -1.640   3.294
  250    HB   ILE  30           HB       ILE  30  -7.005  -2.447   0.387
  251   1HG1  ILE  30          HG12      ILE  30  -4.918  -1.700   2.455
  252   2HG1  ILE  30          HG11      ILE  30  -5.414  -3.363   2.141
  253   1HG2  ILE  30          HG21      ILE  30  -5.745  -0.234   0.250
  254   2HG2  ILE  30          HG22      ILE  30  -6.494   0.189   1.788
  255   3HG2  ILE  30          HG23      ILE  30  -7.499  -0.100   0.369
  256   1HD1  ILE  30          HD11      ILE  30  -4.795  -3.051  -0.258
  257   2HD1  ILE  30          HD12      ILE  30  -3.420  -2.871   0.830
  258   3HD1  ILE  30          HD13      ILE  30  -4.191  -1.442   0.140
  259    H    TYR  31           HN       TYR  31  -9.540  -2.873   0.797
  260    HA   TYR  31           HA       TYR  31 -10.945  -0.434   0.371
  261   1HB   TYR  31          HB2       TYR  31 -11.708  -3.334   0.092
  262   2HB   TYR  31          HB1       TYR  31 -12.906  -2.076  -0.182
  263    HD1  TYR  31           HD1      TYR  31 -10.375  -4.020  -1.733
  264    HD2  TYR  31           HD2      TYR  31 -12.128  -0.105  -1.732
  265    HE1  TYR  31           HE1      TYR  31  -9.555  -3.650  -4.045
  266    HE2  TYR  31           HE2      TYR  31 -11.306   0.266  -4.030
  267    HH   TYR  31           HH       TYR  31  -9.810  -2.312  -5.885
  268    H    GLN  32           HN       GLN  32 -11.466  -2.981   2.808
  269    HA   GLN  32           HA       GLN  32 -13.928  -2.015   3.826
  270   1HB   GLN  32          HB2       GLN  32 -12.983  -4.208   4.426
  271   2HB   GLN  32          HB1       GLN  32 -11.687  -3.411   5.315
  272   1HG   GLN  32          HG2       GLN  32 -13.272  -2.449   6.881
  273   2HG   GLN  32          HG1       GLN  32 -14.632  -3.059   5.938
  274   1HE2  GLN  32          HE21      GLN  32 -14.345  -3.822   8.662
  275   2HE2  GLN  32          HE22      GLN  32 -13.949  -5.471   8.731
  276    H    PHE  33           HN       PHE  33 -10.600  -1.157   4.766
  277    HA   PHE  33           HA       PHE  33 -11.271   0.501   6.964
  278   1HB   PHE  33          HB2       PHE  33  -8.975  -0.211   6.504
  279   2HB   PHE  33          HB1       PHE  33  -8.955   0.757   5.028
  280    HD1  PHE  33           HD1      PHE  33  -8.878   0.845   8.707
  281    HD2  PHE  33           HD2      PHE  33  -8.937   3.201   5.115
  282    HE1  PHE  33           HE1      PHE  33  -8.227   2.852  10.011
  283    HE2  PHE  33           HE2      PHE  33  -8.285   5.207   6.418
  284    HZ   PHE  33           HZ       PHE  33  -7.929   5.033   8.867
  285    H    ILE  34           HN       ILE  34 -10.776   1.447   3.537
  286    HA   ILE  34           HA       ILE  34 -11.201   4.219   3.934
  287    HB   ILE  34           HB       ILE  34 -11.776   2.524   1.490
  288   1HG1  ILE  34          HG12      ILE  34  -9.421   4.321   2.138
  289   2HG1  ILE  34          HG11      ILE  34  -9.417   2.580   2.416
  290   1HG2  ILE  34          HG21      ILE  34 -11.489   4.768   0.316
  291   2HG2  ILE  34          HG22      ILE  34 -11.649   5.522   1.901
  292   3HG2  ILE  34          HG23      ILE  34 -12.985   4.586   1.231
  293   1HD1  ILE  34          HD11      ILE  34  -9.940   3.885  -0.270
  294   2HD1  ILE  34          HD12      ILE  34  -9.793   2.155   0.044
  295   3HD1  ILE  34          HD13      ILE  34  -8.390   3.209   0.228
  296    H    MET  35           HN       MET  35 -13.626   1.752   2.948
  297    HA   MET  35           HA       MET  35 -15.798   3.574   2.797
  298   1HB   MET  35          HB2       MET  35 -15.725   0.617   3.423
  299   2HB   MET  35          HB1       MET  35 -17.226   1.517   3.202
  300   1HG   MET  35          HG2       MET  35 -16.491   2.207   0.955
  301   2HG   MET  35          HG1       MET  35 -14.983   1.321   1.171
  302   1HE   MET  35          HE1       MET  35 -15.037  -0.597  -0.647
  303   2HE   MET  35          HE2       MET  35 -15.632  -2.082   0.092
  304   3HE   MET  35          HE3       MET  35 -14.609  -0.992   1.022
  305    H    ASP  36           HN       ASP  36 -14.704   1.607   5.588
  306    HA   ASP  36           HA       ASP  36 -16.772   2.617   7.333
  307   1HB   ASP  36          HB2       ASP  36 -14.101   1.306   7.893
  308   2HB   ASP  36          HB1       ASP  36 -15.254   1.734   9.157
  309    H    ARG  37           HN       ARG  37 -13.409   3.572   6.713
  310    HA   ARG  37           HA       ARG  37 -13.310   5.551   8.793
  311   1HB   ARG  37          HB2       ARG  37 -11.336   4.490   7.592
  312   2HB   ARG  37          HB1       ARG  37 -11.702   5.547   6.233
  313   1HG   ARG  37          HG2       ARG  37 -10.019   6.656   7.546
  314   2HG   ARG  37          HG1       ARG  37 -11.536   7.511   7.814
  315   1HD   ARG  37          HD2       ARG  37 -11.736   6.749  10.001
  316   2HD   ARG  37          HD1       ARG  37 -10.822   5.274   9.691
  317    HE   ARG  37           HE       ARG  37  -8.940   7.265   9.374
  318   1HH1  ARG  37          HH21      ARG  37 -11.277   6.428  11.766
  319   2HH1  ARG  37          HH22      ARG  37 -10.314   6.984  13.094
  320   1HH2  ARG  37          HH11      ARG  37  -7.665   7.991  11.094
  321   2HH2  ARG  37          HH12      ARG  37  -8.269   7.870  12.713
  322    H    PHE  38           HN       PHE  38 -14.146   5.734   5.336
  323    HA   PHE  38           HA       PHE  38 -15.269   8.469   5.844
  324   1HB   PHE  38          HB2       PHE  38 -13.836   7.606   3.314
  325   2HB   PHE  38          HB1       PHE  38 -14.490   9.203   3.671
  326    HD1  PHE  38           HD1      PHE  38 -11.760   6.854   4.268
  327    HD2  PHE  38           HD2      PHE  38 -13.455  10.629   5.415
  328    HE1  PHE  38           HE1      PHE  38  -9.625   7.478   5.365
  329    HE2  PHE  38           HE2      PHE  38 -11.321  11.255   6.512
  330    HZ   PHE  38           HZ       PHE  38  -9.405   9.679   6.485
  331    HA   PRO  39           HA       PRO  39 -18.592   5.503   4.364
  332   1HB   PRO  39          HB2       PRO  39 -20.046   7.873   5.515
  333   2HB   PRO  39          HB1       PRO  39 -20.445   6.146   5.631
  334   1HG   PRO  39          HG2       PRO  39 -19.319   7.395   7.673
  335   2HG   PRO  39          HG1       PRO  39 -18.825   5.747   7.243
  336   1HD   PRO  39          HD2       PRO  39 -17.367   8.324   6.807
  337   2HD   PRO  39          HD1       PRO  39 -16.712   6.699   7.112
  338    H    PHE  40           HN       PHE  40 -17.504   8.606   3.534
  339    HA   PHE  40           HA       PHE  40 -19.491   9.529   1.726
  340   1HB   PHE  40          HB2       PHE  40 -17.778  11.052   2.312
  341   2HB   PHE  40          HB1       PHE  40 -16.502   9.903   1.921
  342    HD1  PHE  40           HD1      PHE  40 -15.491   9.932  -0.203
  343    HD2  PHE  40           HD2      PHE  40 -19.290  11.861   0.366
  344    HE1  PHE  40           HE1      PHE  40 -15.376  10.841  -2.508
  345    HE2  PHE  40           HE2      PHE  40 -19.174  12.768  -1.940
  346    HZ   PHE  40           HZ       PHE  40 -17.217  12.258  -3.377
  347    H    TYR  41           HN       TYR  41 -16.774   7.286   1.242
  348    HA   TYR  41           HA       TYR  41 -17.128   7.039  -1.598
  349   1HB   TYR  41          HB2       TYR  41 -15.790   5.272   0.458
  350   2HB   TYR  41          HB1       TYR  41 -15.777   4.909  -1.271
  351    HD1  TYR  41           HD1      TYR  41 -14.861   7.455   1.262
  352    HD2  TYR  41           HD2      TYR  41 -14.359   6.102  -2.775
  353    HE1  TYR  41           HE1      TYR  41 -13.031   9.090   0.954
  354    HE2  TYR  41           HE2      TYR  41 -12.530   7.733  -3.104
  355    HH   TYR  41           HH       TYR  41 -11.095   9.439  -0.482
  356    H    ARG  42           HN       ARG  42 -18.864   5.640   1.075
  357    HA   ARG  42           HA       ARG  42 -19.773   3.250  -0.177
  358   1HB   ARG  42          HB2       ARG  42 -21.136   5.073   1.820
  359   2HB   ARG  42          HB1       ARG  42 -21.802   3.522   1.313
  360   1HG   ARG  42          HG2       ARG  42 -19.756   2.391   2.095
  361   2HG   ARG  42          HG1       ARG  42 -19.097   3.940   2.618
  362   1HD   ARG  42          HD2       ARG  42 -20.931   4.246   4.187
  363   2HD   ARG  42          HD1       ARG  42 -21.719   2.781   3.621
  364    HE   ARG  42           HE       ARG  42 -19.646   2.986   5.616
  365   1HH1  ARG  42          HH21      ARG  42 -20.610   1.043   2.927
  366   2HH1  ARG  42          HH22      ARG  42 -19.666  -0.322   3.424
  367   1HH2  ARG  42          HH11      ARG  42 -18.439   1.216   6.271
  368   2HH2  ARG  42          HH12      ARG  42 -18.442  -0.224   5.308
  369    H    GLU  43           HN       GLU  43 -21.004   6.583  -0.353
  370    HA   GLU  43           HA       GLU  43 -23.333   5.965  -1.875
  371   1HB   GLU  43          HB2       GLU  43 -21.678   8.484  -1.677
  372   2HB   GLU  43          HB1       GLU  43 -23.197   8.394  -2.572
  373   1HG   GLU  43          HG2       GLU  43 -24.384   7.705  -0.543
  374   2HG   GLU  43          HG1       GLU  43 -22.872   7.715   0.366
  375    H    ASN  44           HN       ASN  44 -20.058   6.730  -2.832
  376    HA   ASN  44           HA       ASN  44 -20.758   6.194  -5.696
  377   1HB   ASN  44          HB2       ASN  44 -18.330   7.527  -4.457
  378   2HB   ASN  44          HB1       ASN  44 -18.561   7.258  -6.187
  379   1HD2  ASN  44          HD21      ASN  44 -18.636   9.771  -4.213
  380   2HD2  ASN  44          HD22      ASN  44 -19.993  10.618  -4.781
  381    H    LYS  45           HN       LYS  45 -20.539   4.009  -6.036
  382    HA   LYS  45           HA       LYS  45 -18.238   2.579  -4.812
  383   1HB   LYS  45          HB2       LYS  45 -20.717   1.617  -6.251
  384   2HB   LYS  45          HB1       LYS  45 -19.408   0.547  -5.749
  385   1HG   LYS  45          HG2       LYS  45 -19.702   1.279  -3.409
  386   2HG   LYS  45          HG1       LYS  45 -21.013   2.347  -3.910
  387   1HD   LYS  45          HD2       LYS  45 -22.297   0.410  -4.724
  388   2HD   LYS  45          HD1       LYS  45 -20.986  -0.668  -4.244
  389   1HE   LYS  45          HE2       LYS  45 -22.382   1.181  -2.297
  390   2HE   LYS  45          HE1       LYS  45 -22.900  -0.482  -2.577
  391   1HZ   LYS  45          HZ1       LYS  45 -21.307  -1.183  -1.233
  392   2HZ   LYS  45          HZ2       LYS  45 -20.839   0.421  -0.927
  393   3HZ   LYS  45          HZ3       LYS  45 -20.120  -0.449  -2.198
  394    H    GLN  46           HN       GLN  46 -19.611   3.331  -8.014
  395    HA   GLN  46           HA       GLN  46 -17.450   1.904  -9.381
  396   1HB   GLN  46          HB2       GLN  46 -19.627   3.766 -10.363
  397   2HB   GLN  46          HB1       GLN  46 -18.441   3.013 -11.429
  398   1HG   GLN  46          HG2       GLN  46 -19.181   0.790 -10.753
  399   2HG   GLN  46          HG1       GLN  46 -20.294   1.488  -9.574
  400   1HE2  GLN  46          HE21      GLN  46 -21.222  -0.194 -11.723
  401   2HE2  GLN  46          HE22      GLN  46 -22.164   0.757 -12.766
  402    H    GLY  47           HN       GLY  47 -15.694   2.854 -10.452
  403   1HA   GLY  47          HA2       GLY  47 -14.461   4.771 -11.297
  404   2HA   GLY  47          HA1       GLY  47 -15.295   5.796 -10.135
  405    H    TRP  48           HN       TRP  48 -14.786   5.247  -7.761
  406    HA   TRP  48           HA       TRP  48 -11.928   5.340  -7.451
  407   1HB   TRP  48          HB2       TRP  48 -12.317   5.730  -5.168
  408   2HB   TRP  48          HB1       TRP  48 -13.727   6.416  -5.963
  409    HD1  TRP  48           HD1      TRP  48 -16.015   4.953  -5.850
  410    HE1  TRP  48           HE1      TRP  48 -16.840   3.313  -4.046
  411    HE3  TRP  48           HE3      TRP  48 -11.611   3.974  -3.456
  412    HZ2  TRP  48           HZ2      TRP  48 -15.783   1.781  -1.877
  413    HZ3  TRP  48           HZ3      TRP  48 -11.551   2.423  -1.527
  414    HH2  TRP  48           HH2      TRP  48 -13.628   1.326  -0.732
  415    H    GLN  49           HN       GLN  49 -14.185   2.674  -7.372
  416    HA   GLN  49           HA       GLN  49 -12.710   0.895  -5.734
  417   1HB   GLN  49          HB2       GLN  49 -15.004   0.431  -6.516
  418   2HB   GLN  49          HB1       GLN  49 -14.391   0.201  -8.155
  419   1HG   GLN  49          HG2       GLN  49 -13.042  -1.691  -7.447
  420   2HG   GLN  49          HG1       GLN  49 -13.463  -1.407  -5.757
  421   1HE2  GLN  49          HE21      GLN  49 -14.679  -3.302  -5.324
  422   2HE2  GLN  49          HE22      GLN  49 -16.091  -3.723  -6.166
  423    H    ASN  50           HN       ASN  50 -12.534   1.236  -9.309
  424    HA   ASN  50           HA       ASN  50 -10.369  -0.682  -9.494
  425   1HB   ASN  50          HB2       ASN  50 -11.492   1.333 -11.446
  426   2HB   ASN  50          HB1       ASN  50 -10.150   0.264 -11.848
  427   1HD2  ASN  50          HD21      ASN  50 -12.658   0.078 -13.219
  428   2HD2  ASN  50          HD22      ASN  50 -13.377  -1.406 -12.815
  429    H    SER  51           HN       SER  51 -10.493   2.842  -9.235
  430    HA   SER  51           HA       SER  51  -7.828   3.401 -10.022
  431   1HB   SER  51          HB2       SER  51  -8.085   5.503  -8.866
  432   2HB   SER  51          HB1       SER  51  -9.642   5.091  -9.580
  433    HG   SER  51           HG       SER  51  -9.999   5.671  -7.466
  434    H    ILE  52           HN       ILE  52  -9.091   2.338  -6.876
  435    HA   ILE  52           HA       ILE  52  -6.740   2.804  -5.352
  436    HB   ILE  52           HB       ILE  52  -8.882   0.679  -5.107
  437   1HG1  ILE  52          HG12      ILE  52  -9.347   3.257  -4.870
  438   2HG1  ILE  52          HG11      ILE  52 -10.007   2.150  -3.677
  439   1HG2  ILE  52          HG21      ILE  52  -7.078  -0.220  -3.889
  440   2HG2  ILE  52          HG22      ILE  52  -8.045   0.616  -2.675
  441   3HG2  ILE  52          HG23      ILE  52  -6.573   1.361  -3.297
  442   1HD1  ILE  52          HD11      ILE  52  -7.349   3.545  -3.283
  443   2HD1  ILE  52          HD12      ILE  52  -8.325   2.707  -2.080
  444   3HD1  ILE  52          HD13      ILE  52  -8.880   4.239  -2.754
  445    H    ARG  53           HN       ARG  53  -7.747  -0.168  -7.069
  446    HA   ARG  53           HA       ARG  53  -5.310  -1.597  -6.464
  447   1HB   ARG  53          HB2       ARG  53  -7.478  -2.016  -8.537
  448   2HB   ARG  53          HB1       ARG  53  -6.129  -3.132  -8.304
  449   1HG   ARG  53          HG2       ARG  53  -6.773  -3.599  -6.066
  450   2HG   ARG  53          HG1       ARG  53  -7.913  -2.267  -6.033
  451   1HD   ARG  53          HD2       ARG  53  -8.997  -4.520  -6.334
  452   2HD   ARG  53          HD1       ARG  53  -9.362  -3.373  -7.623
  453    HE   ARG  53           HE       ARG  53  -7.120  -4.755  -8.532
  454   1HH1  ARG  53          HH21      ARG  53 -10.279  -5.518  -7.382
  455   2HH1  ARG  53          HH22      ARG  53 -10.421  -6.962  -8.330
  456   1HH2  ARG  53          HH11      ARG  53  -7.290  -6.634  -9.782
  457   2HH2  ARG  53          HH12      ARG  53  -8.728  -7.592  -9.687
  458    H    HIS  54           HN       HIS  54  -6.362   0.337  -9.272
  459    HA   HIS  54           HA       HIS  54  -4.154  -0.298 -10.962
  460   1HB   HIS  54          HB2       HIS  54  -5.813   2.230 -10.741
  461   2HB   HIS  54          HB1       HIS  54  -4.611   1.966 -12.002
  462    HD1  HIS  54           HD1      HIS  54  -7.525   2.310 -12.823
  463    HD2  HIS  54           HD2      HIS  54  -5.839  -1.421 -12.025
  464    HE1  HIS  54           HE1      HIS  54  -8.956   0.603 -14.023
  465    H    ASN  55           HN       ASN  55  -4.548   2.136  -8.416
  466    HA   ASN  55           HA       ASN  55  -2.058   3.475  -8.789
  467   1HB   ASN  55          HB2       ASN  55  -3.700   2.937  -6.294
  468   2HB   ASN  55          HB1       ASN  55  -2.287   3.994  -6.319
  469   1HD2  ASN  55          HD21      ASN  55  -5.202   4.690  -5.880
  470   2HD2  ASN  55          HD22      ASN  55  -5.557   5.863  -7.056
  471    H    LEU  56           HN       LEU  56  -2.959   0.553  -6.984
  472    HA   LEU  56           HA       LEU  56  -0.372   0.115  -5.829
  473   1HB   LEU  56          HB2       LEU  56  -2.653  -1.782  -6.418
  474   2HB   LEU  56          HB1       LEU  56  -1.197  -2.259  -5.551
  475    HG   LEU  56           HG       LEU  56  -3.015   0.018  -4.708
  476   1HD1  LEU  56          HD11      LEU  56  -3.562  -1.656  -2.821
  477   2HD1  LEU  56          HD12      LEU  56  -2.902  -2.888  -3.894
  478   3HD1  LEU  56          HD13      LEU  56  -4.303  -1.943  -4.393
  479   1HD2  LEU  56          HD21      LEU  56  -1.682  -0.601  -2.472
  480   2HD2  LEU  56          HD22      LEU  56  -1.003   0.509  -3.654
  481   3HD2  LEU  56          HD23      LEU  56  -0.476  -1.174  -3.623
  482    H    SER  57           HN       SER  57  -1.870  -0.985  -8.861
  483    HA   SER  57           HA       SER  57   0.408  -2.635  -9.593
  484   1HB   SER  57          HB2       SER  57  -0.699  -2.849 -11.756
  485   2HB   SER  57          HB1       SER  57  -1.895  -3.015 -10.474
  486    HG   SER  57           HG       SER  57  -1.610  -0.432 -11.094
  487    H    LEU  58           HN       LEU  58  -0.769   0.570 -10.695
  488    HA   LEU  58           HA       LEU  58   1.430   1.047 -12.469
  489   1HB   LEU  58          HB2       LEU  58  -0.353   2.977 -10.960
  490   2HB   LEU  58          HB1       LEU  58   0.787   3.462 -12.211
  491    HG   LEU  58           HG       LEU  58  -1.290   1.341 -12.768
  492   1HD1  LEU  58          HD11      LEU  58  -2.553   3.257 -11.940
  493   2HD1  LEU  58          HD12      LEU  58  -2.728   3.166 -13.691
  494   3HD1  LEU  58          HD13      LEU  58  -1.634   4.348 -12.976
  495   1HD2  LEU  58          HD21      LEU  58  -1.040   2.328 -15.086
  496   2HD2  LEU  58          HD22      LEU  58   0.420   1.565 -14.467
  497   3HD2  LEU  58          HD23      LEU  58   0.273   3.321 -14.458
  498    H    ASN  59           HN       ASN  59   0.914   1.797  -9.037
  499    HA   ASN  59           HA       ASN  59   3.551   3.080  -8.832
  500   1HB   ASN  59          HB2       ASN  59   1.380   3.632  -7.470
  501   2HB   ASN  59          HB1       ASN  59   1.860   2.263  -6.469
  502   1HD2  ASN  59          HD21      ASN  59   2.145   5.567  -6.625
  503   2HD2  ASN  59          HD22      ASN  59   3.622   5.766  -5.810
  504    H    GLU  60           HN       GLU  60   5.332   1.845  -8.720
  505    HA   GLU  60           HA       GLU  60   5.133  -0.992  -7.947
  506   1HB   GLU  60          HB2       GLU  60   7.490   0.670  -8.887
  507   2HB   GLU  60          HB1       GLU  60   7.478  -1.084  -8.699
  508   1HG   GLU  60          HG2       GLU  60   5.675  -1.267 -10.366
  509   2HG   GLU  60          HG1       GLU  60   5.655   0.487 -10.550
  510    H    CYS  61           HN       CYS  61   5.423   1.799  -6.222
  511    HA   CYS  61           HA       CYS  61   7.634   1.339  -4.484
  512   1HB   CYS  61          HB2       CYS  61   4.953   2.643  -3.909
  513   2HB   CYS  61          HB1       CYS  61   6.354   2.724  -2.843
  514    HG   CYS  61           HG       CYS  61   6.033   4.725  -4.818
  515    H    PHE  62           HN       PHE  62   4.285   0.173  -4.411
  516    HA   PHE  62           HA       PHE  62   4.662  -1.271  -1.897
  517   1HB   PHE  62          HB2       PHE  62   2.487  -1.560  -3.996
  518   2HB   PHE  62          HB1       PHE  62   2.430  -2.163  -2.340
  519    HD1  PHE  62           HD1      PHE  62   2.241  -0.614  -0.432
  520    HD2  PHE  62           HD2      PHE  62   2.212   0.796  -4.488
  521    HE1  PHE  62           HE1      PHE  62   1.372   1.579   0.334
  522    HE2  PHE  62           HE2      PHE  62   1.342   2.988  -3.722
  523    HZ   PHE  62           HZ       PHE  62   0.922   3.379  -1.310
  524    H    VAL  63           HN       VAL  63   4.962  -3.518  -1.693
  525    HA   VAL  63           HA       VAL  63   5.700  -5.002  -4.203
  526    HB   VAL  63           HB       VAL  63   6.876  -5.298  -1.420
  527   1HG1  VAL  63          HG11      VAL  63   6.987  -7.400  -2.556
  528   2HG1  VAL  63          HG12      VAL  63   8.580  -6.665  -2.733
  529   3HG1  VAL  63          HG13      VAL  63   7.439  -6.631  -4.077
  530   1HG2  VAL  63          HG21      VAL  63   7.651  -3.218  -2.345
  531   2HG2  VAL  63          HG22      VAL  63   7.898  -3.948  -3.932
  532   3HG2  VAL  63          HG23      VAL  63   8.946  -4.392  -2.586
  533    H    LYS  64           HN       LYS  64   4.516  -6.859  -4.503
  534    HA   LYS  64           HA       LYS  64   2.382  -7.527  -2.692
  535   1HB   LYS  64          HB2       LYS  64   3.600  -9.047  -5.010
  536   2HB   LYS  64          HB1       LYS  64   2.186  -9.607  -4.119
  537   1HG   LYS  64          HG2       LYS  64   0.991  -7.531  -4.697
  538   2HG   LYS  64          HG1       LYS  64   2.403  -6.967  -5.595
  539   1HD   LYS  64          HD2       LYS  64   2.248  -8.930  -7.080
  540   2HD   LYS  64          HD1       LYS  64   0.835  -9.495  -6.189
  541   1HE   LYS  64          HE2       LYS  64  -0.443  -7.563  -6.860
  542   2HE   LYS  64          HE1       LYS  64   0.979  -6.807  -7.581
  543   1HZ   LYS  64          HZ1       LYS  64   0.260  -7.771  -9.448
  544   2HZ   LYS  64          HZ2       LYS  64  -0.752  -8.861  -8.628
  545   3HZ   LYS  64          HZ3       LYS  64   0.902  -9.204  -8.806
  546    H    VAL  65           HN       VAL  65   2.267  -9.064  -1.103
  547    HA   VAL  65           HA       VAL  65   4.794 -10.508  -0.395
  548    HB   VAL  65           HB       VAL  65   2.463  -9.691   1.348
  549   1HG1  VAL  65          HG11      VAL  65   4.066 -10.366   3.190
  550   2HG1  VAL  65          HG12      VAL  65   5.081 -11.090   1.942
  551   3HG1  VAL  65          HG13      VAL  65   3.452 -11.706   2.220
  552   1HG2  VAL  65          HG21      VAL  65   5.301  -8.631   1.224
  553   2HG2  VAL  65          HG22      VAL  65   4.034  -8.080   2.322
  554   3HG2  VAL  65          HG23      VAL  65   3.882  -7.797   0.588
  555    HA   PRO  66           HA       PRO  66   2.050 -13.968  -1.467
  556   1HB   PRO  66          HB2       PRO  66   3.858 -15.999  -1.312
  557   2HB   PRO  66          HB1       PRO  66   3.820 -14.857  -2.669
  558   1HG   PRO  66          HG2       PRO  66   5.635 -14.920  -0.305
  559   2HG   PRO  66          HG1       PRO  66   6.002 -14.543  -1.996
  560   1HD   PRO  66          HD2       PRO  66   5.635 -12.625  -0.035
  561   2HD   PRO  66          HD1       PRO  66   5.379 -12.325  -1.769
  562    H    ARG  67           HN       ARG  67   1.693 -16.273  -0.410
  563    HA   ARG  67           HA       ARG  67   2.045 -16.155   2.556
  564   1HB   ARG  67          HB2       ARG  67  -0.305 -16.764   2.877
  565   2HB   ARG  67          HB1       ARG  67  -0.203 -15.255   1.972
  566   1HG   ARG  67          HG2       ARG  67  -0.463 -16.539  -0.142
  567   2HG   ARG  67          HG1       ARG  67  -0.679 -18.013   0.797
  568   1HD   ARG  67          HD2       ARG  67  -2.608 -16.955   1.958
  569   2HD   ARG  67          HD1       ARG  67  -2.444 -15.549   0.911
  570    HE   ARG  67           HE       ARG  67  -3.762 -18.033   0.282
  571   1HH1  ARG  67          HH21      ARG  67  -1.683 -15.659  -1.117
  572   2HH1  ARG  67          HH22      ARG  67  -1.981 -16.179  -2.742
  573   1HH2  ARG  67          HH11      ARG  67  -4.161 -18.706  -1.821
  574   2HH2  ARG  67          HH12      ARG  67  -3.381 -17.896  -3.139
  575    H    ASP  68           HN       ASP  68   1.769 -18.317   3.549
  576    HA   ASP  68           HA       ASP  68   2.984 -20.398   1.983
  577   1HB   ASP  68          HB2       ASP  68   2.953 -20.144   4.558
  578   2HB   ASP  68          HB1       ASP  68   1.359 -20.895   4.482
  579    H    ASP  69           HN       ASP  69   1.833 -22.606   1.723
  580    HA   ASP  69           HA       ASP  69  -0.732 -22.088   0.342
  581   1HB   ASP  69          HB2       ASP  69   1.014 -24.562   0.506
  582   2HB   ASP  69          HB1       ASP  69  -0.456 -24.432  -0.461
  583    H    LYS  70           HN       LYS  70   0.164 -22.925   3.445
  584    HA   LYS  70           HA       LYS  70  -2.091 -24.807   3.878
  585   1HB   LYS  70          HB2       LYS  70   0.084 -23.759   5.710
  586   2HB   LYS  70          HB1       LYS  70  -1.216 -24.823   6.247
  587   1HG   LYS  70          HG2       LYS  70  -0.529 -26.512   4.583
  588   2HG   LYS  70          HG1       LYS  70   0.774 -25.452   4.046
  589   1HD   LYS  70          HD2       LYS  70   1.767 -25.522   6.306
  590   2HD   LYS  70          HD1       LYS  70   0.465 -26.585   6.843
  591   1HE   LYS  70          HE2       LYS  70   1.146 -28.239   5.103
  592   2HE   LYS  70          HE1       LYS  70   2.501 -27.193   4.678
  593   1HZ   LYS  70          HZ1       LYS  70   3.657 -28.037   6.346
  594   2HZ   LYS  70          HZ2       LYS  70   2.377 -29.095   6.708
  595   3HZ   LYS  70          HZ3       LYS  70   2.466 -27.575   7.462
  596    H    LYS  71           HN       LYS  71  -1.880 -21.601   3.496
  597    HA   LYS  71           HA       LYS  71  -4.065 -21.036   5.477
  598   1HB   LYS  71          HB2       LYS  71  -1.786 -19.218   4.640
  599   2HB   LYS  71          HB1       LYS  71  -3.150 -18.720   5.633
  600   1HG   LYS  71          HG2       LYS  71  -1.439 -21.077   6.428
  601   2HG   LYS  71          HG1       LYS  71  -0.942 -19.434   6.818
  602   1HD   LYS  71          HD2       LYS  71  -3.255 -19.132   7.879
  603   2HD   LYS  71          HD1       LYS  71  -3.439 -20.879   7.727
  604   1HE   LYS  71          HE2       LYS  71  -1.217 -21.087   8.963
  605   2HE   LYS  71          HE1       LYS  71  -1.362 -19.365   9.319
  606   1HZ   LYS  71          HZ1       LYS  71  -2.300 -20.526  11.130
  607   2HZ   LYS  71          HZ2       LYS  71  -3.212 -21.539  10.115
  608   3HZ   LYS  71          HZ3       LYS  71  -3.605 -19.891  10.250
  609    HA   PRO  72           HA       PRO  72  -5.358 -20.012   1.129
  610   1HB   PRO  72          HB2       PRO  72  -7.905 -21.314   1.774
  611   2HB   PRO  72          HB1       PRO  72  -6.727 -21.742   0.526
  612   1HG   PRO  72          HG2       PRO  72  -7.194 -23.261   2.737
  613   2HG   PRO  72          HG1       PRO  72  -5.649 -23.237   1.873
  614   1HD   PRO  72          HD2       PRO  72  -6.399 -21.847   4.429
  615   2HD   PRO  72          HD1       PRO  72  -4.870 -22.636   3.977
  616    H    GLY  73           HN       GLY  73  -7.954 -19.272   0.664
  617   1HA   GLY  73          HA2       GLY  73  -9.546 -17.593   1.053
  618   2HA   GLY  73          HA1       GLY  73  -9.165 -17.725   2.769
  619    H    LYS  74           HN       LYS  74  -6.794 -16.820   3.223
  620    HA   LYS  74           HA       LYS  74  -6.877 -14.012   2.561
  621   1HB   LYS  74          HB2       LYS  74  -4.875 -15.803   3.940
  622   2HB   LYS  74          HB1       LYS  74  -4.482 -14.120   3.593
  623   1HG   LYS  74          HG2       LYS  74  -5.411 -14.304   5.847
  624   2HG   LYS  74          HG1       LYS  74  -6.528 -13.413   4.814
  625   1HD   LYS  74          HD2       LYS  74  -7.990 -15.268   4.601
  626   2HD   LYS  74          HD1       LYS  74  -6.779 -16.397   5.207
  627   1HE   LYS  74          HE2       LYS  74  -7.812 -14.138   6.924
  628   2HE   LYS  74          HE1       LYS  74  -8.653 -15.685   6.836
  629   1HZ   LYS  74          HZ1       LYS  74  -5.825 -15.268   7.634
  630   2HZ   LYS  74          HZ2       LYS  74  -6.574 -16.783   7.467
  631   3HZ   LYS  74          HZ3       LYS  74  -7.105 -15.696   8.659
  632    H    GLY  75           HN       GLY  75  -5.782 -12.908   0.964
  633   1HA   GLY  75          HA2       GLY  75  -4.417 -14.551  -1.104
  634   2HA   GLY  75          HA1       GLY  75  -4.978 -12.890  -1.306
  635    H    SER  76           HN       SER  76  -2.838 -12.354  -2.121
  636    HA   SER  76           HA       SER  76  -0.528 -12.612  -0.346
  637   1HB   SER  76          HB2       SER  76  -0.992 -11.137  -2.954
  638   2HB   SER  76          HB1       SER  76   0.546 -11.110  -2.099
  639    HG   SER  76           HG       SER  76  -0.409 -13.627  -2.310
  640    H    TYR  77           HN       TYR  77   0.083 -11.104   1.183
  641    HA   TYR  77           HA       TYR  77  -1.721  -8.867   1.695
  642   1HB   TYR  77          HB2       TYR  77   0.955  -9.373   3.020
  643   2HB   TYR  77          HB1       TYR  77  -0.404  -8.446   3.641
  644    HD1  TYR  77           HD1      TYR  77   0.836 -11.841   2.867
  645    HD2  TYR  77           HD2      TYR  77  -2.305  -9.528   4.661
  646    HE1  TYR  77           HE1      TYR  77  -0.063 -13.894   3.928
  647    HE2  TYR  77           HE2      TYR  77  -3.212 -11.581   5.722
  648    HH   TYR  77           HH       TYR  77  -3.008 -14.250   5.034
  649    H    TRP  78           HN       TRP  78  -0.949  -6.625   1.867
  650    HA   TRP  78           HA       TRP  78   1.155  -5.984  -0.176
  651   1HB   TRP  78          HB2       TRP  78  -1.339  -4.494   0.685
  652   2HB   TRP  78          HB1       TRP  78  -0.087  -3.783  -0.336
  653    HD1  TRP  78           HD1      TRP  78  -2.646  -6.656  -0.314
  654    HE1  TRP  78           HE1      TRP  78  -3.122  -7.336  -2.755
  655    HE3  TRP  78           HE3      TRP  78   0.769  -3.734  -2.719
  656    HZ2  TRP  78           HZ2      TRP  78  -2.170  -6.713  -5.390
  657    HZ3  TRP  78           HZ3      TRP  78   0.968  -3.792  -5.186
  658    HH2  TRP  78           HH2      TRP  78  -0.497  -5.269  -6.524
  659    H    THR  79           HN       THR  79   2.806  -4.608   0.444
  660    HA   THR  79           HA       THR  79   2.658  -3.296   3.115
  661    HB   THR  79           HB       THR  79   3.719  -5.567   3.362
  662    HG1  THR  79           HG1      THR  79   5.470  -3.365   3.713
  663   1HG2  THR  79          HG21      THR  79   5.989  -4.383   1.752
  664   2HG2  THR  79          HG22      THR  79   4.780  -5.454   1.044
  665   3HG2  THR  79          HG23      THR  79   5.824  -6.039   2.339
  666    H    LEU  80           HN       LEU  80   4.386  -1.662   3.381
  667    HA   LEU  80           HA       LEU  80   4.712   0.009   1.096
  668   1HB   LEU  80          HB2       LEU  80   6.371  -0.088   3.634
  669   2HB   LEU  80          HB1       LEU  80   6.337   1.251   2.491
  670    HG   LEU  80           HG       LEU  80   3.902   0.228   3.978
  671   1HD1  LEU  80          HD11      LEU  80   5.437   1.145   5.600
  672   2HD1  LEU  80          HD12      LEU  80   4.198   2.362   5.301
  673   3HD1  LEU  80          HD13      LEU  80   5.790   2.525   4.561
  674   1HD2  LEU  80          HD21      LEU  80   3.111   1.374   2.080
  675   2HD2  LEU  80          HD22      LEU  80   4.445   2.526   2.094
  676   3HD2  LEU  80          HD23      LEU  80   3.161   2.648   3.295
  677    H    ASP  81           HN       ASP  81   7.743   0.027   2.245
  678    HA   ASP  81           HA       ASP  81   8.817  -2.030   0.366
  679   1HB   ASP  81          HB2       ASP  81   8.796   0.185  -0.788
  680   2HB   ASP  81          HB1       ASP  81   9.767   0.852   0.525
  681    HA   PRO  82           HA       PRO  82  10.547  -2.085   4.745
  682   1HB   PRO  82          HB2       PRO  82  10.671  -4.960   3.875
  683   2HB   PRO  82          HB1       PRO  82  10.201  -4.278   5.445
  684   1HG   PRO  82          HG2       PRO  82   8.366  -5.179   3.779
  685   2HG   PRO  82          HG1       PRO  82   8.091  -3.678   4.685
  686   1HD   PRO  82          HD2       PRO  82   8.842  -4.023   1.795
  687   2HD   PRO  82          HD1       PRO  82   7.740  -2.843   2.541
  688    H    ASP  83           HN       ASP  83  12.349  -4.660   4.375
  689    HA   ASP  83           HA       ASP  83  14.725  -3.141   3.496
  690   1HB   ASP  83          HB2       ASP  83  14.375  -5.901   4.714
  691   2HB   ASP  83          HB1       ASP  83  15.936  -5.208   4.274
  692    H    SER  84           HN       SER  84  13.923  -3.081   1.257
  693    HA   SER  84           HA       SER  84  13.422  -5.409  -0.298
  694   1HB   SER  84          HB2       SER  84  13.673  -3.952  -2.207
  695   2HB   SER  84          HB1       SER  84  12.898  -3.034  -0.916
  696    HG   SER  84           HG       SER  84  15.499  -2.798  -0.583
  697    H    TYR  85           HN       TYR  85  16.292  -4.277   1.101
  698    HA   TYR  85           HA       TYR  85  18.260  -5.062  -0.794
  699   1HB   TYR  85          HB2       TYR  85  18.784  -3.835   1.290
  700   2HB   TYR  85          HB1       TYR  85  18.349  -5.258   2.236
  701    HD1  TYR  85           HD1      TYR  85  19.753  -7.255   2.240
  702    HD2  TYR  85           HD2      TYR  85  20.838  -3.779  -0.038
  703    HE1  TYR  85           HE1      TYR  85  22.048  -8.151   1.968
  704    HE2  TYR  85           HE2      TYR  85  23.134  -4.677  -0.313
  705    HH   TYR  85           HH       TYR  85  24.155  -7.641   1.331
  706    H    ASN  86           HN       ASN  86  16.140  -6.920   1.271
  707    HA   ASN  86           HA       ASN  86  17.616  -9.390   1.139
  708   1HB   ASN  86          HB2       ASN  86  14.714  -8.781   1.735
  709   2HB   ASN  86          HB1       ASN  86  15.382 -10.413   1.793
  710   1HD2  ASN  86          HD21      ASN  86  17.945  -9.830   2.914
  711   2HD2  ASN  86          HD22      ASN  86  17.725  -9.257   4.496
  712    H    MET  87           HN       MET  87  15.615  -7.705  -1.042
  713    HA   MET  87           HA       MET  87  14.923 -10.057  -2.643
  714   1HB   MET  87          HB2       MET  87  14.599  -7.084  -3.083
  715   2HB   MET  87          HB1       MET  87  14.245  -8.246  -4.359
  716   1HG   MET  87          HG2       MET  87  12.728  -9.418  -2.631
  717   2HG   MET  87          HG1       MET  87  12.891  -7.946  -1.674
  718   1HE   MET  87          HE1       MET  87  12.968  -5.561  -3.769
  719   2HE   MET  87          HE2       MET  87  12.161  -5.744  -2.215
  720   3HE   MET  87          HE3       MET  87  11.244  -5.200  -3.614
  721    H    PHE  88           HN       PHE  88  15.521  -9.449  -5.223
  722    HA   PHE  88           HA       PHE  88  18.277 -10.128  -5.429
  723   1HB   PHE  88          HB2       PHE  88  16.525  -8.883  -7.567
  724   2HB   PHE  88          HB1       PHE  88  17.980  -9.848  -7.825
  725    HD1  PHE  88           HD1      PHE  88  14.414  -9.929  -7.328
  726    HD2  PHE  88           HD2      PHE  88  18.006 -12.256  -6.950
  727    HE1  PHE  88           HE1      PHE  88  13.061 -12.005  -7.244
  728    HE2  PHE  88           HE2      PHE  88  16.651 -14.333  -6.870
  729    HZ   PHE  88           HZ       PHE  88  14.179 -14.207  -7.016
  730    H    GLU  89           HN       GLU  89  18.519  -8.063  -7.730
  731    HA   GLU  89           HA       GLU  89  19.364  -5.711  -6.075
  732   1HB   GLU  89          HB2       GLU  89  20.923  -7.066  -8.296
  733   2HB   GLU  89          HB1       GLU  89  21.370  -5.531  -7.550
  734   1HG   GLU  89          HG2       GLU  89  21.002  -8.111  -6.005
  735   2HG   GLU  89          HG1       GLU  89  22.564  -7.515  -6.565
  736    H    ASN  90           HN       ASN  90  17.054  -6.381  -7.980
  737    HA   ASN  90           HA       ASN  90  17.410  -4.006  -9.784
  738   1HB   ASN  90          HB2       ASN  90  17.430  -6.111 -11.079
  739   2HB   ASN  90          HB1       ASN  90  15.879  -6.557 -10.369
  740   1HD2  ASN  90          HD21      ASN  90  16.765  -3.240 -11.334
  741   2HD2  ASN  90          HD22      ASN  90  15.617  -3.119 -12.578
  742    H    GLY  91           HN       GLY  91  15.872  -2.466  -9.524
  743   1HA   GLY  91          HA2       GLY  91  13.137  -2.790  -9.137
  744   2HA   GLY  91          HA1       GLY  91  13.824  -2.757  -7.510
  745    H    SER  92           HN       SER  92  13.279  -0.747  -6.801
  746    HA   SER  92           HA       SER  92  14.010   1.619  -8.497
  747   1HB   SER  92          HB2       SER  92  12.306   2.859  -7.311
  748   2HB   SER  92          HB1       SER  92  11.584   1.365  -7.902
  749    HG   SER  92           HG       SER  92  11.015   1.268  -5.851
  750    H    PHE  93           HN       PHE  93  15.269  -0.159  -6.070
  751    HA   PHE  93           HA       PHE  93  15.954   2.013  -4.214
  752   1HB   PHE  93          HB2       PHE  93  15.671  -0.405  -3.519
  753   2HB   PHE  93          HB1       PHE  93  17.164  -0.760  -4.387
  754    HD1  PHE  93           HD1      PHE  93  15.684   0.870  -1.447
  755    HD2  PHE  93           HD2      PHE  93  19.323   0.136  -3.610
  756    HE1  PHE  93           HE1      PHE  93  17.003   1.613   0.518
  757    HE2  PHE  93           HE2      PHE  93  20.639   0.878  -1.643
  758    HZ   PHE  93           HZ       PHE  93  19.481   1.616   0.419
  759    H    LEU  94           HN       LEU  94  17.627   3.385  -4.549
  760    HA   LEU  94           HA       LEU  94  19.677   2.693  -6.615
  761   1HB   LEU  94          HB2       LEU  94  18.585   5.273  -5.505
  762   2HB   LEU  94          HB1       LEU  94  20.179   5.253  -6.256
  763    HG   LEU  94           HG       LEU  94  19.217   4.325  -8.316
  764   1HD1  LEU  94          HD11      LEU  94  16.626   4.388  -8.423
  765   2HD1  LEU  94          HD12      LEU  94  16.692   4.337  -6.661
  766   3HD1  LEU  94          HD13      LEU  94  17.381   3.020  -7.609
  767   1HD2  LEU  94          HD21      LEU  94  19.288   6.807  -7.920
  768   2HD2  LEU  94          HD22      LEU  94  17.619   6.718  -7.357
  769   3HD2  LEU  94          HD23      LEU  94  18.009   6.312  -9.028