*HEADER    CARRIER PROTEIN                         24-OCT-02   1O78
*TITLE     BIOTIN CARBOXYL CARRIER DOMAIN OF TRANSCARBOXYLASE (1.3S)
*TITLE    2 [10-48] DELETION MUTANT
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: BIOTIN CARBOXYL CARRIER PROTEIN OF
*COMPND   3  METHYLMALONYL-COA CARBOXYL-TRANSFERASE;
*COMPND   4 SYNONYM: TRANSCARBOXYLASE, 1.3S SUBUNIT;
*COMPND   5 CHAIN: A;
*COMPND   6 ENGINEERED: YES;
*COMPND   7 OTHER_DETAILS: RESIDUES 10-48 DELETION MUTANT;
*COMPND   8 MUTATION: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: PROPIONIBACTERIUM FREUDENREICHII
*SOURCE   3  SHERMANII;
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   5 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;
*SOURCE   6 EXPRESSION_SYSTEM_PLASMID: PTAC1.3DELTA10-48, PCY216
*KEYWDS    TRANSCARBOXYLASE,CARBOXYL CARRIER, TRANSFERASE
*EXPDTA    NMR, 20 STRUCTURES
*AUTHOR    M.M.JANK,J.D.SADOWSKY,C.PEIKERT,S.BERGER
*REVDAT   1   21-NOV-02 1O78    0




!Same restraint set as Jack_Run22 with additional H-bond constraints added
!based on if 5 or more structures of the 10 lowest energy structures from 
!Run23 (BEFORE minimization w/o NOEs --> i.e., not *XNOE* structures) showed
!the H-bond (calculated with MolMol using default H-bond definition - d<2.4
!a<35.0)

assign  (resid  12  and name HN)  (resid  78 and name  HA)  5  3.3  0
assign  (resid  13  and name HN)  (resid  79 and name  HN)  5  3.3  0
assign  (resid  14  and name HN)  (resid  17 and name  HB1)  3.5  1.8  0
assign  (resid  14  and name HN)  (resid  17 and name  HB2)  5  3.3  0
assign  (resid  14  and name HN)  (resid  17 and name  HG2)  5  3.3  0
assign  (resid  17  and name HN)  (resid  82 and name  HG1)  5  3.3  0
assign  (resid  17  and name HN)  (resid  15 and name  HN)  5  3.3  0
assign  (resid  18  and name HN)  (resid  80 and name  HN)  5  3.3  0
assign  (resid  18  and name HN)  (resid  81 and name  HN)  3.5  1.8  0
assign  (resid  20  and name HN)  (resid  77 and name  HN)  5  3.3  0
assign  (resid  20  and name HN)  (resid  78 and name  HN)  3.5  1.8  0
assign  (resid  20  and name HN)  (resid  80 and name  HD#)  5.0 3.3  0
assign  (resid  20  and name HN)  (resid  80 and name  HG)  3.5  1.8  0
assign  (resid  22  and name HN)  (resid  76 and name  HA2)  5  3.3  0
assign  (resid  22  and name HN)  (resid  77 and name  HN)  5  3.3  0
assign  (resid  23  and name HN)  (resid  76 and name  HA1)  5  3.3  0
assign  (resid  23  and name HN)  (resid  76 and name  HA2)  5  3.3  0
assign  (resid  24  and name HN)  (resid  74 and name  HG#)  5.0  3.3  0
assign  (resid  24  and name HN)  (resid  74 and name  HN)  3.5  1.8  0
assign  (resid  24  and name HN)  (resid  75 and name  HA)  5  3.3  0
assign  (resid  24  and name HN)  (resid  76 and name  HN)  5  3.3  0
assign  (resid  25  and name HN)  (resid  46 and name  HA)  5.0 3.3  0
assign  (resid  25  and name HN)  (resid  47 and name  HB1)  5.0  3.3  0
assign  (resid  25  and name HN)  (resid  47 and name  HN)  3.5  1.8  0
assign  (resid  25  and name HN)  (resid  48 and name  HB*)  5  3.3  0
assign  (resid  25  and name HN)  (resid  46 and name  HD#)  5  3.3  0
assign  (resid  26  and name HN)  (resid  73 and name  HA)  3.5  1.8  0
assign  (resid  27  and name HN)  (resid  45 and name  HB)  5  3.3  0
assign  (resid  27  and name HN)  (resid  46 and name  HA)  3.5  1.8  0
assign  (resid  27  and name HN)  (resid  47 and name  HN)  5  3.3  0
assign  (resid  28  and name HN)  (resid  26 and name  HG1*)  5.0  3.3  0
assign  (resid  28  and name HN)  (resid  45 and name  HB)  3.5  1.8  0
assign  (resid  28  and name HN)  (resid  45 and name  HN)  3.5  1.8  0
assign  (resid  28  and name HN)  (resid  46 and name  HA)  5  3.3  0
assign  (resid  28  and name HN)  (resid  70 and name  HG1)  5  3.3  0
assign  (resid  28  and name HN)  (resid  70 and name  HG2)  5  3.3  0
assign  (resid  29  and name HN)  (resid  70 and name  HG1)  5.0 3.3  0
assign  (resid  29  and name HN)  (resid  70 and name  HG2)  3.5  1.8  0
assign  (resid  30  and name HN)  (resid  44 and name  HA)  3.5  1.8  0
assign  (resid  31  and name HN)  (resid  29 and name  HA)  5.0 3.3  0
assign  (resid  31  and name HN)  (resid  29 and name  HG1*)  3.5  1.8  0
assign  (resid  32  and name HN)  (resid  35 and name  HB1)  3.5  1.8  0
assign  (resid  32  and name HN)  (resid  35 and name  HB2)  5.0 3.3 0
assign  (resid  32  and name HN)  (resid  35 and name  HN)  5  3.3  0
assign  (resid  34  and name HN)  (resid  62 and name  HG2)  5  3.3  0
assign  (resid  34  and name HN)  (resid  63 and name  HB)  3.5  1.8  0
assign  (resid  34  and name HN)  (resid  63 and name  HG1*)  5  3.3  0
assign  (resid  34  and name HN)  (resid  63 and name  HG2*)  5  3.3  0
assign  (resid  34  and name HN)  (resid  64 and name  HA)  5  3.3  0
assign  (resid  35  and name HN)  (resid  32 and name  HN)  5.0 3.3 0
assign  (resid  35  and name HN)  (resid  63 and name  HB)  3.5  1.8  0
assign  (resid  35  and name HN)  (resid  63 and name  HG1*)  5.0 3.3 0
assign  (resid  35  and name HN)  (resid  63 and name  HG2*)  5  3.3  0
assign  (resid  36  and name HN)  (resid  62 and name  HA)  5  3.3  0
assign  (resid  37  and name HN)  (resid  61 and name  HN)  3.5  1.8  0
assign  (resid  37  and name HN)  (resid  62 and name  HA)  3.5  1.8  0
assign  (resid  38  and name HN)  (resid  41 and name  HB1)  3.5  1.8  0
assign  (resid  38  and name HN)  (resid  41 and name  HB2)  3.5  1.8  0
assign  (resid  38  and name HN)  (resid  41 and name  HN)  5  3.3  0
assign  (resid  39  and name HN)  (resid  59 and name  HA)  5  3.3  0
assign  (resid  39  and name HN)  (resid  60 and name  HA)  3.5  1.8  0
assign  (resid  39  and name HN)  (resid  60 and name  HB1)  5  3.3  0
assign  (resid  39  and name HN)  (resid  60 and name  HB2)  5  3.3  0
assign  (resid  39  and name HN)  (resid  60 and name  HN)  3.5  1.8  0
assign  (resid  40  and name HN)  (resid  56 and name  HB1)  5  3.3  0
assign  (resid  40  and name HN)  (resid  56 and name  HB2)  5  3.3  0
assign  (resid  40  and name HN)  (resid  57 and name  HB*)  5  3.3  0
assign  (resid  40  and name HN)  (resid  57 and name  HN)  5  3.3  0
assign  (resid  40  and name HN)  (resid  59 and name  HA)  5.0 3.3 0
assign  (resid  40  and name HN)  (resid  59 and name  HN)  5  3.3  0
assign  (resid  41  and name HE22)  (resid  37 and name  HA)  3.5  1.8  0
assign  (resid  41  and name HN)  (resid  38 and name  HB1)  5.0 3.3  0
assign  (resid  41  and name HN)  (resid  57 and name  HB*)  5.0 3.3  0
assign  (resid  41  and name HN)  (resid  57 and name  HN)  5  3.3  0
assign  (resid  42  and name HN)  (resid  56 and name  HA)  5  3.3  0
assign  (resid  43  and name HN)  (resid  30 and name  HB2)  5  3.3  0
assign  (resid  43  and name HN)  (resid  55 and name  HA)  5  3.3  0
assign  (resid  43  and name HN)  (resid  55 and name  HN)  5.0 3.3  0
assign  (resid  43  and name HN)  (resid  56 and name  HA)  3.5  1.8  0
assign  (resid  44  and name HN)  (resid  55 and name  HG1#)  5  3.3  0
assign  (resid  44  and name HN)  (resid  42 and name  HG2*)  5.0 3.3 0
assign  (resid  44  and name HN)  (resid  55 and name  HB)  3.5  1.8  0
assign  (resid  44  and name HN)  (resid  55 and name  HN)  3.5  1.8  0
assign  (resid  44  and name HN)  (resid  56 and name  HA)  5  3.3  0
assign  (resid  45  and name HN)  (resid  28 and name  HN)  3.5  1.8  0
assign  (resid  45  and name HN)  (resid  29 and name  HA)  3.5  1.8  0
assign  (resid  45  and name HN)  (resid  55 and name  HG1#)  5.0 3.3  0
assign  (resid  45  and name HN)  (resid  30 and name  HD1*)  5  3.3  0
assign  (resid  45  and name HN)  (resid  30 and name  HN)  5  3.3  0
assign  (resid  46  and name HN)  (resid  53 and name  HB)  5.0 3.3  0
assign  (resid  46  and name HN)  (resid  53 and name  HG2*)  5  3.3  0
assign  (resid  46  and name HN)  (resid  53 and name  HN)  3.5  1.8  0
assign  (resid  46  and name HN)  (resid  54 and name  HA)  5  3.3  0
assign  (resid  47  and name HN)  (resid  24 and name  HA1)  5  3.3  0
assign  (resid  47  and name HN)  (resid  24 and name  HA2)  5  3.3  0
assign  (resid  47  and name HN)  (resid  25 and name  HA)  5  3.3  0
assign  (resid  47  and name HN)  (resid  25 and name  HB)  5.0 3.3  0
assign  (resid  47  and name HN)  (resid  25 and name  HN)  3.5  1.8  0
assign  (resid  48  and name HN)  (resid  51 and name  HN)  3.5  1.8  0
assign  (resid  48  and name HN)  (resid  53 and name  HN)  5  3.3  0
assign  (resid  49  and name HN)  (resid  51 and name  HN)  5  3.3  0
assign  (resid  50  and name HN)  (resid  48 and name  HA)  5  3.3  0
assign  (resid  51  and name HN)  (resid  47 and name  HA)  5  3.3  0
assign  (resid  51  and name HN)  (resid  49 and name  HA)  5  3.3  0
assign  (resid  53  and name HN)  (resid  45 and name  HA)  5  3.3  0
assign  (resid  53  and name HN)  (resid  45 and name  HG#)  6  4.3  0
assign  (resid  53  and name HN)  (resid  46 and name  HB#)  5.0 3.3  0
assign  (resid  53  and name HN)  (resid  46 and name  HN)  3.5  1.8  0
assign  (resid  55  and name HN)  (resid  44 and name  HB2)  5  3.3  0
assign  (resid  55  and name HN)  (resid  44 and name  HN)  3.5  1.8  0
assign  (resid  55  and name HN)  (resid  45 and name  HA)  3.5  1.8  0
assign  (resid  56  and name HN)  (resid  42 and name  HA)  3.5  1.8  0
assign  (resid  57  and name HN)  (resid  40 and name  HA2)  5  3.3  0
assign  (resid  57  and name HN)  (resid  41 and name  HB2)  5  3.3  0
assign  (resid  57  and name HN)  (resid  41 and name  HN)  3.5  1.8  0
assign  (resid  57  and name HN)  (resid  42 and name  HA)  3.5  1.8  0
assign  (resid  57  and name HN)  (resid  43 and name  HG1*)  5.0 3.3  0
assign  (resid  59  and name HN)  (resid  39 and name  HA)  5.0 3.3  0
assign  (resid  59  and name HN)  (resid  40 and name  HN)  5  3.3  0
assign  (resid  59  and name HN)  (resid  57 and name  HB*)  5  3.3  0
assign  (resid  59  and name HN)  (resid  83 and name  HD*)  5  3.3  0
assign  (resid  60  and name HN)  (resid  39 and name  HA)  5  3.3  0
assign  (resid  60  and name HN)  (resid  39 and name  HB*)  5.0 3.3 0
assign  (resid  60  and name HN)  (resid  39 and name  HN)  3.5  1.8  0
assign  (resid  61  and name HN)  (resid  36 and name  HG2*)  5  3.3  0
assign  (resid  61  and name HN)  (resid  37 and name  HB)  5  3.3  0
assign  (resid  61  and name HN)  (resid  37 and name  HG2*)  3.5  1.8  0
assign  (resid  61  and name HN)  (resid  37 and name  HN)  3.5  1.8  0
assign  (resid  61  and name HN)  (resid  38 and name  HA)  3.5  1.8  0
assign  (resid  63  and name HN)  (resid  33 and name  HA)  5  3.3  0
assign  (resid  63  and name HN)  (resid  35 and name  HB1)  5  3.3  0
assign  (resid  63  and name HN)  (resid  35 and name  HB2)  5  3.3  0
assign  (resid  63  and name HN)  (resid  35 and name  HN)  5  3.3  0
assign  (resid  63  and name HN)  (resid  36 and name  HA)  3.5  1.8  0
assign  (resid  64  and name HN)  (resid  82 and name  HB2)  5  3.3  0
assign  (resid  64  and name HN)  (resid  82 and name  HG1)  5  3.3  0
assign  (resid  64  and name HN)  (resid  82 and name  HN)  5  3.3  0
assign  (resid  64  and name HN)  (resid  83 and name  HA)  3.5  1.8  0
assign  (resid  65  and name HN)  (resid  63 and name  HA)  5.0 3.3 0
assign  (resid  65  and name HN)  (resid  63 and name  HG1*)  5  3.3  0
assign  (resid  65  and name HN)  (resid  63 and name  HG2*)  5  3.3  0
assign  (resid  65  and name HN)  (resid  82 and name  HB1)  3.5  1.8  0
assign  (resid  65  and name HN)  (resid  82 and name  HN)  3.5  1.8  0
assign  (resid  65  and name HN)  (resid  83 and name  HA)  5.0 3.3  0
assign  (resid  66  and name HN)  (resid  63 and name  HG2*)  5  3.3  0
assign  (resid  67  and name HN)  (resid  81 and name  HA)  3.5  1.8  0
assign  (resid  67  and name HN)  (resid  82 and name  HN)  5  3.3  0
assign  (resid  69  and name HN)  (resid  72 and name  HB1)  3.5  1.8  0
assign  (resid  69  and name HN)  (resid  72 and name  HN)  5  3.3  0
assign  (resid  71  and name HN)  (resid  26 and name  HG2*)  5  3.3  0
assign  (resid  71  and name HN)  (resid  26 and name  HB)  3.5  1.8  0
assign  (resid  71  and name HN)  (resid  26 and name  HG1*)  5  3.3  0
assign  (resid  71  and name HN)  (resid  27 and name  HA)  5  3.3  0
assign  (resid  72  and name HN)  (resid  26 and name  HG2*)  5  3.3  0
assign  (resid  74  and name HN)  (resid  24 and name  HN)  3.5  1.8  0
assign  (resid  74  and name HN)  (resid  25 and name  HA)  3.5  1.8  0
assign  (resid  74  and name HN)  (resid  25 and name  HG2*)  5  3.3  0
assign  (resid  76  and name HN)  (resid  23 and name  HA)  3.5  1.8  0
assign  (resid  76  and name HN)  (resid  23 and name  HB*)  3.5  1.8  0
assign  (resid  76  and name HN)  (resid  23 and name  HN)  5.0 3.3 0
assign  (resid  77  and name HN)  (resid  19 and name  HA)  5  3.3  0
assign  (resid  77  and name HN)  (resid  19 and name  HB1)  5  3.3  0
assign  (resid  77  and name HN)  (resid  20 and name  HB*)  5.0 3.3 0
assign  (resid  77  and name HN)  (resid  20 and name  HN)  5  3.3  0
assign  (resid  77  and name HN)  (resid  21 and name  HA)  5.0 3.3 0
assign  (resid  77  and name HN)  (resid  22 and name  HN)  5  3.3  0
assign  (resid  78  and name HN)  (resid  20 and name  HB*)  5.0 3.3  0
assign  (resid  78  and name HN)  (resid  20 and name  HN)  3.5  1.8  0
assign  (resid  78  and name HN)  (resid  76 and name  HA2)  5  3.3  0
assign  (resid  79  and name HN)  (resid  13 and name  HA)  3.5  1.8  0
assign  (resid  79  and name HN)  (resid  13 and name  HB*)  5  3.3  0
assign  (resid  79  and name HN)  (resid  13 and name  HN)  5  3.3  0
assign  (resid  79  and name HN)  (resid  19 and name  HA)  5  3.3  0
assign  (resid  79  and name HN)  (resid  67 and name  HD1*)  5  3.3  0
assign  (resid  79  and name HN)  (resid  67 and name  HD2*)  5  3.3  0
assign  (resid  80  and name HN)  (resid  17 and name  HB2)  5  3.3  0
assign  (resid  80  and name HN)  (resid  19 and name  HA)  3.5  1.8  0
assign  (resid  80  and name HN)  (resid  67 and name  HD1*)  5  3.3  0
assign  (resid  81  and name HN)  (resid  17 and name  HA)  5.0 3.3  0
assign  (resid  81  and name HN)  (resid  18 and name  HD*)  5.0  3.3  0
assign  (resid  81  and name HN)  (resid  67 and name  HD1*)  5  3.3  0
assign  (resid  81  and name HN)  (resid  79 and name  HA#)  5  3.3  0
assign  (resid  82  and name HN)  (resid  64 and name  HN)  5  3.3  0
assign  (resid  82  and name HN)  (resid  65 and name  HN)  3.5  1.8  0
assign  (resid  82  and name HN)  (resid  66 and name  HA)  5  3.3  0
assign  (resid  82  and name HN)  (resid  67 and name  HD1*)  5  3.3  0
assign  (resid  82  and name HN)  (resid  67 and name  HN)  5  3.3  0
assign  (resid  83  and name HN)  (resid  16 and name  HA1)  5  3.3  0
assign  (resid  83  and name HN)  (resid  16 and name  HA2)  5  3.3  0
assign  (resid  83  and name HN)  (resid  18 and name  HD*)  5  3.3  0
assign  (resid  83  and name HN)  (resid  64 and name  HG1)  5  3.3  0
assign  (resid  84  and name HN)  (resid  64 and name  HG1)  3.5  1.8  0
assign  (resid  84  and name HN)  (resid  64 and name  HG2)  5  3.3  0
!
!H-bond constraints
!
assign (resid 20 and name HN )  (resid 78 and name O ) 2.1 0.3 0.3
assign (resid 20 and name N )  (resid 78 and name O ) 2.9 0.5 0.5
assign (resid 31 and name HN )  (resid 43 and name O ) 2.1 0.3 0.3
assign (resid 31 and name N )  (resid 43 and name O ) 2.9 0.3 0.3
assign (resid 37 and name HN )  (resid 61 and name O ) 2.1 0.3 0.3
assign (resid 37 and name N )  (resid 61 and name O ) 2.9 0.5 0.5
assign (resid 43 and name HN )  (resid 55 and name O ) 2.1 0.3 0.3
assign (resid 43 and name N )  (resid 55 and name O ) 2.9 0.5 0.5
assign (resid 44 and name HN )  (resid 55 and name O ) 2.1 0.3 0.3
assign (resid 44 and name N )  (resid 55 and name O ) 2.9 0.5 0.5
assign (resid 45 and name HN )  (resid 28 and name O ) 2.1 0.3 0.3
assign (resid 45 and name N )  (resid 28 and name O ) 2.9 0.5 0.5
assign (resid 46 and name HN )  (resid 53 and name O ) 2.1 0.3 0.3
assign (resid 46 and name N )  (resid 53 and name O ) 2.9 0.5 0.5
assign (resid 55 and name HN )  (resid 44 and name O ) 2.1 0.3 0.3
assign (resid 55 and name N )  (resid 44 and name O ) 2.9 0.5 0.5
assign (resid 57 and name HN )  (resid 41 and name O ) 2.1 0.3 0.3
assign (resid 57 and name N )  (resid 41 and name O ) 2.9 0.5 0.5
assign (resid 63 and name HN )  (resid 35 and name O ) 2.1 0.3 0.3
assign (resid 63 and name N )  (resid 35 and name O ) 2.9 0.5 0.5
assign (resid 68 and name HN )  (resid 80 and name O ) 2.1 0.3 0.3
assign (resid 68 and name N )  (resid 80 and name O ) 2.9 0.5 0.5
assign (resid 74 and name HN )  (resid 24 and name O ) 2.1 0.3 0.3
assign (resid 74 and name N )  (resid 24 and name O ) 2.9 0.5 0.5
assign (resid 82 and name HN )  (resid 65 and name O ) 2.1 0.3 0.3
assign (resid 82 and name N )  (resid 65 and name O ) 2.9 0.5 0.5
!
!additional H-bond constraints
!
assign (resid 27 and name HN )  (resid 45 and name O ) 2.1 0.3 0.3
assign (resid 27 and name N )  (resid 45 and name O ) 2.9 0.5 0.5
assign (resid 30 and name HN )  (resid 43 and name O ) 2.1 0.3 0.3
assign (resid 30 and name N )  (resid 43 and name O ) 2.9 0.5 0.5
assign (resid 53 and name HN )  (resid 46 and name O ) 2.1 0.3 0.3
assign (resid 53 and name N )  (resid 46 and name O ) 2.9 0.5 0.5
assign (resid 61 and name HN )  (resid 37 and name O ) 2.1 0.3 0.3
assign (resid 61 and name N )  (resid 37 and name O ) 2.9 0.5 0.5
assign (resid 64 and name HN )  (resid 82 and name O ) 2.1 0.3 0.3
assign (resid 64 and name N )  (resid 82 and name O ) 2.9 0.5 0.5
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   MET   1          1H        MET   1   7.369 -12.751  29.771
    2    H2   MET   1          3H        MET   1   5.796 -13.279  30.122
    3    H3   MET   1          2H        MET   1   7.044 -14.413  29.916
    4    HA   MET   1           HA       MET   1   7.212 -13.954  27.596
    5   1HB   MET   1          2HB       MET   1   4.528 -14.399  28.870
    6   2HB   MET   1          1HB       MET   1   4.643 -14.331  27.112
    7   1HG   MET   1          2HG       MET   1   6.716 -15.995  28.374
    8   2HG   MET   1          1HG       MET   1   5.075 -16.590  28.624
    9   1HE   MET   1          1HE       MET   1   7.749 -17.287  27.277
   10   2HE   MET   1          3HE       MET   1   7.354 -18.239  25.840
   11   3HE   MET   1          2HE       MET   1   7.983 -16.601  25.671
   12    QB   MET   1           QB       MET   1   4.585 -14.365  27.991
   13    QG   MET   1           QG       MET   1   5.896 -16.293  28.499
   14    ME   MET   1           QE       MET   1   7.695 -17.376  26.263
   15    H    LYS   2           H        LYS   2   4.299 -12.162  28.670
   16    HA   LYS   2           HA       LYS   2   5.276  -9.761  27.194
   17   1HB   LYS   2          2HB       LYS   2   3.031  -9.661  26.069
   18   2HB   LYS   2          1HB       LYS   2   3.974 -11.078  25.604
   19   1HG   LYS   2          2HG       LYS   2   2.309 -11.505  27.990
   20   2HG   LYS   2          1HG       LYS   2   1.382 -11.153  26.532
   21   1HD   LYS   2          2HD       LYS   2   3.603 -13.032  26.095
   22   2HD   LYS   2          1HD       LYS   2   2.369 -13.635  27.202
   23   1HE   LYS   2          2HE       LYS   2   0.619 -13.258  25.551
   24   2HE   LYS   2          1HE       LYS   2   1.775 -12.477  24.454
   25   1HZ   LYS   2          3HZ       LYS   2   3.104 -14.541  24.529
   26   2HZ   LYS   2          2HZ       LYS   2   1.868 -15.283  25.430
   27   3HZ   LYS   2          1HZ       LYS   2   1.573 -14.773  23.835
   28    QB   LYS   2           QB       LYS   2   3.503 -10.369  25.836
   29    QD   LYS   2           QD       LYS   2   2.986 -13.333  26.649
   30    QG   LYS   2           QG       LYS   2   1.846 -11.329  27.261
   31    QE   LYS   2           QE       LYS   2   1.197 -12.867  25.003
   32    QZ   LYS   2           QZ       LYS   2   2.182 -14.866  24.598
   33    H    LEU   3           H        LEU   3   3.785  -7.851  27.670
   34    HA   LEU   3           HA       LEU   3   2.374  -8.136  30.296
   35   1HB   LEU   3          2HB       LEU   3   4.788  -6.596  29.547
   36   2HB   LEU   3          1HB       LEU   3   3.592  -5.694  30.479
   37    HG   LEU   3           HG       LEU   3   4.338  -8.458  31.368
   38   1HD1  LEU   3          3HD1      LEU   3   5.975  -5.939  31.743
   39   2HD1  LEU   3          2HD1      LEU   3   6.119  -7.340  32.804
   40   3HD1  LEU   3          1HD1      LEU   3   6.514  -7.487  31.092
   41   1HD2  LEU   3          2HD2      LEU   3   3.375  -5.894  32.647
   42   2HD2  LEU   3          1HD2      LEU   3   2.557  -7.456  32.589
   43   3HD2  LEU   3          3HD2      LEU   3   3.984  -7.243  33.605
   44    MD1  LEU   3           QD1      LEU   3   6.203  -6.922  31.880
   45    MD2  LEU   3           QD2      LEU   3   3.305  -6.864  32.947
   46    QB   LEU   3           QB       LEU   3   4.190  -6.145  30.013
   47    QD   LEU   3           QQD      LEU   3   4.754  -6.893  32.413
   48    H    LYS   4           H        LYS   4   0.743  -6.480  30.635
   49    HA   LYS   4           HA       LYS   4  -0.041  -5.029  28.126
   50   1HB   LYS   4          2HB       LYS   4  -1.427  -7.015  28.841
   51   2HB   LYS   4          1HB       LYS   4  -1.816  -6.140  30.322
   52   1HG   LYS   4          2HG       LYS   4  -2.384  -4.246  28.438
   53   2HG   LYS   4          1HG       LYS   4  -2.814  -5.721  27.572
   54   1HD   LYS   4          2HD       LYS   4  -4.800  -5.152  28.708
   55   2HD   LYS   4          1HD       LYS   4  -4.071  -6.381  29.742
   56   1HE   LYS   4          2HE       LYS   4  -3.031  -4.537  31.106
   57   2HE   LYS   4          1HE       LYS   4  -3.957  -3.371  30.138
   58   1HZ   LYS   4          1HZ       LYS   4  -5.965  -4.738  30.681
   59   2HZ   LYS   4          3HZ       LYS   4  -5.021  -5.580  31.811
   60   3HZ   LYS   4          2HZ       LYS   4  -5.290  -3.915  32.006
   61    QB   LYS   4           QB       LYS   4  -1.621  -6.578  29.581
   62    QD   LYS   4           QD       LYS   4  -4.436  -5.766  29.225
   63    QG   LYS   4           QG       LYS   4  -2.599  -4.983  28.005
   64    QE   LYS   4           QE       LYS   4  -3.494  -3.954  30.622
   65    QZ   LYS   4           QZ       LYS   4  -5.425  -4.744  31.499
   66    H    VAL   5           H        VAL   5   0.115  -2.840  28.411
   67    HA   VAL   5           HA       VAL   5  -0.519  -1.712  31.116
   68    HB   VAL   5           HB       VAL   5   1.358  -0.127  30.704
   69   1HG1  VAL   5          1HG1      VAL   5   2.016  -3.080  30.513
   70   2HG1  VAL   5          3HG1      VAL   5   3.200  -1.830  30.894
   71   3HG1  VAL   5          2HG1      VAL   5   1.848  -2.125  31.986
   72   1HG2  VAL   5          2HG2      VAL   5   1.050  -0.835  28.074
   73   2HG2  VAL   5          1HG2      VAL   5   2.474  -0.020  28.723
   74   3HG2  VAL   5          3HG2      VAL   5   2.475  -1.772  28.523
   75    MG1  VAL   5           QG1      VAL   5   2.354  -2.345  31.131
   76    MG2  VAL   5           QG2      VAL   5   1.999  -0.876  28.440
   77    QG   VAL   5           QQG      VAL   5   2.177  -1.611  29.786
   78    H    THR   6           H        THR   6  -2.292  -1.940  28.814
   79    HA   THR   6           HA       THR   6  -3.799  -0.587  27.597
   80    HB   THR   6           HB       THR   6  -2.741   1.792  29.090
   81    HG1  THR   6           HG1      THR   6  -4.139  -0.397  30.227
   82   1HG2  THR   6          2HG2      THR   6  -4.792   1.764  27.566
   83   2HG2  THR   6          1HG2      THR   6  -5.565   0.761  28.794
   84   3HG2  THR   6          3HG2      THR   6  -5.043   2.398  29.192
   85    MG   THR   6           QG2      THR   6  -5.134   1.641  28.517
   86    H    VAL   7           H        VAL   7  -3.819   1.090  25.892
   87    HA   VAL   7           HA       VAL   7  -1.105   2.046  25.067
   88    HB   VAL   7           HB       VAL   7  -3.164   0.664  23.313
   89   1HG1  VAL   7          2HG1      VAL   7  -1.684   2.369  22.208
   90   2HG1  VAL   7          1HG1      VAL   7  -0.287   1.432  22.739
   91   3HG1  VAL   7          3HG1      VAL   7  -1.440   0.730  21.604
   92   1HG2  VAL   7          2HG2      VAL   7  -0.633  -0.306  24.652
   93   2HG2  VAL   7          1HG2      VAL   7  -2.244  -1.019  24.722
   94   3HG2  VAL   7          3HG2      VAL   7  -1.304  -1.108  23.232
   95    MG1  VAL   7           QG1      VAL   7  -1.137   1.510  22.184
   96    MG2  VAL   7           QG2      VAL   7  -1.394  -0.811  24.202
   97    QG   VAL   7           QQG      VAL   7  -1.265   0.350  23.193
   98    H    ASN   8           H        ASN   8  -2.376   4.001  26.103
   99    HA   ASN   8           HA       ASN   8  -4.157   5.259  24.047
  100   1HB   ASN   8          2HB       ASN   8  -4.938   4.781  26.434
  101   2HB   ASN   8          1HB       ASN   8  -3.785   6.007  26.959
  102   1HD2  ASN   8          1HD2      ASN   8  -5.374   7.579  27.613
  103   2HD2  ASN   8          2HD2      ASN   8  -6.404   8.347  26.503
  104    QB   ASN   8           QB       ASN   8  -4.361   5.394  26.696
  105    QD   ASN   8           QD2      ASN   8  -5.889   7.963  27.058
  106    H    GLY   9           H        GLY   9  -3.392   7.081  23.023
  107   1HA   GLY   9          1HA       GLY   9  -0.848   8.262  24.055
  108   2HA   GLY   9          2HA       GLY   9  -2.176   9.299  23.533
  109    QA   GLY   9           QA       GLY   9  -1.512   8.780  23.794
  110    H    ALA  10           H        ALA  10  -1.419   6.284  21.902
  111    HA   ALA  10           HA       ALA  10  -0.923   7.781  19.401
  112   1HB   ALA  10          2HB       ALA  10   1.325   7.526  19.439
  113   2HB   ALA  10          1HB       ALA  10   1.165   7.007  21.116
  114   3HB   ALA  10          3HB       ALA  10   1.174   5.811  19.820
  115    MB   ALA  10           QB       ALA  10   1.221   6.781  20.125
  116    H    GLY  11           H        GLY  11  -0.128   5.840  17.734
  117   1HA   GLY  11          1HA       GLY  11  -1.709   4.321  16.546
  118   2HA   GLY  11          2HA       GLY  11  -2.146   3.665  18.124
  119    QA   GLY  11           QA       GLY  11  -1.927   3.993  17.335
  120    H    LYS  12           H        LYS  12  -0.564   2.799  15.458
  121    HA   LYS  12           HA       LYS  12   1.694   1.456  16.900
  122   1HB   LYS  12          2HB       LYS  12  -0.463   0.292  15.118
  123   2HB   LYS  12          1HB       LYS  12   1.012  -0.585  15.525
  124   1HG   LYS  12          2HG       LYS  12   0.387  -0.905  17.711
  125   2HG   LYS  12          1HG       LYS  12  -0.490   0.624  17.793
  126   1HD   LYS  12          2HD       LYS  12  -1.574  -1.470  15.967
  127   2HD   LYS  12          1HD       LYS  12  -1.766  -1.732  17.700
  128   1HE   LYS  12          2HE       LYS  12  -2.714   0.632  17.841
  129   2HE   LYS  12          1HE       LYS  12  -2.767   0.618  16.066
  130   1HZ   LYS  12          1HZ       LYS  12  -3.916  -1.542  17.745
  131   2HZ   LYS  12          3HZ       LYS  12  -4.830  -0.228  17.184
  132   3HZ   LYS  12          2HZ       LYS  12  -4.126  -1.305  16.076
  133    QB   LYS  12           QB       LYS  12   0.275  -0.147  15.321
  134    QD   LYS  12           QD       LYS  12  -1.670  -1.601  16.834
  135    QG   LYS  12           QG       LYS  12  -0.052  -0.141  17.752
  136    QE   LYS  12           QE       LYS  12  -2.741   0.625  16.954
  137    QZ   LYS  12           QZ       LYS  12  -4.290  -1.025  17.002
  138    H    ALA  13           H        ALA  13   1.514   3.771  14.951
  139    HA   ALA  13           HA       ALA  13   2.290   3.061  12.325
  140   1HB   ALA  13          1HB       ALA  13   3.550   5.375  13.759
  141   2HB   ALA  13          3HB       ALA  13   2.803   5.327  12.162
  142   3HB   ALA  13          2HB       ALA  13   1.794   5.336  13.608
  143    MB   ALA  13           QB       ALA  13   2.715   5.346  13.176
  144    H    GLY  14           H        GLY  14   4.047   1.897  11.664
  145   1HA   GLY  14          1HA       GLY  14   6.073   0.668  11.971
  146   2HA   GLY  14          2HA       GLY  14   6.317   1.504  13.507
  147    QA   GLY  14           QA       GLY  14   6.195   1.086  12.739
  148    H    GLU  15           H        GLU  15   7.839   1.153  10.734
  149    HA   GLU  15           HA       GLU  15   8.595   4.049  10.494
  150   1HB   GLU  15          2HB       GLU  15  10.152   2.452  11.760
  151   2HB   GLU  15          1HB       GLU  15  10.436   1.663  10.208
  152   1HG   GLU  15          2HG       GLU  15  10.818   4.247   9.489
  153   2HG   GLU  15          1HG       GLU  15  11.343   4.319  11.172
  154    QB   GLU  15           QB       GLU  15  10.294   2.058  10.984
  155    QG   GLU  15           QG       GLU  15  11.080   4.283  10.331
  156    H    GLY  16           H        GLY  16   7.713   4.593   8.502
  157   1HA   GLY  16          1HA       GLY  16   8.304   2.753   6.216
  158   2HA   GLY  16          2HA       GLY  16   8.441   4.505   6.075
  159    QA   GLY  16           QA       GLY  16   8.372   3.629   6.145
  160    H    GLU  17           H        GLU  17   5.874   2.923   7.886
  161    HA   GLU  17           HA       GLU  17   3.868   2.668   5.940
  162   1HB   GLU  17          2HB       GLU  17   2.397   2.587   7.805
  163   2HB   GLU  17          1HB       GLU  17   3.948   2.054   8.446
  164   1HG   GLU  17          2HG       GLU  17   2.837   4.872   8.660
  165   2HG   GLU  17          1HG       GLU  17   2.857   3.682   9.960
  166    QB   GLU  17           QB       GLU  17   3.172   2.320   8.126
  167    QG   GLU  17           QG       GLU  17   2.847   4.277   9.310
  168    H    ILE  18           H        ILE  18   1.898   4.149   5.724
  169    HA   ILE  18           HA       ILE  18   2.753   7.027   5.661
  170    HB   ILE  18           HB       ILE  18   0.980   5.478   3.742
  171   1HG1  ILE  18          2HG1      ILE  18   3.330   6.489   2.503
  172   2HG1  ILE  18          1HG1      ILE  18   3.843   5.665   3.976
  173   1HG2  ILE  18          1HG2      ILE  18   1.955   8.332   3.867
  174   2HG2  ILE  18          3HG2      ILE  18   1.473   7.594   2.339
  175   3HG2  ILE  18          2HG2      ILE  18   0.305   7.745   3.653
  176   1HD1  ILE  18          1HD1      ILE  18   1.957   4.453   1.936
  177   2HD1  ILE  18          3HD1      ILE  18   3.695   4.153   1.970
  178   3HD1  ILE  18          2HD1      ILE  18   2.686   3.641   3.322
  179    MG   ILE  18           QG2      ILE  18   1.244   7.890   3.286
  180    MD   ILE  18           QD1      ILE  18   2.780   4.083   2.409
  181    QG   ILE  18           QG1      ILE  18   3.587   6.077   3.239
  182    HA   PRO  19           HA       PRO  19  -0.934   6.956   8.313
  183   1HB   PRO  19          2HB       PRO  19  -0.509   9.429   9.409
  184   2HB   PRO  19          1HB       PRO  19   0.298   7.958   9.991
  185   1HG   PRO  19          2HG       PRO  19   1.331  10.102   8.199
  186   2HG   PRO  19          1HG       PRO  19   2.155   9.216   9.491
  187   1HD   PRO  19          2HD       PRO  19   2.492   8.655   6.851
  188   2HD   PRO  19          1HD       PRO  19   2.654   7.437   8.135
  189    QB   PRO  19           QB       PRO  19  -0.106   8.693   9.700
  190    QG   PRO  19           QG       PRO  19   1.743   9.659   8.845
  191    QD   PRO  19           QD       PRO  19   2.573   8.046   7.493
  192    H    ALA  20           H        ALA  20  -2.963   7.780   7.831
  193    HA   ALA  20           HA       ALA  20  -3.347   9.304   5.405
  194   1HB   ALA  20          1HB       ALA  20  -5.688   9.361   6.972
  195   2HB   ALA  20          3HB       ALA  20  -5.280   8.176   5.732
  196   3HB   ALA  20          2HB       ALA  20  -4.866   7.866   7.418
  197    MB   ALA  20           QB       ALA  20  -5.278   8.468   6.707
  198    HA   PRO  21           HA       PRO  21  -3.512  13.432   6.921
  199   1HB   PRO  21          2HB       PRO  21  -5.802  14.474   5.851
  200   2HB   PRO  21          1HB       PRO  21  -4.363  14.112   4.879
  201   1HG   PRO  21          2HG       PRO  21  -6.886  12.571   5.170
  202   2HG   PRO  21          1HG       PRO  21  -5.865  12.810   3.745
  203   1HD   PRO  21          2HD       PRO  21  -5.872  10.529   5.266
  204   2HD   PRO  21          1HD       PRO  21  -4.499  11.063   4.274
  205    QB   PRO  21           QB       PRO  21  -5.083  14.293   5.365
  206    QG   PRO  21           QG       PRO  21  -6.375  12.690   4.457
  207    QD   PRO  21           QD       PRO  21  -5.185  10.796   4.770
  208    H    LEU  22           H        LEU  22  -6.861  12.147   7.069
  209    HA   LEU  22           HA       LEU  22  -6.937  12.713   9.978
  210   1HB   LEU  22          2HB       LEU  22  -8.178  14.309   7.837
  211   2HB   LEU  22          1HB       LEU  22  -9.304  13.836   9.111
  212    HG   LEU  22           HG       LEU  22  -6.621  15.165   9.589
  213   1HD1  LEU  22          3HD1      LEU  22  -8.183  13.613  11.287
  214   2HD1  LEU  22          2HD1      LEU  22  -6.969  14.787  11.793
  215   3HD1  LEU  22          1HD1      LEU  22  -8.663  15.263  11.683
  216   1HD2  LEU  22          2HD2      LEU  22  -8.753  16.414   8.511
  217   2HD2  LEU  22          1HD2      LEU  22  -9.201  16.512  10.215
  218   3HD2  LEU  22          3HD2      LEU  22  -7.675  17.204   9.663
  219    MD1  LEU  22           QD1      LEU  22  -7.938  14.554  11.587
  220    MD2  LEU  22           QD2      LEU  22  -8.543  16.710   9.463
  221    QB   LEU  22           QB       LEU  22  -8.741  14.072   8.474
  222    QD   LEU  22           QQD      LEU  22  -8.241  15.632  10.525
  223    H    ALA  23           H        ALA  23  -8.923  11.768   7.147
  224    HA   ALA  23           HA       ALA  23  -9.552   9.166   8.229
  225   1HB   ALA  23          3HB       ALA  23 -12.101  10.473   8.254
  226   2HB   ALA  23          1HB       ALA  23 -10.988  11.426   9.236
  227   3HB   ALA  23          2HB       ALA  23 -11.254   9.722   9.605
  228    MB   ALA  23           QB       ALA  23 -11.448  10.540   9.032
  229    H    GLY  24           H        GLY  24 -11.611   8.291   6.949
  230   1HA   GLY  24          1HA       GLY  24 -11.058   8.539   4.156
  231   2HA   GLY  24          2HA       GLY  24 -12.474   9.516   4.545
  232    QA   GLY  24           QA       GLY  24 -11.766   9.027   4.350
  233    H    THR  25           H        THR  25 -12.887   7.438   2.847
  234    HA   THR  25           HA       THR  25 -14.127   5.304   4.557
  235    HB   THR  25           HB       THR  25 -15.300   6.303   1.970
  236    HG1  THR  25           HG1      THR  25 -15.301   8.178   2.974
  237   1HG2  THR  25          2HG2      THR  25 -16.059   4.247   3.424
  238   2HG2  THR  25          1HG2      THR  25 -16.790   5.486   4.443
  239   3HG2  THR  25          3HG2      THR  25 -17.270   5.338   2.753
  240    MG   THR  25           QG2      THR  25 -16.706   5.024   3.540
  241    H    VAL  26           H        VAL  26 -12.748   3.574   4.103
  242    HA   VAL  26           HA       VAL  26 -11.320   3.092   1.710
  243    HB   VAL  26           HB       VAL  26 -12.535   1.148   3.702
  244   1HG1  VAL  26          2HG1      VAL  26 -10.330   0.883   1.645
  245   2HG1  VAL  26          1HG1      VAL  26 -10.512  -0.234   2.997
  246   3HG1  VAL  26          3HG1      VAL  26 -11.791  -0.094   1.792
  247   1HG2  VAL  26          2HG2      VAL  26 -10.791   3.184   4.234
  248   2HG2  VAL  26          1HG2      VAL  26 -10.839   1.668   5.133
  249   3HG2  VAL  26          3HG2      VAL  26  -9.674   1.882   3.826
  250    MG1  VAL  26           QG1      VAL  26 -10.878   0.185   2.144
  251    MG2  VAL  26           QG2      VAL  26 -10.435   2.245   4.397
  252    QG   VAL  26           QQG      VAL  26 -10.656   1.215   3.271
  253    H    SER  27           H        SER  27 -11.790   1.618  -0.056
  254    HA   SER  27           HA       SER  27 -14.714   1.090  -0.489
  255   1HB   SER  27          2HB       SER  27 -12.590   2.349  -2.212
  256   2HB   SER  27          1HB       SER  27 -13.957   1.535  -2.966
  257    HG   SER  27           HG       SER  27 -15.333   2.951  -1.993
  258    QB   SER  27           QB       SER  27 -13.273   1.942  -2.589
  259    H    LYS  28           H        LYS  28 -11.370   0.184  -1.320
  260    HA   LYS  28           HA       LYS  28 -11.935  -2.647  -1.180
  261   1HB   LYS  28          2HB       LYS  28 -12.841  -1.392  -3.470
  262   2HB   LYS  28          1HB       LYS  28 -11.263  -2.000  -3.972
  263   1HG   LYS  28          2HG       LYS  28 -11.836  -4.246  -3.417
  264   2HG   LYS  28          1HG       LYS  28 -13.265  -3.736  -2.518
  265   1HD   LYS  28          2HD       LYS  28 -12.967  -3.159  -5.467
  266   2HD   LYS  28          1HD       LYS  28 -13.652  -4.677  -4.885
  267   1HE   LYS  28          2HE       LYS  28 -15.561  -3.655  -4.050
  268   2HE   LYS  28          1HE       LYS  28 -14.727  -2.118  -3.745
  269   1HZ   LYS  28          2HZ       LYS  28 -15.063  -3.190  -6.483
  270   2HZ   LYS  28          1HZ       LYS  28 -16.254  -2.216  -5.764
  271   3HZ   LYS  28          3HZ       LYS  28 -14.693  -1.600  -6.008
  272    QB   LYS  28           QB       LYS  28 -12.052  -1.696  -3.721
  273    QD   LYS  28           QD       LYS  28 -13.309  -3.918  -5.176
  274    QG   LYS  28           QG       LYS  28 -12.550  -3.991  -2.967
  275    QE   LYS  28           QE       LYS  28 -15.144  -2.886  -3.897
  276    QZ   LYS  28           QZ       LYS  28 -15.337  -2.335  -6.085
  277    H    ILE  29           H        ILE  29  -9.978  -3.661  -0.847
  278    HA   ILE  29           HA       ILE  29  -7.501  -2.069  -1.293
  279    HB   ILE  29           HB       ILE  29  -8.002  -2.980   0.939
  280   1HG1  ILE  29          2HG1      ILE  29  -5.773  -4.597  -0.327
  281   2HG1  ILE  29          1HG1      ILE  29  -5.626  -2.880   0.052
  282   1HG2  ILE  29          3HG2      ILE  29  -8.645  -5.336  -0.667
  283   2HG2  ILE  29          2HG2      ILE  29  -7.593  -5.722   0.694
  284   3HG2  ILE  29          1HG2      ILE  29  -9.145  -4.932   0.975
  285   1HD1  ILE  29          2HD1      ILE  29  -6.348  -5.020   2.074
  286   2HD1  ILE  29          1HD1      ILE  29  -4.728  -4.357   1.862
  287   3HD1  ILE  29          3HD1      ILE  29  -6.043  -3.316   2.411
  288    MG   ILE  29           QG2      ILE  29  -8.461  -5.330   0.334
  289    MD   ILE  29           QD1      ILE  29  -5.706  -4.231   2.116
  290    QG   ILE  29           QG1      ILE  29  -5.699  -3.739  -0.138
  291    H    LEU  30           H        LEU  30  -5.707  -2.992  -2.433
  292    HA   LEU  30           HA       LEU  30  -6.472  -5.166  -4.340
  293   1HB   LEU  30          2HB       LEU  30  -4.788  -2.710  -4.379
  294   2HB   LEU  30          1HB       LEU  30  -4.215  -4.067  -5.349
  295    HG   LEU  30           HG       LEU  30  -5.697  -2.585  -6.665
  296   1HD1  LEU  30          2HD1      LEU  30  -7.059  -2.122  -4.426
  297   2HD1  LEU  30          1HD1      LEU  30  -7.838  -2.005  -6.003
  298   3HD1  LEU  30          3HD1      LEU  30  -8.041  -3.458  -5.024
  299   1HD2  LEU  30          2HD2      LEU  30  -5.997  -5.411  -6.258
  300   2HD2  LEU  30          1HD2      LEU  30  -7.580  -4.719  -6.617
  301   3HD2  LEU  30          3HD2      LEU  30  -6.239  -4.486  -7.740
  302    MD1  LEU  30           QD1      LEU  30  -7.646  -2.529  -5.151
  303    MD2  LEU  30           QD2      LEU  30  -6.605  -4.872  -6.872
  304    QB   LEU  30           QB       LEU  30  -4.502  -3.388  -4.864
  305    QD   LEU  30           QQD      LEU  30  -7.126  -3.700  -6.011
  306    H    VAL  31           H        VAL  31  -3.508  -3.996  -2.679
  307    HA   VAL  31           HA       VAL  31  -2.147  -6.536  -2.924
  308    HB   VAL  31           HB       VAL  31  -1.723  -4.126  -1.124
  309   1HG1  VAL  31          1HG1      VAL  31  -0.726  -4.888  -3.879
  310   2HG1  VAL  31          3HG1      VAL  31  -1.606  -3.433  -3.411
  311   3HG1  VAL  31          2HG1      VAL  31   0.065  -3.658  -2.892
  312   1HG2  VAL  31          1HG2      VAL  31  -0.240  -6.668  -1.524
  313   2HG2  VAL  31          3HG2      VAL  31   0.736  -5.199  -1.505
  314   3HG2  VAL  31          2HG2      VAL  31  -0.283  -5.600  -0.123
  315    MG1  VAL  31           QG1      VAL  31  -0.756  -3.993  -3.394
  316    MG2  VAL  31           QG2      VAL  31   0.071  -5.823  -1.051
  317    QG   VAL  31           QQG      VAL  31  -0.342  -4.908  -2.222
  318    H    LYS  32           H        LYS  32  -1.755  -8.086  -1.253
  319    HA   LYS  32           HA       LYS  32  -3.698  -7.978   1.034
  320   1HB   LYS  32          2HB       LYS  32  -2.882 -10.023  -0.956
  321   2HB   LYS  32          1HB       LYS  32  -3.092 -10.613   0.693
  322   1HG   LYS  32          2HG       LYS  32  -5.344 -10.327   0.638
  323   2HG   LYS  32          1HG       LYS  32  -5.218  -8.785  -0.209
  324   1HD   LYS  32          2HD       LYS  32  -4.342 -10.776  -2.026
  325   2HD   LYS  32          1HD       LYS  32  -5.826 -11.383  -1.292
  326   1HE   LYS  32          2HE       LYS  32  -6.854  -9.088  -1.779
  327   2HE   LYS  32          1HE       LYS  32  -5.432  -8.783  -2.797
  328   1HZ   LYS  32          3HZ       LYS  32  -6.980 -11.290  -3.031
  329   2HZ   LYS  32          2HZ       LYS  32  -7.438  -9.898  -3.891
  330   3HZ   LYS  32          1HZ       LYS  32  -5.913 -10.598  -4.153
  331    QB   LYS  32           QB       LYS  32  -2.987 -10.318  -0.131
  332    QD   LYS  32           QD       LYS  32  -5.084 -11.079  -1.659
  333    QG   LYS  32           QG       LYS  32  -5.281  -9.556   0.214
  334    QE   LYS  32           QE       LYS  32  -6.143  -8.936  -2.288
  335    QZ   LYS  32           QZ       LYS  32  -6.777 -10.595  -3.691
  336    H    GLU  33           H        GLU  33  -1.109  -6.797   1.230
  337    HA   GLU  33           HA       GLU  33   0.762  -6.778   2.660
  338   1HB   GLU  33          2HB       GLU  33  -1.034  -7.344   4.280
  339   2HB   GLU  33          1HB       GLU  33  -0.780  -9.056   3.948
  340   1HG   GLU  33          2HG       GLU  33   1.603  -7.427   4.710
  341   2HG   GLU  33          1HG       GLU  33   0.451  -7.841   5.980
  342    QB   GLU  33           QB       GLU  33  -0.907  -8.200   4.114
  343    QG   GLU  33           QG       GLU  33   1.027  -7.634   5.345
  344    H    GLY  34           H        GLY  34   2.801  -7.764   2.757
  345   1HA   GLY  34          1HA       GLY  34   3.275 -10.560   2.311
  346   2HA   GLY  34          2HA       GLY  34   4.494  -9.289   2.193
  347    QA   GLY  34           QA       GLY  34   3.884  -9.924   2.252
  348    H    ASP  35           H        ASP  35   2.602  -7.937   0.159
  349    HA   ASP  35           HA       ASP  35   3.205  -9.737  -2.164
  350   1HB   ASP  35          2HB       ASP  35   0.870  -8.316  -1.246
  351   2HB   ASP  35          1HB       ASP  35   1.341  -7.699  -2.830
  352    QB   ASP  35           QB       ASP  35   1.105  -8.008  -2.038
  353    H    THR  36           H        THR  36   4.513  -8.889  -3.770
  354    HA   THR  36           HA       THR  36   5.973  -6.436  -3.279
  355    HB   THR  36           HB       THR  36   5.812  -7.877  -5.920
  356    HG1  THR  36           HG1      THR  36   7.013  -8.798  -3.523
  357   1HG2  THR  36          3HG2      THR  36   7.415  -5.871  -4.967
  358   2HG2  THR  36          2HG2      THR  36   8.387  -7.298  -4.611
  359   3HG2  THR  36          1HG2      THR  36   7.867  -6.975  -6.264
  360    MG   THR  36           QG2      THR  36   7.890  -6.715  -5.281
  361    H    VAL  37           H        VAL  37   5.977  -4.565  -4.763
  362    HA   VAL  37           HA       VAL  37   3.539  -4.221  -6.437
  363    HB   VAL  37           HB       VAL  37   2.985  -3.511  -4.136
  364   1HG1  VAL  37          1HG1      VAL  37   2.085  -2.257  -6.113
  365   2HG1  VAL  37          3HG1      VAL  37   2.222  -1.261  -4.665
  366   3HG1  VAL  37          2HG1      VAL  37   3.422  -1.119  -5.949
  367   1HG2  VAL  37          3HG2      VAL  37   5.650  -2.694  -4.081
  368   2HG2  VAL  37          2HG2      VAL  37   4.744  -1.180  -4.098
  369   3HG2  VAL  37          1HG2      VAL  37   4.442  -2.375  -2.835
  370    MG1  VAL  37           QG1      VAL  37   2.576  -1.546  -5.576
  371    MG2  VAL  37           QG2      VAL  37   4.946  -2.083  -3.672
  372    QG   VAL  37           QQG      VAL  37   3.761  -1.814  -4.624
  373    H    LYS  38           H        LYS  38   3.710  -2.162  -7.737
  374    HA   LYS  38           HA       LYS  38   6.579  -1.409  -8.206
  375   1HB   LYS  38          2HB       LYS  38   4.279  -2.093 -10.027
  376   2HB   LYS  38          1HB       LYS  38   5.589  -1.068 -10.614
  377   1HG   LYS  38          2HG       LYS  38   7.184  -2.761 -10.413
  378   2HG   LYS  38          1HG       LYS  38   6.241  -3.644  -9.213
  379   1HD   LYS  38          2HD       LYS  38   5.491  -4.951 -10.888
  380   2HD   LYS  38          1HD       LYS  38   4.603  -3.550 -11.490
  381   1HE   LYS  38          2HE       LYS  38   5.883  -3.844 -13.370
  382   2HE   LYS  38          1HE       LYS  38   7.150  -3.041 -12.420
  383   1HZ   LYS  38          3HZ       LYS  38   6.626  -5.945 -12.195
  384   2HZ   LYS  38          2HZ       LYS  38   7.708  -5.322 -13.348
  385   3HZ   LYS  38          1HZ       LYS  38   7.997  -5.084 -11.691
  386    QB   LYS  38           QB       LYS  38   4.934  -1.581 -10.320
  387    QD   LYS  38           QD       LYS  38   5.047  -4.250 -11.189
  388    QG   LYS  38           QG       LYS  38   6.712  -3.203  -9.813
  389    QE   LYS  38           QE       LYS  38   6.517  -3.442 -12.895
  390    QZ   LYS  38           QZ       LYS  38   7.444  -5.450 -12.411
  391    H    ALA  39           H        ALA  39   6.563   0.768  -9.577
  392    HA   ALA  39           HA       ALA  39   5.245   2.787  -7.948
  393   1HB   ALA  39          2HB       ALA  39   7.340   2.531  -9.916
  394   2HB   ALA  39          3HB       ALA  39   7.067   3.842  -8.769
  395   3HB   ALA  39          1HB       ALA  39   6.288   3.879 -10.351
  396    MB   ALA  39           QB       ALA  39   6.898   3.417  -9.679
  397    H    GLY  40           H        GLY  40   3.000   2.836  -8.211
  398   1HA   GLY  40          1HA       GLY  40   2.005   3.155 -11.016
  399   2HA   GLY  40          2HA       GLY  40   1.365   4.097  -9.670
  400    QA   GLY  40           QA       GLY  40   1.685   3.626 -10.343
  401    H    GLN  41           H        GLN  41   2.167   0.801  -8.996
  402    HA   GLN  41           HA       GLN  41  -0.254  -0.502  -9.775
  403   1HB   GLN  41          2HB       GLN  41   2.137  -0.972  -8.167
  404   2HB   GLN  41          1HB       GLN  41   0.718  -1.758  -7.473
  405   1HG   GLN  41          2HG       GLN  41   0.287  -2.482  -9.982
  406   2HG   GLN  41          1HG       GLN  41   2.023  -2.210 -10.132
  407   1HE2  GLN  41          1HE2      GLN  41   2.220  -4.617 -10.430
  408   2HE2  GLN  41          2HE2      GLN  41   2.189  -5.626  -9.066
  409    QB   GLN  41           QB       GLN  41   1.428  -1.365  -7.820
  410    QG   GLN  41           QG       GLN  41   1.155  -2.346 -10.057
  411    QE   GLN  41           QE2      GLN  41   2.204  -5.121  -9.748
  412    H    THR  42           H        THR  42  -2.250   0.179  -9.082
  413    HA   THR  42           HA       THR  42  -2.877   1.802  -6.876
  414    HB   THR  42           HB       THR  42  -4.478  -0.447  -8.142
  415    HG1  THR  42           HG1      THR  42  -5.092   1.092  -9.594
  416   1HG2  THR  42          3HG2      THR  42  -5.344   2.029  -6.623
  417   2HG2  THR  42          2HG2      THR  42  -6.432   0.916  -7.453
  418   3HG2  THR  42          1HG2      THR  42  -5.496   0.363  -6.065
  419    MG   THR  42           QG2      THR  42  -5.757   1.103  -6.714
  420    H    VAL  43           H        VAL  43  -1.781   1.165  -4.952
  421    HA   VAL  43           HA       VAL  43  -1.624  -1.454  -3.870
  422    HB   VAL  43           HB       VAL  43  -1.831   1.250  -2.498
  423   1HG1  VAL  43          1HG1      VAL  43  -0.002   0.548  -4.369
  424   2HG1  VAL  43          3HG1      VAL  43   0.376   1.600  -3.004
  425   3HG1  VAL  43          2HG1      VAL  43   0.771  -0.118  -2.930
  426   1HG2  VAL  43          1HG2      VAL  43  -1.943  -1.166  -1.268
  427   2HG2  VAL  43          3HG2      VAL  43  -0.195  -0.959  -1.377
  428   3HG2  VAL  43          2HG2      VAL  43  -1.175   0.249  -0.547
  429    MG1  VAL  43           QG1      VAL  43   0.382   0.677  -3.434
  430    MG2  VAL  43           QG2      VAL  43  -1.104  -0.625  -1.064
  431    QG   VAL  43           QQG      VAL  43  -0.361   0.026  -2.249
  432    H    LEU  44           H        LEU  44  -4.161   1.027  -3.592
  433    HA   LEU  44           HA       LEU  44  -6.168  -1.006  -2.971
  434   1HB   LEU  44          2HB       LEU  44  -6.616  -0.171  -0.683
  435   2HB   LEU  44          1HB       LEU  44  -4.974  -0.798  -0.822
  436    HG   LEU  44           HG       LEU  44  -4.991   1.981  -1.561
  437   1HD1  LEU  44          1HD1      LEU  44  -6.265   1.283   1.099
  438   2HD1  LEU  44          3HD1      LEU  44  -5.597   2.871   0.719
  439   3HD1  LEU  44          2HD1      LEU  44  -6.971   2.251  -0.196
  440   1HD2  LEU  44          1HD2      LEU  44  -3.286   0.222  -0.398
  441   2HD2  LEU  44          3HD2      LEU  44  -3.081   1.970  -0.298
  442   3HD2  LEU  44          2HD2      LEU  44  -3.843   1.095   1.029
  443    MD1  LEU  44           QD1      LEU  44  -6.278   2.135   0.540
  444    MD2  LEU  44           QD2      LEU  44  -3.403   1.096   0.111
  445    QB   LEU  44           QB       LEU  44  -5.795  -0.485  -0.752
  446    QD   LEU  44           QQD      LEU  44  -4.840   1.615   0.326
  447    H    VAL  45           H        VAL  45  -8.032   0.696  -1.687
  448    HA   VAL  45           HA       VAL  45  -8.283   3.066  -3.483
  449    HB   VAL  45           HB       VAL  45 -10.393   0.923  -3.062
  450   1HG1  VAL  45          3HG1      VAL  45 -10.852   3.507  -3.648
  451   2HG1  VAL  45          2HG1      VAL  45 -10.493   2.921  -5.272
  452   3HG1  VAL  45          1HG1      VAL  45 -11.810   2.203  -4.347
  453   1HG2  VAL  45          2HG2      VAL  45  -8.386   1.421  -5.257
  454   2HG2  VAL  45          1HG2      VAL  45  -8.782  -0.095  -4.449
  455   3HG2  VAL  45          3HG2      VAL  45  -9.915   0.612  -5.600
  456    MG1  VAL  45           QG1      VAL  45 -11.052   2.877  -4.422
  457    MG2  VAL  45           QG2      VAL  45  -9.028   0.646  -5.102
  458    QG   VAL  45           QQG      VAL  45 -10.040   1.761  -4.762
  459    H    LEU  46           H        LEU  46  -9.556   4.741  -2.555
  460    HA   LEU  46           HA       LEU  46 -10.886   4.245   0.054
  461   1HB   LEU  46          2HB       LEU  46  -8.231   5.169  -0.205
  462   2HB   LEU  46          1HB       LEU  46  -9.190   6.591   0.206
  463    HG   LEU  46           HG       LEU  46 -10.277   4.933   1.971
  464   1HD1  LEU  46          1HD1      LEU  46  -8.106   3.410   0.876
  465   2HD1  LEU  46          3HD1      LEU  46  -7.740   3.778   2.562
  466   3HD1  LEU  46          2HD1      LEU  46  -9.238   2.945   2.145
  467   1HD2  LEU  46          1HD2      LEU  46  -8.556   7.033   2.104
  468   2HD2  LEU  46          3HD2      LEU  46  -9.121   6.149   3.522
  469   3HD2  LEU  46          2HD2      LEU  46  -7.556   5.762   2.806
  470    MD1  LEU  46           QD1      LEU  46  -8.362   3.378   1.861
  471    MD2  LEU  46           QD2      LEU  46  -8.411   6.315   2.810
  472    QB   LEU  46           QB       LEU  46  -8.711   5.880   0.001
  473    QD   LEU  46           QQD      LEU  46  -8.386   4.846   2.336
  474    H    GLU  47           H        GLU  47 -11.903   6.439   0.804
  475    HA   GLU  47           HA       GLU  47 -12.413   8.403  -1.319
  476   1HB   GLU  47          2HB       GLU  47 -13.940   6.038  -1.155
  477   2HB   GLU  47          1HB       GLU  47 -14.962   7.308  -0.482
  478   1HG   GLU  47          2HG       GLU  47 -14.474   8.705  -2.501
  479   2HG   GLU  47          1HG       GLU  47 -13.592   7.339  -3.185
  480    QB   GLU  47           QB       GLU  47 -14.451   6.673  -0.819
  481    QG   GLU  47           QG       GLU  47 -14.033   8.022  -2.843
  482    H    ALA  48           H        ALA  48 -11.917  10.054   0.166
  483    HA   ALA  48           HA       ALA  48 -13.662  10.218   2.603
  484   1HB   ALA  48          3HB       ALA  48 -10.987  11.562   2.179
  485   2HB   ALA  48          1HB       ALA  48 -11.103   9.906   2.775
  486   3HB   ALA  48          2HB       ALA  48 -11.806  11.230   3.705
  487    MB   ALA  48           QB       ALA  48 -11.299  10.899   2.886
  488    H    MET  49           H        MET  49 -11.868  12.251   0.266
  489    HA   MET  49           HA       MET  49 -14.222  14.044   0.045
  490   1HB   MET  49          2HB       MET  49 -11.881  14.517   1.665
  491   2HB   MET  49          1HB       MET  49 -11.947  15.710   0.367
  492   1HG   MET  49          2HG       MET  49 -14.562  15.657   1.146
  493   2HG   MET  49          1HG       MET  49 -13.752  15.339   2.680
  494   1HE   MET  49          3HE       MET  49 -15.188  17.534   0.485
  495   2HE   MET  49          2HE       MET  49 -14.502  19.148   0.657
  496   3HE   MET  49          1HE       MET  49 -13.763  17.998  -0.455
  497    QB   MET  49           QB       MET  49 -11.914  15.113   1.016
  498    QG   MET  49           QG       MET  49 -14.157  15.498   1.913
  499    ME   MET  49           QE       MET  49 -14.484  18.227   0.229
  500    H    LYS  50           H        LYS  50 -13.300  12.338  -1.931
  501    HA   LYS  50           HA       LYS  50 -12.573  12.323  -4.179
  502   1HB   LYS  50          2HB       LYS  50 -13.954  14.649  -3.647
  503   2HB   LYS  50          1HB       LYS  50 -12.445  15.264  -4.323
  504   1HG   LYS  50          2HG       LYS  50 -13.611  14.916  -6.285
  505   2HG   LYS  50          1HG       LYS  50 -12.882  13.320  -6.100
  506   1HD   LYS  50          2HD       LYS  50 -15.260  13.316  -4.550
  507   2HD   LYS  50          1HD       LYS  50 -15.671  14.022  -6.114
  508   1HE   LYS  50          2HE       LYS  50 -14.891  12.093  -7.303
  509   2HE   LYS  50          1HE       LYS  50 -14.092  11.444  -5.857
  510   1HZ   LYS  50          1HZ       LYS  50 -17.009  11.964  -6.079
  511   2HZ   LYS  50          3HZ       LYS  50 -16.295  10.436  -6.261
  512   3HZ   LYS  50          2HZ       LYS  50 -16.206  11.241  -4.768
  513    QB   LYS  50           QB       LYS  50 -13.199  14.957  -3.985
  514    QD   LYS  50           QD       LYS  50 -15.465  13.669  -5.332
  515    QG   LYS  50           QG       LYS  50 -13.246  14.118  -6.192
  516    QE   LYS  50           QE       LYS  50 -14.492  11.769  -6.580
  517    QZ   LYS  50           QZ       LYS  50 -16.503  11.214  -5.703
  518    H    MET  51           H        MET  51 -10.492  12.032  -2.356
  519    HA   MET  51           HA       MET  51  -8.260  13.322  -3.822
  520   1HB   MET  51          2HB       MET  51  -9.139  14.740  -1.834
  521   2HB   MET  51          1HB       MET  51  -8.420  13.497  -0.811
  522   1HG   MET  51          2HG       MET  51  -6.305  13.880  -2.335
  523   2HG   MET  51          1HG       MET  51  -7.072  15.434  -2.667
  524   1HE   MET  51          2HE       MET  51  -8.513  16.384  -0.524
  525   2HE   MET  51          1HE       MET  51  -7.498  17.073   0.740
  526   3HE   MET  51          3HE       MET  51  -7.175  17.443  -0.959
  527    QB   MET  51           QB       MET  51  -8.780  14.119  -1.323
  528    QG   MET  51           QG       MET  51  -6.689  14.657  -2.501
  529    ME   MET  51           QE       MET  51  -7.728  16.967  -0.248
  530    H    GLU  52           H        GLU  52  -9.364  10.530  -3.291
  531    HA   GLU  52           HA       GLU  52  -6.776   9.341  -2.400
  532   1HB   GLU  52          2HB       GLU  52  -9.323   9.381  -0.996
  533   2HB   GLU  52          1HB       GLU  52  -8.808   7.725  -1.325
  534   1HG   GLU  52          2HG       GLU  52  -7.770   8.230   0.734
  535   2HG   GLU  52          1HG       GLU  52  -6.491   8.488  -0.453
  536    QB   GLU  52           QB       GLU  52  -9.065   8.553  -1.160
  537    QG   GLU  52           QG       GLU  52  -7.130   8.359   0.140
  538    H    THR  53           H        THR  53  -9.904   7.752  -2.928
  539    HA   THR  53           HA       THR  53 -10.507   6.073  -4.482
  540    HB   THR  53           HB       THR  53  -8.747   7.401  -6.499
  541    HG1  THR  53           HG1      THR  53  -9.544   9.307  -6.178
  542   1HG2  THR  53          2HG2      THR  53 -11.191   5.885  -6.394
  543   2HG2  THR  53          1HG2      THR  53 -11.496   7.439  -7.168
  544   3HG2  THR  53          3HG2      THR  53 -10.252   6.366  -7.807
  545    MG   THR  53           QG2      THR  53 -10.979   6.564  -7.123
  546    H    GLU  54           H        GLU  54  -8.846   5.198  -6.731
  547    HA   GLU  54           HA       GLU  54  -7.396   3.068  -5.593
  548   1HB   GLU  54          2HB       GLU  54  -7.289   4.566  -8.212
  549   2HB   GLU  54          1HB       GLU  54  -6.236   3.181  -7.918
  550   1HG   GLU  54          2HG       GLU  54  -7.927   1.777  -8.383
  551   2HG   GLU  54          1HG       GLU  54  -8.887   2.489  -7.085
  552    QB   GLU  54           QB       GLU  54  -6.763   3.873  -8.065
  553    QG   GLU  54           QG       GLU  54  -8.407   2.133  -7.734
  554    H    ILE  55           H        ILE  55  -5.742   3.390  -4.117
  555    HA   ILE  55           HA       ILE  55  -3.896   5.678  -4.419
  556    HB   ILE  55           HB       ILE  55  -4.006   3.410  -2.405
  557   1HG1  ILE  55          2HG1      ILE  55  -5.224   6.191  -2.321
  558   2HG1  ILE  55          1HG1      ILE  55  -6.123   4.680  -2.480
  559   1HG2  ILE  55          3HG2      ILE  55  -2.718   6.155  -2.307
  560   2HG2  ILE  55          2HG2      ILE  55  -2.755   4.998  -0.977
  561   3HG2  ILE  55          1HG2      ILE  55  -1.860   4.621  -2.450
  562   1HD1  ILE  55          1HD1      ILE  55  -4.469   4.286  -0.255
  563   2HD1  ILE  55          3HD1      ILE  55  -5.060   5.939  -0.084
  564   3HD1  ILE  55          2HD1      ILE  55  -6.204   4.604  -0.229
  565    MG   ILE  55           QG2      ILE  55  -2.445   5.258  -1.911
  566    MD   ILE  55           QD1      ILE  55  -5.244   4.943  -0.189
  567    QG   ILE  55           QG1      ILE  55  -5.674   5.435  -2.400
  568    H    ASN  56           H        ASN  56  -2.475   5.279  -6.108
  569    HA   ASN  56           HA       ASN  56  -1.315   2.676  -6.674
  570   1HB   ASN  56          2HB       ASN  56  -0.030   4.016  -8.319
  571   2HB   ASN  56          1HB       ASN  56  -1.752   4.394  -8.376
  572   1HD2  ASN  56          1HD2      ASN  56   1.294   5.834  -8.222
  573   2HD2  ASN  56          2HD2      ASN  56   0.832   7.347  -7.607
  574    QB   ASN  56           QB       ASN  56  -0.891   4.205  -8.348
  575    QD   ASN  56           QD2      ASN  56   1.063   6.590  -7.915
  576    H    ALA  57           H        ALA  57   0.629   1.869  -6.020
  577    HA   ALA  57           HA       ALA  57   1.944   2.747  -3.681
  578   1HB   ALA  57          3HB       ALA  57   2.229   0.780  -5.765
  579   2HB   ALA  57          1HB       ALA  57   2.842   0.718  -4.112
  580   3HB   ALA  57          2HB       ALA  57   3.815   1.449  -5.388
  581    MB   ALA  57           QB       ALA  57   2.962   0.982  -5.088
  582    HA   PRO  58           HA       PRO  58   4.231   6.237  -5.133
  583   1HB   PRO  58          2HB       PRO  58   6.171   6.337  -3.206
  584   2HB   PRO  58          1HB       PRO  58   4.493   6.842  -2.919
  585   1HG   PRO  58          2HG       PRO  58   5.863   4.313  -2.168
  586   2HG   PRO  58          1HG       PRO  58   4.650   5.248  -1.282
  587   1HD   PRO  58          2HD       PRO  58   4.093   2.963  -2.684
  588   2HD   PRO  58          1HD       PRO  58   2.904   4.242  -2.354
  589    QB   PRO  58           QB       PRO  58   5.332   6.589  -3.063
  590    QG   PRO  58           QG       PRO  58   5.257   4.780  -1.725
  591    QD   PRO  58           QD       PRO  58   3.499   3.602  -2.519
  592    H    THR  59           H        THR  59   6.026   3.285  -4.263
  593    HA   THR  59           HA       THR  59   7.639   3.558  -6.725
  594    HB   THR  59           HB       THR  59   8.959   3.387  -4.005
  595    HG1  THR  59           HG1      THR  59   8.058   5.374  -4.038
  596   1HG2  THR  59          2HG2      THR  59   9.839   3.493  -6.836
  597   2HG2  THR  59          1HG2      THR  59  10.762   4.482  -5.703
  598   3HG2  THR  59          3HG2      THR  59  10.616   2.743  -5.441
  599    MG   THR  59           QG2      THR  59  10.405   3.573  -5.993
  600    H    ASP  60           H        ASP  60   8.912   1.571  -7.127
  601    HA   ASP  60           HA       ASP  60   7.506  -0.839  -6.614
  602   1HB   ASP  60          2HB       ASP  60  10.434  -0.384  -7.277
  603   2HB   ASP  60          1HB       ASP  60   9.529  -1.869  -7.574
  604    QB   ASP  60           QB       ASP  60   9.982  -1.126  -7.425
  605    H    GLY  61           H        GLY  61   7.758  -2.444  -5.040
  606   1HA   GLY  61          1HA       GLY  61   8.887  -1.665  -2.497
  607   2HA   GLY  61          2HA       GLY  61   9.916  -2.850  -3.302
  608    QA   GLY  61           QA       GLY  61   9.401  -2.258  -2.899
  609    H    LYS  62           H        LYS  62   8.661  -3.466  -0.882
  610    HA   LYS  62           HA       LYS  62   6.429  -5.302  -1.686
  611   1HB   LYS  62          2HB       LYS  62   8.819  -6.271  -1.481
  612   2HB   LYS  62          1HB       LYS  62   8.643  -5.997   0.251
  613   1HG   LYS  62          2HG       LYS  62   6.330  -7.257  -0.141
  614   2HG   LYS  62          1HG       LYS  62   7.208  -7.934  -1.515
  615   1HD   LYS  62          2HD       LYS  62   9.106  -8.385   0.204
  616   2HD   LYS  62          1HD       LYS  62   7.850  -8.155   1.421
  617   1HE   LYS  62          2HE       LYS  62   6.469  -9.901   0.209
  618   2HE   LYS  62          1HE       LYS  62   7.898 -10.232  -0.791
  619   1HZ   LYS  62          1HZ       LYS  62   9.161 -10.444   1.345
  620   2HZ   LYS  62          3HZ       LYS  62   7.674 -10.430   2.161
  621   3HZ   LYS  62          2HZ       LYS  62   8.028 -11.679   1.065
  622    QB   LYS  62           QB       LYS  62   8.731  -6.134  -0.615
  623    QD   LYS  62           QD       LYS  62   8.478  -8.270   0.812
  624    QG   LYS  62           QG       LYS  62   6.769  -7.596  -0.828
  625    QE   LYS  62           QE       LYS  62   7.184 -10.066  -0.291
  626    QZ   LYS  62           QZ       LYS  62   8.288 -10.851   1.524
  627    H    VAL  63           H        VAL  63   4.864  -5.654  -0.022
  628    HA   VAL  63           HA       VAL  63   4.777  -3.570   2.055
  629    HB   VAL  63           HB       VAL  63   2.950  -5.729   0.992
  630   1HG1  VAL  63          3HG1      VAL  63   2.907  -2.710   1.150
  631   2HG1  VAL  63          2HG1      VAL  63   3.015  -3.708  -0.301
  632   3HG1  VAL  63          1HG1      VAL  63   1.518  -3.666   0.631
  633   1HG2  VAL  63          3HG2      VAL  63   2.571  -4.043   3.482
  634   2HG2  VAL  63          2HG2      VAL  63   1.216  -4.749   2.599
  635   3HG2  VAL  63          1HG2      VAL  63   2.432  -5.796   3.332
  636    MG1  VAL  63           QG1      VAL  63   2.480  -3.361   0.493
  637    MG2  VAL  63           QG2      VAL  63   2.073  -4.862   3.138
  638    QG   VAL  63           QQG      VAL  63   2.277  -4.112   1.815
  639    H    GLU  64           H        GLU  64   5.107  -3.905   4.230
  640    HA   GLU  64           HA       GLU  64   6.168  -6.551   5.071
  641   1HB   GLU  64          2HB       GLU  64   6.030  -3.814   6.387
  642   2HB   GLU  64          1HB       GLU  64   6.865  -5.213   7.064
  643   1HG   GLU  64          2HG       GLU  64   7.940  -5.162   4.565
  644   2HG   GLU  64          1HG       GLU  64   7.660  -3.441   4.828
  645    QB   GLU  64           QB       GLU  64   6.448  -4.513   6.725
  646    QG   GLU  64           QG       GLU  64   7.800  -4.302   4.696
  647    H    LYS  65           H        LYS  65   3.406  -4.437   5.444
  648    HA   LYS  65           HA       LYS  65   1.704  -6.454   6.552
  649   1HB   LYS  65          2HB       LYS  65   1.578  -5.484   8.890
  650   2HB   LYS  65          1HB       LYS  65   3.110  -6.274   8.524
  651   1HG   LYS  65          2HG       LYS  65   4.201  -4.165   8.145
  652   2HG   LYS  65          1HG       LYS  65   2.665  -3.299   8.192
  653   1HD   LYS  65          2HD       LYS  65   2.798  -3.094  10.425
  654   2HD   LYS  65          1HD       LYS  65   2.964  -4.842  10.605
  655   1HE   LYS  65          2HE       LYS  65   5.382  -3.402   9.629
  656   2HE   LYS  65          1HE       LYS  65   4.932  -3.138  11.326
  657   1HZ   LYS  65          1HZ       LYS  65   4.936  -5.841  10.127
  658   2HZ   LYS  65          3HZ       LYS  65   6.344  -5.181  10.805
  659   3HZ   LYS  65          2HZ       LYS  65   4.965  -5.413  11.772
  660    QB   LYS  65           QB       LYS  65   2.344  -5.879   8.707
  661    QD   LYS  65           QD       LYS  65   2.881  -3.968  10.515
  662    QG   LYS  65           QG       LYS  65   3.433  -3.732   8.168
  663    QE   LYS  65           QE       LYS  65   5.157  -3.270  10.478
  664    QZ   LYS  65           QZ       LYS  65   5.415  -5.479  10.901
  665    H    VAL  66           H        VAL  66  -0.414  -5.717   6.335
  666    HA   VAL  66           HA       VAL  66  -0.772  -2.904   5.464
  667    HB   VAL  66           HB       VAL  66  -1.675  -4.814   4.164
  668   1HG1  VAL  66          2HG1      VAL  66  -3.667  -2.949   5.474
  669   2HG1  VAL  66          1HG1      VAL  66  -2.869  -2.751   3.914
  670   3HG1  VAL  66          3HG1      VAL  66  -4.092  -4.003   4.126
  671   1HG2  VAL  66          2HG2      VAL  66  -2.322  -5.812   6.694
  672   2HG2  VAL  66          1HG2      VAL  66  -3.880  -5.406   5.975
  673   3HG2  VAL  66          3HG2      VAL  66  -2.788  -6.515   5.146
  674    MG1  VAL  66           QG1      VAL  66  -3.542  -3.234   4.505
  675    MG2  VAL  66           QG2      VAL  66  -2.997  -5.911   5.938
  676    QG   VAL  66           QQG      VAL  66  -3.269  -4.573   5.221
  677    H    LEU  67           H        LEU  67  -1.668  -1.376   6.794
  678    HA   LEU  67           HA       LEU  67  -2.632  -2.215   9.477
  679   1HB   LEU  67          2HB       LEU  67  -1.665   0.298   8.140
  680   2HB   LEU  67          1HB       LEU  67  -2.602   0.422   9.629
  681    HG   LEU  67           HG       LEU  67  -0.419  -1.586   9.639
  682   1HD1  LEU  67          3HD1      LEU  67   0.108   1.401   9.666
  683   2HD1  LEU  67          2HD1      LEU  67   1.286   0.164  10.103
  684   3HD1  LEU  67          1HD1      LEU  67   0.676   0.258   8.450
  685   1HD2  LEU  67          1HD2      LEU  67  -2.090  -0.581  11.507
  686   2HD2  LEU  67          3HD2      LEU  67  -0.484  -1.193  11.900
  687   3HD2  LEU  67          2HD2      LEU  67  -0.740   0.539  11.695
  688    MD1  LEU  67           QD1      LEU  67   0.690   0.608   9.406
  689    MD2  LEU  67           QD2      LEU  67  -1.105  -0.411  11.701
  690    QB   LEU  67           QB       LEU  67  -2.134   0.360   8.885
  691    QD   LEU  67           QQD      LEU  67  -0.207   0.098  10.553
  692    H    VAL  68           H        VAL  68  -3.692  -0.098   6.787
  693    HA   VAL  68           HA       VAL  68  -6.286   0.501   7.762
  694    HB   VAL  68           HB       VAL  68  -5.117   1.584   5.861
  695   1HG1  VAL  68          1HG1      VAL  68  -7.735   1.362   6.129
  696   2HG1  VAL  68          3HG1      VAL  68  -7.054   2.056   4.657
  697   3HG1  VAL  68          2HG1      VAL  68  -7.594   0.377   4.672
  698   1HG2  VAL  68          3HG2      VAL  68  -4.176  -0.560   4.948
  699   2HG2  VAL  68          2HG2      VAL  68  -5.784  -0.956   4.343
  700   3HG2  VAL  68          1HG2      VAL  68  -4.930   0.455   3.718
  701    MG1  VAL  68           QG1      VAL  68  -7.461   1.265   5.153
  702    MG2  VAL  68           QG2      VAL  68  -4.963  -0.354   4.336
  703    QG   VAL  68           QQG      VAL  68  -6.212   0.456   4.745
  704    H    LYS  69           H        LYS  69  -8.371  -0.401   6.929
  705    HA   LYS  69           HA       LYS  69  -8.206  -3.288   6.153
  706   1HB   LYS  69          2HB       LYS  69  -8.545  -2.761   8.659
  707   2HB   LYS  69          1HB       LYS  69 -10.146  -2.185   8.192
  708   1HG   LYS  69          2HG       LYS  69 -10.592  -4.396   7.127
  709   2HG   LYS  69          1HG       LYS  69  -9.029  -4.963   7.716
  710   1HD   LYS  69          2HD       LYS  69 -10.503  -3.747   9.878
  711   2HD   LYS  69          1HD       LYS  69 -11.488  -4.990   9.107
  712   1HE   LYS  69          2HE       LYS  69  -9.493  -6.551   9.276
  713   2HE   LYS  69          1HE       LYS  69  -8.712  -5.319  10.287
  714   1HZ   LYS  69          3HZ       LYS  69 -11.476  -6.206  10.832
  715   2HZ   LYS  69          2HZ       LYS  69 -10.152  -7.073  11.450
  716   3HZ   LYS  69          1HZ       LYS  69 -10.381  -5.445  11.880
  717    QB   LYS  69           QB       LYS  69  -9.345  -2.473   8.426
  718    QD   LYS  69           QD       LYS  69 -10.995  -4.368   9.493
  719    QG   LYS  69           QG       LYS  69  -9.810  -4.679   7.421
  720    QE   LYS  69           QE       LYS  69  -9.103  -5.935   9.782
  721    QZ   LYS  69           QZ       LYS  69 -10.670  -6.241  11.388
  722    H    GLU  70           H        GLU  70 -10.249  -4.054   5.154
  723    HA   GLU  70           HA       GLU  70 -11.401  -2.079   3.362
  724   1HB   GLU  70          2HB       GLU  70 -11.153  -4.900   3.625
  725   2HB   GLU  70          1HB       GLU  70 -12.877  -4.547   3.500
  726   1HG   GLU  70          2HG       GLU  70 -12.308  -3.065   1.511
  727   2HG   GLU  70          1HG       GLU  70 -10.686  -3.755   1.567
  728    QB   GLU  70           QB       GLU  70 -12.015  -4.724   3.563
  729    QG   GLU  70           QG       GLU  70 -11.497  -3.410   1.539
  730    H    ARG  71           H        ARG  71 -13.665  -1.476   3.291
  731    HA   ARG  71           HA       ARG  71 -15.693  -0.753   4.258
  732   1HB   ARG  71          2HB       ARG  71 -15.665  -3.356   4.471
  733   2HB   ARG  71          1HB       ARG  71 -15.366  -3.051   6.183
  734   1HG   ARG  71          2HG       ARG  71 -17.461  -2.177   6.537
  735   2HG   ARG  71          1HG       ARG  71 -17.570  -1.507   4.908
  736   1HD   ARG  71          2HD       ARG  71 -19.028  -3.264   4.600
  737   2HD   ARG  71          1HD       ARG  71 -17.528  -4.178   4.340
  738    HE   ARG  71           HE       ARG  71 -17.659  -4.389   6.989
  739   1HH1  ARG  71          1HH1      ARG  71 -19.596  -4.616   8.399
  740   2HH1  ARG  71          2HH1      ARG  71 -20.891  -5.556   7.733
  741   1HH2  ARG  71          1HH2      ARG  71 -19.595  -5.539   4.515
  742   2HH2  ARG  71          2HH2      ARG  71 -20.889  -6.080   5.532
  743    QB   ARG  71           QB       ARG  71 -15.515  -3.204   5.327
  744    QG   ARG  71           QG       ARG  71 -17.515  -1.842   5.722
  745    QD   ARG  71           QD       ARG  71 -18.278  -3.721   4.470
  746    QH1  ARG  71           QH1      ARG  71 -20.243  -5.086   8.066
  747    QH2  ARG  71           QH2      ARG  71 -20.242  -5.809   5.024
  748    H    ASP  72           H        ASP  72 -13.044   0.129   5.404
  749    HA   ASP  72           HA       ASP  72 -13.920   0.722   8.210
  750   1HB   ASP  72          2HB       ASP  72 -11.829  -0.568   7.945
  751   2HB   ASP  72          1HB       ASP  72 -11.178   0.697   6.902
  752    QB   ASP  72           QB       ASP  72 -11.504   0.064   7.423
  753    H    ALA  73           H        ALA  73 -14.832   2.752   8.254
  754    HA   ALA  73           HA       ALA  73 -13.754   4.847   6.414
  755   1HB   ALA  73          2HB       ALA  73 -16.320   4.554   8.005
  756   2HB   ALA  73          3HB       ALA  73 -16.134   4.368   6.262
  757   3HB   ALA  73          1HB       ALA  73 -15.935   5.955   7.006
  758    MB   ALA  73           QB       ALA  73 -16.130   4.959   7.091
  759    H    VAL  74           H        VAL  74 -14.025   7.137   7.488
  760    HA   VAL  74           HA       VAL  74 -12.888   8.611   8.962
  761    HB   VAL  74           HB       VAL  74 -14.044   8.555  11.155
  762   1HG1  VAL  74          1HG1      VAL  74 -15.448   8.283   8.547
  763   2HG1  VAL  74          3HG1      VAL  74 -16.453   8.199   9.995
  764   3HG1  VAL  74          2HG1      VAL  74 -15.455   9.622   9.695
  765   1HG2  VAL  74          3HG2      VAL  74 -13.975   6.002  11.290
  766   2HG2  VAL  74          2HG2      VAL  74 -15.487   6.763  11.785
  767   3HG2  VAL  74          1HG2      VAL  74 -15.360   6.007  10.198
  768    MG1  VAL  74           QG1      VAL  74 -15.785   8.701   9.412
  769    MG2  VAL  74           QG2      VAL  74 -14.941   6.257  11.091
  770    QG   VAL  74           QQG      VAL  74 -15.363   7.479  10.252
  771    H    GLN  75           H        GLN  75 -10.956   6.821   8.458
  772    HA   GLN  75           HA       GLN  75  -9.811   6.255  11.164
  773   1HB   GLN  75          2HB       GLN  75  -9.037   4.082  10.275
  774   2HB   GLN  75          1HB       GLN  75 -10.793   4.212  10.171
  775   1HG   GLN  75          2HG       GLN  75 -10.657   3.826   7.960
  776   2HG   GLN  75          1HG       GLN  75  -9.756   5.331   7.782
  777   1HE2  GLN  75          1HE2      GLN  75  -8.005   4.781   6.446
  778   2HE2  GLN  75          2HE2      GLN  75  -6.952   3.480   6.732
  779    QB   GLN  75           QB       GLN  75  -9.915   4.147  10.223
  780    QG   GLN  75           QG       GLN  75 -10.207   4.579   7.871
  781    QE   GLN  75           QE2      GLN  75  -7.478   4.131   6.589
  782    H    GLY  76           H        GLY  76  -8.791   8.434  10.399
  783   1HA   GLY  76          1HA       GLY  76  -7.185   9.442   8.761
  784   2HA   GLY  76          2HA       GLY  76  -6.437   7.849   8.644
  785    QA   GLY  76           QA       GLY  76  -6.811   8.645   8.702
  786    H    GLY  77           H        GLY  77  -4.490   9.276   9.266
  787   1HA   GLY  77          1HA       GLY  77  -4.413   9.787  12.203
  788   2HA   GLY  77          2HA       GLY  77  -3.288  10.473  11.028
  789    QA   GLY  77           QA       GLY  77  -3.850  10.130  11.616
  790    H    GLN  78           H        GLN  78  -4.261   7.104  10.941
  791    HA   GLN  78           HA       GLN  78  -1.652   6.286  12.143
  792   1HB   GLN  78          2HB       GLN  78  -4.400   5.213  11.908
  793   2HB   GLN  78          1HB       GLN  78  -3.124   4.011  11.713
  794   1HG   GLN  78          2HG       GLN  78  -2.481   4.155  13.892
  795   2HG   GLN  78          1HG       GLN  78  -2.698   5.905  13.939
  796   1HE2  GLN  78          1HE2      GLN  78  -5.229   6.505  13.690
  797   2HE2  GLN  78          2HE2      GLN  78  -6.262   5.600  14.687
  798    QB   GLN  78           QB       GLN  78  -3.762   4.612  11.811
  799    QG   GLN  78           QG       GLN  78  -2.589   5.030  13.916
  800    QE   GLN  78           QE2      GLN  78  -5.746   6.052  14.188
  801    H    GLY  79           H        GLY  79  -0.296   4.799  10.970
  802   1HA   GLY  79          1HA       GLY  79   0.694   3.870   9.054
  803   2HA   GLY  79          2HA       GLY  79   0.041   5.275   8.212
  804    QA   GLY  79           QA       GLY  79   0.368   4.572   8.633
  805    H    LEU  80           H        LEU  80  -0.838   4.363   6.379
  806    HA   LEU  80           HA       LEU  80  -3.189   2.608   6.731
  807   1HB   LEU  80          2HB       LEU  80  -1.914   3.922   4.308
  808   2HB   LEU  80          1HB       LEU  80  -3.497   3.146   4.332
  809    HG   LEU  80           HG       LEU  80  -2.784   5.413   6.201
  810   1HD1  LEU  80          2HD1      LEU  80  -4.713   3.961   6.782
  811   2HD1  LEU  80          1HD1      LEU  80  -5.226   5.601   6.386
  812   3HD1  LEU  80          3HD1      LEU  80  -5.429   4.304   5.208
  813   1HD2  LEU  80          3HD2      LEU  80  -3.757   5.451   3.358
  814   2HD2  LEU  80          2HD2      LEU  80  -4.319   6.688   4.482
  815   3HD2  LEU  80          1HD2      LEU  80  -2.595   6.514   4.151
  816    MD1  LEU  80           QD1      LEU  80  -5.123   4.622   6.126
  817    MD2  LEU  80           QD2      LEU  80  -3.557   6.218   3.997
  818    QB   LEU  80           QB       LEU  80  -2.706   3.534   4.320
  819    QD   LEU  80           QQD      LEU  80  -4.340   5.420   5.061
  820    H    ILE  81           H        ILE  81  -0.155   2.562   4.816
  821    HA   ILE  81           HA       ILE  81  -0.229  -0.429   4.957
  822    HB   ILE  81           HB       ILE  81   0.403  -0.458   2.573
  823   1HG1  ILE  81          2HG1      ILE  81  -0.169   2.161   1.730
  824   2HG1  ILE  81          1HG1      ILE  81   0.892   2.352   3.126
  825   1HG2  ILE  81          3HG2      ILE  81  -2.054  -0.190   3.459
  826   2HG2  ILE  81          2HG2      ILE  81  -1.941   1.416   2.737
  827   3HG2  ILE  81          1HG2      ILE  81  -1.733  -0.020   1.733
  828   1HD1  ILE  81          2HD1      ILE  81   1.449   0.563   0.740
  829   2HD1  ILE  81          1HD1      ILE  81   2.189   2.139   1.026
  830   3HD1  ILE  81          3HD1      ILE  81   2.514   0.799   2.127
  831    MG   ILE  81           QG2      ILE  81  -1.910   0.402   2.643
  832    MD   ILE  81           QD1      ILE  81   2.051   1.167   1.298
  833    QG   ILE  81           QG1      ILE  81   0.362   2.256   2.428
  834    H    LYS  82           H        LYS  82   1.793  -1.347   5.320
  835    HA   LYS  82           HA       LYS  82   4.030   0.521   5.880
  836   1HB   LYS  82          2HB       LYS  82   2.956  -1.800   7.021
  837   2HB   LYS  82          1HB       LYS  82   4.483  -2.326   6.312
  838   1HG   LYS  82          2HG       LYS  82   4.147   0.040   8.180
  839   2HG   LYS  82          1HG       LYS  82   4.792  -1.537   8.638
  840   1HD   LYS  82          2HD       LYS  82   6.067  -0.275   6.281
  841   2HD   LYS  82          1HD       LYS  82   6.353   0.532   7.823
  842   1HE   LYS  82          2HE       LYS  82   6.762  -2.030   8.593
  843   2HE   LYS  82          1HE       LYS  82   7.272  -2.141   6.897
  844   1HZ   LYS  82          1HZ       LYS  82   8.164  -0.056   8.819
  845   2HZ   LYS  82          3HZ       LYS  82   9.090  -1.393   8.339
  846   3HZ   LYS  82          2HZ       LYS  82   8.664  -0.205   7.202
  847    QB   LYS  82           QB       LYS  82   3.720  -2.063   6.666
  848    QD   LYS  82           QD       LYS  82   6.210   0.129   7.052
  849    QG   LYS  82           QG       LYS  82   4.470  -0.749   8.409
  850    QE   LYS  82           QE       LYS  82   7.017  -2.085   7.745
  851    QZ   LYS  82           QZ       LYS  82   8.640  -0.551   8.120
  852    H    ILE  83           H        ILE  83   5.841   0.633   4.578
  853    HA   ILE  83           HA       ILE  83   6.349  -1.537   2.603
  854    HB   ILE  83           HB       ILE  83   4.884   0.116   1.521
  855   1HG1  ILE  83          2HG1      ILE  83   7.237   1.033   0.147
  856   2HG1  ILE  83          1HG1      ILE  83   7.485  -0.640   0.645
  857   1HG2  ILE  83          3HG2      ILE  83   6.249   1.931   3.145
  858   2HG2  ILE  83          2HG2      ILE  83   6.796   2.320   1.514
  859   3HG2  ILE  83          1HG2      ILE  83   5.074   2.336   1.894
  860   1HD1  ILE  83          2HD1      ILE  83   5.131  -1.090  -0.295
  861   2HD1  ILE  83          1HD1      ILE  83   5.273   0.485  -1.075
  862   3HD1  ILE  83          3HD1      ILE  83   6.415  -0.799  -1.469
  863    MG   ILE  83           QG2      ILE  83   6.040   2.196   2.184
  864    MD   ILE  83           QD1      ILE  83   5.607  -0.468  -0.946
  865    QG   ILE  83           QG1      ILE  83   7.361   0.197   0.396
  866    H    GLY  84           H        GLY  84   8.565  -1.676   2.029
  867   1HA   GLY  84          1HA       GLY  84  10.414  -0.301   3.846
  868   2HA   GLY  84          2HA       GLY  84  10.616   0.118   2.144
  869    QA   GLY  84           QA       GLY  84  10.515  -0.091   2.995

  No H/Q in entry =         869
  Start of MODEL    2
    1    H1   MET   1          2H        MET   1   1.401   7.529  33.885
    2    H2   MET   1          1H        MET   1   0.101   7.801  34.943
    3    H3   MET   1          3H        MET   1   1.383   6.797  35.417
    4    HA   MET   1           HA       MET   1  -0.474   5.410  34.811
    5   1HB   MET   1          2HB       MET   1  -1.441   7.310  33.446
    6   2HB   MET   1          1HB       MET   1  -0.309   6.880  32.163
    7   1HG   MET   1          2HG       MET   1  -1.887   5.431  31.444
    8   2HG   MET   1          1HG       MET   1  -1.466   4.446  32.845
    9   1HE   MET   1          1HE       MET   1  -3.089   7.419  31.596
   10   2HE   MET   1          3HE       MET   1  -4.669   6.655  31.372
   11   3HE   MET   1          2HE       MET   1  -4.428   7.826  32.666
   12    QB   MET   1           QB       MET   1  -0.875   7.095  32.804
   13    QG   MET   1           QG       MET   1  -1.676   4.939  32.144
   14    ME   MET   1           QE       MET   1  -4.062   7.300  31.878
   15    H    LYS   2           H        LYS   2   1.878   4.463  35.124
   16    HA   LYS   2           HA       LYS   2   2.834   3.385  32.490
   17   1HB   LYS   2          2HB       LYS   2   4.133   4.838  34.550
   18   2HB   LYS   2          1HB       LYS   2   4.748   3.187  34.643
   19   1HG   LYS   2          2HG       LYS   2   4.822   3.518  31.971
   20   2HG   LYS   2          1HG       LYS   2   5.036   5.197  32.468
   21   1HD   LYS   2          2HD       LYS   2   6.859   4.381  34.041
   22   2HD   LYS   2          1HD       LYS   2   6.743   2.818  33.232
   23   1HE   LYS   2          2HE       LYS   2   7.606   3.643  31.223
   24   2HE   LYS   2          1HE       LYS   2   7.096   5.307  31.574
   25   1HZ   LYS   2          1HZ       LYS   2   9.096   3.846  33.206
   26   2HZ   LYS   2          3HZ       LYS   2   9.528   4.850  31.910
   27   3HZ   LYS   2          2HZ       LYS   2   8.725   5.503  33.258
   28    QB   LYS   2           QB       LYS   2   4.441   4.013  34.596
   29    QD   LYS   2           QD       LYS   2   6.801   3.599  33.636
   30    QG   LYS   2           QG       LYS   2   4.929   4.358  32.219
   31    QE   LYS   2           QE       LYS   2   7.351   4.475  31.398
   32    QZ   LYS   2           QZ       LYS   2   9.116   4.733  32.791
   33    H    LEU   3           H        LEU   3   0.700   2.171  33.999
   34    HA   LEU   3           HA       LEU   3   1.926  -0.111  35.446
   35   1HB   LEU   3          2HB       LEU   3  -0.392   1.412  35.677
   36   2HB   LEU   3          1HB       LEU   3  -0.968  -0.108  34.993
   37    HG   LEU   3           HG       LEU   3   1.002  -0.385  37.183
   38   1HD1  LEU   3          2HD1      LEU   3  -1.309  -1.776  36.000
   39   2HD1  LEU   3          1HD1      LEU   3   0.122  -2.443  36.786
   40   3HD1  LEU   3          3HD1      LEU   3  -1.236  -1.878  37.759
   41   1HD2  LEU   3          1HD2      LEU   3  -0.345   1.527  37.994
   42   2HD2  LEU   3          3HD2      LEU   3  -1.820   0.600  37.710
   43   3HD2  LEU   3          2HD2      LEU   3  -0.668   0.070  38.936
   44    MD1  LEU   3           QD1      LEU   3  -0.808  -2.032  36.849
   45    MD2  LEU   3           QD2      LEU   3  -0.944   0.732  38.213
   46    QB   LEU   3           QB       LEU   3  -0.680   0.652  35.335
   47    QD   LEU   3           QQD      LEU   3  -0.876  -0.650  37.531
   48    H    LYS   4           H        LYS   4   2.934  -1.116  33.532
   49    HA   LYS   4           HA       LYS   4   2.950  -2.629  31.717
   50   1HB   LYS   4          2HB       LYS   4   0.844  -3.266  33.593
   51   2HB   LYS   4          1HB       LYS   4   0.357  -3.736  31.964
   52   1HG   LYS   4          2HG       LYS   4   2.281  -5.117  31.678
   53   2HG   LYS   4          1HG       LYS   4   3.071  -4.432  33.100
   54   1HD   LYS   4          2HD       LYS   4   1.822  -5.685  34.570
   55   2HD   LYS   4          1HD       LYS   4   0.409  -5.704  33.515
   56   1HE   LYS   4          2HE       LYS   4   2.663  -7.097  32.291
   57   2HE   LYS   4          1HE       LYS   4   2.210  -7.813  33.851
   58   1HZ   LYS   4          2HZ       LYS   4  -0.166  -7.540  33.049
   59   2HZ   LYS   4          1HZ       LYS   4   0.487  -7.305  31.498
   60   3HZ   LYS   4          3HZ       LYS   4   0.745  -8.770  32.312
   61    QB   LYS   4           QB       LYS   4   0.601  -3.501  32.778
   62    QD   LYS   4           QD       LYS   4   1.116  -5.694  34.043
   63    QG   LYS   4           QG       LYS   4   2.676  -4.774  32.389
   64    QE   LYS   4           QE       LYS   4   2.437  -7.455  33.071
   65    QZ   LYS   4           QZ       LYS   4   0.355  -7.872  32.286
   66    H    VAL   5           H        VAL   5   1.340  -3.375  29.789
   67    HA   VAL   5           HA       VAL   5   0.687  -0.965  28.321
   68    HB   VAL   5           HB       VAL   5   1.528  -3.055  27.313
   69   1HG1  VAL   5          2HG1      VAL   5  -1.129  -1.923  26.521
   70   2HG1  VAL   5          1HG1      VAL   5   0.412  -1.869  25.663
   71   3HG1  VAL   5          3HG1      VAL   5  -0.542  -3.352  25.670
   72   1HG2  VAL   5          1HG2      VAL   5  -0.224  -4.290  29.042
   73   2HG2  VAL   5          3HG2      VAL   5  -1.053  -4.459  27.495
   74   3HG2  VAL   5          2HG2      VAL   5   0.583  -5.086  27.692
   75    MG1  VAL   5           QG1      VAL   5  -0.420  -2.382  25.951
   76    MG2  VAL   5           QG2      VAL   5  -0.231  -4.611  28.076
   77    QG   VAL   5           QQG      VAL   5  -0.326  -3.497  27.014
   78    H    THR   6           H        THR   6  -1.214   0.157  28.435
   79    HA   THR   6           HA       THR   6  -3.675  -1.311  29.331
   80    HB   THR   6           HB       THR   6  -4.251   0.818  30.509
   81    HG1  THR   6           HG1      THR   6  -1.606   1.544  29.791
   82   1HG2  THR   6          2HG2      THR   6  -1.895  -0.867  31.121
   83   2HG2  THR   6          1HG2      THR   6  -1.997   0.650  32.015
   84   3HG2  THR   6          3HG2      THR   6  -3.316  -0.516  32.105
   85    MG   THR   6           QG2      THR   6  -2.403  -0.244  31.747
   86    H    VAL   7           H        VAL   7  -2.976   1.986  28.128
   87    HA   VAL   7           HA       VAL   7  -4.730   1.434  25.767
   88    HB   VAL   7           HB       VAL   7  -6.028   2.473  27.600
   89   1HG1  VAL   7          1HG1      VAL   7  -5.865   3.332  24.960
   90   2HG1  VAL   7          3HG1      VAL   7  -7.154   3.735  26.096
   91   3HG1  VAL   7          2HG1      VAL   7  -5.789   4.832  25.885
   92   1HG2  VAL   7          3HG2      VAL   7  -3.995   3.591  28.619
   93   2HG2  VAL   7          2HG2      VAL   7  -4.108   4.803  27.343
   94   3HG2  VAL   7          1HG2      VAL   7  -5.422   4.622  28.507
   95    MG1  VAL   7           QG1      VAL   7  -6.269   3.967  25.647
   96    MG2  VAL   7           QG2      VAL   7  -4.508   4.339  28.156
   97    QG   VAL   7           QQG      VAL   7  -5.389   4.153  26.902
   98    H    ASN   8           H        ASN   8  -4.168   2.674  23.911
   99    HA   ASN   8           HA       ASN   8  -1.777   4.462  24.182
  100   1HB   ASN   8          2HB       ASN   8  -1.733   1.893  23.233
  101   2HB   ASN   8          1HB       ASN   8  -2.004   2.801  21.746
  102   1HD2  ASN   8          1HD2      ASN   8  -0.006   3.125  20.758
  103   2HD2  ASN   8          2HD2      ASN   8   1.414   3.590  21.564
  104    QB   ASN   8           QB       ASN   8  -1.868   2.347  22.490
  105    QD   ASN   8           QD2      ASN   8   0.704   3.358  21.161
  106    H    GLY   9           H        GLY   9  -2.066   6.389  23.112
  107   1HA   GLY   9          1HA       GLY   9  -4.204   7.618  22.189
  108   2HA   GLY   9          2HA       GLY   9  -3.995   6.488  20.849
  109    QA   GLY   9           QA       GLY   9  -4.100   7.053  21.519
  110    H    ALA  10           H        ALA  10  -3.615   8.329  19.430
  111    HA   ALA  10           HA       ALA  10  -2.146   9.731  18.216
  112   1HB   ALA  10          2HB       ALA  10  -1.149  10.474  20.971
  113   2HB   ALA  10          1HB       ALA  10  -1.306  11.515  19.556
  114   3HB   ALA  10          3HB       ALA  10  -2.748  10.952  20.401
  115    MB   ALA  10           QB       ALA  10  -1.734  10.980  20.309
  116    H    GLY  11           H        GLY  11  -0.882   7.849  17.431
  117   1HA   GLY  11          1HA       GLY  11   1.723   7.499  18.853
  118   2HA   GLY  11          2HA       GLY  11   1.679   7.793  17.114
  119    QA   GLY  11           QA       GLY  11   1.701   7.646  17.983
  120    H    LYS  12           H        LYS  12  -0.156   6.185  16.095
  121    HA   LYS  12           HA       LYS  12   0.508   3.444  17.127
  122   1HB   LYS  12          2HB       LYS  12  -1.975   4.823  16.647
  123   2HB   LYS  12          1HB       LYS  12  -1.867   3.433  15.566
  124   1HG   LYS  12          2HG       LYS  12  -1.422   1.949  17.446
  125   2HG   LYS  12          1HG       LYS  12  -1.386   3.319  18.556
  126   1HD   LYS  12          2HD       LYS  12  -3.672   3.587  18.524
  127   2HD   LYS  12          1HD       LYS  12  -3.823   2.997  16.868
  128   1HE   LYS  12          2HE       LYS  12  -4.780   1.300  18.303
  129   2HE   LYS  12          1HE       LYS  12  -3.200   0.683  17.780
  130   1HZ   LYS  12          1HZ       LYS  12  -3.545   2.304  20.236
  131   2HZ   LYS  12          3HZ       LYS  12  -3.637   0.612  20.252
  132   3HZ   LYS  12          2HZ       LYS  12  -2.198   1.378  19.775
  133    QB   LYS  12           QB       LYS  12  -1.921   4.128  16.106
  134    QD   LYS  12           QD       LYS  12  -3.748   3.292  17.696
  135    QG   LYS  12           QG       LYS  12  -1.404   2.634  18.001
  136    QE   LYS  12           QE       LYS  12  -3.990   0.992  18.042
  137    QZ   LYS  12           QZ       LYS  12  -3.126   1.431  20.088
  138    H    ALA  13           H        ALA  13   1.729   5.278  14.950
  139    HA   ALA  13           HA       ALA  13   1.326   3.465  12.599
  140   1HB   ALA  13          2HB       ALA  13   2.634   6.183  12.598
  141   2HB   ALA  13          1HB       ALA  13   1.817   5.359  11.270
  142   3HB   ALA  13          3HB       ALA  13   0.877   6.028  12.604
  143    MB   ALA  13           QB       ALA  13   1.776   5.857  12.158
  144    H    GLY  14           H        GLY  14   3.617   3.939  11.194
  145   1HA   GLY  14          1HA       GLY  14   5.549   2.233  11.813
  146   2HA   GLY  14          2HA       GLY  14   5.905   3.462  13.027
  147    QA   GLY  14           QA       GLY  14   5.727   2.848  12.420
  148    H    GLU  15           H        GLU  15   7.989   3.735  11.915
  149    HA   GLU  15           HA       GLU  15   8.093   5.982  10.178
  150   1HB   GLU  15          2HB       GLU  15  10.475   5.311   9.973
  151   2HB   GLU  15          1HB       GLU  15   9.914   5.184  11.641
  152   1HG   GLU  15          2HG       GLU  15   9.324   2.711  10.941
  153   2HG   GLU  15          1HG       GLU  15  10.519   2.998   9.676
  154    QB   GLU  15           QB       GLU  15  10.194   5.247  10.807
  155    QG   GLU  15           QG       GLU  15   9.922   2.855  10.309
  156    H    GLY  16           H        GLY  16   7.817   2.542   9.488
  157   1HA   GLY  16          1HA       GLY  16   8.060   1.424   7.376
  158   2HA   GLY  16          2HA       GLY  16   8.327   2.990   6.606
  159    QA   GLY  16           QA       GLY  16   8.194   2.207   6.991
  160    H    GLU  17           H        GLU  17   5.678   2.622   8.834
  161    HA   GLU  17           HA       GLU  17   3.688   1.937   6.799
  162   1HB   GLU  17          2HB       GLU  17   3.777   2.631   9.719
  163   2HB   GLU  17          1HB       GLU  17   2.224   2.664   8.883
  164   1HG   GLU  17          2HG       GLU  17   2.172   0.395   8.605
  165   2HG   GLU  17          1HG       GLU  17   3.916   0.282   8.372
  166    QB   GLU  17           QB       GLU  17   3.000   2.648   9.301
  167    QG   GLU  17           QG       GLU  17   3.044   0.338   8.488
  168    H    ILE  18           H        ILE  18   2.072   3.375   5.989
  169    HA   ILE  18           HA       ILE  18   2.742   6.290   6.247
  170    HB   ILE  18           HB       ILE  18   1.443   4.727   3.991
  171   1HG1  ILE  18          2HG1      ILE  18   3.843   5.784   3.093
  172   2HG1  ILE  18          1HG1      ILE  18   4.232   5.262   4.733
  173   1HG2  ILE  18          3HG2      ILE  18   2.232   7.623   4.342
  174   2HG2  ILE  18          2HG2      ILE  18   2.031   6.900   2.746
  175   3HG2  ILE  18          1HG2      ILE  18   0.665   6.970   3.861
  176   1HD1  ILE  18          3HD1      ILE  18   2.663   3.423   2.957
  177   2HD1  ILE  18          2HD1      ILE  18   4.406   3.554   2.727
  178   3HD1  ILE  18          1HD1      ILE  18   3.759   3.029   4.281
  179    MG   ILE  18           QG2      ILE  18   1.643   7.164   3.650
  180    MD   ILE  18           QD1      ILE  18   3.609   3.335   3.322
  181    QG   ILE  18           QG1      ILE  18   4.038   5.523   3.913
  182    HA   PRO  19           HA       PRO  19  -1.396   5.934   8.116
  183   1HB   PRO  19          2HB       PRO  19  -1.214   8.242   9.575
  184   2HB   PRO  19          1HB       PRO  19  -0.534   6.696  10.121
  185   1HG   PRO  19          2HG       PRO  19   0.829   9.027   8.871
  186   2HG   PRO  19          1HG       PRO  19   1.382   7.959  10.169
  187   1HD   PRO  19          2HD       PRO  19   2.230   7.757   7.583
  188   2HD   PRO  19          1HD       PRO  19   2.178   6.386   8.713
  189    QB   PRO  19           QB       PRO  19  -0.874   7.469   9.848
  190    QG   PRO  19           QG       PRO  19   1.105   8.493   9.520
  191    QD   PRO  19           QD       PRO  19   2.204   7.071   8.148
  192    H    ALA  20           H        ALA  20  -3.300   7.426   7.987
  193    HA   ALA  20           HA       ALA  20  -3.475   8.735   5.419
  194   1HB   ALA  20          1HB       ALA  20  -5.205   8.489   7.881
  195   2HB   ALA  20          2HB       ALA  20  -5.418   7.712   6.312
  196   3HB   ALA  20          3HB       ALA  20  -5.728   9.439   6.490
  197    MB   ALA  20           QB       ALA  20  -5.451   8.547   6.894
  198    HA   PRO  21           HA       PRO  21  -1.827  12.585   7.054
  199   1HB   PRO  21          2HB       PRO  21  -1.735  13.925   4.674
  200   2HB   PRO  21          1HB       PRO  21  -0.518  12.728   5.159
  201   1HG   PRO  21          2HG       PRO  21  -2.788  12.458   3.268
  202   2HG   PRO  21          1HG       PRO  21  -1.175  11.733   3.210
  203   1HD   PRO  21          2HD       PRO  21  -3.463  10.416   4.008
  204   2HD   PRO  21          1HD       PRO  21  -1.809   9.935   4.450
  205    QB   PRO  21           QB       PRO  21  -1.127  13.326   4.916
  206    QG   PRO  21           QG       PRO  21  -1.981  12.095   3.239
  207    QD   PRO  21           QD       PRO  21  -2.636  10.175   4.229
  208    H    LEU  22           H        LEU  22  -4.911  11.909   5.916
  209    HA   LEU  22           HA       LEU  22  -6.031  14.330   7.058
  210   1HB   LEU  22          2HB       LEU  22  -5.064  14.470   4.425
  211   2HB   LEU  22          1HB       LEU  22  -6.814  14.320   4.257
  212    HG   LEU  22           HG       LEU  22  -5.418  16.328   6.048
  213   1HD1  LEU  22          1HD1      LEU  22  -6.737  16.618   3.333
  214   2HD1  LEU  22          3HD1      LEU  22  -6.274  17.976   4.358
  215   3HD1  LEU  22          2HD1      LEU  22  -5.039  16.894   3.714
  216   1HD2  LEU  22          3HD2      LEU  22  -8.025  15.301   6.121
  217   2HD2  LEU  22          2HD2      LEU  22  -7.458  16.777   6.903
  218   3HD2  LEU  22          1HD2      LEU  22  -8.178  16.851   5.294
  219    MD1  LEU  22           QD1      LEU  22  -6.017  17.163   3.802
  220    MD2  LEU  22           QD2      LEU  22  -7.887  16.310   6.106
  221    QB   LEU  22           QB       LEU  22  -5.939  14.395   4.341
  222    QD   LEU  22           QQD      LEU  22  -6.952  16.736   4.954
  223    H    ALA  23           H        ALA  23  -6.732  11.878   7.802
  224    HA   ALA  23           HA       ALA  23  -8.506  10.319   7.941
  225   1HB   ALA  23          1HB       ALA  23  -9.897  12.757   6.787
  226   2HB   ALA  23          3HB       ALA  23 -10.701  11.425   7.615
  227   3HB   ALA  23          2HB       ALA  23  -9.586  12.466   8.499
  228    MB   ALA  23           QB       ALA  23 -10.061  12.216   7.634
  229    H    GLY  24           H        GLY  24 -10.681   9.785   6.370
  230   1HA   GLY  24          1HA       GLY  24  -9.402   8.839   3.872
  231   2HA   GLY  24          2HA       GLY  24 -10.838   9.850   3.696
  232    QA   GLY  24           QA       GLY  24 -10.120   9.344   3.784
  233    H    THR  25           H        THR  25 -11.907   7.980   2.719
  234    HA   THR  25           HA       THR  25 -12.998   6.125   4.790
  235    HB   THR  25           HB       THR  25 -13.950   6.911   2.015
  236    HG1  THR  25           HG1      THR  25 -14.813   8.528   3.003
  237   1HG2  THR  25          1HG2      THR  25 -14.631   4.681   3.574
  238   2HG2  THR  25          3HG2      THR  25 -15.940   5.836   3.830
  239   3HG2  THR  25          2HG2      THR  25 -15.528   5.318   2.195
  240    MG   THR  25           QG2      THR  25 -15.366   5.279   3.200
  241    H    VAL  26           H        VAL  26 -11.767   4.250   4.811
  242    HA   VAL  26           HA       VAL  26 -10.384   3.213   2.479
  243    HB   VAL  26           HB       VAL  26 -11.152   1.897   5.108
  244   1HG1  VAL  26          1HG1      VAL  26  -9.030   1.290   3.032
  245   2HG1  VAL  26          3HG1      VAL  26  -9.063   0.566   4.641
  246   3HG1  VAL  26          2HG1      VAL  26 -10.380   0.259   3.508
  247   1HG2  VAL  26          1HG2      VAL  26  -9.746   4.182   4.950
  248   2HG2  VAL  26          3HG2      VAL  26  -9.354   2.923   6.119
  249   3HG2  VAL  26          2HG2      VAL  26  -8.444   3.043   4.614
  250    MG1  VAL  26           QG1      VAL  26  -9.491   0.705   3.727
  251    MG2  VAL  26           QG2      VAL  26  -9.181   3.383   5.228
  252    QG   VAL  26           QQG      VAL  26  -9.336   2.044   4.477
  253    H    SER  27           H        SER  27 -11.322   2.033   0.847
  254    HA   SER  27           HA       SER  27 -13.967   0.739   1.409
  255   1HB   SER  27          2HB       SER  27 -13.009   2.544  -0.582
  256   2HB   SER  27          1HB       SER  27 -13.368   1.018  -1.383
  257    HG   SER  27           HG       SER  27 -15.058   2.668   0.171
  258    QB   SER  27           QB       SER  27 -13.188   1.781  -0.982
  259    H    LYS  28           H        LYS  28 -10.929   0.316  -0.456
  260    HA   LYS  28           HA       LYS  28 -10.911  -2.553   0.143
  261   1HB   LYS  28          2HB       LYS  28 -12.523  -1.756  -1.908
  262   2HB   LYS  28          1HB       LYS  28 -11.007  -2.014  -2.773
  263   1HG   LYS  28          2HG       LYS  28 -10.857  -4.279  -1.666
  264   2HG   LYS  28          1HG       LYS  28 -12.486  -4.014  -1.041
  265   1HD   LYS  28          2HD       LYS  28 -12.713  -3.388  -3.743
  266   2HD   LYS  28          1HD       LYS  28 -11.636  -4.785  -3.727
  267   1HE   LYS  28          2HE       LYS  28 -13.846  -5.147  -1.858
  268   2HE   LYS  28          1HE       LYS  28 -14.425  -4.875  -3.514
  269   1HZ   LYS  28          3HZ       LYS  28 -12.822  -6.515  -4.299
  270   2HZ   LYS  28          2HZ       LYS  28 -12.309  -6.801  -2.705
  271   3HZ   LYS  28          1HZ       LYS  28 -13.888  -7.208  -3.178
  272    QB   LYS  28           QB       LYS  28 -11.765  -1.885  -2.340
  273    QD   LYS  28           QD       LYS  28 -12.175  -4.087  -3.735
  274    QG   LYS  28           QG       LYS  28 -11.672  -4.146  -1.353
  275    QE   LYS  28           QE       LYS  28 -14.135  -5.011  -2.686
  276    QZ   LYS  28           QZ       LYS  28 -13.006  -6.841  -3.394
  277    H    ILE  29           H        ILE  29  -8.878  -3.516  -0.487
  278    HA   ILE  29           HA       ILE  29  -6.834  -1.526  -1.415
  279    HB   ILE  29           HB       ILE  29  -5.288  -2.640   0.087
  280   1HG1  ILE  29          2HG1      ILE  29  -7.544  -4.602   0.628
  281   2HG1  ILE  29          1HG1      ILE  29  -6.081  -4.953  -0.294
  282   1HG2  ILE  29          1HG2      ILE  29  -7.991  -2.231   1.405
  283   2HG2  ILE  29          3HG2      ILE  29  -6.457  -2.338   2.270
  284   3HG2  ILE  29          2HG2      ILE  29  -6.750  -1.002   1.158
  285   1HD1  ILE  29          1HD1      ILE  29  -4.966  -3.965   1.963
  286   2HD1  ILE  29          3HD1      ILE  29  -6.440  -4.659   2.639
  287   3HD1  ILE  29          2HD1      ILE  29  -5.317  -5.679   1.736
  288    MG   ILE  29           QG2      ILE  29  -7.066  -1.857   1.611
  289    MD   ILE  29           QD1      ILE  29  -5.574  -4.768   2.113
  290    QG   ILE  29           QG1      ILE  29  -6.813  -4.777   0.167
  291    H    LEU  30           H        LEU  30  -5.607  -2.136  -3.181
  292    HA   LEU  30           HA       LEU  30  -6.248  -4.726  -4.471
  293   1HB   LEU  30          2HB       LEU  30  -4.959  -2.117  -5.223
  294   2HB   LEU  30          1HB       LEU  30  -4.695  -3.536  -6.238
  295    HG   LEU  30           HG       LEU  30  -7.295  -3.799  -6.105
  296   1HD1  LEU  30          1HD1      LEU  30  -6.804  -1.237  -4.779
  297   2HD1  LEU  30          3HD1      LEU  30  -7.933  -1.095  -6.128
  298   3HD1  LEU  30          2HD1      LEU  30  -8.269  -2.219  -4.811
  299   1HD2  LEU  30          3HD2      LEU  30  -5.982  -3.224  -8.143
  300   2HD2  LEU  30          2HD2      LEU  30  -7.538  -2.393  -8.094
  301   3HD2  LEU  30          1HD2      LEU  30  -6.059  -1.522  -7.684
  302    MD1  LEU  30           QD1      LEU  30  -7.669  -1.517  -5.240
  303    MD2  LEU  30           QD2      LEU  30  -6.526  -2.380  -7.974
  304    QB   LEU  30           QB       LEU  30  -4.827  -2.827  -5.731
  305    QD   LEU  30           QQD      LEU  30  -7.097  -1.948  -6.607
  306    H    VAL  31           H        VAL  31  -3.957  -3.626  -2.266
  307    HA   VAL  31           HA       VAL  31  -1.704  -5.200  -3.379
  308    HB   VAL  31           HB       VAL  31  -1.428  -2.922  -2.374
  309   1HG1  VAL  31          1HG1      VAL  31   0.447  -4.532  -2.402
  310   2HG1  VAL  31          3HG1      VAL  31   0.507  -3.514  -0.964
  311   3HG1  VAL  31          2HG1      VAL  31  -0.085  -5.172  -0.847
  312   1HG2  VAL  31          1HG2      VAL  31  -3.218  -3.669  -0.512
  313   2HG2  VAL  31          3HG2      VAL  31  -1.741  -4.071   0.359
  314   3HG2  VAL  31          2HG2      VAL  31  -2.012  -2.422  -0.202
  315    MG1  VAL  31           QG1      VAL  31   0.290  -4.406  -1.404
  316    MG2  VAL  31           QG2      VAL  31  -2.324  -3.388  -0.118
  317    QG   VAL  31           QQG      VAL  31  -1.017  -3.897  -0.761
  318    H    LYS  32           H        LYS  32  -0.794  -6.994  -2.220
  319    HA   LYS  32           HA       LYS  32  -2.578  -8.175  -0.114
  320   1HB   LYS  32          2HB       LYS  32  -1.999  -9.056  -2.733
  321   2HB   LYS  32          1HB       LYS  32  -1.075 -10.110  -1.662
  322   1HG   LYS  32          2HG       LYS  32  -3.115 -10.568  -0.349
  323   2HG   LYS  32          1HG       LYS  32  -4.041  -9.524  -1.426
  324   1HD   LYS  32          2HD       LYS  32  -4.296 -11.198  -2.905
  325   2HD   LYS  32          1HD       LYS  32  -2.550 -11.431  -2.988
  326   1HE   LYS  32          2HE       LYS  32  -2.782 -13.376  -1.853
  327   2HE   LYS  32          1HE       LYS  32  -3.445 -12.475  -0.475
  328   1HZ   LYS  32          3HZ       LYS  32  -5.054 -13.123  -2.878
  329   2HZ   LYS  32          2HZ       LYS  32  -4.986 -14.155  -1.529
  330   3HZ   LYS  32          1HZ       LYS  32  -5.605 -12.581  -1.368
  331    QB   LYS  32           QB       LYS  32  -1.537  -9.583  -2.198
  332    QD   LYS  32           QD       LYS  32  -3.423 -11.315  -2.946
  333    QG   LYS  32           QG       LYS  32  -3.578 -10.046  -0.887
  334    QE   LYS  32           QE       LYS  32  -3.114 -12.925  -1.164
  335    QZ   LYS  32           QZ       LYS  32  -5.215 -13.287  -1.925
  336    H    GLU  33           H        GLU  33  -1.451  -9.423   1.514
  337    HA   GLU  33           HA       GLU  33   1.144  -8.409   2.262
  338   1HB   GLU  33          2HB       GLU  33  -0.936  -9.577   3.522
  339   2HB   GLU  33          1HB       GLU  33   0.105 -10.989   3.340
  340   1HG   GLU  33          2HG       GLU  33   1.947  -9.819   4.441
  341   2HG   GLU  33          1HG       GLU  33   0.974  -8.352   4.557
  342    QB   GLU  33           QB       GLU  33  -0.416 -10.283   3.431
  343    QG   GLU  33           QG       GLU  33   1.460  -9.085   4.499
  344    H    GLY  34           H        GLY  34   3.147  -9.173   1.700
  345   1HA   GLY  34          1HA       GLY  34   3.519 -11.974   0.894
  346   2HA   GLY  34          2HA       GLY  34   4.793 -10.766   1.065
  347    QA   GLY  34           QA       GLY  34   4.156 -11.370   0.980
  348    H    ASP  35           H        ASP  35   2.886  -8.974  -0.664
  349    HA   ASP  35           HA       ASP  35   3.501 -10.246  -3.308
  350   1HB   ASP  35          2HB       ASP  35   1.176  -9.119  -2.159
  351   2HB   ASP  35          1HB       ASP  35   1.717  -7.967  -3.379
  352    QB   ASP  35           QB       ASP  35   1.446  -8.543  -2.769
  353    H    THR  36           H        THR  36   4.291  -8.759  -4.997
  354    HA   THR  36           HA       THR  36   5.922  -6.539  -3.837
  355    HB   THR  36           HB       THR  36   6.114  -8.158  -6.397
  356    HG1  THR  36           HG1      THR  36   7.361  -9.386  -5.257
  357   1HG2  THR  36          3HG2      THR  36   7.255  -5.605  -5.674
  358   2HG2  THR  36          2HG2      THR  36   8.529  -6.811  -5.852
  359   3HG2  THR  36          1HG2      THR  36   7.416  -6.503  -7.184
  360    MG   THR  36           QG2      THR  36   7.733  -6.306  -6.237
  361    H    VAL  37           H        VAL  37   5.380  -4.462  -4.358
  362    HA   VAL  37           HA       VAL  37   3.435  -4.032  -6.602
  363    HB   VAL  37           HB       VAL  37   2.833  -1.998  -5.263
  364   1HG1  VAL  37          1HG1      VAL  37   2.715  -4.740  -4.004
  365   2HG1  VAL  37          3HG1      VAL  37   1.939  -3.348  -3.249
  366   3HG1  VAL  37          2HG1      VAL  37   1.440  -3.871  -4.858
  367   1HG2  VAL  37          1HG2      VAL  37   5.220  -2.057  -4.177
  368   2HG2  VAL  37          3HG2      VAL  37   3.850  -1.510  -3.211
  369   3HG2  VAL  37          2HG2      VAL  37   4.467  -3.150  -3.017
  370    MG1  VAL  37           QG1      VAL  37   2.031  -3.986  -4.037
  371    MG2  VAL  37           QG2      VAL  37   4.512  -2.239  -3.469
  372    QG   VAL  37           QQG      VAL  37   3.272  -3.113  -3.753
  373    H    LYS  38           H        LYS  38   3.682  -1.671  -7.486
  374    HA   LYS  38           HA       LYS  38   6.592  -0.968  -7.692
  375   1HB   LYS  38          2HB       LYS  38   4.479  -1.516  -9.741
  376   2HB   LYS  38          1HB       LYS  38   5.688  -0.287 -10.116
  377   1HG   LYS  38          2HG       LYS  38   7.485  -1.921  -9.613
  378   2HG   LYS  38          1HG       LYS  38   6.261  -3.151  -9.297
  379   1HD   LYS  38          2HD       LYS  38   6.495  -3.646 -11.504
  380   2HD   LYS  38          1HD       LYS  38   5.478  -2.226 -11.756
  381   1HE   LYS  38          2HE       LYS  38   8.513  -2.135 -11.625
  382   2HE   LYS  38          1HE       LYS  38   7.575  -2.151 -13.131
  383   1HZ   LYS  38          3HZ       LYS  38   6.278  -0.247 -12.080
  384   2HZ   LYS  38          2HZ       LYS  38   7.572  -0.113 -10.986
  385   3HZ   LYS  38          1HZ       LYS  38   7.835   0.106 -12.650
  386    QB   LYS  38           QB       LYS  38   5.083  -0.902  -9.929
  387    QD   LYS  38           QD       LYS  38   5.987  -2.936 -11.630
  388    QG   LYS  38           QG       LYS  38   6.873  -2.536  -9.455
  389    QE   LYS  38           QE       LYS  38   8.044  -2.143 -12.378
  390    QZ   LYS  38           QZ       LYS  38   7.229  -0.085 -11.905
  391    H    ALA  39           H        ALA  39   6.998   1.309  -8.002
  392    HA   ALA  39           HA       ALA  39   5.260   3.100  -6.612
  393   1HB   ALA  39          1HB       ALA  39   7.842   3.066  -7.471
  394   2HB   ALA  39          3HB       ALA  39   7.136   4.179  -8.643
  395   3HB   ALA  39          2HB       ALA  39   7.027   4.528  -6.918
  396    MB   ALA  39           QB       ALA  39   7.335   3.924  -7.677
  397    H    GLY  40           H        GLY  40   3.287   3.775  -7.354
  398   1HA   GLY  40          1HA       GLY  40   3.030   4.360 -10.279
  399   2HA   GLY  40          2HA       GLY  40   2.221   5.306  -9.030
  400    QA   GLY  40           QA       GLY  40   2.625   4.833  -9.654
  401    H    GLN  41           H        GLN  41   2.440   1.842  -8.699
  402    HA   GLN  41           HA       GLN  41  -0.112   1.235  -9.968
  403   1HB   GLN  41          2HB       GLN  41   2.018  -0.213  -9.477
  404   2HB   GLN  41          1HB       GLN  41   1.276  -0.447  -7.893
  405   1HG   GLN  41          2HG       GLN  41  -0.811  -1.221  -9.037
  406   2HG   GLN  41          1HG       GLN  41   0.038  -1.110 -10.580
  407   1HE2  GLN  41          1HE2      GLN  41   0.078  -2.813  -7.430
  408   2HE2  GLN  41          2HE2      GLN  41   0.965  -4.149  -7.985
  409    QB   GLN  41           QB       GLN  41   1.647  -0.330  -8.685
  410    QG   GLN  41           QG       GLN  41  -0.387  -1.166  -9.809
  411    QE   GLN  41           QE2      GLN  41   0.522  -3.481  -7.707
  412    H    THR  42           H        THR  42  -2.078   1.664  -9.054
  413    HA   THR  42           HA       THR  42  -2.479   2.762  -6.463
  414    HB   THR  42           HB       THR  42  -4.484   1.113  -8.015
  415    HG1  THR  42           HG1      THR  42  -4.616   2.694  -9.472
  416   1HG2  THR  42          2HG2      THR  42  -4.728   2.577  -5.719
  417   2HG2  THR  42          1HG2      THR  42  -5.138   3.780  -6.940
  418   3HG2  THR  42          3HG2      THR  42  -6.050   2.275  -6.847
  419    MG   THR  42           QG2      THR  42  -5.305   2.877  -6.502
  420    H    VAL  43           H        VAL  43  -1.731   1.595  -4.689
  421    HA   VAL  43           HA       VAL  43  -2.225  -1.318  -4.508
  422    HB   VAL  43           HB       VAL  43  -0.802  -1.080  -2.503
  423   1HG1  VAL  43          1HG1      VAL  43  -1.822   1.576  -2.570
  424   2HG1  VAL  43          3HG1      VAL  43  -0.743   0.864  -1.369
  425   3HG1  VAL  43          2HG1      VAL  43  -0.074   1.686  -2.778
  426   1HG2  VAL  43          1HG2      VAL  43  -0.064  -0.589  -5.148
  427   2HG2  VAL  43          3HG2      VAL  43   0.716   0.708  -4.242
  428   3HG2  VAL  43          2HG2      VAL  43   1.031  -0.976  -3.822
  429    MG1  VAL  43           QG1      VAL  43  -0.880   1.375  -2.239
  430    MG2  VAL  43           QG2      VAL  43   0.561  -0.286  -4.404
  431    QG   VAL  43           QQG      VAL  43  -0.159   0.545  -3.322
  432    H    LEU  44           H        LEU  44  -3.737   1.621  -3.504
  433    HA   LEU  44           HA       LEU  44  -5.648   0.057  -1.835
  434   1HB   LEU  44          2HB       LEU  44  -3.565   1.541  -0.777
  435   2HB   LEU  44          1HB       LEU  44  -4.913   2.678  -0.725
  436    HG   LEU  44           HG       LEU  44  -6.225   0.598   0.234
  437   1HD1  LEU  44          2HD1      LEU  44  -4.292  -0.948  -0.127
  438   2HD1  LEU  44          1HD1      LEU  44  -3.364  -0.007   1.042
  439   3HD1  LEU  44          3HD1      LEU  44  -4.805  -0.882   1.560
  440   1HD2  LEU  44          3HD2      LEU  44  -5.077   2.865   1.314
  441   2HD2  LEU  44          2HD2      LEU  44  -6.142   1.759   2.181
  442   3HD2  LEU  44          1HD2      LEU  44  -4.392   1.581   2.310
  443    MD1  LEU  44           QD1      LEU  44  -4.154  -0.612   0.825
  444    MD2  LEU  44           QD2      LEU  44  -5.204   2.068   1.935
  445    QB   LEU  44           QB       LEU  44  -4.239   2.110  -0.751
  446    QD   LEU  44           QQD      LEU  44  -4.679   0.728   1.380
  447    H    VAL  45           H        VAL  45  -7.705   1.267  -1.513
  448    HA   VAL  45           HA       VAL  45  -8.077   3.491  -3.494
  449    HB   VAL  45           HB       VAL  45  -9.913   1.152  -2.876
  450   1HG1  VAL  45          1HG1      VAL  45 -10.733   3.572  -3.689
  451   2HG1  VAL  45          3HG1      VAL  45 -10.238   2.925  -5.254
  452   3HG1  VAL  45          2HG1      VAL  45 -11.464   2.088  -4.301
  453   1HG2  VAL  45          3HG2      VAL  45  -8.213   1.768  -5.315
  454   2HG2  VAL  45          2HG2      VAL  45  -7.902   0.487  -4.142
  455   3HG2  VAL  45          1HG2      VAL  45  -9.338   0.417  -5.165
  456    MG1  VAL  45           QG1      VAL  45 -10.811   2.862  -4.415
  457    MG2  VAL  45           QG2      VAL  45  -8.484   0.891  -4.874
  458    QG   VAL  45           QQG      VAL  45  -9.648   1.876  -4.644
  459    H    LEU  46           H        LEU  46  -8.804   5.295  -2.443
  460    HA   LEU  46           HA       LEU  46 -10.330   4.930   0.114
  461   1HB   LEU  46          2HB       LEU  46  -8.176   6.714  -0.850
  462   2HB   LEU  46          1HB       LEU  46  -9.435   7.516   0.090
  463    HG   LEU  46           HG       LEU  46  -8.291   4.932   1.095
  464   1HD1  LEU  46          3HD1      LEU  46  -6.486   6.741   0.423
  465   2HD1  LEU  46          2HD1      LEU  46  -7.044   7.542   1.892
  466   3HD1  LEU  46          1HD1      LEU  46  -6.372   5.914   1.976
  467   1HD2  LEU  46          1HD2      LEU  46 -10.197   6.761   1.984
  468   2HD2  LEU  46          3HD2      LEU  46  -9.436   5.503   2.958
  469   3HD2  LEU  46          2HD2      LEU  46  -8.770   7.137   2.949
  470    MD1  LEU  46           QD1      LEU  46  -6.634   6.732   1.430
  471    MD2  LEU  46           QD2      LEU  46  -9.468   6.467   2.631
  472    QB   LEU  46           QB       LEU  46  -8.806   7.115  -0.380
  473    QD   LEU  46           QQD      LEU  46  -8.051   6.599   2.030
  474    H    GLU  47           H        GLU  47 -11.835   6.914   0.505
  475    HA   GLU  47           HA       GLU  47 -13.041   7.896  -2.050
  476   1HB   GLU  47          2HB       GLU  47 -14.144   6.091   0.032
  477   2HB   GLU  47          1HB       GLU  47 -15.234   7.356  -0.537
  478   1HG   GLU  47          2HG       GLU  47 -14.286   6.539  -2.912
  479   2HG   GLU  47          1HG       GLU  47 -14.091   5.035  -2.013
  480    QB   GLU  47           QB       GLU  47 -14.689   6.724  -0.252
  481    QG   GLU  47           QG       GLU  47 -14.189   5.787  -2.462
  482    H    ALA  48           H        ALA  48 -13.449  10.066  -1.905
  483    HA   ALA  48           HA       ALA  48 -14.145  11.271   0.722
  484   1HB   ALA  48          1HB       ALA  48 -11.607  11.199   0.283
  485   2HB   ALA  48          3HB       ALA  48 -11.912  12.369  -1.001
  486   3HB   ALA  48          2HB       ALA  48 -12.292  12.777   0.672
  487    MB   ALA  48           QB       ALA  48 -11.937  12.115  -0.015
  488    H    MET  49           H        MET  49 -15.538  13.028   0.448
  489    HA   MET  49           HA       MET  49 -17.019  14.471  -0.703
  490   1HB   MET  49          2HB       MET  49 -14.307  14.822  -1.560
  491   2HB   MET  49          1HB       MET  49 -15.359  15.057  -2.957
  492   1HG   MET  49          2HG       MET  49 -16.669  16.377  -0.861
  493   2HG   MET  49          1HG       MET  49 -14.966  16.775  -0.639
  494   1HE   MET  49          3HE       MET  49 -13.485  17.123  -2.347
  495   2HE   MET  49          2HE       MET  49 -13.767  17.690  -3.990
  496   3HE   MET  49          1HE       MET  49 -13.746  18.845  -2.660
  497    QB   MET  49           QB       MET  49 -14.833  14.939  -2.258
  498    QG   MET  49           QG       MET  49 -15.817  16.576  -0.750
  499    ME   MET  49           QE       MET  49 -13.666  17.886  -2.999
  500    H    LYS  50           H        LYS  50 -17.281  11.655  -1.319
  501    HA   LYS  50           HA       LYS  50 -18.274  10.241  -2.932
  502   1HB   LYS  50          2HB       LYS  50 -19.854  12.218  -2.686
  503   2HB   LYS  50          1HB       LYS  50 -19.108  12.894  -4.135
  504   1HG   LYS  50          2HG       LYS  50 -20.254  11.497  -5.488
  505   2HG   LYS  50          1HG       LYS  50 -19.847  10.095  -4.498
  506   1HD   LYS  50          2HD       LYS  50 -21.712  10.373  -3.106
  507   2HD   LYS  50          1HD       LYS  50 -21.902  12.072  -3.539
  508   1HE   LYS  50          2HE       LYS  50 -22.591  11.407  -5.832
  509   2HE   LYS  50          1HE       LYS  50 -22.449   9.700  -5.363
  510   1HZ   LYS  50          1HZ       LYS  50 -24.066  11.642  -3.817
  511   2HZ   LYS  50          3HZ       LYS  50 -24.726  10.735  -5.089
  512   3HZ   LYS  50          2HZ       LYS  50 -24.094   9.946  -3.724
  513    QB   LYS  50           QB       LYS  50 -19.481  12.556  -3.411
  514    QD   LYS  50           QD       LYS  50 -21.807  11.223  -3.323
  515    QG   LYS  50           QG       LYS  50 -20.051  10.796  -4.993
  516    QE   LYS  50           QE       LYS  50 -22.520  10.554  -5.597
  517    QZ   LYS  50           QZ       LYS  50 -24.295  10.774  -4.210
  518    H    MET  51           H        MET  51 -15.548  10.711  -3.446
  519    HA   MET  51           HA       MET  51 -15.538  10.745  -6.440
  520   1HB   MET  51          2HB       MET  51 -14.570  12.744  -4.730
  521   2HB   MET  51          1HB       MET  51 -13.132  11.851  -5.224
  522   1HG   MET  51          2HG       MET  51 -14.571  12.069  -7.583
  523   2HG   MET  51          1HG       MET  51 -14.854  13.623  -6.799
  524   1HE   MET  51          3HE       MET  51 -13.282  14.872  -5.660
  525   2HE   MET  51          2HE       MET  51 -11.800  14.063  -5.158
  526   3HE   MET  51          1HE       MET  51 -11.728  15.348  -6.359
  527    QB   MET  51           QB       MET  51 -13.851  12.297  -4.977
  528    QG   MET  51           QG       MET  51 -14.713  12.846  -7.191
  529    ME   MET  51           QE       MET  51 -12.270  14.761  -5.726
  530    H    GLU  52           H        GLU  52 -13.144   9.986  -7.108
  531    HA   GLU  52           HA       GLU  52 -12.630   7.472  -5.573
  532   1HB   GLU  52          2HB       GLU  52 -11.993   8.361  -8.406
  533   2HB   GLU  52          1HB       GLU  52 -11.588   6.778  -7.741
  534   1HG   GLU  52          2HG       GLU  52 -14.023   6.433  -7.237
  535   2HG   GLU  52          1HG       GLU  52 -14.365   7.942  -8.085
  536    QB   GLU  52           QB       GLU  52 -11.791   7.570  -8.073
  537    QG   GLU  52           QG       GLU  52 -14.194   7.187  -7.661
  538    H    THR  53           H        THR  53 -10.622   7.154  -4.633
  539    HA   THR  53           HA       THR  53  -8.501   9.203  -5.194
  540    HB   THR  53           HB       THR  53  -9.128   7.844  -2.556
  541    HG1  THR  53           HG1      THR  53  -9.916  10.356  -3.601
  542   1HG2  THR  53          3HG2      THR  53  -6.810   8.791  -2.990
  543   2HG2  THR  53          2HG2      THR  53  -7.572  10.376  -3.116
  544   3HG2  THR  53          1HG2      THR  53  -7.656   9.476  -1.602
  545    MG   THR  53           QG2      THR  53  -7.346   9.548  -2.570
  546    H    GLU  54           H        GLU  54  -7.836   7.391  -6.770
  547    HA   GLU  54           HA       GLU  54  -7.005   4.809  -5.995
  548   1HB   GLU  54          2HB       GLU  54  -6.479   6.777  -8.124
  549   2HB   GLU  54          1HB       GLU  54  -5.165   5.625  -7.882
  550   1HG   GLU  54          2HG       GLU  54  -6.364   4.157  -9.104
  551   2HG   GLU  54          1HG       GLU  54  -7.489   4.071  -7.746
  552    QB   GLU  54           QB       GLU  54  -5.822   6.201  -8.003
  553    QG   GLU  54           QG       GLU  54  -6.926   4.114  -8.425
  554    H    ILE  55           H        ILE  55  -5.356   4.119  -4.668
  555    HA   ILE  55           HA       ILE  55  -3.430   6.162  -3.658
  556    HB   ILE  55           HB       ILE  55  -4.047   3.360  -2.667
  557   1HG1  ILE  55          2HG1      ILE  55  -6.101   4.699  -2.644
  558   2HG1  ILE  55          1HG1      ILE  55  -5.503   4.508  -0.997
  559   1HG2  ILE  55          2HG2      ILE  55  -1.994   5.089  -2.001
  560   2HG2  ILE  55          1HG2      ILE  55  -3.210   5.438  -0.772
  561   3HG2  ILE  55          3HG2      ILE  55  -2.607   3.792  -0.974
  562   1HD1  ILE  55          2HD1      ILE  55  -4.950   6.923  -2.745
  563   2HD1  ILE  55          1HD1      ILE  55  -6.206   6.853  -1.511
  564   3HD1  ILE  55          3HD1      ILE  55  -4.508   6.730  -1.049
  565    MG   ILE  55           QG2      ILE  55  -2.604   4.773  -1.249
  566    MD   ILE  55           QD1      ILE  55  -5.221   6.835  -1.768
  567    QG   ILE  55           QG1      ILE  55  -5.802   4.603  -1.820
  568    H    ASN  56           H        ASN  56  -1.948   6.109  -5.462
  569    HA   ASN  56           HA       ASN  56  -0.821   3.719  -6.577
  570   1HB   ASN  56          2HB       ASN  56   0.823   5.316  -7.491
  571   2HB   ASN  56          1HB       ASN  56  -0.808   5.980  -7.600
  572   1HD2  ASN  56          1HD2      ASN  56   1.964   7.313  -7.255
  573   2HD2  ASN  56          2HD2      ASN  56   1.749   8.353  -5.932
  574    QB   ASN  56           QB       ASN  56   0.008   5.648  -7.545
  575    QD   ASN  56           QD2      ASN  56   1.857   7.833  -6.593
  576    H    ALA  57           H        ALA  57   1.002   2.542  -5.967
  577    HA   ALA  57           HA       ALA  57   1.823   2.363  -3.284
  578   1HB   ALA  57          1HB       ALA  57   2.365   1.164  -5.749
  579   2HB   ALA  57          2HB       ALA  57   3.012   0.657  -4.188
  580   3HB   ALA  57          3HB       ALA  57   3.935   1.758  -5.210
  581    MB   ALA  57           QB       ALA  57   3.104   1.193  -5.049
  582    HA   PRO  58           HA       PRO  58   4.436   5.872  -2.721
  583   1HB   PRO  58          2HB       PRO  58   6.081   4.937  -0.744
  584   2HB   PRO  58          1HB       PRO  58   4.393   5.403  -0.456
  585   1HG   PRO  58          2HG       PRO  58   5.575   2.694  -0.798
  586   2HG   PRO  58          1HG       PRO  58   4.291   3.237   0.292
  587   1HD   PRO  58          2HD       PRO  58   3.825   1.883  -2.030
  588   2HD   PRO  58          1HD       PRO  58   2.664   3.014  -1.302
  589    QB   PRO  58           QB       PRO  58   5.237   5.170  -0.600
  590    QG   PRO  58           QG       PRO  58   4.933   2.965  -0.253
  591    QD   PRO  58           QD       PRO  58   3.245   2.448  -1.666
  592    H    THR  59           H        THR  59   5.907   2.692  -3.227
  593    HA   THR  59           HA       THR  59   7.787   3.709  -5.173
  594    HB   THR  59           HB       THR  59   8.772   4.647  -3.122
  595    HG1  THR  59           HG1      THR  59  10.073   3.590  -4.840
  596   1HG2  THR  59          2HG2      THR  59   8.059   2.010  -2.104
  597   2HG2  THR  59          1HG2      THR  59   9.731   2.429  -1.731
  598   3HG2  THR  59          3HG2      THR  59   8.422   3.492  -1.217
  599    MG   THR  59           QG2      THR  59   8.737   2.644  -1.684
  600    H    ASP  60           H        ASP  60   9.328   1.929  -5.856
  601    HA   ASP  60           HA       ASP  60   7.990  -0.582  -6.139
  602   1HB   ASP  60          2HB       ASP  60  10.469   0.738  -6.902
  603   2HB   ASP  60          1HB       ASP  60  10.743  -0.968  -6.547
  604    QB   ASP  60           QB       ASP  60  10.606  -0.115  -6.724
  605    H    GLY  61           H        GLY  61   7.792  -2.190  -4.628
  606   1HA   GLY  61          1HA       GLY  61   9.089  -2.093  -2.073
  607   2HA   GLY  61          2HA       GLY  61   9.914  -3.264  -3.103
  608    QA   GLY  61           QA       GLY  61   9.502  -2.679  -2.588
  609    H    LYS  62           H        LYS  62   9.013  -4.683  -1.251
  610    HA   LYS  62           HA       LYS  62   6.374  -5.770  -2.134
  611   1HB   LYS  62          2HB       LYS  62   8.425  -7.193  -2.212
  612   2HB   LYS  62          1HB       LYS  62   8.605  -6.982  -0.471
  613   1HG   LYS  62          2HG       LYS  62   6.122  -7.847  -0.396
  614   2HG   LYS  62          1HG       LYS  62   6.512  -8.511  -1.983
  615   1HD   LYS  62          2HD       LYS  62   8.233  -8.974   0.462
  616   2HD   LYS  62          1HD       LYS  62   6.947 -10.076  -0.029
  617   1HE   LYS  62          2HE       LYS  62   8.123 -10.848  -1.852
  618   2HE   LYS  62          1HE       LYS  62   8.906  -9.281  -2.137
  619   1HZ   LYS  62          3HZ       LYS  62  10.081  -9.661   0.038
  620   2HZ   LYS  62          2HZ       LYS  62   9.530 -11.267  -0.024
  621   3HZ   LYS  62          1HZ       LYS  62  10.566 -10.674  -1.233
  622    QB   LYS  62           QB       LYS  62   8.515  -7.087  -1.341
  623    QD   LYS  62           QD       LYS  62   7.590  -9.525   0.217
  624    QG   LYS  62           QG       LYS  62   6.317  -8.179  -1.190
  625    QE   LYS  62           QE       LYS  62   8.515 -10.065  -1.994
  626    QZ   LYS  62           QZ       LYS  62  10.059 -10.534  -0.406
  627    H    VAL  63           H        VAL  63   4.792  -6.316  -0.505
  628    HA   VAL  63           HA       VAL  63   4.667  -4.464   1.719
  629    HB   VAL  63           HB       VAL  63   3.048  -6.794   0.683
  630   1HG1  VAL  63          2HG1      VAL  63   2.589  -3.820   1.008
  631   2HG1  VAL  63          1HG1      VAL  63   2.852  -4.689  -0.506
  632   3HG1  VAL  63          3HG1      VAL  63   1.372  -4.951   0.418
  633   1HG2  VAL  63          2HG2      VAL  63   2.505  -5.179   3.197
  634   2HG2  VAL  63          1HG2      VAL  63   1.329  -6.234   2.412
  635   3HG2  VAL  63          3HG2      VAL  63   2.796  -6.917   3.115
  636    MG1  VAL  63           QG1      VAL  63   2.271  -4.487   0.306
  637    MG2  VAL  63           QG2      VAL  63   2.210  -6.110   2.908
  638    QG   VAL  63           QQG      VAL  63   2.240  -5.298   1.607
  639    H    GLU  64           H        GLU  64   4.985  -4.876   3.905
  640    HA   GLU  64           HA       GLU  64   6.264  -7.500   4.589
  641   1HB   GLU  64          2HB       GLU  64   6.583  -4.739   5.817
  642   2HB   GLU  64          1HB       GLU  64   7.493  -6.180   6.271
  643   1HG   GLU  64          2HG       GLU  64   8.036  -6.235   3.669
  644   2HG   GLU  64          1HG       GLU  64   7.701  -4.508   3.800
  645    QB   GLU  64           QB       GLU  64   7.038  -5.460   6.044
  646    QG   GLU  64           QG       GLU  64   7.869  -5.371   3.735
  647    H    LYS  65           H        LYS  65   3.642  -5.315   5.234
  648    HA   LYS  65           HA       LYS  65   2.233  -7.153   6.915
  649   1HB   LYS  65          2HB       LYS  65   4.367  -5.838   8.186
  650   2HB   LYS  65          1HB       LYS  65   2.925  -4.979   8.726
  651   1HG   LYS  65          2HG       LYS  65   3.347  -7.981   8.853
  652   2HG   LYS  65          1HG       LYS  65   3.408  -6.872  10.224
  653   1HD   LYS  65          2HD       LYS  65   1.007  -6.175   9.361
  654   2HD   LYS  65          1HD       LYS  65   1.041  -7.777   8.623
  655   1HE   LYS  65          2HE       LYS  65   1.720  -8.672  10.931
  656   2HE   LYS  65          1HE       LYS  65   1.252  -7.080  11.563
  657   1HZ   LYS  65          2HZ       LYS  65  -0.513  -8.598   9.739
  658   2HZ   LYS  65          1HZ       LYS  65  -0.561  -8.853  11.418
  659   3HZ   LYS  65          3HZ       LYS  65  -0.918  -7.322  10.786
  660    QB   LYS  65           QB       LYS  65   3.646  -5.409   8.456
  661    QD   LYS  65           QD       LYS  65   1.024  -6.976   8.992
  662    QG   LYS  65           QG       LYS  65   3.378  -7.426   9.538
  663    QE   LYS  65           QE       LYS  65   1.486  -7.876  11.247
  664    QZ   LYS  65           QZ       LYS  65  -0.664  -8.258  10.648
  665    H    VAL  66           H        VAL  66   0.181  -6.537   6.346
  666    HA   VAL  66           HA       VAL  66  -0.396  -3.640   5.910
  667    HB   VAL  66           HB       VAL  66  -1.950  -6.168   5.259
  668   1HG1  VAL  66          1HG1      VAL  66  -2.514  -3.275   5.013
  669   2HG1  VAL  66          3HG1      VAL  66  -2.830  -4.221   3.558
  670   3HG1  VAL  66          2HG1      VAL  66  -3.632  -4.639   5.072
  671   1HG2  VAL  66          2HG2      VAL  66   0.148  -4.597   3.834
  672   2HG2  VAL  66          1HG2      VAL  66  -0.190  -6.327   3.780
  673   3HG2  VAL  66          3HG2      VAL  66  -1.200  -5.203   2.872
  674    MG1  VAL  66           QG1      VAL  66  -2.992  -4.045   4.548
  675    MG2  VAL  66           QG2      VAL  66  -0.414  -5.376   3.495
  676    QG   VAL  66           QQG      VAL  66  -1.703  -4.710   4.022
  677    H    LEU  67           H        LEU  67  -1.689  -2.544   7.373
  678    HA   LEU  67           HA       LEU  67  -3.023  -4.178   9.508
  679   1HB   LEU  67          2HB       LEU  67  -2.596  -2.235  10.948
  680   2HB   LEU  67          1HB       LEU  67  -1.095  -2.755  10.183
  681    HG   LEU  67           HG       LEU  67  -2.362  -0.900   8.423
  682   1HD1  LEU  67          1HD1      LEU  67   0.168  -1.295   9.865
  683   2HD1  LEU  67          3HD1      LEU  67  -0.110  -0.721   8.221
  684   3HD1  LEU  67          2HD1      LEU  67  -0.217   0.402   9.576
  685   1HD2  LEU  67          3HD2      LEU  67  -2.578  -0.255  11.319
  686   2HD2  LEU  67          2HD2      LEU  67  -1.978   1.032  10.274
  687   3HD2  LEU  67          1HD2      LEU  67  -3.557   0.309   9.965
  688    MD1  LEU  67           QD1      LEU  67  -0.053  -0.538   9.221
  689    MD2  LEU  67           QD2      LEU  67  -2.704   0.362  10.519
  690    QB   LEU  67           QB       LEU  67  -1.845  -2.495  10.565
  691    QD   LEU  67           QQD      LEU  67  -1.379  -0.088   9.870
  692    H    VAL  68           H        VAL  68  -3.472  -1.739   7.050
  693    HA   VAL  68           HA       VAL  68  -5.849  -0.479   7.975
  694    HB   VAL  68           HB       VAL  68  -4.516   0.293   6.077
  695   1HG1  VAL  68          3HG1      VAL  68  -6.996   0.754   6.144
  696   2HG1  VAL  68          2HG1      VAL  68  -6.304   0.781   4.522
  697   3HG1  VAL  68          1HG1      VAL  68  -7.223  -0.623   5.065
  698   1HG2  VAL  68          2HG2      VAL  68  -5.132  -2.459   5.089
  699   2HG2  VAL  68          1HG2      VAL  68  -4.999  -1.170   3.892
  700   3HG2  VAL  68          3HG2      VAL  68  -3.640  -1.527   4.958
  701    MG1  VAL  68           QG1      VAL  68  -6.841   0.304   5.244
  702    MG2  VAL  68           QG2      VAL  68  -4.590  -1.719   4.647
  703    QG   VAL  68           QQG      VAL  68  -5.716  -0.707   4.945
  704    H    LYS  69           H        LYS  69  -8.068  -1.001   7.621
  705    HA   LYS  69           HA       LYS  69  -8.595  -3.825   6.746
  706   1HB   LYS  69          2HB       LYS  69  -9.570  -2.162   9.064
  707   2HB   LYS  69          1HB       LYS  69 -10.526  -3.525   8.480
  708   1HG   LYS  69          2HG       LYS  69  -7.997  -4.606   8.607
  709   2HG   LYS  69          1HG       LYS  69  -8.007  -3.522   9.997
  710   1HD   LYS  69          2HD       LYS  69 -10.514  -4.983   9.773
  711   2HD   LYS  69          1HD       LYS  69  -9.135  -6.078   9.887
  712   1HE   LYS  69          2HE       LYS  69  -8.860  -5.594  12.084
  713   2HE   LYS  69          1HE       LYS  69  -8.859  -3.851  11.748
  714   1HZ   LYS  69          1HZ       LYS  69 -11.310  -5.526  11.755
  715   2HZ   LYS  69          3HZ       LYS  69 -10.792  -4.624  13.095
  716   3HZ   LYS  69          2HZ       LYS  69 -11.222  -3.833  11.654
  717    QB   LYS  69           QB       LYS  69 -10.048  -2.844   8.772
  718    QD   LYS  69           QD       LYS  69  -9.825  -5.530   9.830
  719    QG   LYS  69           QG       LYS  69  -8.002  -4.064   9.302
  720    QE   LYS  69           QE       LYS  69  -8.859  -4.723  11.916
  721    QZ   LYS  69           QZ       LYS  69 -11.108  -4.661  12.168
  722    H    GLU  70           H        GLU  70 -10.439  -4.118   5.441
  723    HA   GLU  70           HA       GLU  70 -11.383  -1.846   3.922
  724   1HB   GLU  70          2HB       GLU  70 -11.999  -4.781   4.163
  725   2HB   GLU  70          1HB       GLU  70 -13.043  -3.753   3.181
  726   1HG   GLU  70          2HG       GLU  70 -11.550  -4.015   1.511
  727   2HG   GLU  70          1HG       GLU  70 -10.457  -2.998   2.450
  728    QB   GLU  70           QB       GLU  70 -12.521  -4.267   3.672
  729    QG   GLU  70           QG       GLU  70 -11.004  -3.507   1.980
  730    H    ARG  71           H        ARG  71 -12.137  -0.583   5.909
  731    HA   ARG  71           HA       ARG  71 -14.988  -0.578   6.127
  732   1HB   ARG  71          2HB       ARG  71 -13.595  -2.543   7.701
  733   2HB   ARG  71          1HB       ARG  71 -14.319  -1.359   8.788
  734   1HG   ARG  71          2HG       ARG  71 -16.502  -1.680   7.764
  735   2HG   ARG  71          1HG       ARG  71 -15.811  -2.753   6.547
  736   1HD   ARG  71          2HD       ARG  71 -15.387  -4.470   8.131
  737   2HD   ARG  71          1HD       ARG  71 -15.569  -3.358   9.503
  738    HE   ARG  71           HE       ARG  71 -17.941  -3.563   7.783
  739   1HH1  ARG  71          1HH1      ARG  71 -17.993  -2.843  10.702
  740   2HH1  ARG  71          2HH1      ARG  71 -18.616  -4.292  11.417
  741   1HH2  ARG  71          1HH2      ARG  71 -17.986  -6.255   8.627
  742   2HH2  ARG  71          2HH2      ARG  71 -18.611  -6.224  10.242
  743    QB   ARG  71           QB       ARG  71 -13.957  -1.951   8.244
  744    QG   ARG  71           QG       ARG  71 -16.156  -2.217   7.155
  745    QD   ARG  71           QD       ARG  71 -15.478  -3.914   8.817
  746    QH1  ARG  71           QH1      ARG  71 -18.305  -3.568  11.059
  747    QH2  ARG  71           QH2      ARG  71 -18.299  -6.239   9.435
  748    H    ASP  72           H        ASP  72 -12.022  -0.012   8.049
  749    HA   ASP  72           HA       ASP  72 -12.909   2.159   9.617
  750   1HB   ASP  72          2HB       ASP  72 -10.762   0.920   9.819
  751   2HB   ASP  72          1HB       ASP  72 -10.197   1.689   8.335
  752    QB   ASP  72           QB       ASP  72 -10.480   1.304   9.077
  753    H    ALA  73           H        ALA  73 -13.524   4.216   9.065
  754    HA   ALA  73           HA       ALA  73 -12.455   5.411   6.542
  755   1HB   ALA  73          1HB       ALA  73 -15.364   5.296   7.404
  756   2HB   ALA  73          2HB       ALA  73 -14.647   4.311   6.130
  757   3HB   ALA  73          3HB       ALA  73 -14.752   6.061   5.937
  758    MB   ALA  73           QB       ALA  73 -14.921   5.223   6.490
  759    H    VAL  74           H        VAL  74 -12.858   7.805   6.497
  760    HA   VAL  74           HA       VAL  74 -12.695   9.928   7.510
  761    HB   VAL  74           HB       VAL  74 -14.493   8.470   9.473
  762   1HG1  VAL  74          1HG1      VAL  74 -14.982   8.872   6.855
  763   2HG1  VAL  74          3HG1      VAL  74 -16.250   8.958   8.078
  764   3HG1  VAL  74          2HG1      VAL  74 -15.498  10.438   7.482
  765   1HG2  VAL  74          3HG2      VAL  74 -13.737  11.366   9.142
  766   2HG2  VAL  74          2HG2      VAL  74 -15.307  10.917   9.808
  767   3HG2  VAL  74          1HG2      VAL  74 -13.827  10.410  10.621
  768    MG1  VAL  74           QG1      VAL  74 -15.577   9.423   7.472
  769    MG2  VAL  74           QG2      VAL  74 -14.290  10.898   9.857
  770    QG   VAL  74           QQG      VAL  74 -14.934  10.160   8.664
  771    H    GLN  75           H        GLN  75 -11.818  11.058   9.463
  772    HA   GLN  75           HA       GLN  75 -10.172  11.294  11.131
  773   1HB   GLN  75          2HB       GLN  75 -11.915   9.089  11.751
  774   2HB   GLN  75          1HB       GLN  75 -10.290   8.716  12.326
  775   1HG   GLN  75          2HG       GLN  75 -10.749  11.433  12.969
  776   2HG   GLN  75          1HG       GLN  75 -12.212  10.562  13.430
  777   1HE2  GLN  75          1HE2      GLN  75 -10.393  11.659  15.386
  778   2HE2  GLN  75          2HE2      GLN  75  -9.693  10.364  16.232
  779    QB   GLN  75           QB       GLN  75 -11.103   8.903  12.038
  780    QG   GLN  75           QG       GLN  75 -11.480  10.997  13.199
  781    QE   GLN  75           QE2      GLN  75 -10.043  11.011  15.809
  782    H    GLY  76           H        GLY  76  -8.102  11.332  10.341
  783   1HA   GLY  76          1HA       GLY  76  -6.295  10.417   8.986
  784   2HA   GLY  76          2HA       GLY  76  -6.928   8.801   9.294
  785    QA   GLY  76           QA       GLY  76  -6.611   9.609   9.140
  786    H    GLY  77           H        GLY  77  -4.204   9.535   9.744
  787   1HA   GLY  77          1HA       GLY  77  -4.005   9.770  12.702
  788   2HA   GLY  77          2HA       GLY  77  -2.667   9.967  11.570
  789    QA   GLY  77           QA       GLY  77  -3.336   9.869  12.136
  790    H    GLN  78           H        GLN  78  -4.789   7.297  10.995
  791    HA   GLN  78           HA       GLN  78  -3.120   5.405  12.551
  792   1HB   GLN  78          2HB       GLN  78  -5.778   5.510  11.255
  793   2HB   GLN  78          1HB       GLN  78  -4.980   3.938  11.178
  794   1HG   GLN  78          2HG       GLN  78  -4.888   3.727  13.514
  795   2HG   GLN  78          1HG       GLN  78  -5.086   5.460  13.773
  796   1HE2  GLN  78          1HE2      GLN  78  -6.822   2.460  13.052
  797   2HE2  GLN  78          2HE2      GLN  78  -8.378   3.098  13.283
  798    QB   GLN  78           QB       GLN  78  -5.379   4.724  11.217
  799    QG   GLN  78           QG       GLN  78  -4.987   4.593  13.644
  800    QE   GLN  78           QE2      GLN  78  -7.600   2.779  13.168
  801    H    GLY  79           H        GLY  79  -1.665   3.995  11.597
  802   1HA   GLY  79          1HA       GLY  79  -0.344   2.997   9.937
  803   2HA   GLY  79          2HA       GLY  79  -0.506   4.530   9.085
  804    QA   GLY  79           QA       GLY  79  -0.425   3.764   9.511
  805    H    LEU  80           H        LEU  80  -0.422   2.657   7.317
  806    HA   LEU  80           HA       LEU  80  -3.203   1.678   6.793
  807   1HB   LEU  80          2HB       LEU  80  -1.345   3.294   5.028
  808   2HB   LEU  80          1HB       LEU  80  -2.745   2.429   4.391
  809    HG   LEU  80           HG       LEU  80  -2.858   4.507   6.598
  810   1HD1  LEU  80          2HD1      LEU  80  -4.797   2.618   5.379
  811   2HD1  LEU  80          1HD1      LEU  80  -4.785   3.335   6.989
  812   3HD1  LEU  80          3HD1      LEU  80  -5.376   4.267   5.613
  813   1HD2  LEU  80          1HD2      LEU  80  -3.454   4.641   3.633
  814   2HD2  LEU  80          3HD2      LEU  80  -4.074   5.823   4.786
  815   3HD2  LEU  80          2HD2      LEU  80  -2.335   5.645   4.554
  816    MD1  LEU  80           QD1      LEU  80  -4.986   3.406   5.994
  817    MD2  LEU  80           QD2      LEU  80  -3.288   5.370   4.324
  818    QB   LEU  80           QB       LEU  80  -2.045   2.861   4.709
  819    QD   LEU  80           QQD      LEU  80  -4.137   4.388   5.159
  820    H    ILE  81           H        ILE  81  -0.027   1.621   5.114
  821    HA   ILE  81           HA       ILE  81  -0.100  -1.371   5.251
  822    HB   ILE  81           HB       ILE  81   0.567  -1.350   2.840
  823   1HG1  ILE  81          2HG1      ILE  81  -0.015   1.620   3.093
  824   2HG1  ILE  81          1HG1      ILE  81   1.577   0.908   2.828
  825   1HG2  ILE  81          1HG2      ILE  81  -1.925  -1.140   3.891
  826   2HG2  ILE  81          3HG2      ILE  81  -1.906   0.290   2.859
  827   3HG2  ILE  81          2HG2      ILE  81  -1.618  -1.304   2.162
  828   1HD1  ILE  81          2HD1      ILE  81  -0.730   0.363   0.957
  829   2HD1  ILE  81          1HD1      ILE  81   0.324   1.761   0.746
  830   3HD1  ILE  81          3HD1      ILE  81   0.994   0.131   0.664
  831    MG   ILE  81           QG2      ILE  81  -1.816  -0.718   2.971
  832    MD   ILE  81           QD1      ILE  81   0.196   0.751   0.789
  833    QG   ILE  81           QG1      ILE  81   0.781   1.264   2.961
  834    H    LYS  82           H        LYS  82   1.949  -2.307   5.497
  835    HA   LYS  82           HA       LYS  82   4.212  -0.414   5.937
  836   1HB   LYS  82          2HB       LYS  82   3.471  -2.004   7.716
  837   2HB   LYS  82          1HB       LYS  82   3.850  -3.347   6.636
  838   1HG   LYS  82          2HG       LYS  82   6.045  -3.225   7.132
  839   2HG   LYS  82          1HG       LYS  82   6.077  -1.490   6.815
  840   1HD   LYS  82          2HD       LYS  82   5.564  -0.939   9.024
  841   2HD   LYS  82          1HD       LYS  82   4.821  -2.506   9.347
  842   1HE   LYS  82          2HE       LYS  82   6.947  -2.522  10.486
  843   2HE   LYS  82          1HE       LYS  82   7.167  -3.514   9.032
  844   1HZ   LYS  82          1HZ       LYS  82   7.686  -0.595   9.089
  845   2HZ   LYS  82          3HZ       LYS  82   8.897  -1.746   9.382
  846   3HZ   LYS  82          2HZ       LYS  82   8.114  -1.702   7.874
  847    QB   LYS  82           QB       LYS  82   3.660  -2.676   7.176
  848    QD   LYS  82           QD       LYS  82   5.193  -1.722   9.186
  849    QG   LYS  82           QG       LYS  82   6.061  -2.357   6.973
  850    QE   LYS  82           QE       LYS  82   7.057  -3.018   9.759
  851    QZ   LYS  82           QZ       LYS  82   8.232  -1.348   8.782
  852    H    ILE  83           H        ILE  83   5.674  -0.237   4.282
  853    HA   ILE  83           HA       ILE  83   6.196  -2.664   2.596
  854    HB   ILE  83           HB       ILE  83   5.890   0.232   1.737
  855   1HG1  ILE  83          2HG1      ILE  83   4.158  -2.206   1.215
  856   2HG1  ILE  83          1HG1      ILE  83   3.759  -0.897   2.328
  857   1HG2  ILE  83          2HG2      ILE  83   7.369  -1.824   0.545
  858   2HG2  ILE  83          1HG2      ILE  83   5.846  -1.804  -0.343
  859   3HG2  ILE  83          3HG2      ILE  83   6.823  -0.340  -0.237
  860   1HD1  ILE  83          2HD1      ILE  83   4.354  -0.399  -0.594
  861   2HD1  ILE  83          1HD1      ILE  83   2.726  -0.744  -0.010
  862   3HD1  ILE  83          3HD1      ILE  83   3.581   0.690   0.560
  863    MG   ILE  83           QG2      ILE  83   6.679  -1.323  -0.011
  864    MD   ILE  83           QD1      ILE  83   3.554  -0.151  -0.015
  865    QG   ILE  83           QG1      ILE  83   3.959  -1.552   1.772
  866    H    GLY  84           H        GLY  84   8.353  -3.153   2.534
  867   1HA   GLY  84          1HA       GLY  84  10.434  -2.296   3.937
  868   2HA   GLY  84          2HA       GLY  84  10.338  -0.959   2.790
  869    QA   GLY  84           QA       GLY  84  10.386  -1.628   3.363

  No H/Q in entry =         869
  Start of MODEL    3
    1    H1   MET   1          3H        MET   1  13.148  15.707  21.712
    2    H2   MET   1          2H        MET   1  13.565  17.058  20.771
    3    H3   MET   1          1H        MET   1  12.950  17.269  22.341
    4    HA   MET   1           HA       MET   1  10.788  16.671  21.727
    5   1HB   MET   1          2HB       MET   1  12.003  18.819  20.778
    6   2HB   MET   1          1HB       MET   1  11.771  18.013  19.226
    7   1HG   MET   1          2HG       MET   1   9.744  19.067  19.297
    8   2HG   MET   1          1HG       MET   1   9.303  17.684  20.298
    9   1HE   MET   1          1HE       MET   1   7.592  19.428  20.398
   10   2HE   MET   1          3HE       MET   1   7.316  19.432  22.145
   11   3HE   MET   1          2HE       MET   1   7.644  20.942  21.300
   12    QB   MET   1           QB       MET   1  11.887  18.416  20.002
   13    QG   MET   1           QG       MET   1   9.523  18.375  19.797
   14    ME   MET   1           QE       MET   1   7.517  19.934  21.281
   15    H    LYS   2           H        LYS   2  11.599  14.213  21.308
   16    HA   LYS   2           HA       LYS   2  11.415  13.535  18.414
   17   1HB   LYS   2          2HB       LYS   2  12.753  12.543  20.749
   18   2HB   LYS   2          1HB       LYS   2  11.714  11.263  20.120
   19   1HG   LYS   2          2HG       LYS   2  13.202  12.751  18.052
   20   2HG   LYS   2          1HG       LYS   2  14.217  11.826  19.159
   21   1HD   LYS   2          2HD       LYS   2  13.261   9.786  18.548
   22   2HD   LYS   2          1HD       LYS   2  11.773  10.542  17.978
   23   1HE   LYS   2          2HE       LYS   2  14.311  11.263  16.561
   24   2HE   LYS   2          1HE       LYS   2  13.603   9.666  16.241
   25   1HZ   LYS   2          1HZ       LYS   2  12.087  12.222  16.179
   26   2HZ   LYS   2          3HZ       LYS   2  12.675  11.428  14.800
   27   3HZ   LYS   2          2HZ       LYS   2  11.497  10.681  15.770
   28    QB   LYS   2           QB       LYS   2  12.234  11.903  20.434
   29    QD   LYS   2           QD       LYS   2  12.517  10.164  18.263
   30    QG   LYS   2           QG       LYS   2  13.710  12.288  18.606
   31    QE   LYS   2           QE       LYS   2  13.957  10.464  16.401
   32    QZ   LYS   2           QZ       LYS   2  12.086  11.444  15.583
   33    H    LEU   3           H        LEU   3   8.990  14.433  19.027
   34    HA   LEU   3           HA       LEU   3   7.301  12.034  18.983
   35   1HB   LEU   3          2HB       LEU   3   7.970  12.848  21.435
   36   2HB   LEU   3          1HB       LEU   3   6.660  13.995  21.152
   37    HG   LEU   3           HG       LEU   3   5.796  11.959  22.228
   38   1HD1  LEU   3          3HD1      LEU   3   7.689  10.670  20.653
   39   2HD1  LEU   3          2HD1      LEU   3   6.441   9.879  21.616
   40   3HD1  LEU   3          1HD1      LEU   3   6.157  10.213  19.907
   41   1HD2  LEU   3          3HD2      LEU   3   4.569  13.248  20.315
   42   2HD2  LEU   3          2HD2      LEU   3   4.910  11.807  19.355
   43   3HD2  LEU   3          1HD2      LEU   3   3.938  11.681  20.821
   44    MD1  LEU   3           QD1      LEU   3   6.763  10.254  20.725
   45    MD2  LEU   3           QD2      LEU   3   4.472  12.245  20.164
   46    QB   LEU   3           QB       LEU   3   7.315  13.421  21.293
   47    QD   LEU   3           QQD      LEU   3   5.617  11.250  20.444
   48    H    LYS   4           H        LYS   4   7.211  15.575  19.552
   49    HA   LYS   4           HA       LYS   4   4.963  15.727  17.569
   50   1HB   LYS   4          2HB       LYS   4   4.941  16.379  20.204
   51   2HB   LYS   4          1HB       LYS   4   5.456  17.919  19.512
   52   1HG   LYS   4          2HG       LYS   4   3.510  18.052  18.125
   53   2HG   LYS   4          1HG       LYS   4   3.068  16.380  18.472
   54   1HD   LYS   4          2HD       LYS   4   3.186  18.588  20.548
   55   2HD   LYS   4          1HD       LYS   4   1.706  18.027  19.768
   56   1HE   LYS   4          2HE       LYS   4   2.772  15.649  20.614
   57   2HE   LYS   4          1HE       LYS   4   3.292  16.746  21.909
   58   1HZ   LYS   4          1HZ       LYS   4   0.534  16.720  20.815
   59   2HZ   LYS   4          3HZ       LYS   4   0.991  15.815  22.175
   60   3HZ   LYS   4          2HZ       LYS   4   1.088  17.511  22.213
   61    QB   LYS   4           QB       LYS   4   5.199  17.149  19.858
   62    QD   LYS   4           QD       LYS   4   2.446  18.307  20.158
   63    QG   LYS   4           QG       LYS   4   3.289  17.216  18.298
   64    QE   LYS   4           QE       LYS   4   3.032  16.198  21.261
   65    QZ   LYS   4           QZ       LYS   4   0.871  16.682  21.734
   66    H    VAL   5           H        VAL   5   5.522  16.761  15.699
   67    HA   VAL   5           HA       VAL   5   7.885  18.607  15.748
   68    HB   VAL   5           HB       VAL   5   6.608  17.068  13.462
   69   1HG1  VAL   5          3HG1      VAL   5   8.974  18.889  13.738
   70   2HG1  VAL   5          2HG1      VAL   5   9.060  17.552  12.591
   71   3HG1  VAL   5          1HG1      VAL   5   7.799  18.775  12.427
   72   1HG2  VAL   5          1HG2      VAL   5   8.700  16.377  15.476
   73   2HG2  VAL   5          3HG2      VAL   5   7.534  15.332  14.663
   74   3HG2  VAL   5          2HG2      VAL   5   8.981  15.868  13.811
   75    MG1  VAL   5           QG1      VAL   5   8.611  18.405  12.918
   76    MG2  VAL   5           QG2      VAL   5   8.405  15.859  14.650
   77    QG   VAL   5           QQG      VAL   5   8.508  17.132  13.784
   78    H    THR   6           H        THR   6   4.912  18.151  13.789
   79    HA   THR   6           HA       THR   6   4.080  20.933  14.277
   80    HB   THR   6           HB       THR   6   4.930  19.983  11.521
   81    HG1  THR   6           HG1      THR   6   6.161  21.637  13.455
   82   1HG2  THR   6          1HG2      THR   6   3.577  22.409  12.594
   83   2HG2  THR   6          3HG2      THR   6   4.791  22.657  11.339
   84   3HG2  THR   6          2HG2      THR   6   3.398  21.622  11.027
   85    MG   THR   6           QG2      THR   6   3.922  22.230  11.654
   86    H    VAL   7           H        VAL   7   2.972  18.161  14.536
   87    HA   VAL   7           HA       VAL   7   0.638  18.423  12.665
   88    HB   VAL   7           HB       VAL   7   0.509  15.956  12.864
   89   1HG1  VAL   7          3HG1      VAL   7   2.315  17.409  11.412
   90   2HG1  VAL   7          2HG1      VAL   7   3.383  16.301  12.273
   91   3HG1  VAL   7          1HG1      VAL   7   2.092  15.667  11.251
   92   1HG2  VAL   7          3HG2      VAL   7   1.540  16.007  15.216
   93   2HG2  VAL   7          2HG2      VAL   7   2.074  14.706  14.151
   94   3HG2  VAL   7          1HG2      VAL   7   3.103  16.115  14.407
   95    MG1  VAL   7           QG1      VAL   7   2.597  16.459  11.645
   96    MG2  VAL   7           QG2      VAL   7   2.239  15.609  14.591
   97    QG   VAL   7           QQG      VAL   7   2.418  16.034  13.118
   98    H    ASN   8           H        ASN   8   1.689  18.182  15.979
   99    HA   ASN   8           HA       ASN   8   0.473  18.213  18.006
  100   1HB   ASN   8          2HB       ASN   8  -0.383  20.204  16.573
  101   2HB   ASN   8          1HB       ASN   8  -1.812  19.206  16.297
  102   1HD2  ASN   8          1HD2      ASN   8  -2.337  21.506  17.669
  103   2HD2  ASN   8          2HD2      ASN   8  -2.560  21.204  19.324
  104    QB   ASN   8           QB       ASN   8  -1.098  19.705  16.435
  105    QD   ASN   8           QD2      ASN   8  -2.448  21.355  18.497
  106    H    GLY   9           H        GLY   9   0.479  15.763  17.813
  107   1HA   GLY   9          1HA       GLY   9  -1.822  14.391  16.732
  108   2HA   GLY   9          2HA       GLY   9  -1.978  14.606  18.476
  109    QA   GLY   9           QA       GLY   9  -1.900  14.499  17.604
  110    H    ALA  10           H        ALA  10  -1.851  12.041  17.712
  111    HA   ALA  10           HA       ALA  10   0.987  11.227  18.261
  112   1HB   ALA  10          2HB       ALA  10  -1.467  10.822  19.673
  113   2HB   ALA  10          3HB       ALA  10   0.136  10.217  20.091
  114   3HB   ALA  10          1HB       ALA  10  -0.929   9.255  19.066
  115    MB   ALA  10           QB       ALA  10  -0.753  10.098  19.610
  116    H    GLY  11           H        GLY  11  -2.101   9.913  16.978
  117   1HA   GLY  11          1HA       GLY  11  -0.879   9.098  14.485
  118   2HA   GLY  11          2HA       GLY  11  -2.496   8.653  15.030
  119    QA   GLY  11           QA       GLY  11  -1.687   8.876  14.757
  120    H    LYS  12           H        LYS  12  -2.509   6.442  14.803
  121    HA   LYS  12           HA       LYS  12  -0.726   4.872  16.557
  122   1HB   LYS  12          2HB       LYS  12  -3.360   4.715  15.408
  123   2HB   LYS  12          1HB       LYS  12  -2.462   3.260  14.976
  124   1HG   LYS  12          2HG       LYS  12  -1.875   2.916  17.352
  125   2HG   LYS  12          1HG       LYS  12  -2.788   4.365  17.783
  126   1HD   LYS  12          2HD       LYS  12  -4.661   3.016  16.342
  127   2HD   LYS  12          1HD       LYS  12  -3.765   1.668  17.042
  128   1HE   LYS  12          2HE       LYS  12  -4.085   2.575  19.298
  129   2HE   LYS  12          1HE       LYS  12  -4.912   3.995  18.628
  130   1HZ   LYS  12          3HZ       LYS  12  -6.403   2.320  17.469
  131   2HZ   LYS  12          2HZ       LYS  12  -5.771   1.162  18.541
  132   3HZ   LYS  12          1HZ       LYS  12  -6.626   2.503  19.142
  133    QB   LYS  12           QB       LYS  12  -2.911   3.987  15.192
  134    QD   LYS  12           QD       LYS  12  -4.213   2.342  16.692
  135    QG   LYS  12           QG       LYS  12  -2.331   3.640  17.567
  136    QE   LYS  12           QE       LYS  12  -4.498   3.285  18.963
  137    QZ   LYS  12           QZ       LYS  12  -6.267   1.995  18.384
  138    H    ALA  13           H        ALA  13   1.306   5.114  15.367
  139    HA   ALA  13           HA       ALA  13   1.377   3.505  12.834
  140   1HB   ALA  13          3HB       ALA  13   2.494   5.213  11.793
  141   2HB   ALA  13          1HB       ALA  13   3.386   5.644  13.251
  142   3HB   ALA  13          2HB       ALA  13   1.727   6.202  13.036
  143    MB   ALA  13           QB       ALA  13   2.536   5.686  12.693
  144    H    GLY  14           H        GLY  14   3.526   2.483  12.459
  145   1HA   GLY  14          1HA       GLY  14   4.791   0.744  13.688
  146   2HA   GLY  14          2HA       GLY  14   4.888   1.864  15.048
  147    QA   GLY  14           QA       GLY  14   4.839   1.304  14.368
  148    H    GLU  15           H        GLU  15   6.468   0.746  12.246
  149    HA   GLU  15           HA       GLU  15   8.251   3.141  12.133
  150   1HB   GLU  15          2HB       GLU  15   9.008   1.355  13.784
  151   2HB   GLU  15          1HB       GLU  15   9.216   0.282  12.400
  152   1HG   GLU  15          2HG       GLU  15  11.026   1.453  11.583
  153   2HG   GLU  15          1HG       GLU  15  10.462   2.989  12.241
  154    QB   GLU  15           QB       GLU  15   9.112   0.818  13.092
  155    QG   GLU  15           QG       GLU  15  10.744   2.221  11.912
  156    H    GLY  16           H        GLY  16   7.848   3.660   9.975
  157   1HA   GLY  16          1HA       GLY  16   8.368   1.494   7.978
  158   2HA   GLY  16          2HA       GLY  16   8.808   3.182   7.718
  159    QA   GLY  16           QA       GLY  16   8.588   2.338   7.848
  160    H    GLU  17           H        GLU  17   5.778   1.933   9.085
  161    HA   GLU  17           HA       GLU  17   4.145   1.995   6.791
  162   1HB   GLU  17          2HB       GLU  17   2.363   1.924   8.358
  163   2HB   GLU  17          1HB       GLU  17   3.722   1.210   9.220
  164   1HG   GLU  17          2HG       GLU  17   2.784   4.087   9.465
  165   2HG   GLU  17          1HG       GLU  17   2.533   2.815  10.659
  166    QB   GLU  17           QB       GLU  17   3.042   1.567   8.789
  167    QG   GLU  17           QG       GLU  17   2.658   3.451  10.062
  168    H    ILE  18           H        ILE  18   2.623   3.655   6.054
  169    HA   ILE  18           HA       ILE  18   3.611   6.442   6.567
  170    HB   ILE  18           HB       ILE  18   2.331   5.156   4.132
  171   1HG1  ILE  18          2HG1      ILE  18   4.742   6.022   3.305
  172   2HG1  ILE  18          1HG1      ILE  18   5.128   5.722   5.001
  173   1HG2  ILE  18          1HG2      ILE  18   2.176   7.803   4.856
  174   2HG2  ILE  18          3HG2      ILE  18   3.647   7.783   3.885
  175   3HG2  ILE  18          2HG2      ILE  18   2.126   7.217   3.194
  176   1HD1  ILE  18          2HD1      ILE  18   3.535   3.583   3.774
  177   2HD1  ILE  18          1HD1      ILE  18   5.111   3.803   3.017
  178   3HD1  ILE  18          3HD1      ILE  18   5.002   3.474   4.746
  179    MG   ILE  18           QG2      ILE  18   2.650   7.601   3.978
  180    MD   ILE  18           QD1      ILE  18   4.549   3.620   3.846
  181    QG   ILE  18           QG1      ILE  18   4.935   5.872   4.153
  182    HA   PRO  19           HA       PRO  19  -0.619   6.526   8.217
  183   1HB   PRO  19          2HB       PRO  19  -0.291   8.840   9.643
  184   2HB   PRO  19          1HB       PRO  19   0.226   7.251  10.243
  185   1HG   PRO  19          2HG       PRO  19   1.842   9.419   9.000
  186   2HG   PRO  19          1HG       PRO  19   2.242   8.347  10.351
  187   1HD   PRO  19          2HD       PRO  19   3.187   7.982   7.825
  188   2HD   PRO  19          1HD       PRO  19   2.929   6.650   8.972
  189    QB   PRO  19           QB       PRO  19  -0.033   8.046   9.943
  190    QG   PRO  19           QG       PRO  19   2.042   8.883   9.675
  191    QD   PRO  19           QD       PRO  19   3.058   7.316   8.399
  192    H    ALA  20           H        ALA  20  -2.367   7.545   7.260
  193    HA   ALA  20           HA       ALA  20  -2.016   9.277   5.006
  194   1HB   ALA  20          1HB       ALA  20  -4.119   7.944   6.507
  195   2HB   ALA  20          3HB       ALA  20  -4.640   9.544   5.980
  196   3HB   ALA  20          2HB       ALA  20  -4.077   8.366   4.794
  197    MB   ALA  20           QB       ALA  20  -4.279   8.618   5.760
  198    HA   PRO  21           HA       PRO  21  -1.639  13.122   7.187
  199   1HB   PRO  21          2HB       PRO  21  -2.032  14.817   5.079
  200   2HB   PRO  21          1HB       PRO  21  -0.521  13.920   5.327
  201   1HG   PRO  21          2HG       PRO  21  -2.766  13.370   3.462
  202   2HG   PRO  21          1HG       PRO  21  -1.025  13.141   3.236
  203   1HD   PRO  21          2HD       PRO  21  -2.790  11.118   3.816
  204   2HD   PRO  21          1HD       PRO  21  -1.051  11.065   4.175
  205    QB   PRO  21           QB       PRO  21  -1.277  14.369   5.203
  206    QG   PRO  21           QG       PRO  21  -1.895  13.255   3.349
  207    QD   PRO  21           QD       PRO  21  -1.920  11.091   3.996
  208    H    LEU  22           H        LEU  22  -4.443  12.270   5.257
  209    HA   LEU  22           HA       LEU  22  -6.092  14.131   6.936
  210   1HB   LEU  22          2HB       LEU  22  -5.876  13.736   3.981
  211   2HB   LEU  22          1HB       LEU  22  -7.476  14.084   4.639
  212    HG   LEU  22           HG       LEU  22  -5.217  15.763   5.619
  213   1HD1  LEU  22          2HD1      LEU  22  -6.235  15.719   2.795
  214   2HD1  LEU  22          1HD1      LEU  22  -5.811  17.264   3.532
  215   3HD1  LEU  22          3HD1      LEU  22  -4.596  15.994   3.385
  216   1HD2  LEU  22          3HD2      LEU  22  -7.979  15.750   5.858
  217   2HD2  LEU  22          2HD2      LEU  22  -6.926  17.112   6.238
  218   3HD2  LEU  22          1HD2      LEU  22  -7.689  17.004   4.651
  219    MD1  LEU  22           QD1      LEU  22  -5.547  16.326   3.237
  220    MD2  LEU  22           QD2      LEU  22  -7.531  16.622   5.582
  221    QB   LEU  22           QB       LEU  22  -6.676  13.910   4.310
  222    QD   LEU  22           QQD      LEU  22  -6.539  16.474   4.410
  223    H    ALA  23           H        ALA  23  -8.431  13.412   6.991
  224    HA   ALA  23           HA       ALA  23  -8.610  10.572   7.594
  225   1HB   ALA  23          3HB       ALA  23 -10.634  12.827   7.407
  226   2HB   ALA  23          2HB       ALA  23 -10.989  11.231   8.068
  227   3HB   ALA  23          1HB       ALA  23  -9.810  12.273   8.865
  228    MB   ALA  23           QB       ALA  23 -10.477  12.110   8.113
  229    H    GLY  24           H        GLY  24 -10.628   9.362   6.641
  230   1HA   GLY  24          1HA       GLY  24 -10.253   9.176   3.766
  231   2HA   GLY  24          2HA       GLY  24 -11.823   9.863   4.189
  232    QA   GLY  24           QA       GLY  24 -11.038   9.520   3.978
  233    H    THR  25           H        THR  25 -12.178   7.613   2.925
  234    HA   THR  25           HA       THR  25 -12.338   5.417   4.960
  235    HB   THR  25           HB       THR  25 -14.510   6.156   2.983
  236    HG1  THR  25           HG1      THR  25 -15.355   7.448   4.473
  237   1HG2  THR  25          1HG2      THR  25 -14.072   4.013   4.854
  238   2HG2  THR  25          3HG2      THR  25 -15.483   4.948   5.351
  239   3HG2  THR  25          2HG2      THR  25 -15.416   4.243   3.735
  240    MG   THR  25           QG2      THR  25 -14.990   4.402   4.647
  241    H    VAL  26           H        VAL  26 -11.804   3.407   4.124
  242    HA   VAL  26           HA       VAL  26 -10.592   3.211   1.510
  243    HB   VAL  26           HB       VAL  26 -11.547   1.065   3.434
  244   1HG1  VAL  26          2HG1      VAL  26 -10.031   1.061   0.915
  245   2HG1  VAL  26          1HG1      VAL  26  -9.213   0.219   2.231
  246   3HG1  VAL  26          3HG1      VAL  26 -10.835  -0.272   1.745
  247   1HG2  VAL  26          2HG2      VAL  26  -9.515   3.093   3.695
  248   2HG2  VAL  26          1HG2      VAL  26  -9.978   1.841   4.848
  249   3HG2  VAL  26          3HG2      VAL  26  -8.755   1.504   3.622
  250    MG1  VAL  26           QG1      VAL  26 -10.026   0.336   1.630
  251    MG2  VAL  26           QG2      VAL  26  -9.416   2.146   4.055
  252    QG   VAL  26           QQG      VAL  26  -9.721   1.241   2.843
  253    H    SER  27           H        SER  27 -11.745   3.098  -0.380
  254    HA   SER  27           HA       SER  27 -14.568   2.215  -0.353
  255   1HB   SER  27          2HB       SER  27 -13.298   4.192  -1.627
  256   2HB   SER  27          1HB       SER  27 -13.041   2.928  -2.827
  257    HG   SER  27           HG       SER  27 -15.526   3.749  -1.714
  258    QB   SER  27           QB       SER  27 -13.170   3.560  -2.227
  259    H    LYS  28           H        LYS  28 -11.406   1.064  -1.393
  260    HA   LYS  28           HA       LYS  28 -12.355  -1.659  -1.678
  261   1HB   LYS  28          2HB       LYS  28 -13.241  -0.351  -3.712
  262   2HB   LYS  28          1HB       LYS  28 -11.560  -0.267  -4.243
  263   1HG   LYS  28          2HG       LYS  28 -11.573  -2.852  -3.828
  264   2HG   LYS  28          1HG       LYS  28 -13.325  -2.683  -3.937
  265   1HD   LYS  28          2HD       LYS  28 -11.932  -1.228  -6.057
  266   2HD   LYS  28          1HD       LYS  28 -11.591  -2.959  -6.089
  267   1HE   LYS  28          2HE       LYS  28 -13.643  -3.369  -6.952
  268   2HE   LYS  28          1HE       LYS  28 -14.408  -2.542  -5.580
  269   1HZ   LYS  28          1HZ       LYS  28 -13.177  -1.178  -7.917
  270   2HZ   LYS  28          3HZ       LYS  28 -14.844  -1.407  -7.703
  271   3HZ   LYS  28          2HZ       LYS  28 -13.977  -0.426  -6.620
  272    QB   LYS  28           QB       LYS  28 -12.401  -0.309  -3.977
  273    QD   LYS  28           QD       LYS  28 -11.761  -2.094  -6.073
  274    QG   LYS  28           QG       LYS  28 -12.449  -2.768  -3.883
  275    QE   LYS  28           QE       LYS  28 -14.025  -2.956  -6.266
  276    QZ   LYS  28           QZ       LYS  28 -13.999  -1.004  -7.414
  277    H    ILE  29           H        ILE  29 -10.578  -2.877  -1.186
  278    HA   ILE  29           HA       ILE  29  -7.900  -1.682  -1.199
  279    HB   ILE  29           HB       ILE  29  -8.757  -3.158   0.594
  280   1HG1  ILE  29          2HG1      ILE  29  -6.716  -4.957  -0.507
  281   2HG1  ILE  29          1HG1      ILE  29  -6.258  -3.256  -0.606
  282   1HG2  ILE  29          1HG2      ILE  29  -9.592  -4.714  -1.664
  283   2HG2  ILE  29          3HG2      ILE  29  -8.512  -5.699  -0.675
  284   3HG2  ILE  29          2HG2      ILE  29  -9.954  -4.980   0.042
  285   1HD1  ILE  29          3HD1      ILE  29  -7.491  -4.032   1.957
  286   2HD1  ILE  29          2HD1      ILE  29  -5.944  -4.812   1.630
  287   3HD1  ILE  29          1HD1      ILE  29  -6.058  -3.052   1.649
  288    MG   ILE  29           QG2      ILE  29  -9.353  -5.131  -0.766
  289    MD   ILE  29           QD1      ILE  29  -6.498  -3.965   1.745
  290    QG   ILE  29           QG1      ILE  29  -6.487  -4.106  -0.557
  291    H    LEU  30           H        LEU  30  -6.131  -2.442  -2.487
  292    HA   LEU  30           HA       LEU  30  -6.959  -3.905  -4.969
  293   1HB   LEU  30          2HB       LEU  30  -5.430  -1.516  -4.361
  294   2HB   LEU  30          1HB       LEU  30  -4.453  -2.648  -5.298
  295    HG   LEU  30           HG       LEU  30  -5.720  -1.160  -6.795
  296   1HD1  LEU  30          2HD1      LEU  30  -7.644  -1.124  -4.933
  297   2HD1  LEU  30          1HD1      LEU  30  -7.992  -0.800  -6.632
  298   3HD1  LEU  30          3HD1      LEU  30  -8.303  -2.399  -5.958
  299   1HD2  LEU  30          2HD2      LEU  30  -5.474  -3.852  -7.028
  300   2HD2  LEU  30          1HD2      LEU  30  -7.230  -3.697  -7.102
  301   3HD2  LEU  30          3HD2      LEU  30  -6.219  -2.841  -8.266
  302    MD1  LEU  30           QD1      LEU  30  -7.979  -1.441  -5.841
  303    MD2  LEU  30           QD2      LEU  30  -6.308  -3.463  -7.466
  304    QB   LEU  30           QB       LEU  30  -4.942  -2.082  -4.829
  305    QD   LEU  30           QQD      LEU  30  -7.144  -2.452  -6.653
  306    H    VAL  31           H        VAL  31  -4.435  -3.664  -2.472
  307    HA   VAL  31           HA       VAL  31  -3.137  -6.130  -3.520
  308    HB   VAL  31           HB       VAL  31  -1.317  -5.474  -2.034
  309   1HG1  VAL  31          3HG1      VAL  31  -3.448  -3.740  -0.848
  310   2HG1  VAL  31          2HG1      VAL  31  -2.190  -4.678  -0.046
  311   3HG1  VAL  31          1HG1      VAL  31  -1.787  -3.148  -0.825
  312   1HG2  VAL  31          2HG2      VAL  31  -1.605  -4.273  -4.215
  313   2HG2  VAL  31          1HG2      VAL  31  -2.468  -2.999  -3.353
  314   3HG2  VAL  31          3HG2      VAL  31  -0.770  -3.312  -2.995
  315    MG1  VAL  31           QG1      VAL  31  -2.475  -3.855  -0.573
  316    MG2  VAL  31           QG2      VAL  31  -1.614  -3.528  -3.521
  317    QG   VAL  31           QQG      VAL  31  -2.045  -3.692  -2.047
  318    H    LYS  32           H        LYS  32  -2.318  -7.610  -1.604
  319    HA   LYS  32           HA       LYS  32  -4.355  -7.844   0.560
  320   1HB   LYS  32          2HB       LYS  32  -3.744  -9.786  -1.665
  321   2HB   LYS  32          1HB       LYS  32  -4.391 -10.360  -0.128
  322   1HG   LYS  32          2HG       LYS  32  -6.033  -8.222  -0.672
  323   2HG   LYS  32          1HG       LYS  32  -5.729  -8.870  -2.283
  324   1HD   LYS  32          2HD       LYS  32  -6.803 -10.851  -1.841
  325   2HD   LYS  32          1HD       LYS  32  -6.335 -10.845  -0.140
  326   1HE   LYS  32          2HE       LYS  32  -8.065  -9.323   0.448
  327   2HE   LYS  32          1HE       LYS  32  -8.343  -8.865  -1.245
  328   1HZ   LYS  32          1HZ       LYS  32  -8.654 -11.638  -0.236
  329   2HZ   LYS  32          3HZ       LYS  32  -9.947 -10.545  -0.343
  330   3HZ   LYS  32          2HZ       LYS  32  -9.126 -11.028  -1.749
  331    QB   LYS  32           QB       LYS  32  -4.067 -10.073  -0.897
  332    QD   LYS  32           QD       LYS  32  -6.569 -10.848  -0.991
  333    QG   LYS  32           QG       LYS  32  -5.881  -8.546  -1.478
  334    QE   LYS  32           QE       LYS  32  -8.204  -9.094  -0.399
  335    QZ   LYS  32           QZ       LYS  32  -9.242 -11.070  -0.776
  336    H    GLU  33           H        GLU  33  -1.676  -7.025   0.859
  337    HA   GLU  33           HA       GLU  33   0.238  -7.515   2.152
  338   1HB   GLU  33          2HB       GLU  33  -1.814  -8.442   3.503
  339   2HB   GLU  33          1HB       GLU  33  -1.183 -10.021   3.031
  340   1HG   GLU  33          2HG       GLU  33   1.102  -8.777   3.869
  341   2HG   GLU  33          1HG       GLU  33  -0.091  -8.053   4.947
  342    QB   GLU  33           QB       GLU  33  -1.498  -9.232   3.267
  343    QG   GLU  33           QG       GLU  33   0.506  -8.415   4.408
  344    H    GLY  34           H        GLY  34   2.111  -8.934   2.142
  345   1HA   GLY  34          1HA       GLY  34   2.264 -11.499   0.983
  346   2HA   GLY  34          2HA       GLY  34   3.616 -10.367   1.050
  347    QA   GLY  34           QA       GLY  34   2.940 -10.933   1.016
  348    H    ASP  35           H        ASP  35   2.076  -8.354  -0.545
  349    HA   ASP  35           HA       ASP  35   2.235  -9.716  -3.216
  350   1HB   ASP  35          2HB       ASP  35   0.088  -8.473  -1.936
  351   2HB   ASP  35          1HB       ASP  35   0.667  -7.254  -3.071
  352    QB   ASP  35           QB       ASP  35   0.377  -7.864  -2.503
  353    H    THR  36           H        THR  36   3.869  -8.914  -4.470
  354    HA   THR  36           HA       THR  36   5.478  -6.651  -3.675
  355    HB   THR  36           HB       THR  36   5.270  -8.046  -6.362
  356    HG1  THR  36           HG1      THR  36   6.816  -8.715  -4.081
  357   1HG2  THR  36          1HG2      THR  36   6.655  -5.970  -6.250
  358   2HG2  THR  36          3HG2      THR  36   7.613  -6.718  -4.973
  359   3HG2  THR  36          2HG2      THR  36   7.609  -7.413  -6.594
  360    MG   THR  36           QG2      THR  36   7.292  -6.700  -5.939
  361    H    VAL  37           H        VAL  37   5.578  -4.566  -4.680
  362    HA   VAL  37           HA       VAL  37   3.336  -3.888  -6.544
  363    HB   VAL  37           HB       VAL  37   2.697  -3.336  -4.240
  364   1HG1  VAL  37          3HG1      VAL  37   2.032  -1.777  -6.040
  365   2HG1  VAL  37          2HG1      VAL  37   2.320  -0.914  -4.529
  366   3HG1  VAL  37          1HG1      VAL  37   3.532  -0.876  -5.810
  367   1HG2  VAL  37          2HG2      VAL  37   5.377  -1.934  -4.247
  368   2HG2  VAL  37          1HG2      VAL  37   4.118  -1.551  -3.074
  369   3HG2  VAL  37          3HG2      VAL  37   4.804  -3.174  -3.133
  370    MG1  VAL  37           QG1      VAL  37   2.628  -1.189  -5.459
  371    MG2  VAL  37           QG2      VAL  37   4.766  -2.219  -3.485
  372    QG   VAL  37           QQG      VAL  37   3.697  -1.704  -4.472
  373    H    LYS  38           H        LYS  38   3.752  -1.840  -7.726
  374    HA   LYS  38           HA       LYS  38   6.689  -1.296  -8.010
  375   1HB   LYS  38          2HB       LYS  38   5.188  -2.404  -9.854
  376   2HB   LYS  38          1HB       LYS  38   4.588  -0.763 -10.102
  377   1HG   LYS  38          2HG       LYS  38   6.774   0.055 -10.635
  378   2HG   LYS  38          1HG       LYS  38   7.537  -1.437 -10.085
  379   1HD   LYS  38          2HD       LYS  38   5.491  -1.835 -12.166
  380   2HD   LYS  38          1HD       LYS  38   6.886  -0.895 -12.698
  381   1HE   LYS  38          2HE       LYS  38   7.790  -3.134 -11.108
  382   2HE   LYS  38          1HE       LYS  38   6.751  -3.707 -12.429
  383   1HZ   LYS  38          2HZ       LYS  38   8.919  -1.707 -12.774
  384   2HZ   LYS  38          1HZ       LYS  38   9.110  -3.365 -13.091
  385   3HZ   LYS  38          3HZ       LYS  38   8.007  -2.453 -13.999
  386    QB   LYS  38           QB       LYS  38   4.888  -1.584  -9.978
  387    QD   LYS  38           QD       LYS  38   6.188  -1.365 -12.432
  388    QG   LYS  38           QG       LYS  38   7.155  -0.691 -10.360
  389    QE   LYS  38           QE       LYS  38   7.270  -3.420 -11.768
  390    QZ   LYS  38           QZ       LYS  38   8.679  -2.508 -13.288
  391    H    ALA  39           H        ALA  39   7.275   0.950  -8.417
  392    HA   ALA  39           HA       ALA  39   5.926   2.887  -6.826
  393   1HB   ALA  39          1HB       ALA  39   8.193   3.270  -7.302
  394   2HB   ALA  39          3HB       ALA  39   7.993   2.904  -9.015
  395   3HB   ALA  39          2HB       ALA  39   7.398   4.432  -8.365
  396    MB   ALA  39           QB       ALA  39   7.861   3.535  -8.227
  397    H    GLY  40           H        GLY  40   3.831   3.513  -7.279
  398   1HA   GLY  40          1HA       GLY  40   3.264   4.411 -10.073
  399   2HA   GLY  40          2HA       GLY  40   2.492   5.086  -8.636
  400    QA   GLY  40           QA       GLY  40   2.878   4.748  -9.355
  401    H    GLN  41           H        GLN  41   2.170   2.359  -7.449
  402    HA   GLN  41           HA       GLN  41   0.002   1.334  -9.256
  403   1HB   GLN  41          2HB       GLN  41   2.081  -0.075  -8.799
  404   2HB   GLN  41          1HB       GLN  41   1.540  -0.173  -7.123
  405   1HG   GLN  41          2HG       GLN  41  -0.643  -1.099  -7.939
  406   2HG   GLN  41          1HG       GLN  41   0.028  -1.130  -9.570
  407   1HE2  GLN  41          1HE2      GLN  41  -0.435  -3.071  -6.883
  408   2HE2  GLN  41          2HE2      GLN  41   0.808  -4.197  -7.146
  409    QB   GLN  41           QB       GLN  41   1.810  -0.124  -7.961
  410    QG   GLN  41           QG       GLN  41  -0.308  -1.115  -8.755
  411    QE   GLN  41           QE2      GLN  41   0.186  -3.634  -7.014
  412    H    THR  42           H        THR  42  -1.963   1.939  -8.429
  413    HA   THR  42           HA       THR  42  -2.506   2.936  -5.847
  414    HB   THR  42           HB       THR  42  -4.296   1.369  -7.735
  415    HG1  THR  42           HG1      THR  42  -4.194   3.068  -8.938
  416   1HG2  THR  42          3HG2      THR  42  -4.849   3.276  -5.457
  417   2HG2  THR  42          2HG2      THR  42  -6.046   2.915  -6.700
  418   3HG2  THR  42          1HG2      THR  42  -5.441   1.627  -5.659
  419    MG   THR  42           QG2      THR  42  -5.445   2.606  -5.939
  420    H    VAL  43           H        VAL  43  -1.555   1.620  -4.205
  421    HA   VAL  43           HA       VAL  43  -1.949  -1.233  -4.013
  422    HB   VAL  43           HB       VAL  43  -0.992  -0.882  -1.772
  423   1HG1  VAL  43          2HG1      VAL  43  -2.261   1.700  -2.095
  424   2HG1  VAL  43          1HG1      VAL  43  -1.608   0.964  -0.634
  425   3HG1  VAL  43          3HG1      VAL  43  -0.556   1.900  -1.695
  426   1HG2  VAL  43          1HG2      VAL  43   0.391  -0.623  -3.921
  427   2HG2  VAL  43          3HG2      VAL  43   0.301   1.116  -3.637
  428   3HG2  VAL  43          2HG2      VAL  43   1.082   0.067  -2.453
  429    MG1  VAL  43           QG1      VAL  43  -1.475   1.522  -1.475
  430    MG2  VAL  43           QG2      VAL  43   0.591   0.187  -3.337
  431    QG   VAL  43           QQG      VAL  43  -0.442   0.854  -2.406
  432    H    LEU  44           H        LEU  44  -3.888   1.536  -3.137
  433    HA   LEU  44           HA       LEU  44  -6.103  -0.233  -2.348
  434   1HB   LEU  44          2HB       LEU  44  -4.283   1.062  -0.449
  435   2HB   LEU  44          1HB       LEU  44  -5.977   1.451  -0.147
  436    HG   LEU  44           HG       LEU  44  -5.717  -1.354  -0.776
  437   1HD1  LEU  44          2HD1      LEU  44  -3.900  -0.230   1.364
  438   2HD1  LEU  44          1HD1      LEU  44  -4.471  -1.898   1.399
  439   3HD1  LEU  44          3HD1      LEU  44  -3.482  -1.333   0.052
  440   1HD2  LEU  44          2HD2      LEU  44  -7.125   0.393   0.986
  441   2HD2  LEU  44          1HD2      LEU  44  -7.445  -1.311   0.662
  442   3HD2  LEU  44          3HD2      LEU  44  -6.357  -0.851   1.972
  443    MD1  LEU  44           QD1      LEU  44  -3.951  -1.154   0.938
  444    MD2  LEU  44           QD2      LEU  44  -6.976  -0.590   1.207
  445    QB   LEU  44           QB       LEU  44  -5.130   1.257  -0.298
  446    QD   LEU  44           QQD      LEU  44  -5.463  -0.872   1.072
  447    H    VAL  45           H        VAL  45  -8.042   1.200  -1.659
  448    HA   VAL  45           HA       VAL  45  -7.974   3.768  -3.214
  449    HB   VAL  45           HB       VAL  45 -10.168   1.712  -2.782
  450   1HG1  VAL  45          2HG1      VAL  45  -8.048   1.895  -4.666
  451   2HG1  VAL  45          1HG1      VAL  45  -9.403   0.767  -4.677
  452   3HG1  VAL  45          3HG1      VAL  45  -9.533   2.309  -5.523
  453   1HG2  VAL  45          2HG2      VAL  45 -10.152   4.416  -4.136
  454   2HG2  VAL  45          1HG2      VAL  45 -11.343   3.178  -4.535
  455   3HG2  VAL  45          3HG2      VAL  45 -11.259   3.826  -2.897
  456    MG1  VAL  45           QG1      VAL  45  -8.995   1.657  -4.955
  457    MG2  VAL  45           QG2      VAL  45 -10.918   3.807  -3.856
  458    QG   VAL  45           QQG      VAL  45  -9.956   2.732  -4.406
  459    H    LEU  46           H        LEU  46  -8.505   5.574  -2.034
  460    HA   LEU  46           HA       LEU  46  -9.615   5.168   0.716
  461   1HB   LEU  46          2HB       LEU  46  -7.352   6.417  -0.148
  462   2HB   LEU  46          1HB       LEU  46  -8.479   7.773  -0.130
  463    HG   LEU  46           HG       LEU  46  -9.124   6.728   2.240
  464   1HD1  LEU  46          3HD1      LEU  46  -7.164   4.982   1.577
  465   2HD1  LEU  46          2HD1      LEU  46  -6.201   6.213   2.391
  466   3HD1  LEU  46          1HD1      LEU  46  -7.527   5.424   3.244
  467   1HD2  LEU  46          3HD2      LEU  46  -7.702   8.926   1.340
  468   2HD2  LEU  46          2HD2      LEU  46  -8.185   8.641   3.012
  469   3HD2  LEU  46          1HD2      LEU  46  -6.577   8.167   2.467
  470    MD1  LEU  46           QD1      LEU  46  -6.964   5.540   2.404
  471    MD2  LEU  46           QD2      LEU  46  -7.488   8.578   2.273
  472    QB   LEU  46           QB       LEU  46  -7.915   7.095  -0.139
  473    QD   LEU  46           QQD      LEU  46  -7.226   7.059   2.339
  474    H    GLU  47           H        GLU  47 -10.788   7.417   1.368
  475    HA   GLU  47           HA       GLU  47 -12.773   8.672   1.098
  476   1HB   GLU  47          2HB       GLU  47 -10.915   9.250  -0.884
  477   2HB   GLU  47          1HB       GLU  47 -12.399   8.970  -1.796
  478   1HG   GLU  47          2HG       GLU  47 -12.578  11.243  -1.279
  479   2HG   GLU  47          1HG       GLU  47 -13.495  10.499   0.032
  480    QB   GLU  47           QB       GLU  47 -11.657   9.110  -1.340
  481    QG   GLU  47           QG       GLU  47 -13.036  10.871  -0.623
  482    H    ALA  48           H        ALA  48 -14.751   8.829  -0.641
  483    HA   ALA  48           HA       ALA  48 -15.359   6.295  -1.985
  484   1HB   ALA  48          3HB       ALA  48 -17.395   6.767   0.040
  485   2HB   ALA  48          2HB       ALA  48 -16.471   5.300  -0.283
  486   3HB   ALA  48          1HB       ALA  48 -15.808   6.544   0.775
  487    MB   ALA  48           QB       ALA  48 -16.558   6.204   0.177
  488    H    MET  49           H        MET  49 -17.218   8.903  -0.360
  489    HA   MET  49           HA       MET  49 -18.868   9.231  -2.796
  490   1HB   MET  49          2HB       MET  49 -18.959   9.898   0.093
  491   2HB   MET  49          1HB       MET  49 -19.745  11.063  -0.974
  492   1HG   MET  49          2HG       MET  49 -21.518   9.633  -0.768
  493   2HG   MET  49          1HG       MET  49 -20.675   8.752  -2.043
  494   1HE   MET  49          1HE       MET  49 -22.639   8.324   0.695
  495   2HE   MET  49          3HE       MET  49 -21.898   7.290   1.924
  496   3HE   MET  49          2HE       MET  49 -21.449   8.990   1.811
  497    QB   MET  49           QB       MET  49 -19.352  10.480  -0.440
  498    QG   MET  49           QG       MET  49 -21.096   9.193  -1.406
  499    ME   MET  49           QE       MET  49 -21.995   8.201   1.477
  500    H    LYS  50           H        LYS  50 -16.370  10.947  -0.979
  501    HA   LYS  50           HA       LYS  50 -16.677  13.505  -2.287
  502   1HB   LYS  50          2HB       LYS  50 -14.435  12.102  -0.807
  503   2HB   LYS  50          1HB       LYS  50 -14.320  13.777  -1.348
  504   1HG   LYS  50          2HG       LYS  50 -16.096  14.472   0.059
  505   2HG   LYS  50          1HG       LYS  50 -16.640  12.815   0.327
  506   1HD   LYS  50          2HD       LYS  50 -14.174  12.541   1.297
  507   2HD   LYS  50          1HD       LYS  50 -14.343  14.278   1.559
  508   1HE   LYS  50          2HE       LYS  50 -16.123  14.012   3.063
  509   2HE   LYS  50          1HE       LYS  50 -16.550  12.412   2.423
  510   1HZ   LYS  50          2HZ       LYS  50 -14.296  11.671   3.169
  511   2HZ   LYS  50          1HZ       LYS  50 -14.148  13.143   4.004
  512   3HZ   LYS  50          3HZ       LYS  50 -15.369  12.046   4.431
  513    QB   LYS  50           QB       LYS  50 -14.378  12.939  -1.078
  514    QD   LYS  50           QD       LYS  50 -14.258  13.410   1.428
  515    QG   LYS  50           QG       LYS  50 -16.368  13.643   0.193
  516    QE   LYS  50           QE       LYS  50 -16.337  13.212   2.743
  517    QZ   LYS  50           QZ       LYS  50 -14.604  12.287   3.868
  518    H    MET  51           H        MET  51 -14.294  10.862  -2.763
  519    HA   MET  51           HA       MET  51 -14.301  11.101  -5.639
  520   1HB   MET  51          2HB       MET  51 -13.185  13.255  -4.603
  521   2HB   MET  51          1HB       MET  51 -11.797  12.190  -4.379
  522   1HG   MET  51          2HG       MET  51 -11.260  12.682  -6.520
  523   2HG   MET  51          1HG       MET  51 -12.602  11.632  -6.974
  524   1HE   MET  51          2HE       MET  51 -11.310  14.853  -5.966
  525   2HE   MET  51          1HE       MET  51 -12.157  16.091  -6.890
  526   3HE   MET  51          3HE       MET  51 -12.822  15.519  -5.353
  527    QB   MET  51           QB       MET  51 -12.491  12.722  -4.491
  528    QG   MET  51           QG       MET  51 -11.931  12.157  -6.747
  529    ME   MET  51           QE       MET  51 -12.096  15.488  -6.070
  530    H    GLU  52           H        GLU  52 -13.823   8.988  -6.123
  531    HA   GLU  52           HA       GLU  52 -12.626   7.085  -4.431
  532   1HB   GLU  52          2HB       GLU  52 -13.640   7.276  -7.045
  533   2HB   GLU  52          1HB       GLU  52 -11.998   6.661  -7.240
  534   1HG   GLU  52          2HG       GLU  52 -12.552   4.649  -6.377
  535   2HG   GLU  52          1HG       GLU  52 -13.382   5.389  -5.007
  536    QB   GLU  52           QB       GLU  52 -12.819   6.968  -7.143
  537    QG   GLU  52           QG       GLU  52 -12.967   5.019  -5.692
  538    H    THR  53           H        THR  53 -10.715   7.893  -3.429
  539    HA   THR  53           HA       THR  53  -8.502   8.974  -5.008
  540    HB   THR  53           HB       THR  53  -8.608   8.004  -2.135
  541    HG1  THR  53           HG1      THR  53  -9.007  10.344  -1.835
  542   1HG2  THR  53          2HG2      THR  53  -6.690   9.550  -3.792
  543   2HG2  THR  53          1HG2      THR  53  -6.972  10.151  -2.158
  544   3HG2  THR  53          3HG2      THR  53  -6.392   8.504  -2.405
  545    MG   THR  53           QG2      THR  53  -6.685   9.402  -2.785
  546    H    GLU  54           H        GLU  54  -6.771   7.823  -5.807
  547    HA   GLU  54           HA       GLU  54  -6.748   4.873  -5.361
  548   1HB   GLU  54          2HB       GLU  54  -5.723   6.795  -7.443
  549   2HB   GLU  54          1HB       GLU  54  -5.076   5.156  -7.358
  550   1HG   GLU  54          2HG       GLU  54  -7.410   4.274  -7.494
  551   2HG   GLU  54          1HG       GLU  54  -7.986   5.927  -7.714
  552    QB   GLU  54           QB       GLU  54  -5.399   5.976  -7.401
  553    QG   GLU  54           QG       GLU  54  -7.698   5.100  -7.604
  554    H    ILE  55           H        ILE  55  -5.536   4.519  -3.491
  555    HA   ILE  55           HA       ILE  55  -3.261   6.096  -2.694
  556    HB   ILE  55           HB       ILE  55  -4.189   3.298  -1.978
  557   1HG1  ILE  55          2HG1      ILE  55  -5.839   5.136  -1.588
  558   2HG1  ILE  55          1HG1      ILE  55  -5.287   4.394  -0.088
  559   1HG2  ILE  55          2HG2      ILE  55  -2.229   5.173  -0.623
  560   2HG2  ILE  55          1HG2      ILE  55  -2.893   3.724   0.131
  561   3HG2  ILE  55          3HG2      ILE  55  -1.876   3.585  -1.304
  562   1HD1  ILE  55          2HD1      ILE  55  -3.645   6.228   0.203
  563   2HD1  ILE  55          1HD1      ILE  55  -4.237   6.981  -1.277
  564   3HD1  ILE  55          3HD1      ILE  55  -5.296   6.843   0.126
  565    MG   ILE  55           QG2      ILE  55  -2.332   4.160  -0.598
  566    MD   ILE  55           QD1      ILE  55  -4.393   6.684  -0.316
  567    QG   ILE  55           QG1      ILE  55  -5.563   4.765  -0.838
  568    H    ASN  56           H        ASN  56  -1.816   6.150  -4.519
  569    HA   ASN  56           HA       ASN  56  -0.796   3.708  -5.745
  570   1HB   ASN  56          2HB       ASN  56   0.178   6.581  -5.765
  571   2HB   ASN  56          1HB       ASN  56   0.673   5.322  -6.897
  572   1HD2  ASN  56          1HD2      ASN  56  -1.531   7.849  -6.495
  573   2HD2  ASN  56          2HD2      ASN  56  -2.682   7.368  -7.647
  574    QB   ASN  56           QB       ASN  56   0.426   5.951  -6.331
  575    QD   ASN  56           QD2      ASN  56  -2.106   7.608  -7.071
  576    H    ALA  57           H        ALA  57   0.916   2.501  -5.033
  577    HA   ALA  57           HA       ALA  57   2.097   2.695  -2.503
  578   1HB   ALA  57          2HB       ALA  57   2.313   1.150  -4.847
  579   2HB   ALA  57          3HB       ALA  57   3.042   0.795  -3.281
  580   3HB   ALA  57          1HB       ALA  57   3.954   1.692  -4.495
  581    MB   ALA  57           QB       ALA  57   3.103   1.213  -4.208
  582    HA   PRO  58           HA       PRO  58   4.957   6.031  -2.787
  583   1HB   PRO  58          2HB       PRO  58   6.891   5.214  -1.035
  584   2HB   PRO  58          1HB       PRO  58   5.297   5.790  -0.511
  585   1HG   PRO  58          2HG       PRO  58   6.326   3.012  -0.734
  586   2HG   PRO  58          1HG       PRO  58   5.237   3.723   0.467
  587   1HD   PRO  58          2HD       PRO  58   4.411   2.149  -1.624
  588   2HD   PRO  58          1HD       PRO  58   3.384   3.346  -0.805
  589    QB   PRO  58           QB       PRO  58   6.094   5.502  -0.773
  590    QG   PRO  58           QG       PRO  58   5.781   3.368  -0.133
  591    QD   PRO  58           QD       PRO  58   3.898   2.748  -1.214
  592    H    THR  59           H        THR  59   6.352   2.759  -3.021
  593    HA   THR  59           HA       THR  59   7.949   3.590  -5.356
  594    HB   THR  59           HB       THR  59   9.319   4.320  -3.467
  595    HG1  THR  59           HG1      THR  59  11.134   2.993  -3.874
  596   1HG2  THR  59          3HG2      THR  59   8.138   2.165  -2.156
  597   2HG2  THR  59          2HG2      THR  59   9.827   1.685  -2.327
  598   3HG2  THR  59          1HG2      THR  59   9.417   3.196  -1.515
  599    MG   THR  59           QG2      THR  59   9.128   2.349  -1.999
  600    H    ASP  60           H        ASP  60   9.415   1.559  -5.963
  601    HA   ASP  60           HA       ASP  60   7.615  -0.725  -6.198
  602   1HB   ASP  60          2HB       ASP  60   9.487  -1.615  -7.540
  603   2HB   ASP  60          1HB       ASP  60   9.160   0.065  -7.972
  604    QB   ASP  60           QB       ASP  60   9.323  -0.775  -7.756
  605    H    GLY  61           H        GLY  61   7.593  -2.524  -4.894
  606   1HA   GLY  61          1HA       GLY  61   9.092  -2.609  -2.451
  607   2HA   GLY  61          2HA       GLY  61   9.816  -3.710  -3.623
  608    QA   GLY  61           QA       GLY  61   9.454  -3.160  -3.037
  609    H    LYS  62           H        LYS  62   8.026  -3.968  -1.056
  610    HA   LYS  62           HA       LYS  62   5.737  -5.501  -2.135
  611   1HB   LYS  62          2HB       LYS  62   7.862  -6.909  -2.211
  612   2HB   LYS  62          1HB       LYS  62   7.876  -6.827  -0.449
  613   1HG   LYS  62          2HG       LYS  62   5.714  -7.908  -0.315
  614   2HG   LYS  62          1HG       LYS  62   5.526  -7.842  -2.069
  615   1HD   LYS  62          2HD       LYS  62   6.252 -10.061  -1.608
  616   2HD   LYS  62          1HD       LYS  62   7.687  -9.220  -2.195
  617   1HE   LYS  62          2HE       LYS  62   8.635  -9.070  -0.040
  618   2HE   LYS  62          1HE       LYS  62   7.074  -9.334   0.762
  619   1HZ   LYS  62          3HZ       LYS  62   7.005 -11.555  -0.235
  620   2HZ   LYS  62          2HZ       LYS  62   8.545 -11.306  -0.907
  621   3HZ   LYS  62          1HZ       LYS  62   8.351 -11.372   0.780
  622    QB   LYS  62           QB       LYS  62   7.869  -6.868  -1.330
  623    QD   LYS  62           QD       LYS  62   6.970  -9.641  -1.901
  624    QG   LYS  62           QG       LYS  62   5.620  -7.875  -1.192
  625    QE   LYS  62           QE       LYS  62   7.854  -9.202   0.361
  626    QZ   LYS  62           QZ       LYS  62   7.967 -11.411  -0.121
  627    H    VAL  63           H        VAL  63   4.157  -5.924  -0.501
  628    HA   VAL  63           HA       VAL  63   4.071  -4.098   1.707
  629    HB   VAL  63           HB       VAL  63   2.528  -6.523   0.788
  630   1HG1  VAL  63          1HG1      VAL  63   2.307  -4.280  -0.314
  631   2HG1  VAL  63          3HG1      VAL  63   0.799  -4.867   0.387
  632   3HG1  VAL  63          2HG1      VAL  63   1.739  -3.632   1.226
  633   1HG2  VAL  63          1HG2      VAL  63   2.402  -5.202   3.462
  634   2HG2  VAL  63          3HG2      VAL  63   0.863  -5.542   2.669
  635   3HG2  VAL  63          2HG2      VAL  63   1.991  -6.856   3.006
  636    MG1  VAL  63           QG1      VAL  63   1.615  -4.260   0.433
  637    MG2  VAL  63           QG2      VAL  63   1.752  -5.867   3.045
  638    QG   VAL  63           QQG      VAL  63   1.684  -5.063   1.739
  639    H    GLU  64           H        GLU  64   4.555  -4.399   3.877
  640    HA   GLU  64           HA       GLU  64   5.945  -6.955   4.598
  641   1HB   GLU  64          2HB       GLU  64   6.378  -4.044   5.187
  642   2HB   GLU  64          1HB       GLU  64   6.924  -5.236   6.368
  643   1HG   GLU  64          2HG       GLU  64   7.646  -5.333   3.425
  644   2HG   GLU  64          1HG       GLU  64   8.674  -4.607   4.663
  645    QB   GLU  64           QB       GLU  64   6.651  -4.640   5.777
  646    QG   GLU  64           QG       GLU  64   8.160  -4.970   4.044
  647    H    LYS  65           H        LYS  65   3.325  -4.793   5.327
  648    HA   LYS  65           HA       LYS  65   2.082  -6.585   7.186
  649   1HB   LYS  65          2HB       LYS  65   4.261  -5.216   8.256
  650   2HB   LYS  65          1HB       LYS  65   2.876  -4.267   8.795
  651   1HG   LYS  65          2HG       LYS  65   2.956  -7.277   9.060
  652   2HG   LYS  65          1HG       LYS  65   3.581  -6.207  10.316
  653   1HD   LYS  65          2HD       LYS  65   1.434  -5.189  10.641
  654   2HD   LYS  65          1HD       LYS  65   0.780  -5.961   9.197
  655   1HE   LYS  65          2HE       LYS  65   1.895  -7.726  11.351
  656   2HE   LYS  65          1HE       LYS  65   0.292  -7.002  11.591
  657   1HZ   LYS  65          1HZ       LYS  65   1.099  -8.368   9.085
  658   2HZ   LYS  65          3HZ       LYS  65   0.289  -9.161  10.345
  659   3HZ   LYS  65          2HZ       LYS  65  -0.461  -7.869   9.536
  660    QB   LYS  65           QB       LYS  65   3.569  -4.742   8.526
  661    QD   LYS  65           QD       LYS  65   1.107  -5.575   9.919
  662    QG   LYS  65           QG       LYS  65   3.268  -6.742   9.688
  663    QE   LYS  65           QE       LYS  65   1.093  -7.364  11.471
  664    QZ   LYS  65           QZ       LYS  65   0.309  -8.466   9.655
  665    H    VAL  66           H        VAL  66   0.293  -5.892   5.817
  666    HA   VAL  66           HA       VAL  66  -0.489  -3.071   5.734
  667    HB   VAL  66           HB       VAL  66  -0.854  -4.744   3.909
  668   1HG1  VAL  66          2HG1      VAL  66  -1.531  -6.520   5.749
  669   2HG1  VAL  66          1HG1      VAL  66  -3.147  -5.867   5.484
  670   3HG1  VAL  66          3HG1      VAL  66  -2.256  -6.587   4.143
  671   1HG2  VAL  66          3HG2      VAL  66  -3.252  -3.384   5.151
  672   2HG2  VAL  66          2HG2      VAL  66  -2.240  -2.800   3.832
  673   3HG2  VAL  66          1HG2      VAL  66  -3.321  -4.170   3.574
  674    MG1  VAL  66           QG1      VAL  66  -2.311  -6.325   5.125
  675    MG2  VAL  66           QG2      VAL  66  -2.938  -3.451   4.186
  676    QG   VAL  66           QQG      VAL  66  -2.625  -4.888   4.656
  677    H    LEU  67           H        LEU  67  -1.445  -2.114   7.481
  678    HA   LEU  67           HA       LEU  67  -2.910  -3.793   9.451
  679   1HB   LEU  67          2HB       LEU  67  -2.663  -1.814  10.871
  680   2HB   LEU  67          1HB       LEU  67  -1.113  -2.187  10.119
  681    HG   LEU  67           HG       LEU  67  -2.217  -0.523   8.249
  682   1HD1  LEU  67          2HD1      LEU  67   0.065  -0.452   9.298
  683   2HD1  LEU  67          1HD1      LEU  67  -0.660   1.142   9.085
  684   3HD1  LEU  67          3HD1      LEU  67  -0.648   0.386  10.677
  685   1HD2  LEU  67          1HD2      LEU  67  -3.942  -0.242  10.369
  686   2HD2  LEU  67          3HD2      LEU  67  -2.794   1.065  10.661
  687   3HD2  LEU  67          2HD2      LEU  67  -3.668   0.985   9.132
  688    MD1  LEU  67           QD1      LEU  67  -0.414   0.358   9.687
  689    MD2  LEU  67           QD2      LEU  67  -3.468   0.602  10.054
  690    QB   LEU  67           QB       LEU  67  -1.888  -2.001  10.495
  691    QD   LEU  67           QQD      LEU  67  -1.941   0.480   9.870
  692    H    VAL  68           H        VAL  68  -3.466  -1.340   7.003
  693    HA   VAL  68           HA       VAL  68  -6.078  -0.491   7.893
  694    HB   VAL  68           HB       VAL  68  -4.572   0.732   6.335
  695   1HG1  VAL  68          3HG1      VAL  68  -4.028  -1.570   5.153
  696   2HG1  VAL  68          2HG1      VAL  68  -5.402  -1.134   4.138
  697   3HG1  VAL  68          1HG1      VAL  68  -4.000  -0.069   4.226
  698   1HG2  VAL  68          3HG2      VAL  68  -7.279   0.651   6.291
  699   2HG2  VAL  68          2HG2      VAL  68  -6.332   1.707   5.243
  700   3HG2  VAL  68          1HG2      VAL  68  -6.937   0.169   4.629
  701    MG1  VAL  68           QG1      VAL  68  -4.476  -0.924   4.505
  702    MG2  VAL  68           QG2      VAL  68  -6.849   0.843   5.388
  703    QG   VAL  68           QQG      VAL  68  -5.663  -0.041   4.946
  704    H    LYS  69           H        LYS  69  -8.142  -1.146   7.033
  705    HA   LYS  69           HA       LYS  69  -8.157  -3.777   5.592
  706   1HB   LYS  69          2HB       LYS  69  -9.517  -2.864   8.122
  707   2HB   LYS  69          1HB       LYS  69 -10.226  -4.153   7.150
  708   1HG   LYS  69          2HG       LYS  69  -7.877  -5.231   7.218
  709   2HG   LYS  69          1HG       LYS  69  -7.550  -4.112   8.540
  710   1HD   LYS  69          2HD       LYS  69  -9.776  -4.993   9.549
  711   2HD   LYS  69          1HD       LYS  69  -9.583  -6.333   8.418
  712   1HE   LYS  69          2HE       LYS  69  -7.376  -5.487  10.317
  713   2HE   LYS  69          1HE       LYS  69  -8.572  -6.734  10.724
  714   1HZ   LYS  69          2HZ       LYS  69  -8.009  -7.752   8.506
  715   2HZ   LYS  69          1HZ       LYS  69  -6.666  -6.713   8.454
  716   3HZ   LYS  69          3HZ       LYS  69  -6.796  -7.866   9.690
  717    QB   LYS  69           QB       LYS  69  -9.871  -3.508   7.636
  718    QD   LYS  69           QD       LYS  69  -9.680  -5.663   8.983
  719    QG   LYS  69           QG       LYS  69  -7.714  -4.672   7.879
  720    QE   LYS  69           QE       LYS  69  -7.974  -6.110  10.521
  721    QZ   LYS  69           QZ       LYS  69  -7.157  -7.444   8.883
  722    H    GLU  70           H        GLU  70 -10.208  -4.152   4.413
  723    HA   GLU  70           HA       GLU  70 -11.137  -1.832   2.985
  724   1HB   GLU  70          2HB       GLU  70 -11.090  -4.530   2.618
  725   2HB   GLU  70          1HB       GLU  70 -12.786  -4.298   3.045
  726   1HG   GLU  70          2HG       GLU  70 -12.797  -2.400   1.317
  727   2HG   GLU  70          1HG       GLU  70 -11.252  -3.045   0.763
  728    QB   GLU  70           QB       GLU  70 -11.938  -4.414   2.832
  729    QG   GLU  70           QG       GLU  70 -12.024  -2.723   1.040
  730    H    ARG  71           H        ARG  71 -13.270  -0.879   3.056
  731    HA   ARG  71           HA       ARG  71 -15.149   0.011   4.182
  732   1HB   ARG  71          2HB       ARG  71 -15.597  -2.521   3.848
  733   2HB   ARG  71          1HB       ARG  71 -15.237  -2.671   5.569
  734   1HG   ARG  71          2HG       ARG  71 -16.950  -0.670   5.785
  735   2HG   ARG  71          1HG       ARG  71 -17.524  -1.270   4.229
  736   1HD   ARG  71          2HD       ARG  71 -17.699  -3.571   5.270
  737   2HD   ARG  71          1HD       ARG  71 -17.360  -2.813   6.838
  738    HE   ARG  71           HE       ARG  71 -19.412  -1.490   6.579
  739   1HH1  ARG  71          1HH1      ARG  71 -19.398  -4.565   5.315
  740   2HH1  ARG  71          2HH1      ARG  71 -20.780  -4.359   4.292
  741   1HH2  ARG  71          1HH2      ARG  71 -20.959  -0.930   4.781
  742   2HH2  ARG  71          2HH2      ARG  71 -21.664  -2.300   3.989
  743    QB   ARG  71           QB       ARG  71 -15.417  -2.596   4.708
  744    QG   ARG  71           QG       ARG  71 -17.237  -0.970   5.007
  745    QD   ARG  71           QD       ARG  71 -17.530  -3.192   6.054
  746    QH1  ARG  71           QH1      ARG  71 -20.089  -4.462   4.803
  747    QH2  ARG  71           QH2      ARG  71 -21.312  -1.615   4.385
  748    H    ASP  72           H        ASP  72 -12.349  -0.063   5.526
  749    HA   ASP  72           HA       ASP  72 -13.227   0.195   8.375
  750   1HB   ASP  72          2HB       ASP  72 -11.362  -1.373   7.643
  751   2HB   ASP  72          1HB       ASP  72 -10.429   0.062   7.217
  752    QB   ASP  72           QB       ASP  72 -10.896  -0.655   7.430
  753    H    ALA  73           H        ALA  73 -14.127   2.362   8.060
  754    HA   ALA  73           HA       ALA  73 -12.845   4.572   6.862
  755   1HB   ALA  73          3HB       ALA  73 -14.907   4.046   8.926
  756   2HB   ALA  73          2HB       ALA  73 -14.203   5.662   8.959
  757   3HB   ALA  73          1HB       ALA  73 -14.989   5.071   7.494
  758    MB   ALA  73           QB       ALA  73 -14.700   4.926   8.460
  759    H    VAL  74           H        VAL  74 -11.427   6.183   7.702
  760    HA   VAL  74           HA       VAL  74 -10.315   5.845  10.427
  761    HB   VAL  74           HB       VAL  74  -9.078   4.281   8.943
  762   1HG1  VAL  74          1HG1      VAL  74  -7.909   5.401  10.821
  763   2HG1  VAL  74          3HG1      VAL  74  -6.820   5.103   9.467
  764   3HG1  VAL  74          2HG1      VAL  74  -7.462   6.723   9.742
  765   1HG2  VAL  74          3HG2      VAL  74  -9.295   6.472   7.128
  766   2HG2  VAL  74          2HG2      VAL  74  -7.579   6.189   7.421
  767   3HG2  VAL  74          1HG2      VAL  74  -8.600   4.879   6.828
  768    MG1  VAL  74           QG1      VAL  74  -7.397   5.742  10.010
  769    MG2  VAL  74           QG2      VAL  74  -8.491   5.847   7.126
  770    QG   VAL  74           QQG      VAL  74  -7.944   5.794   8.568
  771    H    GLN  75           H        GLN  75  -8.810   7.690  10.938
  772    HA   GLN  75           HA       GLN  75  -9.628  10.141   9.431
  773   1HB   GLN  75          2HB       GLN  75  -9.016   9.403  12.246
  774   2HB   GLN  75          1HB       GLN  75  -8.524  11.021  11.744
  775   1HG   GLN  75          2HG       GLN  75 -10.653  11.749  11.807
  776   2HG   GLN  75          1HG       GLN  75 -11.174  10.438  10.747
  777   1HE2  GLN  75          1HE2      GLN  75 -13.108   9.966  11.988
  778   2HE2  GLN  75          2HE2      GLN  75 -13.032   9.274  13.537
  779    QB   GLN  75           QB       GLN  75  -8.770  10.212  11.995
  780    QG   GLN  75           QG       GLN  75 -10.913  11.094  11.277
  781    QE   GLN  75           QE2      GLN  75 -13.070   9.620  12.762
  782    H    GLY  76           H        GLY  76  -7.761  11.923   9.795
  783   1HA   GLY  76          1HA       GLY  76  -5.677  12.578   8.905
  784   2HA   GLY  76          2HA       GLY  76  -5.442  10.919   8.354
  785    QA   GLY  76           QA       GLY  76  -5.559  11.749   8.630
  786    H    GLY  77           H        GLY  77  -3.552  10.210   9.235
  787   1HA   GLY  77          1HA       GLY  77  -2.994  10.900  12.090
  788   2HA   GLY  77          2HA       GLY  77  -1.749  10.515  10.901
  789    QA   GLY  77           QA       GLY  77  -2.372  10.708  11.496
  790    H    GLN  78           H        GLN  78  -3.172   8.255   9.752
  791    HA   GLN  78           HA       GLN  78  -2.785   6.303  11.989
  792   1HB   GLN  78          2HB       GLN  78  -5.217   7.090  10.885
  793   2HB   GLN  78          1HB       GLN  78  -4.853   5.582  10.047
  794   1HG   GLN  78          2HG       GLN  78  -5.935   4.788  11.952
  795   2HG   GLN  78          1HG       GLN  78  -4.248   4.727  12.465
  796   1HE2  GLN  78          1HE2      GLN  78  -6.769   7.321  12.301
  797   2HE2  GLN  78          2HE2      GLN  78  -6.489   7.886  13.877
  798    QB   GLN  78           QB       GLN  78  -5.035   6.336  10.466
  799    QG   GLN  78           QG       GLN  78  -5.092   4.757  12.208
  800    QE   GLN  78           QE2      GLN  78  -6.629   7.603  13.089
  801    H    GLY  79           H        GLY  79  -1.326   4.761  11.373
  802   1HA   GLY  79          1HA       GLY  79  -0.131   3.267  10.007
  803   2HA   GLY  79          2HA       GLY  79   0.002   4.645   8.915
  804    QA   GLY  79           QA       GLY  79  -0.064   3.956   9.461
  805    H    LEU  80           H        LEU  80  -0.224   3.285   7.055
  806    HA   LEU  80           HA       LEU  80  -3.002   2.223   6.652
  807   1HB   LEU  80          2HB       LEU  80  -1.021   3.626   4.841
  808   2HB   LEU  80          1HB       LEU  80  -2.449   2.801   4.216
  809    HG   LEU  80           HG       LEU  80  -2.619   4.902   6.383
  810   1HD1  LEU  80          3HD1      LEU  80  -4.525   3.331   6.090
  811   2HD1  LEU  80          2HD1      LEU  80  -4.964   4.988   5.675
  812   3HD1  LEU  80          1HD1      LEU  80  -4.640   3.815   4.397
  813   1HD2  LEU  80          2HD2      LEU  80  -2.807   5.225   3.373
  814   2HD2  LEU  80          1HD2      LEU  80  -3.320   6.447   4.536
  815   3HD2  LEU  80          3HD2      LEU  80  -1.623   5.979   4.442
  816    MD1  LEU  80           QD1      LEU  80  -4.710   4.045   5.387
  817    MD2  LEU  80           QD2      LEU  80  -2.583   5.884   4.117
  818    QB   LEU  80           QB       LEU  80  -1.735   3.214   4.529
  819    QD   LEU  80           QQD      LEU  80  -3.647   4.964   4.752
  820    H    ILE  81           H        ILE  81   0.209   1.888   5.085
  821    HA   ILE  81           HA       ILE  81  -0.071  -1.084   5.331
  822    HB   ILE  81           HB       ILE  81   0.653  -1.241   2.977
  823   1HG1  ILE  81          2HG1      ILE  81   0.299   1.337   1.974
  824   2HG1  ILE  81          1HG1      ILE  81   1.233   1.585   3.450
  825   1HG2  ILE  81          2HG2      ILE  81  -1.832  -0.539   3.872
  826   2HG2  ILE  81          1HG2      ILE  81  -1.515   0.751   2.713
  827   3HG2  ILE  81          3HG2      ILE  81  -1.465  -0.932   2.192
  828   1HD1  ILE  81          1HD1      ILE  81   2.872  -0.100   2.701
  829   2HD1  ILE  81          3HD1      ILE  81   1.942  -0.350   1.224
  830   3HD1  ILE  81          2HD1      ILE  81   2.725   1.203   1.521
  831    MG   ILE  81           QG2      ILE  81  -1.604  -0.240   2.926
  832    MD   ILE  81           QD1      ILE  81   2.513   0.251   1.815
  833    QG   ILE  81           QG1      ILE  81   0.766   1.461   2.712
  834    H    LYS  82           H        LYS  82   1.826  -2.043   6.011
  835    HA   LYS  82           HA       LYS  82   4.151  -0.348   6.587
  836   1HB   LYS  82          2HB       LYS  82   3.294  -2.091   8.121
  837   2HB   LYS  82          1HB       LYS  82   3.630  -3.322   6.903
  838   1HG   LYS  82          2HG       LYS  82   5.608  -3.488   8.048
  839   2HG   LYS  82          1HG       LYS  82   6.052  -2.131   7.011
  840   1HD   LYS  82          2HD       LYS  82   6.603  -1.568   9.313
  841   2HD   LYS  82          1HD       LYS  82   5.246  -0.569   8.792
  842   1HE   LYS  82          2HE       LYS  82   4.008  -1.372  10.507
  843   2HE   LYS  82          1HE       LYS  82   4.198  -3.017   9.868
  844   1HZ   LYS  82          3HZ       LYS  82   6.375  -1.660  11.339
  845   2HZ   LYS  82          2HZ       LYS  82   5.183  -2.554  12.154
  846   3HZ   LYS  82          1HZ       LYS  82   6.194  -3.315  11.019
  847    QB   LYS  82           QB       LYS  82   3.462  -2.707   7.512
  848    QD   LYS  82           QD       LYS  82   5.924  -1.068   9.052
  849    QG   LYS  82           QG       LYS  82   5.830  -2.809   7.529
  850    QE   LYS  82           QE       LYS  82   4.103  -2.195  10.187
  851    QZ   LYS  82           QZ       LYS  82   5.917  -2.510  11.504
  852    H    ILE  83           H        ILE  83   6.164  -0.471   5.545
  853    HA   ILE  83           HA       ILE  83   6.752  -2.536   3.554
  854    HB   ILE  83           HB       ILE  83   5.165  -1.127   2.336
  855   1HG1  ILE  83          2HG1      ILE  83   7.893  -0.292   1.354
  856   2HG1  ILE  83          1HG1      ILE  83   7.385  -1.980   1.282
  857   1HG2  ILE  83          3HG2      ILE  83   6.268   0.923   3.885
  858   2HG2  ILE  83          2HG2      ILE  83   6.791   1.289   2.241
  859   3HG2  ILE  83          1HG2      ILE  83   5.073   1.112   2.602
  860   1HD1  ILE  83          2HD1      ILE  83   5.288  -1.175   0.086
  861   2HD1  ILE  83          1HD1      ILE  83   6.071   0.400  -0.047
  862   3HD1  ILE  83          3HD1      ILE  83   6.787  -1.009  -0.827
  863    MG   ILE  83           QG2      ILE  83   6.044   1.108   2.909
  864    MD   ILE  83           QD1      ILE  83   6.049  -0.595  -0.263
  865    QG   ILE  83           QG1      ILE  83   7.639  -1.136   1.318
  866    H    GLY  84           H        GLY  84   8.942  -2.192   2.621
  867   1HA   GLY  84          1HA       GLY  84  11.205  -1.932   3.487
  868   2HA   GLY  84          2HA       GLY  84  10.635  -0.581   4.467
  869    QA   GLY  84           QA       GLY  84  10.920  -1.256   3.977

  No H/Q in entry =         869
  Start of MODEL    4
    1    H1   MET   1          2H        MET   1 -15.083   4.207  35.175
    2    H2   MET   1          1H        MET   1 -13.672   3.637  34.420
    3    H3   MET   1          3H        MET   1 -14.271   5.178  34.042
    4    HA   MET   1           HA       MET   1 -14.866   3.739  32.245
    5   1HB   MET   1          2HB       MET   1 -14.816   1.902  34.372
    6   2HB   MET   1          1HB       MET   1 -16.485   1.891  33.802
    7   1HG   MET   1          2HG       MET   1 -15.587   1.631  31.454
    8   2HG   MET   1          1HG       MET   1 -13.988   1.402  32.160
    9   1HE   MET   1          2HE       MET   1 -13.647  -0.408  31.038
   10   2HE   MET   1          1HE       MET   1 -13.289  -1.487  32.382
   11   3HE   MET   1          3HE       MET   1 -14.411  -1.993  31.112
   12    QB   MET   1           QB       MET   1 -15.650   1.897  34.087
   13    QG   MET   1           QG       MET   1 -14.787   1.517  31.807
   14    ME   MET   1           QE       MET   1 -13.783  -1.296  31.511
   15    H    LYS   2           H        LYS   2 -15.975   6.083  33.012
   16    HA   LYS   2           HA       LYS   2 -18.757   5.883  33.834
   17   1HB   LYS   2          2HB       LYS   2 -17.117   7.819  34.105
   18   2HB   LYS   2          1HB       LYS   2 -17.343   8.137  32.385
   19   1HG   LYS   2          2HG       LYS   2 -19.555   8.794  32.655
   20   2HG   LYS   2          1HG       LYS   2 -19.761   7.853  34.132
   21   1HD   LYS   2          2HD       LYS   2 -17.917  10.244  33.980
   22   2HD   LYS   2          1HD       LYS   2 -19.614  10.385  34.442
   23   1HE   LYS   2          2HE       LYS   2 -19.126   8.574  36.206
   24   2HE   LYS   2          1HE       LYS   2 -17.409   8.891  35.881
   25   1HZ   LYS   2          3HZ       LYS   2 -17.923  11.294  36.182
   26   2HZ   LYS   2          2HZ       LYS   2 -19.469  10.853  36.732
   27   3HZ   LYS   2          1HZ       LYS   2 -18.087  10.374  37.597
   28    QB   LYS   2           QB       LYS   2 -17.230   7.978  33.245
   29    QD   LYS   2           QD       LYS   2 -18.766  10.314  34.211
   30    QG   LYS   2           QG       LYS   2 -19.658   8.323  33.394
   31    QE   LYS   2           QE       LYS   2 -18.267   8.733  36.044
   32    QZ   LYS   2           QZ       LYS   2 -18.493  10.841  36.837
   33    H    LEU   3           H        LEU   3 -17.280   6.908  30.725
   34    HA   LEU   3           HA       LEU   3 -19.790   6.010  29.354
   35   1HB   LEU   3          2HB       LEU   3 -17.672   8.090  28.744
   36   2HB   LEU   3          1HB       LEU   3 -18.927   7.639  27.590
   37    HG   LEU   3           HG       LEU   3 -19.793   8.335  30.360
   38   1HD1  LEU   3          1HD1      LEU   3 -21.114   7.657  28.104
   39   2HD1  LEU   3          3HD1      LEU   3 -21.805   8.723  29.328
   40   3HD1  LEU   3          2HD1      LEU   3 -21.052   9.406  27.887
   41   1HD2  LEU   3          2HD2      LEU   3 -18.735  10.295  28.316
   42   2HD2  LEU   3          1HD2      LEU   3 -19.896  10.770  29.556
   43   3HD2  LEU   3          3HD2      LEU   3 -18.307  10.165  30.021
   44    MD1  LEU   3           QD1      LEU   3 -21.324   8.595  28.440
   45    MD2  LEU   3           QD2      LEU   3 -18.979  10.410  29.298
   46    QB   LEU   3           QB       LEU   3 -18.300   7.865  28.167
   47    QD   LEU   3           QQD      LEU   3 -20.152   9.502  28.869
   48    H    LYS   4           H        LYS   4 -18.968   5.745  26.802
   49    HA   LYS   4           HA       LYS   4 -16.656   3.838  26.854
   50   1HB   LYS   4          2HB       LYS   4 -18.985   2.800  26.949
   51   2HB   LYS   4          1HB       LYS   4 -19.254   3.466  25.338
   52   1HG   LYS   4          2HG       LYS   4 -18.484   1.191  25.068
   53   2HG   LYS   4          1HG       LYS   4 -17.170   2.262  24.580
   54   1HD   LYS   4          2HD       LYS   4 -15.907   1.803  26.478
   55   2HD   LYS   4          1HD       LYS   4 -17.321   1.362  27.436
   56   1HE   LYS   4          2HE       LYS   4 -16.337  -0.737  27.008
   57   2HE   LYS   4          1HE       LYS   4 -17.524  -0.615  25.695
   58   1HZ   LYS   4          2HZ       LYS   4 -15.700   0.565  24.421
   59   2HZ   LYS   4          1HZ       LYS   4 -14.624  -0.024  25.597
   60   3HZ   LYS   4          3HZ       LYS   4 -15.504  -1.109  24.635
   61    QB   LYS   4           QB       LYS   4 -19.119   3.133  26.143
   62    QD   LYS   4           QD       LYS   4 -16.614   1.582  26.957
   63    QG   LYS   4           QG       LYS   4 -17.827   1.726  24.824
   64    QE   LYS   4           QE       LYS   4 -16.931  -0.676  26.351
   65    QZ   LYS   4           QZ       LYS   4 -15.276  -0.189  24.884
   66    H    VAL   5           H        VAL   5 -18.937   5.486  24.635
   67    HA   VAL   5           HA       VAL   5 -18.557   6.667  22.632
   68    HB   VAL   5           HB       VAL   5 -15.710   6.825  23.670
   69   1HG1  VAL   5          2HG1      VAL   5 -17.396   8.439  21.759
   70   2HG1  VAL   5          1HG1      VAL   5 -15.976   9.133  22.542
   71   3HG1  VAL   5          3HG1      VAL   5 -15.804   7.731  21.487
   72   1HG2  VAL   5          3HG2      VAL   5 -18.133   8.513  24.367
   73   2HG2  VAL   5          2HG2      VAL   5 -17.233   7.471  25.470
   74   3HG2  VAL   5          1HG2      VAL   5 -16.472   8.915  24.802
   75    MG1  VAL   5           QG1      VAL   5 -16.392   8.434  21.929
   76    MG2  VAL   5           QG2      VAL   5 -17.280   8.300  24.880
   77    QG   VAL   5           QQG      VAL   5 -16.836   8.367  23.404
   78    H    THR   6           H        THR   6 -18.132   5.999  20.542
   79    HA   THR   6           HA       THR   6 -16.558   3.489  20.221
   80    HB   THR   6           HB       THR   6 -17.783   3.432  18.044
   81    HG1  THR   6           HG1      THR   6 -19.429   5.054  17.814
   82   1HG2  THR   6          2HG2      THR   6 -18.933   3.358  20.700
   83   2HG2  THR   6          1HG2      THR   6 -20.141   3.845  19.512
   84   3HG2  THR   6          3HG2      THR   6 -19.272   2.323  19.314
   85    MG   THR   6           QG2      THR   6 -19.448   3.176  19.842
   86    H    VAL   7           H        VAL   7 -15.150   6.020  20.592
   87    HA   VAL   7           HA       VAL   7 -13.850   6.256  17.897
   88    HB   VAL   7           HB       VAL   7 -14.336   8.407  19.985
   89   1HG1  VAL   7          3HG1      VAL   7 -12.742   8.246  17.501
   90   2HG1  VAL   7          2HG1      VAL   7 -13.782   9.664  17.621
   91   3HG1  VAL   7          1HG1      VAL   7 -12.580   9.342  18.871
   92   1HG2  VAL   7          2HG2      VAL   7 -15.699   7.787  17.349
   93   2HG2  VAL   7          1HG2      VAL   7 -16.435   7.783  18.952
   94   3HG2  VAL   7          3HG2      VAL   7 -15.908   9.301  18.228
   95    MG1  VAL   7           QG1      VAL   7 -13.035   9.084  17.998
   96    MG2  VAL   7           QG2      VAL   7 -16.014   8.290  18.176
   97    QG   VAL   7           QQG      VAL   7 -14.525   8.687  18.087
   98    H    ASN   8           H        ASN   8 -13.286   4.767  20.597
   99    HA   ASN   8           HA       ASN   8 -10.710   6.005  21.382
  100   1HB   ASN   8          2HB       ASN   8 -12.720   4.696  22.710
  101   2HB   ASN   8          1HB       ASN   8 -11.551   3.395  22.486
  102   1HD2  ASN   8          1HD2      ASN   8 -11.813   6.755  23.734
  103   2HD2  ASN   8          2HD2      ASN   8 -10.539   6.603  24.846
  104    QB   ASN   8           QB       ASN   8 -12.136   4.045  22.598
  105    QD   ASN   8           QD2      ASN   8 -11.176   6.679  24.290
  106    H    GLY   9           H        GLY   9  -8.698   4.977  21.032
  107   1HA   GLY   9          1HA       GLY   9  -8.673   2.993  18.844
  108   2HA   GLY   9          2HA       GLY   9  -7.940   2.482  20.364
  109    QA   GLY   9           QA       GLY   9  -8.307   2.737  19.604
  110    H    ALA  10           H        ALA  10  -5.865   2.366  19.257
  111    HA   ALA  10           HA       ALA  10  -4.673   5.059  18.670
  112   1HB   ALA  10          2HB       ALA  10  -3.824   4.393  20.773
  113   2HB   ALA  10          3HB       ALA  10  -2.573   3.867  19.647
  114   3HB   ALA  10          1HB       ALA  10  -3.725   2.698  20.293
  115    MB   ALA  10           QB       ALA  10  -3.374   3.653  20.238
  116    H    GLY  11           H        GLY  11  -3.663   5.169  16.694
  117   1HA   GLY  11          1HA       GLY  11  -3.700   3.934  14.467
  118   2HA   GLY  11          2HA       GLY  11  -2.974   2.587  15.346
  119    QA   GLY  11           QA       GLY  11  -3.337   3.261  14.907
  120    H    LYS  12           H        LYS  12  -2.415   6.008  14.489
  121    HA   LYS  12           HA       LYS  12  -0.398   7.127  13.976
  122   1HB   LYS  12          2HB       LYS  12  -0.251   5.826  16.486
  123   2HB   LYS  12          1HB       LYS  12   1.307   5.554  15.704
  124   1HG   LYS  12          2HG       LYS  12   1.425   7.641  16.940
  125   2HG   LYS  12          1HG       LYS  12   1.424   8.014  15.215
  126   1HD   LYS  12          2HD       LYS  12  -1.293   7.859  16.153
  127   2HD   LYS  12          1HD       LYS  12  -0.383   8.964  17.183
  128   1HE   LYS  12          2HE       LYS  12   0.525   9.938  14.928
  129   2HE   LYS  12          1HE       LYS  12  -0.896   9.146  14.220
  130   1HZ   LYS  12          1HZ       LYS  12  -0.950  10.973  16.564
  131   2HZ   LYS  12          3HZ       LYS  12  -1.408  11.404  14.989
  132   3HZ   LYS  12          2HZ       LYS  12  -2.297  10.234  15.841
  133    QB   LYS  12           QB       LYS  12   0.528   5.690  16.095
  134    QD   LYS  12           QD       LYS  12  -0.838   8.411  16.668
  135    QG   LYS  12           QG       LYS  12   1.425   7.828  16.077
  136    QE   LYS  12           QE       LYS  12  -0.186   9.542  14.574
  137    QZ   LYS  12           QZ       LYS  12  -1.552  10.871  15.798
  138    H    ALA  13           H        ALA  13   2.046   6.571  13.358
  139    HA   ALA  13           HA       ALA  13   2.001   4.048  11.727
  140   1HB   ALA  13          1HB       ALA  13   2.842   5.277   9.947
  141   2HB   ALA  13          3HB       ALA  13   1.902   6.530  10.757
  142   3HB   ALA  13          2HB       ALA  13   3.648   6.440  10.999
  143    MB   ALA  13           QB       ALA  13   2.797   6.082  10.568
  144    H    GLY  14           H        GLY  14   4.604   3.941  10.927
  145   1HA   GLY  14          1HA       GLY  14   6.079   2.650  12.791
  146   2HA   GLY  14          2HA       GLY  14   6.382   4.328  13.246
  147    QA   GLY  14           QA       GLY  14   6.230   3.489  13.019
  148    H    GLU  15           H        GLU  15   8.529   2.814  12.435
  149    HA   GLU  15           HA       GLU  15   9.483   4.308  10.119
  150   1HB   GLU  15          2HB       GLU  15  10.545   2.183  11.981
  151   2HB   GLU  15          1HB       GLU  15  11.487   2.716  10.588
  152   1HG   GLU  15          2HG       GLU  15  11.232   5.081  11.406
  153   2HG   GLU  15          1HG       GLU  15  10.477   4.439  12.866
  154    QB   GLU  15           QB       GLU  15  11.016   2.449  11.284
  155    QG   GLU  15           QG       GLU  15  10.854   4.760  12.136
  156    H    GLY  16           H        GLY  16   7.797   3.404   8.577
  157   1HA   GLY  16          1HA       GLY  16   8.186   0.577   7.807
  158   2HA   GLY  16          2HA       GLY  16   8.658   1.784   6.610
  159    QA   GLY  16           QA       GLY  16   8.422   1.180   7.209
  160    H    GLU  17           H        GLU  17   6.013   2.569   8.711
  161    HA   GLU  17           HA       GLU  17   4.001   1.658   6.718
  162   1HB   GLU  17          2HB       GLU  17   3.972   2.683   9.560
  163   2HB   GLU  17          1HB       GLU  17   2.481   2.518   8.631
  164   1HG   GLU  17          2HG       GLU  17   2.438   0.337   9.180
  165   2HG   GLU  17          1HG       GLU  17   3.913   0.114   8.238
  166    QB   GLU  17           QB       GLU  17   3.227   2.600   9.095
  167    QG   GLU  17           QG       GLU  17   3.176   0.226   8.709
  168    H    ILE  18           H        ILE  18   2.183   3.311   6.308
  169    HA   ILE  18           HA       ILE  18   3.343   6.063   6.010
  170    HB   ILE  18           HB       ILE  18   1.453   4.576   4.157
  171   1HG1  ILE  18          2HG1      ILE  18   3.857   4.979   2.828
  172   2HG1  ILE  18          1HG1      ILE  18   4.372   4.523   4.453
  173   1HG2  ILE  18          1HG2      ILE  18   2.766   7.276   4.146
  174   2HG2  ILE  18          3HG2      ILE  18   2.446   6.468   2.612
  175   3HG2  ILE  18          2HG2      ILE  18   1.115   6.839   3.707
  176   1HD1  ILE  18          1HD1      ILE  18   2.620   2.619   4.243
  177   2HD1  ILE  18          3HD1      ILE  18   2.671   2.962   2.515
  178   3HD1  ILE  18          2HD1      ILE  18   4.134   2.449   3.356
  179    MG   ILE  18           QG2      ILE  18   2.109   6.861   3.489
  180    MD   ILE  18           QD1      ILE  18   3.142   2.677   3.371
  181    QG   ILE  18           QG1      ILE  18   4.114   4.751   3.640
  182    HA   PRO  19           HA       PRO  19  -0.342   7.078   8.312
  183   1HB   PRO  19          2HB       PRO  19  -0.109   9.800   8.190
  184   2HB   PRO  19          1HB       PRO  19   0.873   8.795   9.274
  185   1HG   PRO  19          2HG       PRO  19   1.594  10.035   6.671
  186   2HG   PRO  19          1HG       PRO  19   2.575   9.809   8.127
  187   1HD   PRO  19          2HD       PRO  19   2.749   8.228   5.893
  188   2HD   PRO  19          1HD       PRO  19   3.205   7.701   7.528
  189    QB   PRO  19           QB       PRO  19   0.382   9.297   8.732
  190    QG   PRO  19           QG       PRO  19   2.085   9.922   7.399
  191    QD   PRO  19           QD       PRO  19   2.977   7.965   6.710
  192    H    ALA  20           H        ALA  20  -2.432   7.233   7.553
  193    HA   ALA  20           HA       ALA  20  -3.117   7.520   4.830
  194   1HB   ALA  20          3HB       ALA  20  -5.420   8.051   5.903
  195   2HB   ALA  20          2HB       ALA  20  -4.657   6.519   6.329
  196   3HB   ALA  20          1HB       ALA  20  -4.582   7.882   7.446
  197    MB   ALA  20           QB       ALA  20  -4.887   7.484   6.559
  198    HA   PRO  21           HA       PRO  21  -2.718  11.927   4.372
  199   1HB   PRO  21          2HB       PRO  21  -3.880  12.163   1.909
  200   2HB   PRO  21          1HB       PRO  21  -2.244  11.521   2.146
  201   1HG   PRO  21          2HG       PRO  21  -4.780  10.083   1.604
  202   2HG   PRO  21          1HG       PRO  21  -3.131   9.709   1.080
  203   1HD   PRO  21          2HD       PRO  21  -4.457   8.444   3.145
  204   2HD   PRO  21          1HD       PRO  21  -2.692   8.485   2.942
  205    QB   PRO  21           QB       PRO  21  -3.062  11.842   2.028
  206    QG   PRO  21           QG       PRO  21  -3.955   9.896   1.342
  207    QD   PRO  21           QD       PRO  21  -3.575   8.464   3.043
  208    H    LEU  22           H        LEU  22  -4.087  13.163   5.620
  209    HA   LEU  22           HA       LEU  22  -6.083  14.145   6.429
  210   1HB   LEU  22          2HB       LEU  22  -6.293  13.909   3.443
  211   2HB   LEU  22          1HB       LEU  22  -7.662  14.555   4.350
  212    HG   LEU  22           HG       LEU  22  -6.141  16.362   3.606
  213   1HD1  LEU  22          3HD1      LEU  22  -7.353  16.174   5.975
  214   2HD1  LEU  22          2HD1      LEU  22  -5.688  16.194   6.556
  215   3HD1  LEU  22          1HD1      LEU  22  -6.301  17.536   5.590
  216   1HD2  LEU  22          3HD2      LEU  22  -4.088  14.830   3.749
  217   2HD2  LEU  22          2HD2      LEU  22  -3.872  16.482   4.324
  218   3HD2  LEU  22          1HD2      LEU  22  -4.091  15.168   5.479
  219    MD1  LEU  22           QD1      LEU  22  -6.448  16.635   6.040
  220    MD2  LEU  22           QD2      LEU  22  -4.017  15.493   4.517
  221    QB   LEU  22           QB       LEU  22  -6.977  14.232   3.897
  222    QD   LEU  22           QQD      LEU  22  -5.232  16.064   5.279
  223    H    ALA  23           H        ALA  23  -6.083  11.410   6.979
  224    HA   ALA  23           HA       ALA  23  -7.532   9.586   7.407
  225   1HB   ALA  23          3HB       ALA  23  -9.933  11.256   7.141
  226   2HB   ALA  23          2HB       ALA  23  -9.289  10.443   8.568
  227   3HB   ALA  23          1HB       ALA  23  -8.662  12.021   8.094
  228    MB   ALA  23           QB       ALA  23  -9.295  11.240   7.934
  229    H    GLY  24           H        GLY  24 -10.269   9.312   6.489
  230   1HA   GLY  24          1HA       GLY  24  -9.712   8.612   3.655
  231   2HA   GLY  24          2HA       GLY  24 -11.126   9.610   3.997
  232    QA   GLY  24           QA       GLY  24 -10.419   9.111   3.826
  233    H    THR  25           H        THR  25 -12.069   7.533   2.911
  234    HA   THR  25           HA       THR  25 -12.809   5.624   5.102
  235    HB   THR  25           HB       THR  25 -14.920   5.412   3.851
  236    HG1  THR  25           HG1      THR  25 -15.110   6.969   2.050
  237   1HG2  THR  25          2HG2      THR  25 -13.936   7.785   5.088
  238   2HG2  THR  25          1HG2      THR  25 -14.949   8.268   3.726
  239   3HG2  THR  25          3HG2      THR  25 -15.606   7.223   4.986
  240    MG   THR  25           QG2      THR  25 -14.830   7.759   4.600
  241    H    VAL  26           H        VAL  26 -11.665   3.736   4.820
  242    HA   VAL  26           HA       VAL  26 -10.652   2.878   2.225
  243    HB   VAL  26           HB       VAL  26 -10.904   1.407   4.869
  244   1HG1  VAL  26          2HG1      VAL  26  -9.033   1.046   2.507
  245   2HG1  VAL  26          1HG1      VAL  26  -8.955   0.139   4.017
  246   3HG1  VAL  26          3HG1      VAL  26 -10.351  -0.039   2.954
  247   1HG2  VAL  26          1HG2      VAL  26  -8.922   3.422   3.826
  248   2HG2  VAL  26          3HG2      VAL  26  -9.695   3.352   5.409
  249   3HG2  VAL  26          2HG2      VAL  26  -8.422   2.201   4.997
  250    MG1  VAL  26           QG1      VAL  26  -9.446   0.382   3.159
  251    MG2  VAL  26           QG2      VAL  26  -9.013   2.992   4.744
  252    QG   VAL  26           QQG      VAL  26  -9.230   1.687   3.952
  253    H    SER  27           H        SER  27 -12.095   2.089   0.720
  254    HA   SER  27           HA       SER  27 -14.328   0.345   1.706
  255   1HB   SER  27          2HB       SER  27 -15.282   2.213   0.663
  256   2HB   SER  27          1HB       SER  27 -13.986   2.331  -0.526
  257    HG   SER  27           HG       SER  27 -15.912   1.471  -1.423
  258    QB   SER  27           QB       SER  27 -14.634   2.272   0.068
  259    H    LYS  28           H        LYS  28 -11.381   0.309  -0.020
  260    HA   LYS  28           HA       LYS  28 -11.723  -2.490  -0.752
  261   1HB   LYS  28          2HB       LYS  28 -13.016  -1.067  -2.464
  262   2HB   LYS  28          1HB       LYS  28 -11.438  -0.502  -3.013
  263   1HG   LYS  28          2HG       LYS  28 -11.226  -2.364  -4.255
  264   2HG   LYS  28          1HG       LYS  28 -11.268  -3.328  -2.778
  265   1HD   LYS  28          2HD       LYS  28 -13.821  -3.120  -2.895
  266   2HD   LYS  28          1HD       LYS  28 -13.590  -2.522  -4.538
  267   1HE   LYS  28          2HE       LYS  28 -13.792  -4.797  -4.984
  268   2HE   LYS  28          1HE       LYS  28 -12.042  -4.720  -4.692
  269   1HZ   LYS  28          2HZ       LYS  28 -13.956  -5.057  -2.466
  270   2HZ   LYS  28          1HZ       LYS  28 -13.382  -6.400  -3.333
  271   3HZ   LYS  28          3HZ       LYS  28 -12.294  -5.404  -2.497
  272    QB   LYS  28           QB       LYS  28 -12.227  -0.785  -2.738
  273    QD   LYS  28           QD       LYS  28 -13.705  -2.821  -3.717
  274    QG   LYS  28           QG       LYS  28 -11.247  -2.846  -3.516
  275    QE   LYS  28           QE       LYS  28 -12.917  -4.759  -4.838
  276    QZ   LYS  28           QZ       LYS  28 -13.211  -5.620  -2.765
  277    H    ILE  29           H        ILE  29  -9.702  -3.423  -1.396
  278    HA   ILE  29           HA       ILE  29  -7.350  -1.560  -1.289
  279    HB   ILE  29           HB       ILE  29  -7.624  -2.810   0.795
  280   1HG1  ILE  29          2HG1      ILE  29  -5.485  -4.353  -0.636
  281   2HG1  ILE  29          1HG1      ILE  29  -5.326  -2.602  -0.503
  282   1HG2  ILE  29          2HG2      ILE  29  -8.415  -4.898  -1.058
  283   2HG2  ILE  29          1HG2      ILE  29  -7.169  -5.482   0.045
  284   3HG2  ILE  29          3HG2      ILE  29  -8.665  -4.806   0.686
  285   1HD1  ILE  29          1HD1      ILE  29  -6.069  -4.092   1.970
  286   2HD1  ILE  29          3HD1      ILE  29  -4.408  -4.254   1.400
  287   3HD1  ILE  29          2HD1      ILE  29  -5.058  -2.660   1.783
  288    MG   ILE  29           QG2      ILE  29  -8.083  -5.062  -0.109
  289    MD   ILE  29           QD1      ILE  29  -5.178  -3.668   1.717
  290    QG   ILE  29           QG1      ILE  29  -5.405  -3.478  -0.570
  291    H    LEU  30           H        LEU  30  -5.671  -2.038  -2.757
  292    HA   LEU  30           HA       LEU  30  -6.328  -4.092  -4.832
  293   1HB   LEU  30          2HB       LEU  30  -5.205  -1.370  -4.756
  294   2HB   LEU  30          1HB       LEU  30  -4.321  -2.472  -5.814
  295    HG   LEU  30           HG       LEU  30  -6.139  -1.335  -7.040
  296   1HD1  LEU  30          2HD1      LEU  30  -7.535  -1.472  -4.718
  297   2HD1  LEU  30          1HD1      LEU  30  -8.298  -1.230  -6.290
  298   3HD1  LEU  30          3HD1      LEU  30  -8.236  -2.843  -5.577
  299   1HD2  LEU  30          2HD2      LEU  30  -5.592  -4.076  -6.966
  300   2HD2  LEU  30          1HD2      LEU  30  -7.353  -3.984  -6.944
  301   3HD2  LEU  30          3HD2      LEU  30  -6.445  -3.218  -8.248
  302    MD1  LEU  30           QD1      LEU  30  -8.023  -1.848  -5.529
  303    MD2  LEU  30           QD2      LEU  30  -6.463  -3.759  -7.386
  304    QB   LEU  30           QB       LEU  30  -4.763  -1.921  -5.285
  305    QD   LEU  30           QQD      LEU  30  -7.243  -2.804  -6.457
  306    H    VAL  31           H        VAL  31  -3.640  -2.797  -2.869
  307    HA   VAL  31           HA       VAL  31  -1.700  -4.754  -3.763
  308    HB   VAL  31           HB       VAL  31  -1.137  -2.546  -2.831
  309   1HG1  VAL  31          2HG1      VAL  31  -3.010  -3.397  -0.804
  310   2HG1  VAL  31          1HG1      VAL  31  -1.475  -2.961  -0.055
  311   3HG1  VAL  31          3HG1      VAL  31  -2.323  -1.795  -1.071
  312   1HG2  VAL  31          2HG2      VAL  31   0.395  -4.563  -2.543
  313   2HG2  VAL  31          1HG2      VAL  31   0.662  -3.239  -1.408
  314   3HG2  VAL  31          3HG2      VAL  31  -0.215  -4.680  -0.892
  315    MG1  VAL  31           QG1      VAL  31  -2.269  -2.718  -0.644
  316    MG2  VAL  31           QG2      VAL  31   0.281  -4.160  -1.614
  317    QG   VAL  31           QQG      VAL  31  -0.994  -3.439  -1.129
  318    H    LYS  32           H        LYS  32  -0.730  -6.388  -2.230
  319    HA   LYS  32           HA       LYS  32  -2.666  -7.445  -0.212
  320   1HB   LYS  32          2HB       LYS  32  -2.795  -8.428  -2.629
  321   2HB   LYS  32          1HB       LYS  32  -1.280  -9.229  -2.212
  322   1HG   LYS  32          2HG       LYS  32  -2.292 -10.405  -0.393
  323   2HG   LYS  32          1HG       LYS  32  -3.743  -9.405  -0.464
  324   1HD   LYS  32          2HD       LYS  32  -4.565 -10.485  -2.342
  325   2HD   LYS  32          1HD       LYS  32  -2.960 -10.949  -2.907
  326   1HE   LYS  32          2HE       LYS  32  -2.899 -12.438  -0.748
  327   2HE   LYS  32          1HE       LYS  32  -4.664 -12.259  -0.796
  328   1HZ   LYS  32          3HZ       LYS  32  -4.546 -12.875  -3.187
  329   2HZ   LYS  32          2HZ       LYS  32  -2.902 -13.252  -2.972
  330   3HZ   LYS  32          1HZ       LYS  32  -4.094 -14.131  -2.138
  331    QB   LYS  32           QB       LYS  32  -2.038  -8.829  -2.420
  332    QD   LYS  32           QD       LYS  32  -3.762 -10.717  -2.624
  333    QG   LYS  32           QG       LYS  32  -3.017  -9.905  -0.428
  334    QE   LYS  32           QE       LYS  32  -3.782 -12.348  -0.772
  335    QZ   LYS  32           QZ       LYS  32  -3.847 -13.419  -2.766
  336    H    GLU  33           H        GLU  33  -1.592  -9.065   1.236
  337    HA   GLU  33           HA       GLU  33   1.012  -8.187   2.106
  338   1HB   GLU  33          2HB       GLU  33   0.736 -10.041   3.709
  339   2HB   GLU  33          1HB       GLU  33  -0.776  -9.150   3.540
  340   1HG   GLU  33          2HG       GLU  33  -1.240 -10.936   1.638
  341   2HG   GLU  33          1HG       GLU  33  -0.070 -11.889   2.551
  342    QB   GLU  33           QB       GLU  33  -0.020  -9.596   3.625
  343    QG   GLU  33           QG       GLU  33  -0.655 -11.412   2.095
  344    H    GLY  34           H        GLY  34   3.025  -8.982   1.571
  345   1HA   GLY  34          1HA       GLY  34   3.373 -11.645   0.426
  346   2HA   GLY  34          2HA       GLY  34   4.650 -10.457   0.691
  347    QA   GLY  34           QA       GLY  34   4.011 -11.051   0.558
  348    H    ASP  35           H        ASP  35   2.903  -8.431  -0.800
  349    HA   ASP  35           HA       ASP  35   3.418  -9.460  -3.573
  350   1HB   ASP  35          2HB       ASP  35   1.072  -8.559  -2.318
  351   2HB   ASP  35          1HB       ASP  35   1.578  -7.214  -3.341
  352    QB   ASP  35           QB       ASP  35   1.325  -7.887  -2.829
  353    H    THR  36           H        THR  36   4.910  -8.285  -4.729
  354    HA   THR  36           HA       THR  36   6.231  -5.983  -3.533
  355    HB   THR  36           HB       THR  36   6.389  -7.113  -6.345
  356    HG1  THR  36           HG1      THR  36   7.814  -8.554  -5.542
  357   1HG2  THR  36          1HG2      THR  36   7.791  -5.020  -4.894
  358   2HG2  THR  36          3HG2      THR  36   8.900  -6.281  -5.434
  359   3HG2  THR  36          2HG2      THR  36   7.879  -5.443  -6.604
  360    MG   THR  36           QG2      THR  36   8.190  -5.582  -5.644
  361    H    VAL  37           H        VAL  37   5.364  -3.952  -3.613
  362    HA   VAL  37           HA       VAL  37   3.401  -3.288  -5.749
  363    HB   VAL  37           HB       VAL  37   2.841  -2.924  -3.375
  364   1HG1  VAL  37          3HG1      VAL  37   2.249  -1.263  -5.336
  365   2HG1  VAL  37          2HG1      VAL  37   1.896  -0.814  -3.668
  366   3HG1  VAL  37          1HG1      VAL  37   3.328  -0.171  -4.469
  367   1HG2  VAL  37          2HG2      VAL  37   5.399  -1.325  -3.463
  368   2HG2  VAL  37          1HG2      VAL  37   4.156  -0.984  -2.260
  369   3HG2  VAL  37          3HG2      VAL  37   4.920  -2.571  -2.312
  370    MG1  VAL  37           QG1      VAL  37   2.491  -0.750  -4.491
  371    MG2  VAL  37           QG2      VAL  37   4.825  -1.627  -2.678
  372    QG   VAL  37           QQG      VAL  37   3.658  -1.188  -3.585
  373    H    LYS  38           H        LYS  38   3.686  -1.399  -7.063
  374    HA   LYS  38           HA       LYS  38   6.525  -0.457  -7.260
  375   1HB   LYS  38          2HB       LYS  38   5.049  -1.719  -9.108
  376   2HB   LYS  38          1HB       LYS  38   4.501  -0.072  -9.425
  377   1HG   LYS  38          2HG       LYS  38   6.372   0.217 -10.648
  378   2HG   LYS  38          1HG       LYS  38   7.280   0.146  -9.137
  379   1HD   LYS  38          2HD       LYS  38   8.143  -1.503 -10.755
  380   2HD   LYS  38          1HD       LYS  38   7.446  -2.307  -9.349
  381   1HE   LYS  38          2HE       LYS  38   5.841  -3.314 -10.605
  382   2HE   LYS  38          1HE       LYS  38   5.471  -1.806 -11.468
  383   1HZ   LYS  38          3HZ       LYS  38   7.522  -2.086 -12.737
  384   2HZ   LYS  38          2HZ       LYS  38   7.825  -3.559 -11.947
  385   3HZ   LYS  38          1HZ       LYS  38   6.479  -3.401 -12.971
  386    QB   LYS  38           QB       LYS  38   4.775  -0.895  -9.267
  387    QD   LYS  38           QD       LYS  38   7.795  -1.905 -10.052
  388    QG   LYS  38           QG       LYS  38   6.826   0.182  -9.892
  389    QE   LYS  38           QE       LYS  38   5.656  -2.560 -11.036
  390    QZ   LYS  38           QZ       LYS  38   7.275  -3.015 -12.552
  391    H    ALA  39           H        ALA  39   6.835   1.846  -7.695
  392    HA   ALA  39           HA       ALA  39   5.185   3.596  -6.139
  393   1HB   ALA  39          1HB       ALA  39   7.647   3.768  -6.857
  394   2HB   ALA  39          3HB       ALA  39   7.041   4.376  -8.398
  395   3HB   ALA  39          2HB       ALA  39   6.714   5.264  -6.908
  396    MB   ALA  39           QB       ALA  39   7.134   4.469  -7.388
  397    H    GLY  40           H        GLY  40   3.194   4.378  -6.690
  398   1HA   GLY  40          1HA       GLY  40   2.679   5.016  -9.556
  399   2HA   GLY  40          2HA       GLY  40   1.840   5.756  -8.194
  400    QA   GLY  40           QA       GLY  40   2.259   5.386  -8.875
  401    H    GLN  41           H        GLN  41   2.157   2.449  -7.606
  402    HA   GLN  41           HA       GLN  41  -0.185   1.595  -9.172
  403   1HB   GLN  41          2HB       GLN  41   2.073   0.406  -8.126
  404   2HB   GLN  41          1HB       GLN  41   0.823  -0.115  -6.996
  405   1HG   GLN  41          2HG       GLN  41  -0.546  -0.934  -8.874
  406   2HG   GLN  41          1HG       GLN  41   0.691  -0.402 -10.014
  407   1HE2  GLN  41          1HE2      GLN  41  -0.233  -2.962  -7.846
  408   2HE2  GLN  41          2HE2      GLN  41   1.149  -3.924  -8.063
  409    QB   GLN  41           QB       GLN  41   1.448   0.145  -7.561
  410    QG   GLN  41           QG       GLN  41   0.072  -0.668  -9.444
  411    QE   GLN  41           QE2      GLN  41   0.458  -3.443  -7.955
  412    H    THR  42           H        THR  42  -2.246   1.879  -8.440
  413    HA   THR  42           HA       THR  42  -2.993   3.066  -5.987
  414    HB   THR  42           HB       THR  42  -4.632   1.068  -7.559
  415    HG1  THR  42           HG1      THR  42  -4.241   3.801  -8.175
  416   1HG2  THR  42          2HG2      THR  42  -5.233   3.569  -5.968
  417   2HG2  THR  42          1HG2      THR  42  -6.410   2.806  -7.038
  418   3HG2  THR  42          3HG2      THR  42  -5.785   1.926  -5.643
  419    MG   THR  42           QG2      THR  42  -5.809   2.767  -6.216
  420    H    VAL  43           H        VAL  43  -2.204   2.129  -4.090
  421    HA   VAL  43           HA       VAL  43  -2.262  -0.772  -3.668
  422    HB   VAL  43           HB       VAL  43  -1.377  -0.087  -1.437
  423   1HG1  VAL  43          3HG1      VAL  43  -2.830   2.078  -1.519
  424   2HG1  VAL  43          2HG1      VAL  43  -1.233   2.164  -0.774
  425   3HG1  VAL  43          1HG1      VAL  43  -1.472   2.760  -2.415
  426   1HG2  VAL  43          3HG2      VAL  43   0.044  -0.244  -3.543
  427   2HG2  VAL  43          2HG2      VAL  43  -0.074   1.512  -3.647
  428   3HG2  VAL  43          1HG2      VAL  43   0.706   0.761  -2.254
  429    MG1  VAL  43           QG1      VAL  43  -1.845   2.334  -1.569
  430    MG2  VAL  43           QG2      VAL  43   0.225   0.676  -3.148
  431    QG   VAL  43           QQG      VAL  43  -0.810   1.505  -2.359
  432    H    LEU  44           H        LEU  44  -4.355   1.955  -3.017
  433    HA   LEU  44           HA       LEU  44  -6.377   0.097  -1.902
  434   1HB   LEU  44          2HB       LEU  44  -4.708   1.944  -0.355
  435   2HB   LEU  44          1HB       LEU  44  -6.433   2.190  -0.080
  436    HG   LEU  44           HG       LEU  44  -5.853  -0.636  -0.156
  437   1HD1  LEU  44          2HD1      LEU  44  -4.077   1.108   1.529
  438   2HD1  LEU  44          1HD1      LEU  44  -4.579  -0.470   2.135
  439   3HD1  LEU  44          3HD1      LEU  44  -3.669  -0.353   0.628
  440   1HD2  LEU  44          3HD2      LEU  44  -7.091   1.381   1.665
  441   2HD2  LEU  44          2HD2      LEU  44  -7.777  -0.102   1.001
  442   3HD2  LEU  44          1HD2      LEU  44  -6.651  -0.180   2.356
  443    MD1  LEU  44           QD1      LEU  44  -4.108   0.095   1.431
  444    MD2  LEU  44           QD2      LEU  44  -7.173   0.366   1.674
  445    QB   LEU  44           QB       LEU  44  -5.571   2.067  -0.218
  446    QD   LEU  44           QQD      LEU  44  -5.641   0.231   1.552
  447    H    VAL  45           H        VAL  45  -8.513   1.199  -1.685
  448    HA   VAL  45           HA       VAL  45  -8.727   3.553  -3.534
  449    HB   VAL  45           HB       VAL  45 -10.707   1.325  -2.960
  450   1HG1  VAL  45          2HG1      VAL  45 -10.720   3.793  -4.636
  451   2HG1  VAL  45          1HG1      VAL  45 -11.457   2.347  -5.326
  452   3HG1  VAL  45          3HG1      VAL  45 -12.054   2.997  -3.799
  453   1HG2  VAL  45          3HG2      VAL  45  -8.448   1.595  -4.864
  454   2HG2  VAL  45          2HG2      VAL  45  -9.197   0.140  -4.206
  455   3HG2  VAL  45          1HG2      VAL  45  -9.958   0.994  -5.548
  456    MG1  VAL  45           QG1      VAL  45 -11.410   3.046  -4.587
  457    MG2  VAL  45           QG2      VAL  45  -9.201   0.909  -4.873
  458    QG   VAL  45           QQG      VAL  45 -10.306   1.978  -4.730
  459    H    LEU  46           H        LEU  46  -9.486   5.378  -2.548
  460    HA   LEU  46           HA       LEU  46 -10.768   5.138   0.130
  461   1HB   LEU  46          2HB       LEU  46  -8.759   6.694  -0.814
  462   2HB   LEU  46          1HB       LEU  46 -10.130   7.762  -1.113
  463    HG   LEU  46           HG       LEU  46 -10.586   6.723   1.449
  464   1HD1  LEU  46          3HD1      LEU  46  -7.671   7.416   1.003
  465   2HD1  LEU  46          2HD1      LEU  46  -8.429   7.389   2.595
  466   3HD1  LEU  46          1HD1      LEU  46  -8.325   5.908   1.641
  467   1HD2  LEU  46          3HD2      LEU  46 -10.319   9.218   0.143
  468   2HD2  LEU  46          2HD2      LEU  46 -10.970   8.921   1.755
  469   3HD2  LEU  46          1HD2      LEU  46  -9.257   9.283   1.549
  470    MD1  LEU  46           QD1      LEU  46  -8.142   6.904   1.746
  471    MD2  LEU  46           QD2      LEU  46 -10.182   9.141   1.149
  472    QB   LEU  46           QB       LEU  46  -9.445   7.228  -0.964
  473    QD   LEU  46           QQD      LEU  46  -9.162   8.023   1.448
  474    H    GLU  47           H        GLU  47 -12.620   6.719   0.520
  475    HA   GLU  47           HA       GLU  47 -14.290   7.110  -1.938
  476   1HB   GLU  47          2HB       GLU  47 -14.639   5.300   0.257
  477   2HB   GLU  47          1HB       GLU  47 -15.920   6.512   0.334
  478   1HG   GLU  47          2HG       GLU  47 -15.410   5.568  -2.394
  479   2HG   GLU  47          1HG       GLU  47 -15.923   4.278  -1.306
  480    QB   GLU  47           QB       GLU  47 -15.279   5.906   0.295
  481    QG   GLU  47           QG       GLU  47 -15.666   4.923  -1.850
  482    H    ALA  48           H        ALA  48 -13.534   9.393  -1.710
  483    HA   ALA  48           HA       ALA  48 -14.999  10.834   0.479
  484   1HB   ALA  48          2HB       ALA  48 -13.088  12.019   0.922
  485   2HB   ALA  48          3HB       ALA  48 -12.612  12.071  -0.776
  486   3HB   ALA  48          1HB       ALA  48 -12.299  10.625   0.184
  487    MB   ALA  48           QB       ALA  48 -12.666  11.572   0.110
  488    H    MET  49           H        MET  49 -14.429  13.426  -0.592
  489    HA   MET  49           HA       MET  49 -16.562  13.813  -2.419
  490   1HB   MET  49          2HB       MET  49 -14.461  15.300  -1.116
  491   2HB   MET  49          1HB       MET  49 -14.612  15.843  -2.788
  492   1HG   MET  49          2HG       MET  49 -17.099  16.035  -2.419
  493   2HG   MET  49          1HG       MET  49 -16.813  15.703  -0.710
  494   1HE   MET  49          1HE       MET  49 -14.783  17.012   0.557
  495   2HE   MET  49          3HE       MET  49 -15.275  18.696   0.792
  496   3HE   MET  49          2HE       MET  49 -16.454  17.397   0.960
  497    QB   MET  49           QB       MET  49 -14.537  15.571  -1.952
  498    QG   MET  49           QG       MET  49 -16.956  15.869  -1.565
  499    ME   MET  49           QE       MET  49 -15.504  17.701   0.770
  500    H    LYS  50           H        LYS  50 -13.267  12.807  -2.963
  501    HA   LYS  50           HA       LYS  50 -13.020  13.555  -5.730
  502   1HB   LYS  50          2HB       LYS  50 -11.652  11.962  -3.688
  503   2HB   LYS  50          1HB       LYS  50 -11.481  11.276  -5.304
  504   1HG   LYS  50          2HG       LYS  50  -9.681  12.793  -5.164
  505   2HG   LYS  50          1HG       LYS  50 -10.915  13.701  -6.041
  506   1HD   LYS  50          2HD       LYS  50 -11.618  14.790  -3.951
  507   2HD   LYS  50          1HD       LYS  50 -10.417  13.863  -3.053
  508   1HE   LYS  50          2HE       LYS  50  -8.595  14.947  -4.231
  509   2HE   LYS  50          1HE       LYS  50  -9.733  15.758  -5.327
  510   1HZ   LYS  50          1HZ       LYS  50 -10.799  16.714  -3.300
  511   2HZ   LYS  50          3HZ       LYS  50  -9.497  16.119  -2.390
  512   3HZ   LYS  50          2HZ       LYS  50  -9.227  17.286  -3.595
  513    QB   LYS  50           QB       LYS  50 -11.566  11.619  -4.496
  514    QD   LYS  50           QD       LYS  50 -11.018  14.327  -3.502
  515    QG   LYS  50           QG       LYS  50 -10.298  13.247  -5.602
  516    QE   LYS  50           QE       LYS  50  -9.164  15.353  -4.779
  517    QZ   LYS  50           QZ       LYS  50  -9.841  16.706  -3.095
  518    H    MET  51           H        MET  51 -14.906  11.127  -4.168
  519    HA   MET  51           HA       MET  51 -16.245   9.386  -5.027
  520   1HB   MET  51          2HB       MET  51 -16.432  11.584  -6.656
  521   2HB   MET  51          1HB       MET  51 -15.930  10.344  -7.807
  522   1HG   MET  51          2HG       MET  51 -17.867   9.128  -7.556
  523   2HG   MET  51          1HG       MET  51 -18.071   9.605  -5.871
  524   1HE   MET  51          1HE       MET  51 -20.462   9.392  -7.030
  525   2HE   MET  51          3HE       MET  51 -20.543  10.547  -5.692
  526   3HE   MET  51          2HE       MET  51 -21.345  10.906  -7.218
  527    QB   MET  51           QB       MET  51 -16.181  10.964  -7.232
  528    QG   MET  51           QG       MET  51 -17.969   9.367  -6.713
  529    ME   MET  51           QE       MET  51 -20.783  10.282  -6.647
  530    H    GLU  52           H        GLU  52 -15.051   7.492  -4.882
  531    HA   GLU  52           HA       GLU  52 -13.680   5.700  -5.586
  532   1HB   GLU  52          2HB       GLU  52 -15.319   6.258  -7.568
  533   2HB   GLU  52          1HB       GLU  52 -13.862   6.867  -8.354
  534   1HG   GLU  52          2HG       GLU  52 -12.835   4.567  -7.607
  535   2HG   GLU  52          1HG       GLU  52 -14.522   4.062  -7.508
  536    QB   GLU  52           QB       GLU  52 -14.590   6.563  -7.961
  537    QG   GLU  52           QG       GLU  52 -13.678   4.315  -7.557
  538    H    THR  53           H        THR  53 -11.933   7.033  -4.423
  539    HA   THR  53           HA       THR  53  -9.997   8.356  -6.251
  540    HB   THR  53           HB       THR  53  -9.946   7.996  -3.240
  541    HG1  THR  53           HG1      THR  53 -10.835  10.189  -3.354
  542   1HG2  THR  53          3HG2      THR  53  -7.882   8.760  -4.610
  543   2HG2  THR  53          2HG2      THR  53  -8.784  10.257  -4.854
  544   3HG2  THR  53          1HG2      THR  53  -8.363   9.736  -3.222
  545    MG   THR  53           QG2      THR  53  -8.343   9.584  -4.229
  546    H    GLU  54           H        GLU  54  -8.135   7.325  -6.891
  547    HA   GLU  54           HA       GLU  54  -7.623   4.581  -5.872
  548   1HB   GLU  54          2HB       GLU  54  -6.961   6.241  -8.269
  549   2HB   GLU  54          1HB       GLU  54  -5.854   4.931  -7.854
  550   1HG   GLU  54          2HG       GLU  54  -7.275   3.428  -8.733
  551   2HG   GLU  54          1HG       GLU  54  -8.539   3.956  -7.621
  552    QB   GLU  54           QB       GLU  54  -6.407   5.586  -8.061
  553    QG   GLU  54           QG       GLU  54  -7.907   3.692  -8.177
  554    H    ILE  55           H        ILE  55  -6.273   4.496  -4.109
  555    HA   ILE  55           HA       ILE  55  -4.339   6.622  -3.542
  556    HB   ILE  55           HB       ILE  55  -4.824   3.918  -2.250
  557   1HG1  ILE  55          2HG1      ILE  55  -5.992   6.654  -1.640
  558   2HG1  ILE  55          1HG1      ILE  55  -6.872   5.289  -2.327
  559   1HG2  ILE  55          2HG2      ILE  55  -2.763   5.725  -1.832
  560   2HG2  ILE  55          1HG2      ILE  55  -3.938   6.170  -0.594
  561   3HG2  ILE  55          3HG2      ILE  55  -3.317   4.520  -0.669
  562   1HD1  ILE  55          3HD1      ILE  55  -5.652   4.231  -0.049
  563   2HD1  ILE  55          2HD1      ILE  55  -6.197   5.830   0.456
  564   3HD1  ILE  55          1HD1      ILE  55  -7.351   4.674  -0.209
  565    MG   ILE  55           QG2      ILE  55  -3.339   5.472  -1.032
  566    MD   ILE  55           QD1      ILE  55  -6.400   4.912   0.066
  567    QG   ILE  55           QG1      ILE  55  -6.432   5.971  -1.983
  568    H    ASN  56           H        ASN  56  -2.800   6.531  -5.236
  569    HA   ASN  56           HA       ASN  56  -1.511   4.157  -6.208
  570   1HB   ASN  56          2HB       ASN  56  -0.833   7.104  -6.164
  571   2HB   ASN  56          1HB       ASN  56   0.143   5.916  -7.029
  572   1HD2  ASN  56          1HD2      ASN  56  -0.424   6.672  -9.164
  573   2HD2  ASN  56          2HD2      ASN  56  -1.994   6.524  -9.788
  574    QB   ASN  56           QB       ASN  56  -0.345   6.510  -6.596
  575    QD   ASN  56           QD2      ASN  56  -1.209   6.598  -9.476
  576    H    ALA  57           H        ALA  57   0.526   3.287  -5.669
  577    HA   ALA  57           HA       ALA  57   1.327   3.342  -2.913
  578   1HB   ALA  57          2HB       ALA  57   2.690   2.439  -5.468
  579   2HB   ALA  57          1HB       ALA  57   3.280   2.053  -3.852
  580   3HB   ALA  57          3HB       ALA  57   1.716   1.445  -4.389
  581    MB   ALA  57           QB       ALA  57   2.562   1.979  -4.570
  582    HA   PRO  58           HA       PRO  58   3.913   6.932  -2.964
  583   1HB   PRO  58          2HB       PRO  58   5.433   6.403  -0.753
  584   2HB   PRO  58          1HB       PRO  58   3.740   6.925  -0.656
  585   1HG   PRO  58          2HG       PRO  58   4.904   4.211  -0.349
  586   2HG   PRO  58          1HG       PRO  58   3.541   4.959   0.495
  587   1HD   PRO  58          2HD       PRO  58   3.291   3.146  -1.555
  588   2HD   PRO  58          1HD       PRO  58   2.047   4.332  -1.107
  589    QB   PRO  58           QB       PRO  58   4.587   6.664  -0.705
  590    QG   PRO  58           QG       PRO  58   4.222   4.585   0.073
  591    QD   PRO  58           QD       PRO  58   2.669   3.739  -1.331
  592    H    THR  59           H        THR  59   5.561   3.820  -2.318
  593    HA   THR  59           HA       THR  59   7.590   4.513  -4.378
  594    HB   THR  59           HB       THR  59   8.525   3.479  -1.723
  595    HG1  THR  59           HG1      THR  59   8.101   5.277  -0.744
  596   1HG2  THR  59          2HG2      THR  59  10.058   3.716  -3.660
  597   2HG2  THR  59          1HG2      THR  59   9.685   5.439  -3.722
  598   3HG2  THR  59          3HG2      THR  59  10.518   4.767  -2.321
  599    MG   THR  59           QG2      THR  59  10.087   4.641  -3.234
  600    H    ASP  60           H        ASP  60   8.617   2.627  -5.249
  601    HA   ASP  60           HA       ASP  60   7.088   0.201  -5.227
  602   1HB   ASP  60          2HB       ASP  60   8.994  -0.622  -6.571
  603   2HB   ASP  60          1HB       ASP  60   8.538   1.008  -7.067
  604    QB   ASP  60           QB       ASP  60   8.766   0.193  -6.819
  605    H    GLY  61           H        GLY  61   7.543  -1.805  -4.194
  606   1HA   GLY  61          1HA       GLY  61   8.806  -1.641  -1.600
  607   2HA   GLY  61          2HA       GLY  61   9.817  -2.530  -2.740
  608    QA   GLY  61           QA       GLY  61   9.311  -2.086  -2.170
  609    H    LYS  62           H        LYS  62   8.737  -3.806  -0.497
  610    HA   LYS  62           HA       LYS  62   6.595  -5.532  -1.697
  611   1HB   LYS  62          2HB       LYS  62   8.914  -6.481  -1.711
  612   2HB   LYS  62          1HB       LYS  62   8.946  -6.335   0.046
  613   1HG   LYS  62          2HG       LYS  62   7.038  -7.850   0.241
  614   2HG   LYS  62          1HG       LYS  62   6.904  -7.944  -1.515
  615   1HD   LYS  62          2HD       LYS  62   8.124  -9.881  -0.985
  616   2HD   LYS  62          1HD       LYS  62   9.386  -8.732  -1.428
  617   1HE   LYS  62          2HE       LYS  62  10.256  -8.737   0.673
  618   2HE   LYS  62          1HE       LYS  62   8.652  -8.583   1.416
  619   1HZ   LYS  62          1HZ       LYS  62   9.759 -11.069   0.222
  620   2HZ   LYS  62          3HZ       LYS  62   9.645 -10.755   1.884
  621   3HZ   LYS  62          2HZ       LYS  62   8.233 -10.909   0.951
  622    QB   LYS  62           QB       LYS  62   8.930  -6.408  -0.833
  623    QD   LYS  62           QD       LYS  62   8.755  -9.307  -1.206
  624    QG   LYS  62           QG       LYS  62   6.971  -7.897  -0.637
  625    QE   LYS  62           QE       LYS  62   9.454  -8.660   1.044
  626    QZ   LYS  62           QZ       LYS  62   9.212 -10.911   1.019
  627    H    VAL  63           H        VAL  63   4.933  -6.140  -0.278
  628    HA   VAL  63           HA       VAL  63   4.689  -4.615   2.210
  629    HB   VAL  63           HB       VAL  63   3.015  -6.578   0.633
  630   1HG1  VAL  63          1HG1      VAL  63   3.403  -3.901   0.381
  631   2HG1  VAL  63          3HG1      VAL  63   1.903  -4.710  -0.072
  632   3HG1  VAL  63          2HG1      VAL  63   2.038  -3.919   1.499
  633   1HG2  VAL  63          2HG2      VAL  63   2.320  -5.349   3.324
  634   2HG2  VAL  63          1HG2      VAL  63   1.188  -6.210   2.281
  635   3HG2  VAL  63          3HG2      VAL  63   2.552  -7.067   3.001
  636    MG1  VAL  63           QG1      VAL  63   2.448  -4.177   0.603
  637    MG2  VAL  63           QG2      VAL  63   2.020  -6.208   2.868
  638    QG   VAL  63           QQG      VAL  63   2.234  -5.193   1.736
  639    H    GLU  64           H        GLU  64   4.835  -5.440   4.291
  640    HA   GLU  64           HA       GLU  64   5.850  -8.246   4.552
  641   1HB   GLU  64          2HB       GLU  64   6.288  -5.686   6.114
  642   2HB   GLU  64          1HB       GLU  64   6.823  -7.261   6.703
  643   1HG   GLU  64          2HG       GLU  64   7.688  -7.112   4.021
  644   2HG   GLU  64          1HG       GLU  64   8.068  -5.545   4.736
  645    QB   GLU  64           QB       GLU  64   6.555  -6.474   6.408
  646    QG   GLU  64           QG       GLU  64   7.878  -6.329   4.378
  647    H    LYS  65           H        LYS  65   3.265  -6.088   5.331
  648    HA   LYS  65           HA       LYS  65   1.685  -8.129   6.591
  649   1HB   LYS  65          2HB       LYS  65   3.618  -6.686   8.218
  650   2HB   LYS  65          1HB       LYS  65   1.977  -6.433   8.812
  651   1HG   LYS  65          2HG       LYS  65   2.592  -9.218   8.047
  652   2HG   LYS  65          1HG       LYS  65   3.505  -8.613   9.429
  653   1HD   LYS  65          2HD       LYS  65   0.565  -8.066   9.330
  654   2HD   LYS  65          1HD       LYS  65   1.100  -9.692   9.759
  655   1HE   LYS  65          2HE       LYS  65   2.420  -7.356  11.109
  656   2HE   LYS  65          1HE       LYS  65   0.811  -7.868  11.658
  657   1HZ   LYS  65          1HZ       LYS  65   1.727 -10.195  11.631
  658   2HZ   LYS  65          3HZ       LYS  65   3.269  -9.513  11.456
  659   3HZ   LYS  65          2HZ       LYS  65   2.350  -9.184  12.846
  660    QB   LYS  65           QB       LYS  65   2.797  -6.559   8.515
  661    QD   LYS  65           QD       LYS  65   0.833  -8.879   9.544
  662    QG   LYS  65           QG       LYS  65   3.048  -8.916   8.738
  663    QE   LYS  65           QE       LYS  65   1.615  -7.612  11.383
  664    QZ   LYS  65           QZ       LYS  65   2.449  -9.631  11.978
  665    H    VAL  66           H        VAL  66  -0.418  -7.448   6.354
  666    HA   VAL  66           HA       VAL  66  -1.021  -4.773   5.400
  667    HB   VAL  66           HB       VAL  66  -3.334  -5.664   5.447
  668   1HG1  VAL  66          3HG1      VAL  66  -1.099  -7.417   4.434
  669   2HG1  VAL  66          2HG1      VAL  66  -2.786  -7.858   4.171
  670   3HG1  VAL  66          1HG1      VAL  66  -2.159  -6.344   3.519
  671   1HG2  VAL  66          3HG2      VAL  66  -2.166  -7.337   7.500
  672   2HG2  VAL  66          2HG2      VAL  66  -3.867  -7.111   7.090
  673   3HG2  VAL  66          1HG2      VAL  66  -2.911  -8.335   6.252
  674    MG1  VAL  66           QG1      VAL  66  -2.014  -7.207   4.041
  675    MG2  VAL  66           QG2      VAL  66  -2.981  -7.595   6.947
  676    QG   VAL  66           QQG      VAL  66  -2.498  -7.401   5.494
  677    H    LEU  67           H        LEU  67  -2.225  -3.142   6.529
  678    HA   LEU  67           HA       LEU  67  -2.356  -3.503   9.508
  679   1HB   LEU  67          2HB       LEU  67  -0.726  -1.818   7.995
  680   2HB   LEU  67          1HB       LEU  67  -2.036  -0.766   8.535
  681    HG   LEU  67           HG       LEU  67  -0.439  -2.584  10.360
  682   1HD1  LEU  67          3HD1      LEU  67   0.568  -0.373   9.182
  683   2HD1  LEU  67          2HD1      LEU  67  -0.265   0.379  10.542
  684   3HD1  LEU  67          1HD1      LEU  67   0.975  -0.840  10.833
  685   1HD2  LEU  67          1HD2      LEU  67  -2.948  -1.568  10.738
  686   2HD2  LEU  67          3HD2      LEU  67  -1.815  -1.908  12.046
  687   3HD2  LEU  67          2HD2      LEU  67  -1.955  -0.271  11.403
  688    MD1  LEU  67           QD1      LEU  67   0.426  -0.278  10.186
  689    MD2  LEU  67           QD2      LEU  67  -2.240  -1.249  11.396
  690    QB   LEU  67           QB       LEU  67  -1.381  -1.292   8.265
  691    QD   LEU  67           QQD      LEU  67  -0.907  -0.763  10.791
  692    H    VAL  68           H        VAL  68  -3.552  -1.289   6.942
  693    HA   VAL  68           HA       VAL  68  -6.034  -0.808   8.448
  694    HB   VAL  68           HB       VAL  68  -5.137   0.044   5.675
  695   1HG1  VAL  68          1HG1      VAL  68  -7.399   0.794   7.500
  696   2HG1  VAL  68          3HG1      VAL  68  -6.715   2.019   6.431
  697   3HG1  VAL  68          2HG1      VAL  68  -7.411   0.548   5.753
  698   1HG2  VAL  68          1HG2      VAL  68  -3.555   0.690   7.499
  699   2HG2  VAL  68          3HG2      VAL  68  -4.340   2.082   6.754
  700   3HG2  VAL  68          2HG2      VAL  68  -4.886   1.498   8.326
  701    MG1  VAL  68           QG1      VAL  68  -7.175   1.121   6.561
  702    MG2  VAL  68           QG2      VAL  68  -4.260   1.423   7.526
  703    QG   VAL  68           QQG      VAL  68  -5.718   1.272   7.044
  704    H    LYS  69           H        LYS  69  -8.156  -1.322   7.590
  705    HA   LYS  69           HA       LYS  69  -8.195  -3.423   5.454
  706   1HB   LYS  69          2HB       LYS  69  -9.205  -3.455   8.286
  707   2HB   LYS  69          1HB       LYS  69 -10.040  -4.411   7.062
  708   1HG   LYS  69          2HG       LYS  69  -7.046  -4.566   7.382
  709   2HG   LYS  69          1HG       LYS  69  -8.122  -5.556   8.368
  710   1HD   LYS  69          2HD       LYS  69  -9.225  -6.182   6.080
  711   2HD   LYS  69          1HD       LYS  69  -7.703  -5.617   5.391
  712   1HE   LYS  69          2HE       LYS  69  -6.905  -7.225   7.534
  713   2HE   LYS  69          1HE       LYS  69  -8.256  -8.111   6.796
  714   1HZ   LYS  69          1HZ       LYS  69  -5.962  -6.930   5.318
  715   2HZ   LYS  69          3HZ       LYS  69  -6.154  -8.580   5.660
  716   3HZ   LYS  69          2HZ       LYS  69  -7.252  -7.794   4.629
  717    QB   LYS  69           QB       LYS  69  -9.623  -3.933   7.674
  718    QD   LYS  69           QD       LYS  69  -8.464  -5.900   5.735
  719    QG   LYS  69           QG       LYS  69  -7.584  -5.061   7.875
  720    QE   LYS  69           QE       LYS  69  -7.581  -7.668   7.165
  721    QZ   LYS  69           QZ       LYS  69  -6.456  -7.768   5.202
  722    H    GLU  70           H        GLU  70 -10.469  -3.716   4.591
  723    HA   GLU  70           HA       GLU  70 -11.654  -1.215   3.854
  724   1HB   GLU  70          2HB       GLU  70 -12.734  -4.055   3.821
  725   2HB   GLU  70          1HB       GLU  70 -13.388  -2.708   2.888
  726   1HG   GLU  70          2HG       GLU  70 -11.685  -2.762   1.371
  727   2HG   GLU  70          1HG       GLU  70 -10.475  -3.147   2.595
  728    QB   GLU  70           QB       GLU  70 -13.061  -3.382   3.355
  729    QG   GLU  70           QG       GLU  70 -11.080  -2.955   1.983
  730    H    ARG  71           H        ARG  71 -11.944  -0.261   6.071
  731    HA   ARG  71           HA       ARG  71 -14.668  -0.469   6.986
  732   1HB   ARG  71          2HB       ARG  71 -12.634  -2.280   8.076
  733   2HB   ARG  71          1HB       ARG  71 -13.458  -1.351   9.329
  734   1HG   ARG  71          2HG       ARG  71 -15.508  -2.120   7.596
  735   2HG   ARG  71          1HG       ARG  71 -14.470  -3.543   7.698
  736   1HD   ARG  71          2HD       ARG  71 -15.400  -4.001   9.713
  737   2HD   ARG  71          1HD       ARG  71 -14.675  -2.507  10.339
  738    HE   ARG  71           HE       ARG  71 -17.072  -1.995   8.771
  739   1HH1  ARG  71          1HH1      ARG  71 -18.994  -2.879  10.115
  740   2HH1  ARG  71          2HH1      ARG  71 -18.974  -2.322  11.755
  741   1HH2  ARG  71          1HH2      ARG  71 -15.669  -1.281  11.640
  742   2HH2  ARG  71          2HH2      ARG  71 -17.091  -1.417  12.619
  743    QB   ARG  71           QB       ARG  71 -13.046  -1.815   8.702
  744    QG   ARG  71           QG       ARG  71 -14.989  -2.832   7.647
  745    QD   ARG  71           QD       ARG  71 -15.037  -3.254  10.026
  746    QH1  ARG  71           QH1      ARG  71 -18.984  -2.600  10.935
  747    QH2  ARG  71           QH2      ARG  71 -16.380  -1.349  12.129
  748    H    ASP  72           H        ASP  72 -11.343   0.211   8.142
  749    HA   ASP  72           HA       ASP  72 -11.901   2.203  10.041
  750   1HB   ASP  72          2HB       ASP  72  -9.595   2.927   9.564
  751   2HB   ASP  72          1HB       ASP  72  -9.700   1.165   9.539
  752    QB   ASP  72           QB       ASP  72  -9.647   2.046   9.551
  753    H    ALA  73           H        ALA  73 -12.891   4.171   9.836
  754    HA   ALA  73           HA       ALA  73 -12.851   5.496   7.140
  755   1HB   ALA  73          3HB       ALA  73 -14.973   4.788   9.062
  756   2HB   ALA  73          1HB       ALA  73 -15.088   5.096   7.329
  757   3HB   ALA  73          2HB       ALA  73 -15.074   6.445   8.464
  758    MB   ALA  73           QB       ALA  73 -15.045   5.443   8.285
  759    H    VAL  74           H        VAL  74 -12.890   7.857   7.221
  760    HA   VAL  74           HA       VAL  74 -11.777   9.832   7.933
  761    HB   VAL  74           HB       VAL  74 -13.001  10.746   9.869
  762   1HG1  VAL  74          2HG1      VAL  74 -14.588   9.065   7.914
  763   2HG1  VAL  74          1HG1      VAL  74 -15.333  10.236   9.003
  764   3HG1  VAL  74          3HG1      VAL  74 -14.184  10.776   7.779
  765   1HG2  VAL  74          2HG2      VAL  74 -12.878   8.516  11.140
  766   2HG2  VAL  74          1HG2      VAL  74 -14.396   9.406  11.253
  767   3HG2  VAL  74          3HG2      VAL  74 -14.267   8.019  10.174
  768    MG1  VAL  74           QG1      VAL  74 -14.702  10.025   8.232
  769    MG2  VAL  74           QG2      VAL  74 -13.847   8.647  10.855
  770    QG   VAL  74           QQG      VAL  74 -14.274   9.336   9.544
  771    H    GLN  75           H        GLN  75 -10.074   7.619   8.486
  772    HA   GLN  75           HA       GLN  75  -8.965   8.333  11.182
  773   1HB   GLN  75          2HB       GLN  75  -9.722   5.888  10.005
  774   2HB   GLN  75          1HB       GLN  75  -7.959   5.888   9.983
  775   1HG   GLN  75          2HG       GLN  75  -7.788   5.923  12.282
  776   2HG   GLN  75          1HG       GLN  75  -9.305   6.801  12.486
  777   1HE2  GLN  75          1HE2      GLN  75 -11.142   5.202  11.147
  778   2HE2  GLN  75          2HE2      GLN  75 -11.205   3.660  11.854
  779    QB   GLN  75           QB       GLN  75  -8.840   5.888   9.994
  780    QG   GLN  75           QG       GLN  75  -8.546   6.362  12.384
  781    QE   GLN  75           QE2      GLN  75 -11.174   4.431  11.500
  782    H    GLY  76           H        GLY  76  -7.613  10.063  10.427
  783   1HA   GLY  76          1HA       GLY  76  -5.966  11.008   8.913
  784   2HA   GLY  76          2HA       GLY  76  -5.632   9.382   8.314
  785    QA   GLY  76           QA       GLY  76  -5.799  10.195   8.613
  786    H    GLY  77           H        GLY  77  -3.370   9.581   8.739
  787   1HA   GLY  77          1HA       GLY  77  -2.489  10.139  11.493
  788   2HA   GLY  77          2HA       GLY  77  -1.437   9.822  10.114
  789    QA   GLY  77           QA       GLY  77  -1.963   9.981  10.803
  790    H    GLN  78           H        GLN  78  -3.409   7.392   9.654
  791    HA   GLN  78           HA       GLN  78  -2.442   5.628  11.851
  792   1HB   GLN  78          2HB       GLN  78  -4.865   5.805  11.075
  793   2HB   GLN  78          1HB       GLN  78  -4.351   5.031   9.576
  794   1HG   GLN  78          2HG       GLN  78  -3.849   3.010  10.635
  795   2HG   GLN  78          1HG       GLN  78  -3.648   3.774  12.213
  796   1HE2  GLN  78          1HE2      GLN  78  -6.183   3.017   9.770
  797   2HE2  GLN  78          2HE2      GLN  78  -7.444   2.893  10.899
  798    QB   GLN  78           QB       GLN  78  -4.608   5.418  10.325
  799    QG   GLN  78           QG       GLN  78  -3.749   3.392  11.424
  800    QE   GLN  78           QE2      GLN  78  -6.814   2.955  10.334
  801    H    GLY  79           H        GLY  79  -1.242   3.713  11.359
  802   1HA   GLY  79          1HA       GLY  79   0.424   2.513  10.219
  803   2HA   GLY  79          2HA       GLY  79   0.618   3.924   9.179
  804    QA   GLY  79           QA       GLY  79   0.521   3.219   9.699
  805    H    LEU  80           H        LEU  80  -0.163   3.779   7.110
  806    HA   LEU  80           HA       LEU  80  -2.453   2.380   6.223
  807   1HB   LEU  80          2HB       LEU  80   0.015   3.565   5.100
  808   2HB   LEU  80          1HB       LEU  80  -0.751   2.350   4.075
  809    HG   LEU  80           HG       LEU  80  -2.415   4.508   5.347
  810   1HD1  LEU  80          2HD1      LEU  80  -0.664   4.717   2.893
  811   2HD1  LEU  80          1HD1      LEU  80  -2.102   5.717   3.098
  812   3HD1  LEU  80          3HD1      LEU  80  -0.774   5.834   4.253
  813   1HD2  LEU  80          3HD2      LEU  80  -2.718   2.377   3.371
  814   2HD2  LEU  80          2HD2      LEU  80  -3.958   3.277   4.244
  815   3HD2  LEU  80          1HD2      LEU  80  -3.270   3.935   2.760
  816    MD1  LEU  80           QD1      LEU  80  -1.180   5.423   3.415
  817    MD2  LEU  80           QD2      LEU  80  -3.315   3.196   3.458
  818    QB   LEU  80           QB       LEU  80  -0.368   2.958   4.587
  819    QD   LEU  80           QQD      LEU  80  -2.248   4.309   3.437
  820    H    ILE  81           H        ILE  81   0.748   1.285   5.155
  821    HA   ILE  81           HA       ILE  81   0.169  -1.470   6.142
  822    HB   ILE  81           HB       ILE  81   0.722  -0.639   3.273
  823   1HG1  ILE  81          2HG1      ILE  81  -1.690  -1.930   4.592
  824   2HG1  ILE  81          1HG1      ILE  81  -1.606  -0.275   3.988
  825   1HG2  ILE  81          2HG2      ILE  81   0.429  -3.376   4.547
  826   2HG2  ILE  81          1HG2      ILE  81   0.438  -3.085   2.808
  827   3HG2  ILE  81          3HG2      ILE  81   1.872  -2.725   3.769
  828   1HD1  ILE  81          3HD1      ILE  81  -0.737  -1.896   1.855
  829   2HD1  ILE  81          2HD1      ILE  81  -2.146  -2.715   2.527
  830   3HD1  ILE  81          1HD1      ILE  81  -2.276  -1.044   1.981
  831    MG   ILE  81           QG2      ILE  81   0.913  -3.062   3.708
  832    MD   ILE  81           QD1      ILE  81  -1.720  -1.885   2.121
  833    QG   ILE  81           QG1      ILE  81  -1.648  -1.103   4.290
  834    H    LYS  82           H        LYS  82   2.139  -2.844   6.051
  835    HA   LYS  82           HA       LYS  82   4.585  -1.248   6.510
  836   1HB   LYS  82          2HB       LYS  82   3.596  -3.264   7.856
  837   2HB   LYS  82          1HB       LYS  82   4.342  -4.250   6.598
  838   1HG   LYS  82          2HG       LYS  82   6.442  -3.849   7.361
  839   2HG   LYS  82          1HG       LYS  82   6.102  -2.144   7.661
  840   1HD   LYS  82          2HD       LYS  82   5.021  -2.655   9.757
  841   2HD   LYS  82          1HD       LYS  82   5.091  -4.387   9.428
  842   1HE   LYS  82          2HE       LYS  82   7.369  -4.520   9.887
  843   2HE   LYS  82          1HE       LYS  82   7.659  -2.824   9.450
  844   1HZ   LYS  82          2HZ       LYS  82   5.901  -3.545  11.714
  845   2HZ   LYS  82          1HZ       LYS  82   7.582  -3.410  11.928
  846   3HZ   LYS  82          3HZ       LYS  82   6.683  -2.068  11.407
  847    QB   LYS  82           QB       LYS  82   3.969  -3.757   7.227
  848    QD   LYS  82           QD       LYS  82   5.056  -3.521   9.593
  849    QG   LYS  82           QG       LYS  82   6.272  -2.997   7.511
  850    QE   LYS  82           QE       LYS  82   7.514  -3.672   9.668
  851    QZ   LYS  82           QZ       LYS  82   6.722  -3.007  11.683
  852    H    ILE  83           H        ILE  83   6.236  -1.096   5.025
  853    HA   ILE  83           HA       ILE  83   6.288  -3.040   2.749
  854    HB   ILE  83           HB       ILE  83   6.637  -1.107   1.243
  855   1HG1  ILE  83          2HG1      ILE  83   5.776   0.933   3.142
  856   2HG1  ILE  83          1HG1      ILE  83   7.311   0.207   3.618
  857   1HG2  ILE  83          2HG2      ILE  83   4.329  -1.943   1.756
  858   2HG2  ILE  83          1HG2      ILE  83   4.207  -0.712   3.014
  859   3HG2  ILE  83          3HG2      ILE  83   4.368  -0.233   1.324
  860   1HD1  ILE  83          1HD1      ILE  83   8.220   0.637   1.365
  861   2HD1  ILE  83          3HD1      ILE  83   6.686   1.364   0.886
  862   3HD1  ILE  83          2HD1      ILE  83   7.679   2.135   2.122
  863    MG   ILE  83           QG2      ILE  83   4.301  -0.963   2.031
  864    MD   ILE  83           QD1      ILE  83   7.528   1.379   1.458
  865    QG   ILE  83           QG1      ILE  83   6.543   0.570   3.380
  866    H    GLY  84           H        GLY  84   7.961  -2.803   5.195
  867   1HA   GLY  84          1HA       GLY  84  10.454  -1.521   4.588
  868   2HA   GLY  84          2HA       GLY  84  10.527  -3.212   4.093
  869    QA   GLY  84           QA       GLY  84  10.490  -2.366   4.340

  No H/Q in entry =         869
  Start of MODEL    5
    1    H1   MET   1          2H        MET   1  -9.273 -18.681  12.421
    2    H2   MET   1          1H        MET   1  -8.479 -19.098  10.979
    3    H3   MET   1          3H        MET   1  -9.384 -20.264  11.813
    4    HA   MET   1           HA       MET   1  -7.818 -20.468  13.518
    5   1HB   MET   1          2HB       MET   1  -6.881 -20.237  10.703
    6   2HB   MET   1          1HB       MET   1  -5.624 -20.373  11.933
    7   1HG   MET   1          2HG       MET   1  -7.087 -22.334  12.854
    8   2HG   MET   1          1HG       MET   1  -7.810 -22.323  11.245
    9   1HE   MET   1          1HE       MET   1  -5.412 -23.345  13.540
   10   2HE   MET   1          3HE       MET   1  -5.715 -24.852  12.664
   11   3HE   MET   1          2HE       MET   1  -4.093 -24.165  12.708
   12    QB   MET   1           QB       MET   1  -6.253 -20.305  11.318
   13    QG   MET   1           QG       MET   1  -7.449 -22.329  12.049
   14    ME   MET   1           QE       MET   1  -5.073 -24.121  12.971
   15    H    LYS   2           H        LYS   2  -8.182 -18.309  14.657
   16    HA   LYS   2           HA       LYS   2  -5.799 -16.525  14.271
   17   1HB   LYS   2          2HB       LYS   2  -8.622 -15.808  15.130
   18   2HB   LYS   2          1HB       LYS   2  -7.298 -14.673  14.867
   19   1HG   LYS   2          2HG       LYS   2  -7.253 -15.942  12.489
   20   2HG   LYS   2          1HG       LYS   2  -8.962 -16.134  12.881
   21   1HD   LYS   2          2HD       LYS   2  -9.360 -13.839  12.885
   22   2HD   LYS   2          1HD       LYS   2  -7.675 -13.444  13.227
   23   1HE   LYS   2          2HE       LYS   2  -8.081 -12.872  10.908
   24   2HE   LYS   2          1HE       LYS   2  -7.122 -14.367  10.903
   25   1HZ   LYS   2          2HZ       LYS   2 -10.091 -14.319  10.890
   26   2HZ   LYS   2          1HZ       LYS   2  -9.155 -14.451   9.479
   27   3HZ   LYS   2          3HZ       LYS   2  -9.081 -15.665  10.659
   28    QB   LYS   2           QB       LYS   2  -7.960 -15.240  14.998
   29    QD   LYS   2           QD       LYS   2  -8.518 -13.642  13.056
   30    QG   LYS   2           QG       LYS   2  -8.107 -16.038  12.685
   31    QE   LYS   2           QE       LYS   2  -7.601 -13.620  10.905
   32    QZ   LYS   2           QZ       LYS   2  -9.442 -14.812  10.342
   33    H    LEU   3           H        LEU   3  -4.803 -15.799  16.205
   34    HA   LEU   3           HA       LEU   3  -5.721 -17.182  18.705
   35   1HB   LEU   3          2HB       LEU   3  -3.027 -16.382  17.585
   36   2HB   LEU   3          1HB       LEU   3  -3.229 -16.825  19.280
   37    HG   LEU   3           HG       LEU   3  -4.516 -18.900  18.157
   38   1HD1  LEU   3          1HD1      LEU   3  -1.508 -18.626  18.451
   39   2HD1  LEU   3          3HD1      LEU   3  -2.641 -19.064  19.731
   40   3HD1  LEU   3          2HD1      LEU   3  -2.382 -20.156  18.372
   41   1HD2  LEU   3          3HD2      LEU   3  -2.654 -17.789  16.075
   42   2HD2  LEU   3          2HD2      LEU   3  -2.891 -19.533  16.192
   43   3HD2  LEU   3          1HD2      LEU   3  -4.267 -18.476  15.872
   44    MD1  LEU   3           QD1      LEU   3  -2.177 -19.282  18.852
   45    MD2  LEU   3           QD2      LEU   3  -3.271 -18.599  16.046
   46    QB   LEU   3           QB       LEU   3  -3.128 -16.604  18.432
   47    QD   LEU   3           QQD      LEU   3  -2.724 -18.941  17.449
   48    H    LYS   4           H        LYS   4  -4.618 -15.850  20.680
   49    HA   LYS   4           HA       LYS   4  -5.797 -13.142  20.519
   50   1HB   LYS   4          2HB       LYS   4  -5.389 -13.222  22.980
   51   2HB   LYS   4          1HB       LYS   4  -6.292 -14.625  22.410
   52   1HG   LYS   4          2HG       LYS   4  -3.401 -15.039  22.276
   53   2HG   LYS   4          1HG       LYS   4  -3.958 -14.704  23.917
   54   1HD   LYS   4          2HD       LYS   4  -5.746 -16.531  22.508
   55   2HD   LYS   4          1HD       LYS   4  -4.101 -17.162  22.614
   56   1HE   LYS   4          2HE       LYS   4  -5.140 -15.922  25.105
   57   2HE   LYS   4          1HE       LYS   4  -5.908 -17.448  24.621
   58   1HZ   LYS   4          3HZ       LYS   4  -2.971 -17.078  24.575
   59   2HZ   LYS   4          2HZ       LYS   4  -3.780 -17.638  25.960
   60   3HZ   LYS   4          1HZ       LYS   4  -3.846 -18.530  24.515
   61    QB   LYS   4           QB       LYS   4  -5.840 -13.923  22.695
   62    QD   LYS   4           QD       LYS   4  -4.924 -16.847  22.561
   63    QG   LYS   4           QG       LYS   4  -3.680 -14.871  23.097
   64    QE   LYS   4           QE       LYS   4  -5.524 -16.685  24.863
   65    QZ   LYS   4           QZ       LYS   4  -3.532 -17.749  25.017
   66    H    VAL   5           H        VAL   5  -4.577 -11.228  20.842
   67    HA   VAL   5           HA       VAL   5  -1.743 -11.390  20.096
   68    HB   VAL   5           HB       VAL   5  -3.599  -9.097  20.812
   69   1HG1  VAL   5          1HG1      VAL   5  -0.796  -9.193  19.682
   70   2HG1  VAL   5          3HG1      VAL   5  -1.846  -7.792  19.469
   71   3HG1  VAL   5          2HG1      VAL   5  -1.371  -8.298  21.090
   72   1HG2  VAL   5          2HG2      VAL   5  -3.160 -10.722  18.402
   73   2HG2  VAL   5          1HG2      VAL   5  -4.510  -9.663  18.812
   74   3HG2  VAL   5          3HG2      VAL   5  -3.039  -8.987  18.111
   75    MG1  VAL   5           QG1      VAL   5  -1.338  -8.428  20.081
   76    MG2  VAL   5           QG2      VAL   5  -3.570  -9.791  18.442
   77    QG   VAL   5           QQG      VAL   5  -2.454  -9.109  19.261
   78    H    THR   6           H        THR   6  -0.472 -12.127  21.814
   79    HA   THR   6           HA       THR   6  -0.944 -11.143  24.557
   80    HB   THR   6           HB       THR   6   1.126 -12.979  23.308
   81    HG1  THR   6           HG1      THR   6  -0.212 -14.575  23.917
   82   1HG2  THR   6          2HG2      THR   6   0.744 -11.918  26.037
   83   2HG2  THR   6          1HG2      THR   6   0.964 -13.665  25.942
   84   3HG2  THR   6          3HG2      THR   6   2.190 -12.583  25.279
   85    MG   THR   6           QG2      THR   6   1.300 -12.722  25.753
   86    H    VAL   7           H        VAL   7   1.182 -10.503  21.842
   87    HA   VAL   7           HA       VAL   7   3.066  -8.932  23.500
   88    HB   VAL   7           HB       VAL   7   3.805 -10.428  21.655
   89   1HG1  VAL   7          2HG1      VAL   7   1.617  -9.303  20.314
   90   2HG1  VAL   7          1HG1      VAL   7   3.031  -8.654  19.484
   91   3HG1  VAL   7          3HG1      VAL   7   2.816 -10.400  19.628
   92   1HG2  VAL   7          2HG2      VAL   7   4.856  -8.071  22.305
   93   2HG2  VAL   7          1HG2      VAL   7   5.484  -9.002  20.945
   94   3HG2  VAL   7          3HG2      VAL   7   4.370  -7.665  20.660
   95    MG1  VAL   7           QG1      VAL   7   2.488  -9.453  19.808
   96    MG2  VAL   7           QG2      VAL   7   4.903  -8.246  21.303
   97    QG   VAL   7           QQG      VAL   7   3.696  -8.849  20.556
   98    H    ASN   8           H        ASN   8   3.538  -6.647  22.815
   99    HA   ASN   8           HA       ASN   8   1.011  -5.184  22.321
  100   1HB   ASN   8          2HB       ASN   8   2.759  -4.733  24.152
  101   2HB   ASN   8          1HB       ASN   8   3.777  -4.086  22.865
  102   1HD2  ASN   8          1HD2      ASN   8   0.491  -3.692  24.287
  103   2HD2  ASN   8          2HD2      ASN   8   0.364  -2.042  23.912
  104    QB   ASN   8           QB       ASN   8   3.268  -4.409  23.509
  105    QD   ASN   8           QD2      ASN   8   0.428  -2.867  24.100
  106    H    GLY   9           H        GLY   9   0.896  -3.514  20.661
  107   1HA   GLY   9          1HA       GLY   9   1.652  -4.219  18.084
  108   2HA   GLY   9          2HA       GLY   9   2.993  -3.235  18.672
  109    QA   GLY   9           QA       GLY   9   2.322  -3.727  18.378
  110    H    ALA  10           H        ALA  10   1.236  -2.486  16.515
  111    HA   ALA  10           HA       ALA  10   0.070  -0.562  15.790
  112   1HB   ALA  10          1HB       ALA  10  -1.324  -1.889  17.874
  113   2HB   ALA  10          2HB       ALA  10  -2.005  -0.821  16.646
  114   3HB   ALA  10          3HB       ALA  10  -1.479  -0.162  18.195
  115    MB   ALA  10           QB       ALA  10  -1.602  -0.957  17.572
  116    H    GLY  11           H        GLY  11  -0.892   1.633  17.288
  117   1HA   GLY  11          1HA       GLY  11   1.572   2.649  18.643
  118   2HA   GLY  11          2HA       GLY  11  -0.057   3.241  18.978
  119    QA   GLY  11           QA       GLY  11   0.757   2.945  18.810
  120    H    LYS  12           H        LYS  12  -1.171   4.309  17.084
  121    HA   LYS  12           HA       LYS  12  -1.198   5.949  15.392
  122   1HB   LYS  12          2HB       LYS  12   0.014   7.171  17.101
  123   2HB   LYS  12          1HB       LYS  12   1.519   6.357  16.681
  124   1HG   LYS  12          2HG       LYS  12   1.946   7.998  15.202
  125   2HG   LYS  12          1HG       LYS  12   0.532   7.485  14.279
  126   1HD   LYS  12          2HD       LYS  12  -0.907   8.935  15.653
  127   2HD   LYS  12          1HD       LYS  12   0.494   9.439  16.598
  128   1HE   LYS  12          2HE       LYS  12   1.515  10.155  14.309
  129   2HE   LYS  12          1HE       LYS  12  -0.159  10.080  13.722
  130   1HZ   LYS  12          2HZ       LYS  12   0.721  11.547  16.153
  131   2HZ   LYS  12          1HZ       LYS  12   0.408  12.275  14.651
  132   3HZ   LYS  12          3HZ       LYS  12  -0.848  11.521  15.505
  133    QB   LYS  12           QB       LYS  12   0.766   6.764  16.891
  134    QD   LYS  12           QD       LYS  12  -0.206   9.187  16.126
  135    QG   LYS  12           QG       LYS  12   1.239   7.741  14.740
  136    QE   LYS  12           QE       LYS  12   0.678  10.117  14.016
  137    QZ   LYS  12           QZ       LYS  12   0.094  11.781  15.436
  138    H    ALA  13           H        ALA  13   2.301   5.556  15.088
  139    HA   ALA  13           HA       ALA  13   2.060   3.739  12.780
  140   1HB   ALA  13          1HB       ALA  13   2.792   5.386  11.165
  141   2HB   ALA  13          2HB       ALA  13   3.056   6.582  12.434
  142   3HB   ALA  13          3HB       ALA  13   1.417   6.073  12.030
  143    MB   ALA  13           QB       ALA  13   2.422   6.014  11.876
  144    H    GLY  14           H        GLY  14   4.152   2.953  12.107
  145   1HA   GLY  14          1HA       GLY  14   6.155   2.047  13.257
  146   2HA   GLY  14          2HA       GLY  14   6.347   3.625  14.024
  147    QA   GLY  14           QA       GLY  14   6.251   2.836  13.641
  148    H    GLU  15           H        GLU  15   8.592   3.240  12.985
  149    HA   GLU  15           HA       GLU  15   8.971   5.014  10.798
  150   1HB   GLU  15          2HB       GLU  15  10.495   3.148  12.463
  151   2HB   GLU  15          1HB       GLU  15  11.151   3.286  10.830
  152   1HG   GLU  15          2HG       GLU  15  11.485   5.618  11.033
  153   2HG   GLU  15          1HG       GLU  15  10.408   5.736  12.426
  154    QB   GLU  15           QB       GLU  15  10.823   3.217  11.646
  155    QG   GLU  15           QG       GLU  15  10.946   5.677  11.730
  156    H    GLY  16           H        GLY  16   7.998   4.589   8.824
  157   1HA   GLY  16          1HA       GLY  16   8.318   1.834   7.704
  158   2HA   GLY  16          2HA       GLY  16   8.637   3.267   6.724
  159    QA   GLY  16           QA       GLY  16   8.477   2.551   7.214
  160    H    GLU  17           H        GLU  17   6.043   3.315   9.051
  161    HA   GLU  17           HA       GLU  17   4.008   2.669   6.987
  162   1HB   GLU  17          2HB       GLU  17   3.950   3.228   9.967
  163   2HB   GLU  17          1HB       GLU  17   2.505   2.881   9.017
  164   1HG   GLU  17          2HG       GLU  17   3.022   0.667   8.789
  165   2HG   GLU  17          1HG       GLU  17   4.755   0.981   8.671
  166    QB   GLU  17           QB       GLU  17   3.227   3.054   9.492
  167    QG   GLU  17           QG       GLU  17   3.889   0.824   8.730
  168    H    ILE  18           H        ILE  18   2.229   4.193   6.600
  169    HA   ILE  18           HA       ILE  18   2.979   7.050   7.131
  170    HB   ILE  18           HB       ILE  18   1.713   5.757   4.693
  171   1HG1  ILE  18          2HG1      ILE  18   4.011   6.970   3.861
  172   2HG1  ILE  18          1HG1      ILE  18   4.482   6.461   5.483
  173   1HG2  ILE  18          1HG2      ILE  18   2.419   8.629   5.348
  174   2HG2  ILE  18          3HG2      ILE  18   2.100   8.062   3.710
  175   3HG2  ILE  18          2HG2      ILE  18   0.832   7.983   4.931
  176   1HD1  ILE  18          3HD1      ILE  18   3.240   4.210   4.656
  177   2HD1  ILE  18          2HD1      ILE  18   3.813   4.813   3.101
  178   3HD1  ILE  18          1HD1      ILE  18   4.961   4.498   4.402
  179    MG   ILE  18           QG2      ILE  18   1.784   8.225   4.663
  180    MD   ILE  18           QD1      ILE  18   4.005   4.507   4.053
  181    QG   ILE  18           QG1      ILE  18   4.247   6.715   4.672
  182    HA   PRO  19           HA       PRO  19  -1.127   6.663   8.980
  183   1HB   PRO  19          2HB       PRO  19  -1.066   9.058  10.305
  184   2HB   PRO  19          1HB       PRO  19  -0.275   7.592  10.919
  185   1HG   PRO  19          2HG       PRO  19   0.907   9.931   9.511
  186   2HG   PRO  19          1HG       PRO  19   1.556   8.974  10.851
  187   1HD   PRO  19          2HD       PRO  19   2.358   8.680   8.259
  188   2HD   PRO  19          1HD       PRO  19   2.420   7.376   9.463
  189    QB   PRO  19           QB       PRO  19  -0.670   8.325  10.612
  190    QG   PRO  19           QG       PRO  19   1.231   9.452  10.181
  191    QD   PRO  19           QD       PRO  19   2.389   8.028   8.861
  192    H    ALA  20           H        ALA  20  -3.148   7.843   8.664
  193    HA   ALA  20           HA       ALA  20  -3.121   9.491   6.189
  194   1HB   ALA  20          2HB       ALA  20  -4.766   7.491   7.391
  195   2HB   ALA  20          1HB       ALA  20  -5.732   8.959   7.246
  196   3HB   ALA  20          3HB       ALA  20  -4.973   8.257   5.817
  197    MB   ALA  20           QB       ALA  20  -5.157   8.236   6.818
  198    HA   PRO  21           HA       PRO  21  -3.602  12.960   9.047
  199   1HB   PRO  21          2HB       PRO  21  -3.215  14.921   7.182
  200   2HB   PRO  21          1HB       PRO  21  -1.881  14.027   7.937
  201   1HG   PRO  21          2HG       PRO  21  -3.108  13.684   5.253
  202   2HG   PRO  21          1HG       PRO  21  -1.416  13.538   5.750
  203   1HD   PRO  21          2HD       PRO  21  -3.074  11.403   5.302
  204   2HD   PRO  21          1HD       PRO  21  -1.654  11.357   6.370
  205    QB   PRO  21           QB       PRO  21  -2.548  14.474   7.560
  206    QG   PRO  21           QG       PRO  21  -2.262  13.611   5.501
  207    QD   PRO  21           QD       PRO  21  -2.364  11.380   5.836
  208    H    LEU  22           H        LEU  22  -5.573  11.889   6.506
  209    HA   LEU  22           HA       LEU  22  -7.706  13.816   7.322
  210   1HB   LEU  22          2HB       LEU  22  -8.235  14.172   4.938
  211   2HB   LEU  22          1HB       LEU  22  -6.567  14.633   5.276
  212    HG   LEU  22           HG       LEU  22  -6.442  11.900   4.665
  213   1HD1  LEU  22          1HD1      LEU  22  -8.748  13.114   3.403
  214   2HD1  LEU  22          3HD1      LEU  22  -7.565  12.641   2.186
  215   3HD1  LEU  22          2HD1      LEU  22  -8.191  11.444   3.319
  216   1HD2  LEU  22          1HD2      LEU  22  -5.652  14.489   3.445
  217   2HD2  LEU  22          3HD2      LEU  22  -4.662  13.086   3.846
  218   3HD2  LEU  22          2HD2      LEU  22  -5.631  13.089   2.372
  219    MD1  LEU  22           QD1      LEU  22  -8.168  12.400   2.969
  220    MD2  LEU  22           QD2      LEU  22  -5.315  13.555   3.221
  221    QB   LEU  22           QB       LEU  22  -7.401  14.403   5.107
  222    QD   LEU  22           QQD      LEU  22  -6.741  12.977   3.095
  223    H    ALA  23           H        ALA  23  -7.238  10.935   7.910
  224    HA   ALA  23           HA       ALA  23  -8.439   8.893   7.885
  225   1HB   ALA  23          1HB       ALA  23 -10.879  10.394   7.075
  226   2HB   ALA  23          3HB       ALA  23 -10.627   9.324   8.453
  227   3HB   ALA  23          2HB       ALA  23 -10.035  10.984   8.507
  228    MB   ALA  23           QB       ALA  23 -10.513  10.234   8.012
  229    H    GLY  24           H        GLY  24 -10.740   8.219   6.324
  230   1HA   GLY  24          1HA       GLY  24  -9.591   7.232   3.943
  231   2HA   GLY  24          2HA       GLY  24 -10.389   8.749   3.526
  232    QA   GLY  24           QA       GLY  24  -9.990   7.990   3.734
  233    H    THR  25           H        THR  25 -11.225   6.189   2.548
  234    HA   THR  25           HA       THR  25 -13.945   6.041   3.793
  235    HB   THR  25           HB       THR  25 -13.297   4.979   1.069
  236    HG1  THR  25           HG1      THR  25 -13.342   7.701   1.831
  237   1HG2  THR  25          2HG2      THR  25 -15.605   5.804   2.614
  238   2HG2  THR  25          1HG2      THR  25 -15.546   6.659   1.073
  239   3HG2  THR  25          3HG2      THR  25 -15.544   4.896   1.103
  240    MG   THR  25           QG2      THR  25 -15.565   5.787   1.596
  241    H    VAL  26           H        VAL  26 -14.425   3.551   2.176
  242    HA   VAL  26           HA       VAL  26 -14.034   1.550   4.065
  243    HB   VAL  26           HB       VAL  26 -14.140   0.012   2.026
  244   1HG1  VAL  26          1HG1      VAL  26 -13.332   2.460   0.742
  245   2HG1  VAL  26          3HG1      VAL  26 -13.534   0.858   0.035
  246   3HG1  VAL  26          2HG1      VAL  26 -14.904   1.965   0.119
  247   1HG2  VAL  26          1HG2      VAL  26 -16.062   1.377   3.295
  248   2HG2  VAL  26          3HG2      VAL  26 -16.231   2.110   1.700
  249   3HG2  VAL  26          2HG2      VAL  26 -16.406   0.366   1.893
  250    MG1  VAL  26           QG1      VAL  26 -13.923   1.761   0.299
  251    MG2  VAL  26           QG2      VAL  26 -16.233   1.284   2.296
  252    QG   VAL  26           QQG      VAL  26 -15.078   1.523   1.297
  253    H    SER  27           H        SER  27 -11.668   2.729   1.696
  254    HA   SER  27           HA       SER  27  -9.373   2.239   1.472
  255   1HB   SER  27          2HB       SER  27  -8.294   2.232   3.520
  256   2HB   SER  27          1HB       SER  27  -9.898   2.719   4.056
  257    HG   SER  27           HG       SER  27 -10.299   0.425   4.370
  258    QB   SER  27           QB       SER  27  -9.096   2.475   3.788
  259    H    LYS  28           H        LYS  28 -11.238   0.249   0.543
  260    HA   LYS  28           HA       LYS  28 -10.566  -2.402   1.428
  261   1HB   LYS  28          2HB       LYS  28 -11.957  -1.053  -0.822
  262   2HB   LYS  28          1HB       LYS  28 -11.389  -2.692  -1.149
  263   1HG   LYS  28          2HG       LYS  28 -12.607  -2.542   1.478
  264   2HG   LYS  28          1HG       LYS  28 -13.725  -1.969   0.239
  265   1HD   LYS  28          2HD       LYS  28 -12.182  -4.569   0.034
  266   2HD   LYS  28          1HD       LYS  28 -13.832  -4.455   0.649
  267   1HE   LYS  28          2HE       LYS  28 -14.710  -4.200  -1.442
  268   2HE   LYS  28          1HE       LYS  28 -13.414  -3.094  -1.942
  269   1HZ   LYS  28          3HZ       LYS  28 -11.926  -5.132  -1.832
  270   2HZ   LYS  28          2HZ       LYS  28 -13.355  -6.050  -1.813
  271   3HZ   LYS  28          1HZ       LYS  28 -13.003  -5.048  -3.139
  272    QB   LYS  28           QB       LYS  28 -11.673  -1.873  -0.985
  273    QD   LYS  28           QD       LYS  28 -13.007  -4.512   0.341
  274    QG   LYS  28           QG       LYS  28 -13.166  -2.255   0.858
  275    QE   LYS  28           QE       LYS  28 -14.062  -3.647  -1.692
  276    QZ   LYS  28           QZ       LYS  28 -12.762  -5.410  -2.262
  277    H    ILE  29           H        ILE  29  -8.336  -2.831   1.452
  278    HA   ILE  29           HA       ILE  29  -6.436  -1.963  -0.494
  279    HB   ILE  29           HB       ILE  29  -5.918  -2.789   1.769
  280   1HG1  ILE  29          2HG1      ILE  29  -4.660  -4.841  -0.010
  281   2HG1  ILE  29          1HG1      ILE  29  -4.390  -3.140  -0.390
  282   1HG2  ILE  29          3HG2      ILE  29  -7.758  -4.706   1.318
  283   2HG2  ILE  29          2HG2      ILE  29  -6.298  -5.622   0.943
  284   3HG2  ILE  29          1HG2      ILE  29  -6.489  -4.878   2.530
  285   1HD1  ILE  29          3HD1      ILE  29  -3.605  -2.758   1.929
  286   2HD1  ILE  29          2HD1      ILE  29  -3.838  -4.471   2.280
  287   3HD1  ILE  29          1HD1      ILE  29  -2.623  -3.969   1.104
  288    MG   ILE  29           QG2      ILE  29  -6.848  -5.069   1.597
  289    MD   ILE  29           QD1      ILE  29  -3.355  -3.733   1.771
  290    QG   ILE  29           QG1      ILE  29  -4.525  -3.990  -0.200
  291    H    LEU  30           H        LEU  30  -6.505  -2.514  -2.643
  292    HA   LEU  30           HA       LEU  30  -7.935  -4.808  -3.670
  293   1HB   LEU  30          2HB       LEU  30  -5.866  -2.911  -4.823
  294   2HB   LEU  30          1HB       LEU  30  -6.767  -4.079  -5.790
  295    HG   LEU  30           HG       LEU  30  -8.223  -2.151  -3.997
  296   1HD1  LEU  30          1HD1      LEU  30  -6.873  -1.607  -6.612
  297   2HD1  LEU  30          3HD1      LEU  30  -8.453  -0.881  -6.323
  298   3HD1  LEU  30          2HD1      LEU  30  -7.112  -0.535  -5.232
  299   1HD2  LEU  30          1HD2      LEU  30  -9.363  -4.117  -5.081
  300   2HD2  LEU  30          3HD2      LEU  30 -10.036  -2.557  -5.552
  301   3HD2  LEU  30          2HD2      LEU  30  -8.960  -3.420  -6.650
  302    MD1  LEU  30           QD1      LEU  30  -7.479  -1.008  -6.056
  303    MD2  LEU  30           QD2      LEU  30  -9.453  -3.365  -5.761
  304    QB   LEU  30           QB       LEU  30  -6.317  -3.495  -5.306
  305    QD   LEU  30           QQD      LEU  30  -8.466  -2.186  -5.908
  306    H    VAL  31           H        VAL  31  -4.631  -4.247  -2.628
  307    HA   VAL  31           HA       VAL  31  -3.744  -6.859  -3.752
  308    HB   VAL  31           HB       VAL  31  -1.514  -5.996  -3.141
  309   1HG1  VAL  31          2HG1      VAL  31  -2.565  -5.274  -5.275
  310   2HG1  VAL  31          1HG1      VAL  31  -3.240  -3.871  -4.448
  311   3HG1  VAL  31          3HG1      VAL  31  -1.493  -4.037  -4.617
  312   1HG2  VAL  31          2HG2      VAL  31  -2.980  -4.519  -1.249
  313   2HG2  VAL  31          1HG2      VAL  31  -1.243  -4.430  -1.540
  314   3HG2  VAL  31          3HG2      VAL  31  -2.335  -3.322  -2.372
  315    MG1  VAL  31           QG1      VAL  31  -2.432  -4.394  -4.780
  316    MG2  VAL  31           QG2      VAL  31  -2.186  -4.090  -1.720
  317    QG   VAL  31           QQG      VAL  31  -2.309  -4.242  -3.250
  318    H    LYS  32           H        LYS  32  -1.752  -7.359  -1.764
  319    HA   LYS  32           HA       LYS  32  -3.273  -7.712   0.774
  320   1HB   LYS  32          2HB       LYS  32  -3.167  -9.653  -1.176
  321   2HB   LYS  32          1HB       LYS  32  -1.800 -10.093  -0.153
  322   1HG   LYS  32          2HG       LYS  32  -3.773  -9.481   1.689
  323   2HG   LYS  32          1HG       LYS  32  -4.671 -10.283   0.399
  324   1HD   LYS  32          2HD       LYS  32  -2.139 -11.401   1.635
  325   2HD   LYS  32          1HD       LYS  32  -3.765 -11.860   2.143
  326   1HE   LYS  32          2HE       LYS  32  -4.187 -13.044   0.197
  327   2HE   LYS  32          1HE       LYS  32  -3.121 -12.015  -0.781
  328   1HZ   LYS  32          2HZ       LYS  32  -1.224 -12.913   0.465
  329   2HZ   LYS  32          1HZ       LYS  32  -2.268 -13.970   1.290
  330   3HZ   LYS  32          3HZ       LYS  32  -2.051 -14.129  -0.385
  331    QB   LYS  32           QB       LYS  32  -2.483  -9.873  -0.664
  332    QD   LYS  32           QD       LYS  32  -2.952 -11.631   1.889
  333    QG   LYS  32           QG       LYS  32  -4.222  -9.882   1.044
  334    QE   LYS  32           QE       LYS  32  -3.654 -12.530  -0.292
  335    QZ   LYS  32           QZ       LYS  32  -1.848 -13.670   0.457
  336    H    GLU  33           H        GLU  33  -1.616  -8.995   2.338
  337    HA   GLU  33           HA       GLU  33   0.770  -7.299   2.496
  338   1HB   GLU  33          2HB       GLU  33   1.062  -8.545   4.624
  339   2HB   GLU  33          1HB       GLU  33  -0.587  -7.942   4.456
  340   1HG   GLU  33          2HG       GLU  33  -0.494 -10.491   3.197
  341   2HG   GLU  33          1HG       GLU  33   0.290 -10.655   4.769
  342    QB   GLU  33           QB       GLU  33   0.238  -8.244   4.540
  343    QG   GLU  33           QG       GLU  33  -0.102 -10.573   3.983
  344    H    GLY  34           H        GLY  34   2.951  -8.106   2.423
  345   1HA   GLY  34          1HA       GLY  34   3.488 -10.897   1.772
  346   2HA   GLY  34          2HA       GLY  34   4.683  -9.602   1.835
  347    QA   GLY  34           QA       GLY  34   4.086 -10.249   1.804
  348    H    ASP  35           H        ASP  35   2.362  -8.333  -0.083
  349    HA   ASP  35           HA       ASP  35   3.185  -9.737  -2.574
  350   1HB   ASP  35          2HB       ASP  35   0.895  -8.212  -1.557
  351   2HB   ASP  35          1HB       ASP  35   1.365  -7.728  -3.186
  352    QB   ASP  35           QB       ASP  35   1.130  -7.970  -2.371
  353    H    THR  36           H        THR  36   3.683  -8.242  -4.474
  354    HA   THR  36           HA       THR  36   5.482  -6.044  -3.546
  355    HB   THR  36           HB       THR  36   5.284  -7.607  -6.143
  356    HG1  THR  36           HG1      THR  36   6.282  -8.987  -4.917
  357   1HG2  THR  36          2HG2      THR  36   6.190  -5.258  -6.335
  358   2HG2  THR  36          1HG2      THR  36   7.471  -5.731  -5.218
  359   3HG2  THR  36          3HG2      THR  36   7.334  -6.520  -6.789
  360    MG   THR  36           QG2      THR  36   6.999  -5.836  -6.114
  361    H    VAL  37           H        VAL  37   5.447  -4.016  -4.746
  362    HA   VAL  37           HA       VAL  37   2.981  -3.521  -6.363
  363    HB   VAL  37           HB       VAL  37   2.555  -2.882  -4.037
  364   1HG1  VAL  37          2HG1      VAL  37   1.877  -1.381  -6.029
  365   2HG1  VAL  37          1HG1      VAL  37   1.836  -0.658  -4.421
  366   3HG1  VAL  37          3HG1      VAL  37   3.186  -0.321  -5.505
  367   1HG2  VAL  37          2HG2      VAL  37   5.198  -1.460  -4.364
  368   2HG2  VAL  37          1HG2      VAL  37   4.041  -0.978  -3.122
  369   3HG2  VAL  37          3HG2      VAL  37   4.719  -2.607  -3.113
  370    MG1  VAL  37           QG1      VAL  37   2.300  -0.787  -5.318
  371    MG2  VAL  37           QG2      VAL  37   4.653  -1.681  -3.533
  372    QG   VAL  37           QQG      VAL  37   3.476  -1.234  -4.426
  373    H    LYS  38           H        LYS  38   3.182  -1.356  -7.529
  374    HA   LYS  38           HA       LYS  38   6.051  -0.687  -8.096
  375   1HB   LYS  38          2HB       LYS  38   4.518  -2.148  -9.732
  376   2HB   LYS  38          1HB       LYS  38   3.959  -0.550 -10.228
  377   1HG   LYS  38          2HG       LYS  38   5.766  -0.717 -11.638
  378   2HG   LYS  38          1HG       LYS  38   6.605  -0.077 -10.224
  379   1HD   LYS  38          2HD       LYS  38   7.162  -2.371  -9.510
  380   2HD   LYS  38          1HD       LYS  38   6.325  -3.015 -10.923
  381   1HE   LYS  38          2HE       LYS  38   8.196  -2.734 -12.165
  382   2HE   LYS  38          1HE       LYS  38   8.191  -0.998 -11.791
  383   1HZ   LYS  38          2HZ       LYS  38   9.171  -1.536  -9.618
  384   2HZ   LYS  38          1HZ       LYS  38   9.281  -3.168 -10.077
  385   3HZ   LYS  38          3HZ       LYS  38  10.183  -1.994 -10.904
  386    QB   LYS  38           QB       LYS  38   4.238  -1.349  -9.980
  387    QD   LYS  38           QD       LYS  38   6.744  -2.693 -10.216
  388    QG   LYS  38           QG       LYS  38   6.186  -0.397 -10.931
  389    QE   LYS  38           QE       LYS  38   8.193  -1.866 -11.978
  390    QZ   LYS  38           QZ       LYS  38   9.545  -2.233 -10.200
  391    H    ALA  39           H        ALA  39   6.330   1.529  -8.950
  392    HA   ALA  39           HA       ALA  39   4.781   3.496  -7.528
  393   1HB   ALA  39          1HB       ALA  39   7.218   3.304  -8.833
  394   2HB   ALA  39          2HB       ALA  39   6.539   4.788  -8.164
  395   3HB   ALA  39          3HB       ALA  39   6.305   4.403  -9.869
  396    MB   ALA  39           QB       ALA  39   6.687   4.165  -8.955
  397    H    GLY  40           H        GLY  40   2.778   4.226  -8.105
  398   1HA   GLY  40          1HA       GLY  40   2.182   4.794 -10.929
  399   2HA   GLY  40          2HA       GLY  40   1.158   5.203  -9.552
  400    QA   GLY  40           QA       GLY  40   1.670   4.998 -10.241
  401    H    GLN  41           H        GLN  41   0.892   2.691  -8.350
  402    HA   GLN  41           HA       GLN  41  -0.628   1.198 -10.460
  403   1HB   GLN  41          2HB       GLN  41   1.733   0.387  -9.371
  404   2HB   GLN  41          1HB       GLN  41   0.596  -0.322  -8.225
  405   1HG   GLN  41          2HG       GLN  41  -0.503  -1.571  -9.925
  406   2HG   GLN  41          1HG       GLN  41   0.261  -0.637 -11.211
  407   1HE2  GLN  41          1HE2      GLN  41   1.031  -2.955  -8.575
  408   2HE2  GLN  41          2HE2      GLN  41   2.421  -3.580  -9.323
  409    QB   GLN  41           QB       GLN  41   1.164   0.033  -8.798
  410    QG   GLN  41           QG       GLN  41  -0.121  -1.104 -10.568
  411    QE   GLN  41           QE2      GLN  41   1.726  -3.267  -8.949
  412    H    THR  42           H        THR  42  -2.747   1.538  -9.841
  413    HA   THR  42           HA       THR  42  -3.732   2.220  -7.296
  414    HB   THR  42           HB       THR  42  -5.001   0.548  -9.493
  415    HG1  THR  42           HG1      THR  42  -5.144   3.336  -9.032
  416   1HG2  THR  42          1HG2      THR  42  -6.208   2.192  -7.253
  417   2HG2  THR  42          3HG2      THR  42  -7.125   1.510  -8.596
  418   3HG2  THR  42          2HG2      THR  42  -6.315   0.442  -7.449
  419    MG   THR  42           QG2      THR  42  -6.549   1.381  -7.766
  420    H    VAL  43           H        VAL  43  -3.404   1.058  -5.434
  421    HA   VAL  43           HA       VAL  43  -3.713  -1.925  -5.584
  422    HB   VAL  43           HB       VAL  43  -2.005  -1.943  -3.750
  423   1HG1  VAL  43          1HG1      VAL  43  -1.586  -1.040  -6.521
  424   2HG1  VAL  43          3HG1      VAL  43  -0.247  -0.659  -5.438
  425   3HG1  VAL  43          2HG1      VAL  43  -0.782  -2.328  -5.625
  426   1HG2  VAL  43          3HG2      VAL  43  -2.672   0.779  -3.603
  427   2HG2  VAL  43          2HG2      VAL  43  -1.385  -0.037  -2.716
  428   3HG2  VAL  43          1HG2      VAL  43  -1.034   0.749  -4.256
  429    MG1  VAL  43           QG1      VAL  43  -0.872  -1.342  -5.862
  430    MG2  VAL  43           QG2      VAL  43  -1.697   0.497  -3.525
  431    QG   VAL  43           QQG      VAL  43  -1.284  -0.423  -4.693
  432    H    LEU  44           H        LEU  44  -4.821   1.006  -4.134
  433    HA   LEU  44           HA       LEU  44  -6.333  -0.619  -2.112
  434   1HB   LEU  44          2HB       LEU  44  -4.280   1.237  -1.661
  435   2HB   LEU  44          1HB       LEU  44  -5.766   2.111  -1.285
  436    HG   LEU  44           HG       LEU  44  -6.413  -0.070   0.011
  437   1HD1  LEU  44          1HD1      LEU  44  -5.352   2.364   0.744
  438   2HD1  LEU  44          3HD1      LEU  44  -5.951   1.147   1.871
  439   3HD1  LEU  44          2HD1      LEU  44  -4.230   1.230   1.494
  440   1HD2  LEU  44          1HD2      LEU  44  -4.344  -1.244  -0.955
  441   2HD2  LEU  44          3HD2      LEU  44  -3.401  -0.270   0.174
  442   3HD2  LEU  44          2HD2      LEU  44  -4.601  -1.411   0.782
  443    MD1  LEU  44           QD1      LEU  44  -5.177   1.580   1.370
  444    MD2  LEU  44           QD2      LEU  44  -4.115  -0.975   0.001
  445    QB   LEU  44           QB       LEU  44  -5.023   1.674  -1.473
  446    QD   LEU  44           QQD      LEU  44  -4.646   0.303   0.685
  447    H    VAL  45           H        VAL  45  -8.318   0.566  -1.332
  448    HA   VAL  45           HA       VAL  45  -9.490   2.255  -3.518
  449    HB   VAL  45           HB       VAL  45 -10.719   0.224  -1.626
  450   1HG1  VAL  45          3HG1      VAL  45 -10.119   0.260  -4.591
  451   2HG1  VAL  45          2HG1      VAL  45  -9.552  -0.894  -3.385
  452   3HG1  VAL  45          1HG1      VAL  45 -11.247  -0.886  -3.867
  453   1HG2  VAL  45          2HG2      VAL  45 -11.892   2.324  -3.373
  454   2HG2  VAL  45          1HG2      VAL  45 -12.648   0.733  -3.451
  455   3HG2  VAL  45          3HG2      VAL  45 -12.544   1.584  -1.911
  456    MG1  VAL  45           QG1      VAL  45 -10.306  -0.507  -3.947
  457    MG2  VAL  45           QG2      VAL  45 -12.361   1.547  -2.912
  458    QG   VAL  45           QQG      VAL  45 -11.334   0.520  -3.430
  459    H    LEU  46           H        LEU  46  -9.261   4.329  -2.674
  460    HA   LEU  46           HA       LEU  46 -10.607   4.854  -0.054
  461   1HB   LEU  46          2HB       LEU  46  -7.994   4.640  -0.099
  462   2HB   LEU  46          1HB       LEU  46  -8.052   6.228  -0.865
  463    HG   LEU  46           HG       LEU  46  -9.804   6.501   1.262
  464   1HD1  LEU  46          1HD1      LEU  46  -7.472   4.730   2.023
  465   2HD1  LEU  46          3HD1      LEU  46  -8.339   5.714   3.200
  466   3HD1  LEU  46          2HD1      LEU  46  -9.187   4.443   2.318
  467   1HD2  LEU  46          1HD2      LEU  46  -7.561   7.740   0.282
  468   2HD2  LEU  46          3HD2      LEU  46  -8.406   8.228   1.750
  469   3HD2  LEU  46          2HD2      LEU  46  -6.994   7.175   1.853
  470    MD1  LEU  46           QD1      LEU  46  -8.333   4.962   2.513
  471    MD2  LEU  46           QD2      LEU  46  -7.654   7.714   1.295
  472    QB   LEU  46           QB       LEU  46  -8.023   5.434  -0.482
  473    QD   LEU  46           QQD      LEU  46  -7.993   6.338   1.904
  474    H    GLU  47           H        GLU  47 -11.888   6.689  -0.129
  475    HA   GLU  47           HA       GLU  47 -11.597   8.481  -2.518
  476   1HB   GLU  47          2HB       GLU  47 -13.519   6.737  -2.403
  477   2HB   GLU  47          1HB       GLU  47 -14.203   7.791  -1.164
  478   1HG   GLU  47          2HG       GLU  47 -13.971   9.706  -2.817
  479   2HG   GLU  47          1HG       GLU  47 -13.583   8.498  -4.043
  480    QB   GLU  47           QB       GLU  47 -13.861   7.264  -1.783
  481    QG   GLU  47           QG       GLU  47 -13.777   9.102  -3.430
  482    H    ALA  48           H        ALA  48 -10.754  10.334  -1.588
  483    HA   ALA  48           HA       ALA  48 -12.356  11.614   0.575
  484   1HB   ALA  48          2HB       ALA  48  -9.402  11.770   0.823
  485   2HB   ALA  48          3HB       ALA  48 -10.107  10.182   1.130
  486   3HB   ALA  48          1HB       ALA  48 -10.624  11.575   2.080
  487    MB   ALA  48           QB       ALA  48 -10.044  11.176   1.345
  488    H    MET  49           H        MET  49 -12.854  12.778  -1.607
  489    HA   MET  49           HA       MET  49 -12.640  14.730  -2.913
  490   1HB   MET  49          2HB       MET  49 -11.247  15.195  -0.339
  491   2HB   MET  49          1HB       MET  49 -10.806  16.304  -1.636
  492   1HG   MET  49          2HG       MET  49 -13.664  15.686  -0.850
  493   2HG   MET  49          1HG       MET  49 -12.762  17.079  -0.257
  494   1HE   MET  49          2HE       MET  49 -13.950  18.632  -0.713
  495   2HE   MET  49          1HE       MET  49 -13.521  19.629  -2.101
  496   3HE   MET  49          3HE       MET  49 -15.079  18.792  -2.056
  497    QB   MET  49           QB       MET  49 -11.026  15.749  -0.988
  498    QG   MET  49           QG       MET  49 -13.213  16.383  -0.554
  499    ME   MET  49           QE       MET  49 -14.184  19.018  -1.624
  500    H    LYS  50           H        LYS  50  -9.306  14.838  -1.720
  501    HA   LYS  50           HA       LYS  50  -8.139  15.153  -4.294
  502   1HB   LYS  50          2HB       LYS  50  -7.362  14.798  -1.512
  503   2HB   LYS  50          1HB       LYS  50  -6.227  13.999  -2.600
  504   1HG   LYS  50          2HG       LYS  50  -7.123  16.726  -3.380
  505   2HG   LYS  50          1HG       LYS  50  -6.040  16.616  -1.993
  506   1HD   LYS  50          2HD       LYS  50  -5.419  15.113  -4.526
  507   2HD   LYS  50          1HD       LYS  50  -4.997  16.818  -4.378
  508   1HE   LYS  50          2HE       LYS  50  -3.446  16.424  -2.667
  509   2HE   LYS  50          1HE       LYS  50  -4.220  14.901  -2.186
  510   1HZ   LYS  50          1HZ       LYS  50  -2.983  15.322  -4.850
  511   2HZ   LYS  50          3HZ       LYS  50  -2.141  14.644  -3.544
  512   3HZ   LYS  50          2HZ       LYS  50  -3.510  13.857  -4.171
  513    QB   LYS  50           QB       LYS  50  -6.795  14.398  -2.056
  514    QD   LYS  50           QD       LYS  50  -5.208  15.966  -4.452
  515    QG   LYS  50           QG       LYS  50  -6.582  16.671  -2.687
  516    QE   LYS  50           QE       LYS  50  -3.833  15.663  -2.427
  517    QZ   LYS  50           QZ       LYS  50  -2.878  14.608  -4.188
  518    H    MET  51           H        MET  51  -8.687  12.224  -2.338
  519    HA   MET  51           HA       MET  51  -7.386  10.509  -4.360
  520   1HB   MET  51          2HB       MET  51  -8.833  10.024  -1.739
  521   2HB   MET  51          1HB       MET  51  -8.084   8.742  -2.690
  522   1HG   MET  51          2HG       MET  51  -6.587  11.189  -1.718
  523   2HG   MET  51          1HG       MET  51  -6.619   9.657  -0.846
  524   1HE   MET  51          3HE       MET  51  -4.852  11.820  -3.043
  525   2HE   MET  51          2HE       MET  51  -3.900  11.030  -1.788
  526   3HE   MET  51          1HE       MET  51  -3.466  10.812  -3.481
  527    QB   MET  51           QB       MET  51  -8.458   9.383  -2.214
  528    QG   MET  51           QG       MET  51  -6.603  10.423  -1.282
  529    ME   MET  51           QE       MET  51  -4.073  11.221  -2.771
  530    H    GLU  52           H        GLU  52  -8.601   8.716  -5.377
  531    HA   GLU  52           HA       GLU  52 -11.560   9.082  -5.486
  532   1HB   GLU  52          2HB       GLU  52 -11.405   9.064  -7.971
  533   2HB   GLU  52          1HB       GLU  52 -10.557  10.443  -7.272
  534   1HG   GLU  52          2HG       GLU  52  -8.860   8.065  -7.509
  535   2HG   GLU  52          1HG       GLU  52  -9.468   8.634  -9.064
  536    QB   GLU  52           QB       GLU  52 -10.981   9.753  -7.621
  537    QG   GLU  52           QG       GLU  52  -9.164   8.349  -8.287
  538    H    THR  53           H        THR  53 -10.987   6.998  -4.142
  539    HA   THR  53           HA       THR  53 -11.114   4.654  -4.012
  540    HB   THR  53           HB       THR  53 -11.833   4.952  -6.945
  541    HG1  THR  53           HG1      THR  53 -13.812   5.429  -6.273
  542   1HG2  THR  53          3HG2      THR  53 -11.354   2.648  -5.613
  543   2HG2  THR  53          2HG2      THR  53 -13.051   2.891  -5.203
  544   3HG2  THR  53          1HG2      THR  53 -12.557   2.789  -6.893
  545    MG   THR  53           QG2      THR  53 -12.321   2.776  -5.903
  546    H    GLU  54           H        GLU  54  -9.972   4.921  -7.395
  547    HA   GLU  54           HA       GLU  54  -8.038   2.874  -7.211
  548   1HB   GLU  54          2HB       GLU  54  -8.336   5.349  -8.921
  549   2HB   GLU  54          1HB       GLU  54  -7.072   4.156  -9.219
  550   1HG   GLU  54          2HG       GLU  54  -9.242   2.529  -8.975
  551   2HG   GLU  54          1HG       GLU  54  -9.989   3.965  -9.677
  552    QB   GLU  54           QB       GLU  54  -7.704   4.753  -9.070
  553    QG   GLU  54           QG       GLU  54  -9.616   3.247  -9.326
  554    H    ILE  55           H        ILE  55  -6.819   3.160  -5.226
  555    HA   ILE  55           HA       ILE  55  -5.208   5.619  -4.907
  556    HB   ILE  55           HB       ILE  55  -5.643   3.066  -3.331
  557   1HG1  ILE  55          2HG1      ILE  55  -7.438   4.748  -3.254
  558   2HG1  ILE  55          1HG1      ILE  55  -6.619   4.658  -1.695
  559   1HG2  ILE  55          1HG2      ILE  55  -3.643   5.281  -2.908
  560   2HG2  ILE  55          3HG2      ILE  55  -4.314   4.407  -1.531
  561   3HG2  ILE  55          2HG2      ILE  55  -3.406   3.539  -2.770
  562   1HD1  ILE  55          1HD1      ILE  55  -5.131   6.574  -2.566
  563   2HD1  ILE  55          3HD1      ILE  55  -6.343   6.775  -3.831
  564   3HD1  ILE  55          2HD1      ILE  55  -6.793   6.983  -2.139
  565    MG   ILE  55           QG2      ILE  55  -3.788   4.409  -2.403
  566    MD   ILE  55           QD1      ILE  55  -6.089   6.777  -2.845
  567    QG   ILE  55           QG1      ILE  55  -7.028   4.703  -2.475
  568    H    ASN  56           H        ASN  56  -3.582   5.634  -6.454
  569    HA   ASN  56           HA       ASN  56  -2.112   3.237  -7.236
  570   1HB   ASN  56          2HB       ASN  56  -1.681   6.204  -7.705
  571   2HB   ASN  56          1HB       ASN  56  -0.832   4.915  -8.560
  572   1HD2  ASN  56          1HD2      ASN  56  -3.643   6.869  -8.617
  573   2HD2  ASN  56          2HD2      ASN  56  -4.506   6.002  -9.793
  574    QB   ASN  56           QB       ASN  56  -1.256   5.560  -8.132
  575    QD   ASN  56           QD2      ASN  56  -4.075   6.436  -9.205
  576    H    ALA  57           H        ALA  57  -0.358   2.428  -6.185
  577    HA   ALA  57           HA       ALA  57   0.678   3.368  -3.740
  578   1HB   ALA  57          2HB       ALA  57   0.966   1.159  -5.160
  579   2HB   ALA  57          3HB       ALA  57   2.236   1.646  -4.037
  580   3HB   ALA  57          1HB       ALA  57   2.411   1.972  -5.761
  581    MB   ALA  57           QB       ALA  57   1.871   1.592  -4.986
  582    HA   PRO  58           HA       PRO  58   3.135   6.844  -4.906
  583   1HB   PRO  58          2HB       PRO  58   4.961   6.837  -2.865
  584   2HB   PRO  58          1HB       PRO  58   3.277   7.357  -2.653
  585   1HG   PRO  58          2HG       PRO  58   4.555   4.757  -1.963
  586   2HG   PRO  58          1HG       PRO  58   3.346   5.692  -1.069
  587   1HD   PRO  58          2HD       PRO  58   2.729   3.505  -2.564
  588   2HD   PRO  58          1HD       PRO  58   1.598   4.850  -2.289
  589    QB   PRO  58           QB       PRO  58   4.119   7.097  -2.759
  590    QG   PRO  58           QG       PRO  58   3.950   5.224  -1.516
  591    QD   PRO  58           QD       PRO  58   2.164   4.178  -2.427
  592    H    THR  59           H        THR  59   5.106   4.087  -3.714
  593    HA   THR  59           HA       THR  59   6.776   4.321  -6.184
  594    HB   THR  59           HB       THR  59   8.777   4.080  -4.686
  595    HG1  THR  59           HG1      THR  59   8.519   4.031  -2.562
  596   1HG2  THR  59          1HG2      THR  59   6.952   6.438  -4.146
  597   2HG2  THR  59          3HG2      THR  59   8.679   6.402  -3.792
  598   3HG2  THR  59          2HG2      THR  59   8.119   6.299  -5.461
  599    MG   THR  59           QG2      THR  59   7.917   6.379  -4.466
  600    H    ASP  60           H        ASP  60   7.898   2.318  -6.701
  601    HA   ASP  60           HA       ASP  60   6.415  -0.075  -6.224
  602   1HB   ASP  60          2HB       ASP  60   8.320  -1.112  -7.390
  603   2HB   ASP  60          1HB       ASP  60   7.900   0.418  -8.158
  604    QB   ASP  60           QB       ASP  60   8.110  -0.347  -7.774
  605    H    GLY  61           H        GLY  61   7.372  -2.070  -5.160
  606   1HA   GLY  61          1HA       GLY  61   8.404  -1.347  -2.489
  607   2HA   GLY  61          2HA       GLY  61   9.428  -2.415  -3.451
  608    QA   GLY  61           QA       GLY  61   8.916  -1.881  -2.970
  609    H    LYS  62           H        LYS  62   8.281  -3.242  -0.996
  610    HA   LYS  62           HA       LYS  62   6.084  -5.090  -1.853
  611   1HB   LYS  62          2HB       LYS  62   8.523  -5.992  -1.870
  612   2HB   LYS  62          1HB       LYS  62   8.404  -5.930  -0.111
  613   1HG   LYS  62          2HG       LYS  62   6.336  -7.327  -0.242
  614   2HG   LYS  62          1HG       LYS  62   6.581  -7.468  -1.984
  615   1HD   LYS  62          2HD       LYS  62   9.002  -8.262  -1.248
  616   2HD   LYS  62          1HD       LYS  62   8.171  -8.663   0.256
  617   1HE   LYS  62          2HE       LYS  62   6.705  -9.517  -2.156
  618   2HE   LYS  62          1HE       LYS  62   8.271 -10.325  -1.936
  619   1HZ   LYS  62          3HZ       LYS  62   6.392  -9.932   0.315
  620   2HZ   LYS  62          2HZ       LYS  62   6.293 -11.299  -0.690
  621   3HZ   LYS  62          1HZ       LYS  62   7.703 -11.003   0.213
  622    QB   LYS  62           QB       LYS  62   8.463  -5.961  -0.990
  623    QD   LYS  62           QD       LYS  62   8.587  -8.462  -0.496
  624    QG   LYS  62           QG       LYS  62   6.459  -7.398  -1.113
  625    QE   LYS  62           QE       LYS  62   7.488  -9.921  -2.046
  626    QZ   LYS  62           QZ       LYS  62   6.796 -10.745  -0.054
  627    H    VAL  63           H        VAL  63   4.573  -5.522  -0.205
  628    HA   VAL  63           HA       VAL  63   4.540  -3.680   2.058
  629    HB   VAL  63           HB       VAL  63   2.791  -5.911   1.003
  630   1HG1  VAL  63          3HG1      VAL  63   2.868  -3.663  -0.117
  631   2HG1  VAL  63          2HG1      VAL  63   1.275  -4.084   0.511
  632   3HG1  VAL  63          1HG1      VAL  63   2.296  -2.949   1.391
  633   1HG2  VAL  63          2HG2      VAL  63   2.357  -4.238   3.500
  634   2HG2  VAL  63          1HG2      VAL  63   1.115  -5.228   2.732
  635   3HG2  VAL  63          3HG2      VAL  63   2.542  -5.990   3.434
  636    MG1  VAL  63           QG1      VAL  63   2.146  -3.565   0.595
  637    MG2  VAL  63           QG2      VAL  63   2.004  -5.152   3.222
  638    QG   VAL  63           QQG      VAL  63   2.075  -4.359   1.909
  639    H    GLU  64           H        GLU  64   5.166  -4.109   4.129
  640    HA   GLU  64           HA       GLU  64   6.187  -6.851   4.749
  641   1HB   GLU  64          2HB       GLU  64   6.692  -4.117   5.973
  642   2HB   GLU  64          1HB       GLU  64   7.470  -5.612   6.494
  643   1HG   GLU  64          2HG       GLU  64   7.880  -5.631   3.757
  644   2HG   GLU  64          1HG       GLU  64   8.050  -3.923   4.168
  645    QB   GLU  64           QB       GLU  64   7.081  -4.864   6.233
  646    QG   GLU  64           QG       GLU  64   7.965  -4.777   3.963
  647    H    LYS  65           H        LYS  65   3.602  -4.688   5.399
  648    HA   LYS  65           HA       LYS  65   2.252  -6.476   7.183
  649   1HB   LYS  65          2HB       LYS  65   4.316  -4.826   8.318
  650   2HB   LYS  65          1HB       LYS  65   2.757  -4.293   8.951
  651   1HG   LYS  65          2HG       LYS  65   2.277  -6.384   9.895
  652   2HG   LYS  65          1HG       LYS  65   3.411  -7.228   8.839
  653   1HD   LYS  65          2HD       LYS  65   5.022  -5.417  10.199
  654   2HD   LYS  65          1HD       LYS  65   3.884  -5.961  11.432
  655   1HE   LYS  65          2HE       LYS  65   4.829  -8.029  11.521
  656   2HE   LYS  65          1HE       LYS  65   4.882  -8.159   9.751
  657   1HZ   LYS  65          1HZ       LYS  65   6.734  -6.534   9.792
  658   2HZ   LYS  65          3HZ       LYS  65   6.752  -6.633  11.485
  659   3HZ   LYS  65          2HZ       LYS  65   7.119  -8.005  10.551
  660    QB   LYS  65           QB       LYS  65   3.537  -4.560   8.634
  661    QD   LYS  65           QD       LYS  65   4.453  -5.689  10.816
  662    QG   LYS  65           QG       LYS  65   2.844  -6.806   9.367
  663    QE   LYS  65           QE       LYS  65   4.856  -8.094  10.636
  664    QZ   LYS  65           QZ       LYS  65   6.869  -7.057  10.609
  665    H    VAL  66           H        VAL  66   0.094  -5.826   7.268
  666    HA   VAL  66           HA       VAL  66  -0.635  -3.347   5.850
  667    HB   VAL  66           HB       VAL  66  -2.912  -4.320   6.087
  668   1HG1  VAL  66          2HG1      VAL  66  -0.584  -5.725   4.946
  669   2HG1  VAL  66          1HG1      VAL  66  -1.998  -6.750   5.193
  670   3HG1  VAL  66          3HG1      VAL  66  -2.122  -5.303   4.193
  671   1HG2  VAL  66          1HG2      VAL  66  -1.684  -5.627   8.297
  672   2HG2  VAL  66          3HG2      VAL  66  -3.364  -5.735   7.775
  673   3HG2  VAL  66          2HG2      VAL  66  -2.173  -6.880   7.156
  674    MG1  VAL  66           QG1      VAL  66  -1.568  -5.926   4.777
  675    MG2  VAL  66           QG2      VAL  66  -2.407  -6.081   7.743
  676    QG   VAL  66           QQG      VAL  66  -1.988  -6.003   6.260
  677    H    LEU  67           H        LEU  67  -2.189  -1.812   6.814
  678    HA   LEU  67           HA       LEU  67  -2.006  -1.660   9.807
  679   1HB   LEU  67          2HB       LEU  67  -0.774  -0.039   7.944
  680   2HB   LEU  67          1HB       LEU  67  -2.256   0.852   8.284
  681    HG   LEU  67           HG       LEU  67  -0.578   1.605   9.843
  682   1HD1  LEU  67          2HD1      LEU  67   0.922  -0.347   9.643
  683   2HD1  LEU  67          1HD1      LEU  67   0.607   0.056  11.331
  684   3HD1  LEU  67          3HD1      LEU  67  -0.218  -1.312  10.582
  685   1HD2  LEU  67          2HD2      LEU  67  -2.967   1.023  10.659
  686   2HD2  LEU  67          1HD2      LEU  67  -2.208  -0.359  11.448
  687   3HD2  LEU  67          3HD2      LEU  67  -1.722   1.280  11.882
  688    MD1  LEU  67           QD1      LEU  67   0.437  -0.534  10.518
  689    MD2  LEU  67           QD2      LEU  67  -2.299   0.648  11.330
  690    QB   LEU  67           QB       LEU  67  -1.515   0.406   8.114
  691    QD   LEU  67           QQD      LEU  67  -0.931   0.057  10.924
  692    H    VAL  68           H        VAL  68  -3.706   0.115   7.208
  693    HA   VAL  68           HA       VAL  68  -6.101   0.561   8.696
  694    HB   VAL  68           HB       VAL  68  -5.326   1.804   6.688
  695   1HG1  VAL  68          1HG1      VAL  68  -4.557  -0.336   5.518
  696   2HG1  VAL  68          3HG1      VAL  68  -6.247  -0.598   5.093
  697   3HG1  VAL  68          2HG1      VAL  68  -5.401   0.831   4.502
  698   1HG2  VAL  68          2HG2      VAL  68  -7.757   1.733   7.380
  699   2HG2  VAL  68          1HG2      VAL  68  -7.498   2.080   5.670
  700   3HG2  VAL  68          3HG2      VAL  68  -7.996   0.467   6.177
  701    MG1  VAL  68           QG1      VAL  68  -5.402  -0.034   5.038
  702    MG2  VAL  68           QG2      VAL  68  -7.750   1.427   6.409
  703    QG   VAL  68           QQG      VAL  68  -6.576   0.696   5.724
  704    H    LYS  69           H        LYS  69  -8.292  -0.353   7.961
  705    HA   LYS  69           HA       LYS  69  -8.043  -3.307   7.491
  706   1HB   LYS  69          2HB       LYS  69  -9.829  -1.581   9.202
  707   2HB   LYS  69          1HB       LYS  69 -10.324  -3.214   8.753
  708   1HG   LYS  69          2HG       LYS  69  -7.583  -3.263   9.627
  709   2HG   LYS  69          1HG       LYS  69  -8.571  -2.460  10.849
  710   1HD   LYS  69          2HD       LYS  69  -9.467  -5.050   9.590
  711   2HD   LYS  69          1HD       LYS  69  -8.365  -5.043  10.969
  712   1HE   LYS  69          2HE       LYS  69  -9.997  -4.359  12.431
  713   2HE   LYS  69          1HE       LYS  69 -10.773  -3.312  11.226
  714   1HZ   LYS  69          1HZ       LYS  69 -10.771  -6.255  10.948
  715   2HZ   LYS  69          3HZ       LYS  69 -11.977  -5.459  11.836
  716   3HZ   LYS  69          2HZ       LYS  69 -11.779  -5.123  10.183
  717    QB   LYS  69           QB       LYS  69 -10.076  -2.397   8.977
  718    QD   LYS  69           QD       LYS  69  -8.916  -5.046  10.279
  719    QG   LYS  69           QG       LYS  69  -8.077  -2.862  10.238
  720    QE   LYS  69           QE       LYS  69 -10.385  -3.835  11.829
  721    QZ   LYS  69           QZ       LYS  69 -11.509  -5.612  10.989
  722    H    GLU  70           H        GLU  70  -9.241  -4.152   5.805
  723    HA   GLU  70           HA       GLU  70 -10.238  -2.586   3.689
  724   1HB   GLU  70          2HB       GLU  70  -9.814  -5.236   4.265
  725   2HB   GLU  70          1HB       GLU  70 -11.574  -5.178   4.174
  726   1HG   GLU  70          2HG       GLU  70 -11.472  -4.185   1.954
  727   2HG   GLU  70          1HG       GLU  70  -9.713  -4.083   2.045
  728    QB   GLU  70           QB       GLU  70 -10.694  -5.207   4.219
  729    QG   GLU  70           QG       GLU  70 -10.593  -4.134   1.999
  730    H    ARG  71           H        ARG  71 -12.179  -1.517   3.354
  731    HA   ARG  71           HA       ARG  71 -14.339  -0.675   3.814
  732   1HB   ARG  71          2HB       ARG  71 -14.300  -3.521   3.972
  733   2HB   ARG  71          1HB       ARG  71 -15.364  -2.941   5.251
  734   1HG   ARG  71          2HG       ARG  71 -16.697  -1.688   3.681
  735   2HG   ARG  71          1HG       ARG  71 -15.543  -1.990   2.381
  736   1HD   ARG  71          2HD       ARG  71 -16.093  -4.327   2.308
  737   2HD   ARG  71          1HD       ARG  71 -17.017  -4.219   3.819
  738    HE   ARG  71           HE       ARG  71 -18.123  -2.317   2.045
  739   1HH1  ARG  71          1HH1      ARG  71 -18.680  -3.388  -0.193
  740   2HH1  ARG  71          2HH1      ARG  71 -19.661  -4.803  -0.004
  741   1HH2  ARG  71          1HH2      ARG  71 -18.966  -5.155   3.376
  742   2HH2  ARG  71          2HH2      ARG  71 -19.824  -5.803   2.018
  743    QB   ARG  71           QB       ARG  71 -14.832  -3.231   4.611
  744    QG   ARG  71           QG       ARG  71 -16.120  -1.839   3.031
  745    QD   ARG  71           QD       ARG  71 -16.555  -4.273   3.064
  746    QH1  ARG  71           QH1      ARG  71 -19.171  -4.096  -0.098
  747    QH2  ARG  71           QH2      ARG  71 -19.395  -5.479   2.697
  748    H    ASP  72           H        ASP  72 -12.505   0.236   5.653
  749    HA   ASP  72           HA       ASP  72 -13.702  -0.235   8.348
  750   1HB   ASP  72          2HB       ASP  72 -11.249  -0.487   7.971
  751   2HB   ASP  72          1HB       ASP  72 -11.176   1.203   7.470
  752    QB   ASP  72           QB       ASP  72 -11.213   0.358   7.720
  753    H    ALA  73           H        ALA  73 -13.283   2.182   5.843
  754    HA   ALA  73           HA       ALA  73 -14.218   4.337   5.597
  755   1HB   ALA  73          1HB       ALA  73 -16.019   2.703   7.024
  756   2HB   ALA  73          3HB       ALA  73 -15.987   4.235   7.897
  757   3HB   ALA  73          2HB       ALA  73 -16.399   4.206   6.182
  758    MB   ALA  73           QB       ALA  73 -16.135   3.715   7.034
  759    H    VAL  74           H        VAL  74 -13.716   6.385   6.363
  760    HA   VAL  74           HA       VAL  74 -12.312   7.878   7.572
  761    HB   VAL  74           HB       VAL  74 -13.418   8.256   9.834
  762   1HG1  VAL  74          2HG1      VAL  74 -14.716   8.245   7.161
  763   2HG1  VAL  74          1HG1      VAL  74 -15.775   8.500   8.548
  764   3HG1  VAL  74          3HG1      VAL  74 -14.417   9.589   8.264
  765   1HG2  VAL  74          2HG2      VAL  74 -14.063   5.833  10.146
  766   2HG2  VAL  74          1HG2      VAL  74 -15.385   6.973  10.388
  767   3HG2  VAL  74          3HG2      VAL  74 -15.274   6.058   8.885
  768    MG1  VAL  74           QG1      VAL  74 -14.969   8.778   7.991
  769    MG2  VAL  74           QG2      VAL  74 -14.907   6.288   9.806
  770    QG   VAL  74           QQG      VAL  74 -14.938   7.533   8.899
  771    H    GLN  75           H        GLN  75 -10.258   6.790   7.652
  772    HA   GLN  75           HA       GLN  75  -9.665   5.566  10.326
  773   1HB   GLN  75          2HB       GLN  75  -9.371   4.549   7.578
  774   2HB   GLN  75          1HB       GLN  75  -7.907   4.391   8.549
  775   1HG   GLN  75          2HG       GLN  75 -10.211   3.664  10.128
  776   2HG   GLN  75          1HG       GLN  75 -10.191   2.732   8.630
  777   1HE2  GLN  75          1HE2      GLN  75  -7.477   3.950  10.675
  778   2HE2  GLN  75          2HE2      GLN  75  -6.772   2.423  10.903
  779    QB   GLN  75           QB       GLN  75  -8.639   4.470   8.063
  780    QG   GLN  75           QG       GLN  75 -10.201   3.198   9.379
  781    QE   GLN  75           QE2      GLN  75  -7.124   3.186  10.789
  782    H    GLY  76           H        GLY  76  -9.143   8.115  10.372
  783   1HA   GLY  76          1HA       GLY  76  -7.500   9.842   9.812
  784   2HA   GLY  76          2HA       GLY  76  -6.388   8.563   9.320
  785    QA   GLY  76           QA       GLY  76  -6.944   9.203   9.566
  786    H    GLY  77           H        GLY  77  -4.781   9.456  10.789
  787   1HA   GLY  77          1HA       GLY  77  -5.431   9.226  13.683
  788   2HA   GLY  77          2HA       GLY  77  -4.025  10.059  13.018
  789    QA   GLY  77           QA       GLY  77  -4.728   9.642  13.351
  790    H    GLN  78           H        GLN  78  -4.789   6.982  11.639
  791    HA   GLN  78           HA       GLN  78  -2.624   5.711  13.282
  792   1HB   GLN  78          2HB       GLN  78  -5.208   4.999  13.194
  793   2HB   GLN  78          1HB       GLN  78  -4.653   4.125  11.766
  794   1HG   GLN  78          2HG       GLN  78  -3.370   2.674  12.985
  795   2HG   GLN  78          1HG       GLN  78  -2.940   3.896  14.181
  796   1HE2  GLN  78          1HE2      GLN  78  -4.709   1.084  13.843
  797   2HE2  GLN  78          2HE2      GLN  78  -5.840   1.320  15.087
  798    QB   GLN  78           QB       GLN  78  -4.931   4.562  12.480
  799    QG   GLN  78           QG       GLN  78  -3.155   3.285  13.583
  800    QE   GLN  78           QE2      GLN  78  -5.275   1.202  14.465
  801    H    GLY  79           H        GLY  79  -1.345   4.054  12.054
  802   1HA   GLY  79          1HA       GLY  79  -0.047   3.420  10.207
  803   2HA   GLY  79          2HA       GLY  79  -0.281   5.067   9.628
  804    QA   GLY  79           QA       GLY  79  -0.164   4.244   9.917
  805    H    LEU  80           H        LEU  80  -0.253   3.556   7.561
  806    HA   LEU  80           HA       LEU  80  -3.088   2.767   6.962
  807   1HB   LEU  80          2HB       LEU  80  -0.992   4.193   5.294
  808   2HB   LEU  80          1HB       LEU  80  -2.528   3.616   4.647
  809    HG   LEU  80           HG       LEU  80  -2.392   5.446   7.047
  810   1HD1  LEU  80          3HD1      LEU  80  -1.803   6.054   4.273
  811   2HD1  LEU  80          2HD1      LEU  80  -3.248   6.914   4.805
  812   3HD1  LEU  80          1HD1      LEU  80  -1.730   7.113   5.682
  813   1HD2  LEU  80          2HD2      LEU  80  -4.508   4.477   5.136
  814   2HD2  LEU  80          1HD2      LEU  80  -4.531   4.486   6.900
  815   3HD2  LEU  80          3HD2      LEU  80  -4.723   5.995   6.007
  816    MD1  LEU  80           QD1      LEU  80  -2.260   6.694   4.920
  817    MD2  LEU  80           QD2      LEU  80  -4.587   4.986   6.015
  818    QB   LEU  80           QB       LEU  80  -1.760   3.905   4.971
  819    QD   LEU  80           QQD      LEU  80  -3.424   5.840   5.467
  820    H    ILE  81           H        ILE  81   0.344   2.244   6.112
  821    HA   ILE  81           HA       ILE  81   0.059  -0.624   5.996
  822    HB   ILE  81           HB       ILE  81  -1.251  -0.064   4.009
  823   1HG1  ILE  81          2HG1      ILE  81   1.530  -1.022   3.248
  824   2HG1  ILE  81          1HG1      ILE  81   0.240  -2.043   3.887
  825   1HG2  ILE  81          3HG2      ILE  81   0.675   2.024   3.789
  826   2HG2  ILE  81          2HG2      ILE  81   0.791   1.045   2.327
  827   3HG2  ILE  81          1HG2      ILE  81  -0.753   1.760   2.789
  828   1HD1  ILE  81          2HD1      ILE  81  -0.775  -0.507   1.675
  829   2HD1  ILE  81          1HD1      ILE  81   0.699  -1.339   1.180
  830   3HD1  ILE  81          3HD1      ILE  81  -0.655  -2.259   1.835
  831    MG   ILE  81           QG2      ILE  81   0.238   1.610   2.968
  832    MD   ILE  81           QD1      ILE  81  -0.244  -1.368   1.563
  833    QG   ILE  81           QG1      ILE  81   0.885  -1.533   3.568
  834    H    LYS  82           H        LYS  82   2.122  -1.577   5.896
  835    HA   LYS  82           HA       LYS  82   4.414   0.323   5.811
  836   1HB   LYS  82          2HB       LYS  82   4.149  -1.130   7.764
  837   2HB   LYS  82          1HB       LYS  82   4.099  -2.555   6.725
  838   1HG   LYS  82          2HG       LYS  82   6.398  -2.013   5.927
  839   2HG   LYS  82          1HG       LYS  82   6.446  -0.664   7.063
  840   1HD   LYS  82          2HD       LYS  82   5.649  -3.248   8.252
  841   2HD   LYS  82          1HD       LYS  82   7.307  -3.192   7.653
  842   1HE   LYS  82          2HE       LYS  82   7.927  -1.490   9.138
  843   2HE   LYS  82          1HE       LYS  82   6.256  -0.923   9.339
  844   1HZ   LYS  82          3HZ       LYS  82   5.804  -3.219  10.271
  845   2HZ   LYS  82          2HZ       LYS  82   7.489  -3.403  10.391
  846   3HZ   LYS  82          1HZ       LYS  82   6.702  -2.172  11.259
  847    QB   LYS  82           QB       LYS  82   4.124  -1.842   7.245
  848    QD   LYS  82           QD       LYS  82   6.478  -3.220   7.953
  849    QG   LYS  82           QG       LYS  82   6.422  -1.338   6.495
  850    QE   LYS  82           QE       LYS  82   7.091  -1.206   9.238
  851    QZ   LYS  82           QZ       LYS  82   6.665  -2.932  10.640
  852    H    ILE  83           H        ILE  83   5.687   0.386   4.010
  853    HA   ILE  83           HA       ILE  83   5.715  -2.014   2.209
  854    HB   ILE  83           HB       ILE  83   5.904  -0.271   0.359
  855   1HG1  ILE  83          2HG1      ILE  83   4.627   1.765   2.064
  856   2HG1  ILE  83          1HG1      ILE  83   6.321   1.477   2.452
  857   1HG2  ILE  83          2HG2      ILE  83   3.699  -1.355   1.616
  858   2HG2  ILE  83          1HG2      ILE  83   3.328   0.369   1.617
  859   3HG2  ILE  83          3HG2      ILE  83   3.662  -0.460   0.098
  860   1HD1  ILE  83          2HD1      ILE  83   5.481   1.813  -0.414
  861   2HD1  ILE  83          1HD1      ILE  83   5.722   3.232   0.604
  862   3HD1  ILE  83          3HD1      ILE  83   7.055   2.113   0.323
  863    MG   ILE  83           QG2      ILE  83   3.563  -0.482   1.110
  864    MD   ILE  83           QD1      ILE  83   6.086   2.386   0.171
  865    QG   ILE  83           QG1      ILE  83   5.474   1.621   2.258
  866    H    GLY  84           H        GLY  84   7.763  -2.842   2.363
  867   1HA   GLY  84          1HA       GLY  84  10.041  -0.912   2.239
  868   2HA   GLY  84          2HA       GLY  84  10.101  -2.560   1.610
  869    QA   GLY  84           QA       GLY  84  10.071  -1.736   1.924

  No H/Q in entry =         869
  Start of MODEL    6
    1    H1   MET   1          3H        MET   1 -26.190  -1.280  28.190
    2    H2   MET   1          2H        MET   1 -27.710  -0.554  27.967
    3    H3   MET   1          1H        MET   1 -27.208  -1.812  26.942
    4    HA   MET   1           HA       MET   1 -25.659  -0.478  25.832
    5   1HB   MET   1          2HB       MET   1 -28.284   0.789  26.563
    6   2HB   MET   1          1HB       MET   1 -27.170   1.663  25.511
    7   1HG   MET   1          2HG       MET   1 -27.468   0.215  23.769
    8   2HG   MET   1          1HG       MET   1 -27.599  -1.189  24.828
    9   1HE   MET   1          1HE       MET   1 -28.964   1.210  22.677
   10   2HE   MET   1          3HE       MET   1 -29.736  -0.289  22.144
   11   3HE   MET   1          2HE       MET   1 -30.720   1.063  22.697
   12    QB   MET   1           QB       MET   1 -27.727   1.226  26.037
   13    QG   MET   1           QG       MET   1 -27.533  -0.487  24.299
   14    ME   MET   1           QE       MET   1 -29.807   0.661  22.506
   15    H    LYS   2           H        LYS   2 -26.681   0.893  28.921
   16    HA   LYS   2           HA       LYS   2 -24.995   3.239  28.839
   17   1HB   LYS   2          2HB       LYS   2 -27.063   2.601  30.289
   18   2HB   LYS   2          1HB       LYS   2 -25.894   1.773  31.318
   19   1HG   LYS   2          2HG       LYS   2 -25.155   3.716  32.194
   20   2HG   LYS   2          1HG       LYS   2 -24.988   4.447  30.597
   21   1HD   LYS   2          2HD       LYS   2 -26.725   5.761  31.236
   22   2HD   LYS   2          1HD       LYS   2 -27.720   4.348  30.884
   23   1HE   LYS   2          2HE       LYS   2 -27.922   3.761  33.140
   24   2HE   LYS   2          1HE       LYS   2 -26.434   4.614  33.596
   25   1HZ   LYS   2          2HZ       LYS   2 -28.729   6.066  32.433
   26   2HZ   LYS   2          1HZ       LYS   2 -28.657   5.753  34.101
   27   3HZ   LYS   2          3HZ       LYS   2 -27.444   6.678  33.360
   28    QB   LYS   2           QB       LYS   2 -26.479   2.187  30.804
   29    QD   LYS   2           QD       LYS   2 -27.222   5.054  31.060
   30    QG   LYS   2           QG       LYS   2 -25.071   4.081  31.395
   31    QE   LYS   2           QE       LYS   2 -27.178   4.187  33.368
   32    QZ   LYS   2           QZ       LYS   2 -28.277   6.166  33.298
   33    H    LEU   3           H        LEU   3 -23.167   1.573  27.941
   34    HA   LEU   3           HA       LEU   3 -21.237   1.303  30.155
   35   1HB   LEU   3          2HB       LEU   3 -22.854  -0.774  29.852
   36   2HB   LEU   3          1HB       LEU   3 -21.777  -1.147  28.505
   37    HG   LEU   3           HG       LEU   3 -20.105  -0.433  30.669
   38   1HD1  LEU   3          2HD1      LEU   3 -19.975  -2.198  28.732
   39   2HD1  LEU   3          1HD1      LEU   3 -19.157  -2.533  30.258
   40   3HD1  LEU   3          3HD1      LEU   3 -20.719  -3.278  29.911
   41   1HD2  LEU   3          3HD2      LEU   3 -22.431  -2.198  31.447
   42   2HD2  LEU   3          2HD2      LEU   3 -20.875  -2.293  32.273
   43   3HD2  LEU   3          1HD2      LEU   3 -21.797  -0.790  32.300
   44    MD1  LEU   3           QD1      LEU   3 -19.950  -2.670  29.634
   45    MD2  LEU   3           QD2      LEU   3 -21.701  -1.760  32.007
   46    QB   LEU   3           QB       LEU   3 -22.316  -0.960  29.178
   47    QD   LEU   3           QQD      LEU   3 -20.826  -2.215  30.820
   48    H    LYS   4           H        LYS   4 -19.089   0.411  29.190
   49    HA   LYS   4           HA       LYS   4 -18.804   1.364  26.355
   50   1HB   LYS   4          2HB       LYS   4 -17.658   2.260  28.813
   51   2HB   LYS   4          1HB       LYS   4 -16.365   1.539  27.853
   52   1HG   LYS   4          2HG       LYS   4 -16.533   3.114  26.188
   53   2HG   LYS   4          1HG       LYS   4 -18.268   3.328  26.422
   54   1HD   LYS   4          2HD       LYS   4 -17.133   5.345  27.164
   55   2HD   LYS   4          1HD       LYS   4 -17.778   4.510  28.577
   56   1HE   LYS   4          2HE       LYS   4 -15.523   3.455  28.922
   57   2HE   LYS   4          1HE       LYS   4 -14.902   4.464  27.601
   58   1HZ   LYS   4          3HZ       LYS   4 -16.427   5.613  29.861
   59   2HZ   LYS   4          2HZ       LYS   4 -14.740   5.423  29.934
   60   3HZ   LYS   4          1HZ       LYS   4 -15.435   6.418  28.745
   61    QB   LYS   4           QB       LYS   4 -17.011   1.899  28.333
   62    QD   LYS   4           QD       LYS   4 -17.456   4.927  27.870
   63    QG   LYS   4           QG       LYS   4 -17.400   3.221  26.305
   64    QE   LYS   4           QE       LYS   4 -15.213   3.959  28.262
   65    QZ   LYS   4           QZ       LYS   4 -15.534   5.818  29.513
   66    H    VAL   5           H        VAL   5 -16.711   0.412  25.353
   67    HA   VAL   5           HA       VAL   5 -16.465  -2.468  26.167
   68    HB   VAL   5           HB       VAL   5 -16.216  -1.078  23.480
   69   1HG1  VAL   5          3HG1      VAL   5 -18.442  -2.160  24.960
   70   2HG1  VAL   5          2HG1      VAL   5 -18.446  -1.369  23.383
   71   3HG1  VAL   5          1HG1      VAL   5 -18.187  -3.111  23.496
   72   1HG2  VAL   5          3HG2      VAL   5 -14.996  -3.447  24.316
   73   2HG2  VAL   5          2HG2      VAL   5 -16.449  -3.986  23.475
   74   3HG2  VAL   5          1HG2      VAL   5 -15.280  -2.957  22.645
   75    MG1  VAL   5           QG1      VAL   5 -18.358  -2.213  23.946
   76    MG2  VAL   5           QG2      VAL   5 -15.575  -3.463  23.479
   77    QG   VAL   5           QQG      VAL   5 -16.967  -2.838  23.712
   78    H    THR   6           H        THR   6 -14.693  -1.761  27.645
   79    HA   THR   6           HA       THR   6 -12.455  -1.173  28.173
   80    HB   THR   6           HB       THR   6 -12.525  -3.542  27.361
   81    HG1  THR   6           HG1      THR   6 -10.577  -2.403  28.087
   82   1HG2  THR   6          2HG2      THR   6 -11.772  -2.205  24.756
   83   2HG2  THR   6          1HG2      THR   6 -11.477  -3.914  25.074
   84   3HG2  THR   6          3HG2      THR   6 -13.127  -3.292  25.060
   85    MG   THR   6           QG2      THR   6 -12.125  -3.137  24.963
   86    H    VAL   7           H        VAL   7 -13.722   0.720  26.233
   87    HA   VAL   7           HA       VAL   7 -13.070   2.457  24.762
   88    HB   VAL   7           HB       VAL   7 -10.436   1.924  26.175
   89   1HG1  VAL   7          1HG1      VAL   7 -13.013   2.678  27.217
   90   2HG1  VAL   7          3HG1      VAL   7 -11.495   2.460  28.089
   91   3HG1  VAL   7          2HG1      VAL   7 -11.895   4.031  27.393
   92   1HG2  VAL   7          2HG2      VAL   7 -11.375   3.956  24.326
   93   2HG2  VAL   7          1HG2      VAL   7 -10.921   4.674  25.873
   94   3HG2  VAL   7          3HG2      VAL   7  -9.752   3.706  24.973
   95    MG1  VAL   7           QG1      VAL   7 -12.134   3.056  27.567
   96    MG2  VAL   7           QG2      VAL   7 -10.683   4.112  25.057
   97    QG   VAL   7           QQG      VAL   7 -11.408   3.584  26.312
   98    H    ASN   8           H        ASN   8 -13.214   0.349  23.184
   99    HA   ASN   8           HA       ASN   8 -10.602  -0.340  21.990
  100   1HB   ASN   8          2HB       ASN   8 -13.347  -1.327  22.067
  101   2HB   ASN   8          1HB       ASN   8 -12.690  -1.354  20.431
  102   1HD2  ASN   8          1HD2      ASN   8  -9.995  -1.934  20.874
  103   2HD2  ASN   8          2HD2      ASN   8  -9.844  -3.449  21.624
  104    QB   ASN   8           QB       ASN   8 -13.019  -1.341  21.249
  105    QD   ASN   8           QD2      ASN   8  -9.920  -2.692  21.249
  106    H    GLY   9           H        GLY   9 -11.006  -0.434  19.338
  107   1HA   GLY   9          1HA       GLY   9 -12.142   2.141  18.420
  108   2HA   GLY   9          2HA       GLY   9 -11.597   0.826  17.378
  109    QA   GLY   9           QA       GLY   9 -11.869   1.484  17.899
  110    H    ALA  10           H        ALA  10 -10.883   3.837  17.694
  111    HA   ALA  10           HA       ALA  10  -8.930   5.120  17.330
  112   1HB   ALA  10          2HB       ALA  10  -7.645   5.048  19.219
  113   2HB   ALA  10          1HB       ALA  10  -8.848   3.882  19.768
  114   3HB   ALA  10          3HB       ALA  10  -7.338   3.319  19.055
  115    MB   ALA  10           QB       ALA  10  -7.943   4.083  19.347
  116    H    GLY  11           H        GLY  11  -6.356   4.660  16.934
  117   1HA   GLY  11          1HA       GLY  11  -5.701   3.808  14.545
  118   2HA   GLY  11          2HA       GLY  11  -6.081   2.228  15.232
  119    QA   GLY  11           QA       GLY  11  -5.891   3.018  14.889
  120    H    LYS  12           H        LYS  12  -3.680   1.963  14.596
  121    HA   LYS  12           HA       LYS  12  -1.785   3.215  16.506
  122   1HB   LYS  12          2HB       LYS  12  -3.031   1.080  17.399
  123   2HB   LYS  12          1HB       LYS  12  -1.929   0.216  16.326
  124   1HG   LYS  12          2HG       LYS  12  -0.067   1.635  17.449
  125   2HG   LYS  12          1HG       LYS  12  -1.265   1.937  18.708
  126   1HD   LYS  12          2HD       LYS  12  -1.590  -0.637  18.720
  127   2HD   LYS  12          1HD       LYS  12  -0.048  -0.688  17.866
  128   1HE   LYS  12          2HE       LYS  12  -0.436   0.785  20.493
  129   2HE   LYS  12          1HE       LYS  12   0.181  -0.875  20.380
  130   1HZ   LYS  12          3HZ       LYS  12   1.314   1.418  18.872
  131   2HZ   LYS  12          2HZ       LYS  12   1.950   0.853  20.343
  132   3HZ   LYS  12          1HZ       LYS  12   1.947  -0.152  18.973
  133    QB   LYS  12           QB       LYS  12  -2.480   0.648  16.862
  134    QD   LYS  12           QD       LYS  12  -0.819  -0.663  18.293
  135    QG   LYS  12           QG       LYS  12  -0.666   1.786  18.079
  136    QE   LYS  12           QE       LYS  12  -0.128  -0.045  20.436
  137    QZ   LYS  12           QZ       LYS  12   1.737   0.706  19.396
  138    H    ALA  13           H        ALA  13   0.309   3.265  15.660
  139    HA   ALA  13           HA       ALA  13   0.690   1.945  12.993
  140   1HB   ALA  13          2HB       ALA  13   2.266   4.304  13.984
  141   2HB   ALA  13          3HB       ALA  13   0.611   4.550  13.424
  142   3HB   ALA  13          1HB       ALA  13   1.823   3.881  12.331
  143    MB   ALA  13           QB       ALA  13   1.567   4.245  13.246
  144    H    GLY  14           H        GLY  14   3.100   1.508  12.549
  145   1HA   GLY  14          1HA       GLY  14   4.483  -0.344  13.567
  146   2HA   GLY  14          2HA       GLY  14   4.437   0.589  15.064
  147    QA   GLY  14           QA       GLY  14   4.460   0.123  14.316
  148    H    GLU  15           H        GLU  15   6.464  -0.187  12.657
  149    HA   GLU  15           HA       GLU  15   7.774   2.512  12.594
  150   1HB   GLU  15          2HB       GLU  15   8.621   0.641  14.220
  151   2HB   GLU  15          1HB       GLU  15   9.278  -0.094  12.757
  152   1HG   GLU  15          2HG       GLU  15  11.067   1.256  13.069
  153   2HG   GLU  15          1HG       GLU  15  10.024   2.564  12.509
  154    QB   GLU  15           QB       GLU  15   8.949   0.273  13.488
  155    QG   GLU  15           QG       GLU  15  10.545   1.910  12.789
  156    H    GLY  16           H        GLY  16   7.210   2.925  10.409
  157   1HA   GLY  16          1HA       GLY  16   8.504   1.106   8.429
  158   2HA   GLY  16          2HA       GLY  16   8.213   2.826   8.167
  159    QA   GLY  16           QA       GLY  16   8.358   1.966   8.298
  160    H    GLU  17           H        GLU  17   5.569   3.062   8.949
  161    HA   GLU  17           HA       GLU  17   4.146   1.186   7.093
  162   1HB   GLU  17          2HB       GLU  17   2.137   1.909   8.598
  163   2HB   GLU  17          1HB       GLU  17   3.298   0.758   9.246
  164   1HG   GLU  17          2HG       GLU  17   2.763   2.510  10.902
  165   2HG   GLU  17          1HG       GLU  17   4.458   2.587  10.433
  166    QB   GLU  17           QB       GLU  17   2.717   1.333   8.922
  167    QG   GLU  17           QG       GLU  17   3.610   2.548  10.668
  168    H    ILE  18           H        ILE  18   1.994   2.303   6.294
  169    HA   ILE  18           HA       ILE  18   2.748   5.035   5.325
  170    HB   ILE  18           HB       ILE  18   0.655   3.156   4.199
  171   1HG1  ILE  18          2HG1      ILE  18   2.713   1.879   4.178
  172   2HG1  ILE  18          1HG1      ILE  18   2.450   2.489   2.547
  173   1HG2  ILE  18          2HG2      ILE  18   1.928   5.713   3.421
  174   2HG2  ILE  18          1HG2      ILE  18   1.724   4.540   2.120
  175   3HG2  ILE  18          3HG2      ILE  18   0.324   5.091   3.040
  176   1HD1  ILE  18          1HD1      ILE  18   3.888   4.532   3.732
  177   2HD1  ILE  18          3HD1      ILE  18   4.611   3.086   4.439
  178   3HD1  ILE  18          2HD1      ILE  18   4.567   3.283   2.686
  179    MG   ILE  18           QG2      ILE  18   1.325   5.115   2.861
  180    MD   ILE  18           QD1      ILE  18   4.355   3.634   3.619
  181    QG   ILE  18           QG1      ILE  18   2.582   2.184   3.362
  182    HA   PRO  19           HA       PRO  19  -0.707   5.983   8.131
  183   1HB   PRO  19          2HB       PRO  19  -0.014   8.604   8.503
  184   2HB   PRO  19          1HB       PRO  19   0.718   7.272   9.419
  185   1HG   PRO  19          2HG       PRO  19   1.787   8.779   7.088
  186   2HG   PRO  19          1HG       PRO  19   2.629   8.162   8.519
  187   1HD   PRO  19          2HD       PRO  19   2.696   6.946   6.072
  188   2HD   PRO  19          1HD       PRO  19   2.919   6.086   7.611
  189    QB   PRO  19           QB       PRO  19   0.352   7.938   8.961
  190    QG   PRO  19           QG       PRO  19   2.208   8.470   7.804
  191    QD   PRO  19           QD       PRO  19   2.807   6.516   6.842
  192    H    ALA  20           H        ALA  20  -2.658   7.125   7.676
  193    HA   ALA  20           HA       ALA  20  -3.036   7.913   4.875
  194   1HB   ALA  20          2HB       ALA  20  -5.046   8.230   7.088
  195   2HB   ALA  20          1HB       ALA  20  -5.306   7.723   5.420
  196   3HB   ALA  20          3HB       ALA  20  -4.567   6.613   6.574
  197    MB   ALA  20           QB       ALA  20  -4.973   7.522   6.361
  198    HA   PRO  21           HA       PRO  21  -2.119  12.169   6.051
  199   1HB   PRO  21          2HB       PRO  21  -2.234  13.201   3.518
  200   2HB   PRO  21          1HB       PRO  21  -0.819  12.336   4.149
  201   1HG   PRO  21          2HG       PRO  21  -2.980  11.368   2.349
  202   2HG   PRO  21          1HG       PRO  21  -1.245  11.024   2.316
  203   1HD   PRO  21          2HD       PRO  21  -3.104   9.293   3.308
  204   2HD   PRO  21          1HD       PRO  21  -1.414   9.343   3.858
  205    QB   PRO  21           QB       PRO  21  -1.526  12.768   3.834
  206    QG   PRO  21           QG       PRO  21  -2.113  11.196   2.332
  207    QD   PRO  21           QD       PRO  21  -2.259   9.318   3.583
  208    H    LEU  22           H        LEU  22  -4.961  10.808   4.736
  209    HA   LEU  22           HA       LEU  22  -6.504  13.221   5.517
  210   1HB   LEU  22          2HB       LEU  22  -5.775  13.179   3.017
  211   2HB   LEU  22          1HB       LEU  22  -6.973  11.895   2.846
  212    HG   LEU  22           HG       LEU  22  -8.708  13.391   3.772
  213   1HD1  LEU  22          1HD1      LEU  22  -7.443  13.584   1.253
  214   2HD1  LEU  22          3HD1      LEU  22  -9.087  14.075   1.660
  215   3HD1  LEU  22          2HD1      LEU  22  -7.769  15.240   1.760
  216   1HD2  LEU  22          2HD2      LEU  22  -6.315  15.126   4.167
  217   2HD2  LEU  22          1HD2      LEU  22  -7.822  15.923   3.714
  218   3HD2  LEU  22          3HD2      LEU  22  -7.748  14.941   5.178
  219    MD1  LEU  22           QD1      LEU  22  -8.100  14.300   1.558
  220    MD2  LEU  22           QD2      LEU  22  -7.295  15.330   4.353
  221    QB   LEU  22           QB       LEU  22  -6.374  12.537   2.932
  222    QD   LEU  22           QQD      LEU  22  -7.697  14.815   2.955
  223    H    ALA  23           H        ALA  23  -8.222  12.512   6.714
  224    HA   ALA  23           HA       ALA  23  -8.857   9.780   7.167
  225   1HB   ALA  23          2HB       ALA  23 -10.158  12.449   7.599
  226   2HB   ALA  23          3HB       ALA  23  -9.591  11.280   8.794
  227   3HB   ALA  23          1HB       ALA  23 -11.096  10.990   7.922
  228    MB   ALA  23           QB       ALA  23 -10.282  11.573   8.105
  229    H    GLY  24           H        GLY  24 -11.289   9.022   6.737
  230   1HA   GLY  24          1HA       GLY  24 -11.618   9.063   3.800
  231   2HA   GLY  24          2HA       GLY  24 -12.976   9.688   4.733
  232    QA   GLY  24           QA       GLY  24 -12.297   9.376   4.267
  233    H    THR  25           H        THR  25 -12.813   7.263   3.024
  234    HA   THR  25           HA       THR  25 -13.220   5.108   5.060
  235    HB   THR  25           HB       THR  25 -15.315   4.543   3.743
  236    HG1  THR  25           HG1      THR  25 -14.867   5.654   1.863
  237   1HG2  THR  25          1HG2      THR  25 -15.020   7.170   5.200
  238   2HG2  THR  25          3HG2      THR  25 -16.588   6.584   4.647
  239   3HG2  THR  25          2HG2      THR  25 -15.658   5.645   5.814
  240    MG   THR  25           QG2      THR  25 -15.755   6.466   5.221
  241    H    VAL  26           H        VAL  26 -11.413   3.865   4.352
  242    HA   VAL  26           HA       VAL  26 -10.443   3.503   1.748
  243    HB   VAL  26           HB       VAL  26 -10.715   1.471   3.988
  244   1HG1  VAL  26          1HG1      VAL  26 -10.024   0.588   1.717
  245   2HG1  VAL  26          3HG1      VAL  26  -8.618   1.649   1.809
  246   3HG1  VAL  26          2HG1      VAL  26  -8.825   0.356   2.989
  247   1HG2  VAL  26          2HG2      VAL  26  -8.841   3.759   3.459
  248   2HG2  VAL  26          1HG2      VAL  26  -9.604   3.276   4.973
  249   3HG2  VAL  26          3HG2      VAL  26  -8.259   2.338   4.324
  250    MG1  VAL  26           QG1      VAL  26  -9.156   0.864   2.172
  251    MG2  VAL  26           QG2      VAL  26  -8.901   3.124   4.252
  252    QG   VAL  26           QQG      VAL  26  -9.028   1.994   3.212
  253    H    SER  27           H        SER  27 -11.990   3.240   0.094
  254    HA   SER  27           HA       SER  27 -14.353   1.679   0.192
  255   1HB   SER  27          2HB       SER  27 -13.315   3.379  -1.544
  256   2HB   SER  27          1HB       SER  27 -12.679   1.917  -2.292
  257    HG   SER  27           HG       SER  27 -14.637   1.369  -2.878
  258    QB   SER  27           QB       SER  27 -12.997   2.648  -1.918
  259    H    LYS  28           H        LYS  28 -11.038   0.752  -0.761
  260    HA   LYS  28           HA       LYS  28 -11.446  -2.011   0.010
  261   1HB   LYS  28          2HB       LYS  28 -12.835  -1.816  -2.062
  262   2HB   LYS  28          1HB       LYS  28 -11.384  -1.353  -2.953
  263   1HG   LYS  28          2HG       LYS  28 -10.544  -3.479  -2.955
  264   2HG   LYS  28          1HG       LYS  28 -11.163  -3.833  -1.342
  265   1HD   LYS  28          2HD       LYS  28 -13.502  -3.618  -2.681
  266   2HD   LYS  28          1HD       LYS  28 -12.465  -4.191  -3.988
  267   1HE   LYS  28          2HE       LYS  28 -13.084  -6.236  -3.075
  268   2HE   LYS  28          1HE       LYS  28 -11.664  -5.897  -2.066
  269   1HZ   LYS  28          1HZ       LYS  28 -14.361  -4.892  -1.372
  270   2HZ   LYS  28          3HZ       LYS  28 -13.815  -6.410  -0.849
  271   3HZ   LYS  28          2HZ       LYS  28 -12.991  -5.002  -0.374
  272    QB   LYS  28           QB       LYS  28 -12.109  -1.585  -2.507
  273    QD   LYS  28           QD       LYS  28 -12.984  -3.904  -3.335
  274    QG   LYS  28           QG       LYS  28 -10.854  -3.656  -2.148
  275    QE   LYS  28           QE       LYS  28 -12.374  -6.067  -2.570
  276    QZ   LYS  28           QZ       LYS  28 -13.722  -5.434  -0.865
  277    H    ILE  29           H        ILE  29  -9.473  -3.269  -0.302
  278    HA   ILE  29           HA       ILE  29  -7.067  -1.547  -0.592
  279    HB   ILE  29           HB       ILE  29  -7.397  -2.966   1.408
  280   1HG1  ILE  29          2HG1      ILE  29  -5.211  -4.395  -0.021
  281   2HG1  ILE  29          1HG1      ILE  29  -5.098  -2.636   0.034
  282   1HG2  ILE  29          1HG2      ILE  29  -8.325  -4.824  -0.505
  283   2HG2  ILE  29          3HG2      ILE  29  -6.853  -5.522   0.169
  284   3HG2  ILE  29          2HG2      ILE  29  -8.182  -5.070   1.235
  285   1HD1  ILE  29          1HD1      ILE  29  -5.757  -4.130   2.550
  286   2HD1  ILE  29          3HD1      ILE  29  -4.083  -4.084   1.994
  287   3HD1  ILE  29          2HD1      ILE  29  -4.935  -2.581   2.354
  288    MG   ILE  29           QG2      ILE  29  -7.787  -5.139   0.299
  289    MD   ILE  29           QD1      ILE  29  -4.925  -3.598   2.299
  290    QG   ILE  29           QG1      ILE  29  -5.154  -3.516   0.006
  291    H    LEU  30           H        LEU  30  -5.646  -1.791  -2.297
  292    HA   LEU  30           HA       LEU  30  -6.350  -3.804  -4.386
  293   1HB   LEU  30          2HB       LEU  30  -5.410  -1.042  -4.268
  294   2HB   LEU  30          1HB       LEU  30  -4.428  -2.021  -5.357
  295    HG   LEU  30           HG       LEU  30  -6.360  -1.001  -6.533
  296   1HD1  LEU  30          2HD1      LEU  30  -7.953  -2.645  -4.543
  297   2HD1  LEU  30          1HD1      LEU  30  -7.945  -0.886  -4.689
  298   3HD1  LEU  30          3HD1      LEU  30  -8.641  -1.876  -5.973
  299   1HD2  LEU  30          2HD2      LEU  30  -5.902  -3.915  -6.278
  300   2HD2  LEU  30          1HD2      LEU  30  -7.426  -3.458  -7.042
  301   3HD2  LEU  30          3HD2      LEU  30  -5.896  -2.895  -7.717
  302    MD1  LEU  30           QD1      LEU  30  -8.180  -1.802  -5.068
  303    MD2  LEU  30           QD2      LEU  30  -6.408  -3.423  -7.013
  304    QB   LEU  30           QB       LEU  30  -4.919  -1.531  -4.812
  305    QD   LEU  30           QQD      LEU  30  -7.294  -2.612  -6.040
  306    H    VAL  31           H        VAL  31  -3.817  -2.831  -2.163
  307    HA   VAL  31           HA       VAL  31  -1.775  -4.538  -3.436
  308    HB   VAL  31           HB       VAL  31  -1.242  -2.368  -2.383
  309   1HG1  VAL  31          1HG1      VAL  31  -2.939  -3.449  -0.313
  310   2HG1  VAL  31          3HG1      VAL  31  -1.373  -3.010   0.369
  311   3HG1  VAL  31          2HG1      VAL  31  -2.328  -1.804  -0.492
  312   1HG2  VAL  31          1HG2      VAL  31  -0.143  -4.857  -1.062
  313   2HG2  VAL  31          3HG2      VAL  31   0.572  -3.920  -2.375
  314   3HG2  VAL  31          2HG2      VAL  31   0.515  -3.252  -0.743
  315    MG1  VAL  31           QG1      VAL  31  -2.214  -2.755  -0.146
  316    MG2  VAL  31           QG2      VAL  31   0.315  -4.010  -1.393
  317    QG   VAL  31           QQG      VAL  31  -0.949  -3.382  -0.770
  318    H    LYS  32           H        LYS  32  -0.864  -6.407  -2.358
  319    HA   LYS  32           HA       LYS  32  -2.655  -7.620  -0.276
  320   1HB   LYS  32          2HB       LYS  32  -2.487  -8.447  -2.805
  321   2HB   LYS  32          1HB       LYS  32  -1.045  -9.261  -2.196
  322   1HG   LYS  32          2HG       LYS  32  -2.489 -10.900  -1.569
  323   2HG   LYS  32          1HG       LYS  32  -2.867  -9.825  -0.223
  324   1HD   LYS  32          2HD       LYS  32  -4.595  -8.743  -1.792
  325   2HD   LYS  32          1HD       LYS  32  -4.368 -10.157  -2.821
  326   1HE   LYS  32          2HE       LYS  32  -6.224 -10.687  -1.389
  327   2HE   LYS  32          1HE       LYS  32  -4.841 -11.563  -0.706
  328   1HZ   LYS  32          2HZ       LYS  32  -5.478  -8.792   0.107
  329   2HZ   LYS  32          1HZ       LYS  32  -6.192 -10.123   0.883
  330   3HZ   LYS  32          3HZ       LYS  32  -4.508  -9.932   0.911
  331    QB   LYS  32           QB       LYS  32  -1.766  -8.854  -2.500
  332    QD   LYS  32           QD       LYS  32  -4.482  -9.450  -2.306
  333    QG   LYS  32           QG       LYS  32  -2.678 -10.362  -0.896
  334    QE   LYS  32           QE       LYS  32  -5.532 -11.125  -1.048
  335    QZ   LYS  32           QZ       LYS  32  -5.393  -9.616   0.634
  336    H    GLU  33           H        GLU  33  -1.578  -8.814   1.380
  337    HA   GLU  33           HA       GLU  33   1.082  -7.928   2.077
  338   1HB   GLU  33          2HB       GLU  33  -1.025  -8.823   3.437
  339   2HB   GLU  33          1HB       GLU  33  -0.201 -10.371   3.245
  340   1HG   GLU  33          2HG       GLU  33   1.896  -9.216   4.123
  341   2HG   GLU  33          1HG       GLU  33   0.852  -7.865   4.571
  342    QB   GLU  33           QB       GLU  33  -0.613  -9.597   3.341
  343    QG   GLU  33           QG       GLU  33   1.374  -8.540   4.347
  344    H    GLY  34           H        GLY  34   3.044  -8.925   1.681
  345   1HA   GLY  34          1HA       GLY  34   3.190 -11.755   0.944
  346   2HA   GLY  34          2HA       GLY  34   4.557 -10.649   1.086
  347    QA   GLY  34           QA       GLY  34   3.874 -11.202   1.015
  348    H    ASP  35           H        ASP  35   3.061  -8.695  -0.702
  349    HA   ASP  35           HA       ASP  35   3.630 -10.092  -3.297
  350   1HB   ASP  35          2HB       ASP  35   1.246  -8.814  -2.238
  351   2HB   ASP  35          1HB       ASP  35   1.763  -8.031  -3.732
  352    QB   ASP  35           QB       ASP  35   1.504  -8.423  -2.985
  353    H    THR  36           H        THR  36   4.804  -8.868  -4.802
  354    HA   THR  36           HA       THR  36   6.184  -6.478  -3.770
  355    HB   THR  36           HB       THR  36   6.330  -8.067  -6.353
  356    HG1  THR  36           HG1      THR  36   7.658  -9.274  -5.282
  357   1HG2  THR  36          3HG2      THR  36   7.485  -5.514  -5.588
  358   2HG2  THR  36          2HG2      THR  36   8.737  -6.709  -5.924
  359   3HG2  THR  36          1HG2      THR  36   7.525  -6.334  -7.149
  360    MG   THR  36           QG2      THR  36   7.916  -6.186  -6.220
  361    H    VAL  37           H        VAL  37   5.210  -4.499  -4.030
  362    HA   VAL  37           HA       VAL  37   3.321  -4.111  -6.304
  363    HB   VAL  37           HB       VAL  37   2.647  -3.653  -3.941
  364   1HG1  VAL  37          1HG1      VAL  37   1.909  -2.307  -6.089
  365   2HG1  VAL  37          3HG1      VAL  37   1.428  -1.747  -4.487
  366   3HG1  VAL  37          2HG1      VAL  37   2.789  -0.990  -5.314
  367   1HG2  VAL  37          3HG2      VAL  37   5.191  -2.553  -3.743
  368   2HG2  VAL  37          2HG2      VAL  37   4.136  -1.141  -3.759
  369   3HG2  VAL  37          1HG2      VAL  37   3.907  -2.397  -2.543
  370    MG1  VAL  37           QG1      VAL  37   2.042  -1.681  -5.297
  371    MG2  VAL  37           QG2      VAL  37   4.411  -2.030  -3.348
  372    QG   VAL  37           QQG      VAL  37   3.227  -1.856  -4.323
  373    H    LYS  38           H        LYS  38   3.544  -2.211  -7.656
  374    HA   LYS  38           HA       LYS  38   6.359  -1.195  -7.808
  375   1HB   LYS  38          2HB       LYS  38   4.225  -1.972  -9.737
  376   2HB   LYS  38          1HB       LYS  38   5.260  -0.623 -10.210
  377   1HG   LYS  38          2HG       LYS  38   6.739  -2.888  -9.059
  378   2HG   LYS  38          1HG       LYS  38   5.888  -3.285 -10.553
  379   1HD   LYS  38          2HD       LYS  38   7.142  -0.699 -10.808
  380   2HD   LYS  38          1HD       LYS  38   8.337  -1.893 -10.299
  381   1HE   LYS  38          2HE       LYS  38   8.441  -2.468 -12.504
  382   2HE   LYS  38          1HE       LYS  38   6.868  -3.248 -12.241
  383   1HZ   LYS  38          1HZ       LYS  38   7.112  -0.347 -12.777
  384   2HZ   LYS  38          3HZ       LYS  38   6.965  -1.474 -14.035
  385   3HZ   LYS  38          2HZ       LYS  38   5.726  -1.324 -12.883
  386    QB   LYS  38           QB       LYS  38   4.743  -1.298  -9.973
  387    QD   LYS  38           QD       LYS  38   7.739  -1.296 -10.553
  388    QG   LYS  38           QG       LYS  38   6.314  -3.087  -9.806
  389    QE   LYS  38           QE       LYS  38   7.654  -2.858 -12.372
  390    QZ   LYS  38           QZ       LYS  38   6.601  -1.048 -13.232
  391    H    ALA  39           H        ALA  39   6.684   1.060  -7.965
  392    HA   ALA  39           HA       ALA  39   4.911   2.827  -6.660
  393   1HB   ALA  39          1HB       ALA  39   7.455   2.862  -7.699
  394   2HB   ALA  39          2HB       ALA  39   6.633   4.275  -7.037
  395   3HB   ALA  39          3HB       ALA  39   6.618   3.979  -8.777
  396    MB   ALA  39           QB       ALA  39   6.902   3.705  -7.838
  397    H    GLY  40           H        GLY  40   3.257   4.184  -7.398
  398   1HA   GLY  40          1HA       GLY  40   2.686   4.250 -10.314
  399   2HA   GLY  40          2HA       GLY  40   2.009   5.352  -9.115
  400    QA   GLY  40           QA       GLY  40   2.348   4.801  -9.715
  401    H    GLN  41           H        GLN  41   2.136   1.834  -8.775
  402    HA   GLN  41           HA       GLN  41  -0.525   1.271  -9.702
  403   1HB   GLN  41          2HB       GLN  41   1.685  -0.132  -8.942
  404   2HB   GLN  41          1HB       GLN  41   0.655  -0.367  -7.530
  405   1HG   GLN  41          2HG       GLN  41  -1.191  -0.874  -9.355
  406   2HG   GLN  41          1HG       GLN  41   0.211  -1.235 -10.363
  407   1HE2  GLN  41          1HE2      GLN  41   1.272  -3.227 -10.016
  408   2HE2  GLN  41          2HE2      GLN  41   0.874  -4.306  -8.767
  409    QB   GLN  41           QB       GLN  41   1.170  -0.250  -8.236
  410    QG   GLN  41           QG       GLN  41  -0.490  -1.055  -9.859
  411    QE   GLN  41           QE2      GLN  41   1.073  -3.766  -9.392
  412    H    THR  42           H        THR  42  -2.428   1.853  -8.727
  413    HA   THR  42           HA       THR  42  -2.648   3.238  -6.264
  414    HB   THR  42           HB       THR  42  -4.336   3.200  -8.059
  415    HG1  THR  42           HG1      THR  42  -5.089   3.684  -6.010
  416   1HG2  THR  42          3HG2      THR  42  -3.890   0.562  -8.247
  417   2HG2  THR  42          2HG2      THR  42  -5.318   0.519  -7.214
  418   3HG2  THR  42          1HG2      THR  42  -5.396   1.299  -8.793
  419    MG   THR  42           QG2      THR  42  -4.868   0.793  -8.085
  420    H    VAL  43           H        VAL  43  -1.691   2.236  -4.470
  421    HA   VAL  43           HA       VAL  43  -2.024  -0.609  -3.911
  422    HB   VAL  43           HB       VAL  43  -0.795   0.015  -1.852
  423   1HG1  VAL  43          1HG1      VAL  43   0.252  -0.133  -4.241
  424   2HG1  VAL  43          3HG1      VAL  43   0.411   1.617  -4.095
  425   3HG1  VAL  43          2HG1      VAL  43   1.214   0.558  -2.935
  426   1HG2  VAL  43          1HG2      VAL  43  -2.078   2.250  -1.689
  427   2HG2  VAL  43          3HG2      VAL  43  -0.369   2.267  -1.256
  428   3HG2  VAL  43          2HG2      VAL  43  -0.885   2.871  -2.831
  429    MG1  VAL  43           QG1      VAL  43   0.625   0.681  -3.757
  430    MG2  VAL  43           QG2      VAL  43  -1.110   2.463  -1.925
  431    QG   VAL  43           QQG      VAL  43  -0.243   1.572  -2.841
  432    H    LEU  44           H        LEU  44  -3.879   2.248  -3.262
  433    HA   LEU  44           HA       LEU  44  -5.801   0.615  -1.692
  434   1HB   LEU  44          2HB       LEU  44  -3.948   2.633  -0.628
  435   2HB   LEU  44          1HB       LEU  44  -5.629   2.925  -0.182
  436    HG   LEU  44           HG       LEU  44  -4.291   0.228   0.130
  437   1HD1  LEU  44          3HD1      LEU  44  -4.388   2.622   1.942
  438   2HD1  LEU  44          2HD1      LEU  44  -4.435   1.004   2.644
  439   3HD1  LEU  44          1HD1      LEU  44  -3.060   1.495   1.655
  440   1HD2  LEU  44          2HD2      LEU  44  -6.934   0.850   0.103
  441   2HD2  LEU  44          1HD2      LEU  44  -6.257  -0.456   1.077
  442   3HD2  LEU  44          3HD2      LEU  44  -6.570   1.117   1.808
  443    MD1  LEU  44           QD1      LEU  44  -3.961   1.707   2.080
  444    MD2  LEU  44           QD2      LEU  44  -6.587   0.504   0.996
  445    QB   LEU  44           QB       LEU  44  -4.789   2.779  -0.405
  446    QD   LEU  44           QQD      LEU  44  -5.274   1.105   1.538
  447    H    VAL  45           H        VAL  45  -7.915   1.636  -1.584
  448    HA   VAL  45           HA       VAL  45  -8.252   3.959  -3.454
  449    HB   VAL  45           HB       VAL  45 -10.003   1.508  -3.062
  450   1HG1  VAL  45          1HG1      VAL  45 -10.935   3.887  -3.803
  451   2HG1  VAL  45          3HG1      VAL  45 -10.249   3.416  -5.357
  452   3HG1  VAL  45          2HG1      VAL  45 -11.485   2.413  -4.597
  453   1HG2  VAL  45          1HG2      VAL  45  -7.693   1.333  -4.270
  454   2HG2  VAL  45          3HG2      VAL  45  -9.116   0.663  -5.067
  455   3HG2  VAL  45          2HG2      VAL  45  -8.488   2.234  -5.561
  456    MG1  VAL  45           QG1      VAL  45 -10.890   3.239  -4.585
  457    MG2  VAL  45           QG2      VAL  45  -8.433   1.410  -4.966
  458    QG   VAL  45           QQG      VAL  45  -9.661   2.324  -4.776
  459    H    LEU  46           H        LEU  46  -9.018   5.676  -2.283
  460    HA   LEU  46           HA       LEU  46 -10.615   5.146   0.182
  461   1HB   LEU  46          2HB       LEU  46  -8.685   7.143  -0.798
  462   2HB   LEU  46          1HB       LEU  46 -10.058   7.844   0.059
  463    HG   LEU  46           HG       LEU  46  -8.200   7.294   1.608
  464   1HD1  LEU  46          2HD1      LEU  46 -10.939   6.371   1.775
  465   2HD1  LEU  46          1HD1      LEU  46  -9.877   5.314   2.706
  466   3HD1  LEU  46          3HD1      LEU  46  -9.915   7.044   3.045
  467   1HD2  LEU  46          3HD2      LEU  46  -7.826   5.098   0.019
  468   2HD2  LEU  46          2HD2      LEU  46  -7.168   5.260   1.647
  469   3HD2  LEU  46          1HD2      LEU  46  -8.677   4.385   1.389
  470    MD1  LEU  46           QD1      LEU  46 -10.244   6.243   2.509
  471    MD2  LEU  46           QD2      LEU  46  -7.891   4.914   1.018
  472    QB   LEU  46           QB       LEU  46  -9.372   7.494  -0.369
  473    QD   LEU  46           QQD      LEU  46  -9.067   5.579   1.764
  474    H    GLU  47           H        GLU  47 -12.339   6.966   0.553
  475    HA   GLU  47           HA       GLU  47 -13.616   7.995  -1.898
  476   1HB   GLU  47          2HB       GLU  47 -14.236   5.572  -1.719
  477   2HB   GLU  47          1HB       GLU  47 -14.958   5.911  -0.145
  478   1HG   GLU  47          2HG       GLU  47 -15.971   7.840  -1.981
  479   2HG   GLU  47          1HG       GLU  47 -16.121   6.255  -2.740
  480    QB   GLU  47           QB       GLU  47 -14.597   5.742  -0.932
  481    QG   GLU  47           QG       GLU  47 -16.046   7.047  -2.361
  482    H    ALA  48           H        ALA  48 -14.191  10.030  -1.226
  483    HA   ALA  48           HA       ALA  48 -15.408  10.315   1.503
  484   1HB   ALA  48          1HB       ALA  48 -14.222  12.624   1.358
  485   2HB   ALA  48          3HB       ALA  48 -13.224  11.205   1.678
  486   3HB   ALA  48          2HB       ALA  48 -13.283  11.895   0.056
  487    MB   ALA  48           QB       ALA  48 -13.577  11.908   1.031
  488    H    MET  49           H        MET  49 -14.840  12.745  -1.021
  489    HA   MET  49           HA       MET  49 -17.675  13.533  -0.922
  490   1HB   MET  49          2HB       MET  49 -15.366  14.887  -1.144
  491   2HB   MET  49          1HB       MET  49 -15.711  14.674  -2.861
  492   1HG   MET  49          2HG       MET  49 -17.948  15.655  -2.542
  493   2HG   MET  49          1HG       MET  49 -17.615  15.865  -0.823
  494   1HE   MET  49          1HE       MET  49 -16.801  16.516  -4.336
  495   2HE   MET  49          3HE       MET  49 -15.936  18.056  -4.427
  496   3HE   MET  49          2HE       MET  49 -15.074  16.581  -3.996
  497    QB   MET  49           QB       MET  49 -15.539  14.780  -2.003
  498    QG   MET  49           QG       MET  49 -17.782  15.760  -1.683
  499    ME   MET  49           QE       MET  49 -15.937  17.051  -4.253
  500    H    LYS  50           H        LYS  50 -17.792  11.031  -1.904
  501    HA   LYS  50           HA       LYS  50 -18.465   9.740  -3.769
  502   1HB   LYS  50          2HB       LYS  50 -19.574  12.373  -3.853
  503   2HB   LYS  50          1HB       LYS  50 -19.195  11.897  -5.509
  504   1HG   LYS  50          2HG       LYS  50 -20.517   9.864  -3.770
  505   2HG   LYS  50          1HG       LYS  50 -21.505  11.210  -4.344
  506   1HD   LYS  50          2HD       LYS  50 -20.055  10.436  -6.596
  507   2HD   LYS  50          1HD       LYS  50 -20.481   8.910  -5.819
  508   1HE   LYS  50          2HE       LYS  50 -22.369   9.334  -7.170
  509   2HE   LYS  50          1HE       LYS  50 -22.872  10.015  -5.610
  510   1HZ   LYS  50          2HZ       LYS  50 -21.470  11.553  -7.731
  511   2HZ   LYS  50          1HZ       LYS  50 -23.152  11.580  -7.494
  512   3HZ   LYS  50          3HZ       LYS  50 -22.118  12.167  -6.285
  513    QB   LYS  50           QB       LYS  50 -19.385  12.135  -4.681
  514    QD   LYS  50           QD       LYS  50 -20.268   9.673  -6.208
  515    QG   LYS  50           QG       LYS  50 -21.011  10.537  -4.057
  516    QE   LYS  50           QE       LYS  50 -22.621   9.674  -6.390
  517    QZ   LYS  50           QZ       LYS  50 -22.247  11.766  -7.170
  518    H    MET  51           H        MET  51 -15.657  10.505  -3.673
  519    HA   MET  51           HA       MET  51 -15.066  10.441  -6.605
  520   1HB   MET  51          2HB       MET  51 -14.751  12.652  -4.940
  521   2HB   MET  51          1HB       MET  51 -13.135  11.944  -4.995
  522   1HG   MET  51          2HG       MET  51 -13.086  13.312  -6.879
  523   2HG   MET  51          1HG       MET  51 -13.617  11.783  -7.582
  524   1HE   MET  51          1HE       MET  51 -14.641  12.603  -9.598
  525   2HE   MET  51          3HE       MET  51 -15.796  13.934  -9.758
  526   3HE   MET  51          2HE       MET  51 -14.131  14.260  -9.283
  527    QB   MET  51           QB       MET  51 -13.943  12.298  -4.968
  528    QG   MET  51           QG       MET  51 -13.352  12.547  -7.231
  529    ME   MET  51           QE       MET  51 -14.856  13.599  -9.547
  530    H    GLU  52           H        GLU  52 -14.252   8.343  -6.692
  531    HA   GLU  52           HA       GLU  52 -12.881   6.955  -4.637
  532   1HB   GLU  52          2HB       GLU  52 -13.483   6.714  -7.474
  533   2HB   GLU  52          1HB       GLU  52 -11.894   6.045  -7.105
  534   1HG   GLU  52          2HG       GLU  52 -12.759   4.461  -5.615
  535   2HG   GLU  52          1HG       GLU  52 -14.239   5.382  -5.344
  536    QB   GLU  52           QB       GLU  52 -12.689   6.380  -7.290
  537    QG   GLU  52           QG       GLU  52 -13.499   4.922  -5.480
  538    H    THR  53           H        THR  53 -11.068   7.808  -3.662
  539    HA   THR  53           HA       THR  53  -9.076   9.320  -5.240
  540    HB   THR  53           HB       THR  53  -9.368   8.581  -2.310
  541    HG1  THR  53           HG1      THR  53  -9.644  11.085  -3.592
  542   1HG2  THR  53          3HG2      THR  53  -7.281  10.144  -3.807
  543   2HG2  THR  53          2HG2      THR  53  -7.675  10.565  -2.140
  544   3HG2  THR  53          1HG2      THR  53  -7.068   8.955  -2.523
  545    MG   THR  53           QG2      THR  53  -7.341   9.888  -2.823
  546    H    GLU  54           H        GLU  54  -8.233   7.529  -6.554
  547    HA   GLU  54           HA       GLU  54  -7.238   5.069  -5.505
  548   1HB   GLU  54          2HB       GLU  54  -6.585   6.795  -7.903
  549   2HB   GLU  54          1HB       GLU  54  -5.818   5.226  -7.651
  550   1HG   GLU  54          2HG       GLU  54  -8.635   4.925  -7.233
  551   2HG   GLU  54          1HG       GLU  54  -8.386   5.758  -8.770
  552    QB   GLU  54           QB       GLU  54  -6.201   6.010  -7.777
  553    QG   GLU  54           QG       GLU  54  -8.510   5.341  -8.002
  554    H    ILE  55           H        ILE  55  -5.379   4.633  -4.349
  555    HA   ILE  55           HA       ILE  55  -3.483   6.900  -3.903
  556    HB   ILE  55           HB       ILE  55  -3.955   4.348  -2.330
  557   1HG1  ILE  55          2HG1      ILE  55  -5.016   7.172  -1.978
  558   2HG1  ILE  55          1HG1      ILE  55  -5.963   5.716  -2.281
  559   1HG2  ILE  55          1HG2      ILE  55  -1.856   6.248  -2.273
  560   2HG2  ILE  55          3HG2      ILE  55  -2.862   6.583  -0.863
  561   3HG2  ILE  55          2HG2      ILE  55  -2.177   4.975  -1.095
  562   1HD1  ILE  55          2HD1      ILE  55  -5.112   4.786  -0.107
  563   2HD1  ILE  55          1HD1      ILE  55  -4.341   6.341   0.204
  564   3HD1  ILE  55          3HD1      ILE  55  -6.097   6.237   0.086
  565    MG   ILE  55           QG2      ILE  55  -2.298   5.935  -1.410
  566    MD   ILE  55           QD1      ILE  55  -5.183   5.788   0.061
  567    QG   ILE  55           QG1      ILE  55  -5.489   6.444  -2.130
  568    H    ASN  56           H        ASN  56  -1.999   6.645  -5.581
  569    HA   ASN  56           HA       ASN  56  -0.965   4.106  -6.494
  570   1HB   ASN  56          2HB       ASN  56   0.610   5.594  -7.700
  571   2HB   ASN  56          1HB       ASN  56  -1.049   6.183  -7.826
  572   1HD2  ASN  56          1HD2      ASN  56   2.130   7.066  -6.885
  573   2HD2  ASN  56          2HD2      ASN  56   1.741   8.518  -6.096
  574    QB   ASN  56           QB       ASN  56  -0.220   5.888  -7.763
  575    QD   ASN  56           QD2      ASN  56   1.936   7.792  -6.490
  576    H    ALA  57           H        ALA  57   0.822   2.979  -5.768
  577    HA   ALA  57           HA       ALA  57   1.887   3.337  -3.169
  578   1HB   ALA  57          1HB       ALA  57   2.035   1.523  -5.261
  579   2HB   ALA  57          2HB       ALA  57   2.905   1.383  -3.733
  580   3HB   ALA  57          3HB       ALA  57   3.693   2.110  -5.133
  581    MB   ALA  57           QB       ALA  57   2.878   1.672  -4.709
  582    HA   PRO  58           HA       PRO  58   4.747   6.649  -3.754
  583   1HB   PRO  58          2HB       PRO  58   6.484   6.131  -1.704
  584   2HB   PRO  58          1HB       PRO  58   4.861   6.802  -1.449
  585   1HG   PRO  58          2HG       PRO  58   5.825   4.007  -1.118
  586   2HG   PRO  58          1HG       PRO  58   4.678   4.929  -0.135
  587   1HD   PRO  58          2HD       PRO  58   3.926   3.056  -1.970
  588   2HD   PRO  58          1HD       PRO  58   2.910   4.438  -1.502
  589    QB   PRO  58           QB       PRO  58   5.673   6.467  -1.577
  590    QG   PRO  58           QG       PRO  58   5.251   4.468  -0.627
  591    QD   PRO  58           QD       PRO  58   3.418   3.747  -1.736
  592    H    THR  59           H        THR  59   6.039   3.358  -3.342
  593    HA   THR  59           HA       THR  59   7.909   3.807  -5.579
  594    HB   THR  59           HB       THR  59   9.018   2.931  -2.914
  595    HG1  THR  59           HG1      THR  59   8.594   4.867  -2.244
  596   1HG2  THR  59          2HG2      THR  59  10.061   3.888  -5.548
  597   2HG2  THR  59          1HG2      THR  59  11.002   4.236  -4.098
  598   3HG2  THR  59          3HG2      THR  59  10.634   2.567  -4.531
  599    MG   THR  59           QG2      THR  59  10.565   3.563  -4.726
  600    H    ASP  60           H        ASP  60   8.889   1.761  -6.285
  601    HA   ASP  60           HA       ASP  60   7.125  -0.521  -5.969
  602   1HB   ASP  60          2HB       ASP  60   8.818  -1.569  -7.465
  603   2HB   ASP  60          1HB       ASP  60   8.336   0.028  -8.040
  604    QB   ASP  60           QB       ASP  60   8.577  -0.771  -7.753
  605    H    GLY  61           H        GLY  61   7.418  -2.337  -4.671
  606   1HA   GLY  61          1HA       GLY  61   9.094  -2.174  -2.363
  607   2HA   GLY  61          2HA       GLY  61   9.866  -3.223  -3.552
  608    QA   GLY  61           QA       GLY  61   9.480  -2.698  -2.958
  609    H    LYS  62           H        LYS  62   9.065  -4.311  -1.140
  610    HA   LYS  62           HA       LYS  62   6.711  -5.983  -1.955
  611   1HB   LYS  62          2HB       LYS  62   9.372  -6.616  -1.342
  612   2HB   LYS  62          1HB       LYS  62   8.467  -7.069   0.103
  613   1HG   LYS  62          2HG       LYS  62   7.169  -8.634  -1.031
  614   2HG   LYS  62          1HG       LYS  62   7.398  -7.843  -2.592
  615   1HD   LYS  62          2HD       LYS  62   8.712  -9.865  -2.613
  616   2HD   LYS  62          1HD       LYS  62   9.833  -8.511  -2.471
  617   1HE   LYS  62          2HE       LYS  62  10.650  -9.434  -0.572
  618   2HE   LYS  62          1HE       LYS  62   9.051  -9.244   0.177
  619   1HZ   LYS  62          2HZ       LYS  62   9.853 -11.481  -1.610
  620   2HZ   LYS  62          1HZ       LYS  62   9.719 -11.583   0.081
  621   3HZ   LYS  62          3HZ       LYS  62   8.339 -11.294  -0.863
  622    QB   LYS  62           QB       LYS  62   8.920  -6.842  -0.620
  623    QD   LYS  62           QD       LYS  62   9.273  -9.188  -2.542
  624    QG   LYS  62           QG       LYS  62   7.283  -8.239  -1.811
  625    QE   LYS  62           QE       LYS  62   9.850  -9.339  -0.198
  626    QZ   LYS  62           QZ       LYS  62   9.304 -11.453  -0.797
  627    H    VAL  63           H        VAL  63   5.023  -6.184  -0.469
  628    HA   VAL  63           HA       VAL  63   4.861  -4.278   1.710
  629    HB   VAL  63           HB       VAL  63   3.182  -6.559   0.649
  630   1HG1  VAL  63          3HG1      VAL  63   3.478  -4.153  -0.376
  631   2HG1  VAL  63          2HG1      VAL  63   1.869  -4.868  -0.274
  632   3HG1  VAL  63          1HG1      VAL  63   2.383  -3.679   0.925
  633   1HG2  VAL  63          2HG2      VAL  63   2.840  -6.447   3.117
  634   2HG2  VAL  63          1HG2      VAL  63   2.474  -4.728   2.970
  635   3HG2  VAL  63          3HG2      VAL  63   1.408  -5.924   2.230
  636    MG1  VAL  63           QG1      VAL  63   2.576  -4.233   0.092
  637    MG2  VAL  63           QG2      VAL  63   2.241  -5.700   2.773
  638    QG   VAL  63           QQG      VAL  63   2.408  -4.966   1.432
  639    H    GLU  64           H        GLU  64   5.070  -4.648   3.914
  640    HA   GLU  64           HA       GLU  64   6.257  -7.271   4.719
  641   1HB   GLU  64          2HB       GLU  64   6.547  -4.407   5.481
  642   2HB   GLU  64          1HB       GLU  64   6.702  -5.580   6.790
  643   1HG   GLU  64          2HG       GLU  64   8.247  -5.693   4.182
  644   2HG   GLU  64          1HG       GLU  64   8.889  -5.077   5.705
  645    QB   GLU  64           QB       GLU  64   6.624  -4.994   6.136
  646    QG   GLU  64           QG       GLU  64   8.568  -5.385   4.944
  647    H    LYS  65           H        LYS  65   3.469  -5.231   5.072
  648    HA   LYS  65           HA       LYS  65   1.957  -7.190   6.523
  649   1HB   LYS  65          2HB       LYS  65   3.796  -5.597   8.046
  650   2HB   LYS  65          1HB       LYS  65   2.156  -5.133   8.498
  651   1HG   LYS  65          2HG       LYS  65   1.817  -7.789   8.482
  652   2HG   LYS  65          1HG       LYS  65   3.546  -7.751   8.831
  653   1HD   LYS  65          2HD       LYS  65   3.232  -6.488  10.815
  654   2HD   LYS  65          1HD       LYS  65   1.582  -6.050  10.368
  655   1HE   LYS  65          2HE       LYS  65   2.314  -8.952  10.730
  656   2HE   LYS  65          1HE       LYS  65   1.906  -7.947  12.135
  657   1HZ   LYS  65          2HZ       LYS  65   0.249  -8.044   9.677
  658   2HZ   LYS  65          1HZ       LYS  65  -0.039  -9.046  11.018
  659   3HZ   LYS  65          3HZ       LYS  65  -0.159  -7.362  11.179
  660    QB   LYS  65           QB       LYS  65   2.976  -5.365   8.272
  661    QD   LYS  65           QD       LYS  65   2.407  -6.269  10.592
  662    QG   LYS  65           QG       LYS  65   2.682  -7.770   8.657
  663    QE   LYS  65           QE       LYS  65   2.110  -8.450  11.432
  664    QZ   LYS  65           QZ       LYS  65   0.017  -8.150  10.625
  665    H    VAL  66           H        VAL  66  -0.223  -6.402   6.978
  666    HA   VAL  66           HA       VAL  66  -0.819  -3.661   5.927
  667    HB   VAL  66           HB       VAL  66  -2.743  -4.706   4.726
  668   1HG1  VAL  66          2HG1      VAL  66  -1.999  -6.931   6.383
  669   2HG1  VAL  66          1HG1      VAL  66  -3.397  -6.775   5.320
  670   3HG1  VAL  66          3HG1      VAL  66  -1.879  -7.415   4.692
  671   1HG2  VAL  66          1HG2      VAL  66  -0.263  -4.487   3.840
  672   2HG2  VAL  66          3HG2      VAL  66  -0.305  -6.249   3.902
  673   3HG2  VAL  66          2HG2      VAL  66  -1.463  -5.374   2.898
  674    MG1  VAL  66           QG1      VAL  66  -2.425  -7.040   5.465
  675    MG2  VAL  66           QG2      VAL  66  -0.677  -5.370   3.547
  676    QG   VAL  66           QQG      VAL  66  -1.551  -6.205   4.506
  677    H    LEU  67           H        LEU  67  -1.385  -2.793   7.958
  678    HA   LEU  67           HA       LEU  67  -3.119  -4.289   9.800
  679   1HB   LEU  67          2HB       LEU  67  -2.777  -2.306  11.202
  680   2HB   LEU  67          1HB       LEU  67  -1.241  -2.801  10.494
  681    HG   LEU  67           HG       LEU  67  -2.466  -1.042   8.633
  682   1HD1  LEU  67          2HD1      LEU  67  -0.094  -0.985  10.482
  683   2HD1  LEU  67          1HD1      LEU  67  -0.126  -1.100   8.722
  684   3HD1  LEU  67          3HD1      LEU  67  -0.488   0.434   9.513
  685   1HD2  LEU  67          2HD2      LEU  67  -3.356  -0.465  11.264
  686   2HD2  LEU  67          1HD2      LEU  67  -2.131   0.740  10.871
  687   3HD2  LEU  67          3HD2      LEU  67  -3.536   0.539   9.826
  688    MD1  LEU  67           QD1      LEU  67  -0.236  -0.550   9.572
  689    MD2  LEU  67           QD2      LEU  67  -3.008   0.271  10.654
  690    QB   LEU  67           QB       LEU  67  -2.009  -2.553  10.848
  691    QD   LEU  67           QQD      LEU  67  -1.622  -0.140  10.113
  692    H    VAL  68           H        VAL  68  -3.566  -2.140   7.136
  693    HA   VAL  68           HA       VAL  68  -5.809  -0.604   7.715
  694    HB   VAL  68           HB       VAL  68  -6.366  -0.984   5.292
  695   1HG1  VAL  68          1HG1      VAL  68  -4.321   0.383   6.322
  696   2HG1  VAL  68          3HG1      VAL  68  -3.388  -0.817   5.430
  697   3HG1  VAL  68          2HG1      VAL  68  -4.530   0.221   4.579
  698   1HG2  VAL  68          1HG2      VAL  68  -5.171  -3.471   5.788
  699   2HG2  VAL  68          3HG2      VAL  68  -5.690  -2.850   4.221
  700   3HG2  VAL  68          2HG2      VAL  68  -4.024  -2.620   4.751
  701    MG1  VAL  68           QG1      VAL  68  -4.080  -0.071   5.444
  702    MG2  VAL  68           QG2      VAL  68  -4.962  -2.980   4.920
  703    QG   VAL  68           QQG      VAL  68  -4.521  -1.526   5.182
  704    H    LYS  69           H        LYS  69  -8.110  -0.982   7.559
  705    HA   LYS  69           HA       LYS  69  -8.916  -3.857   7.874
  706   1HB   LYS  69          2HB       LYS  69  -9.398  -1.388   9.445
  707   2HB   LYS  69          1HB       LYS  69 -10.797  -2.443   9.241
  708   1HG   LYS  69          2HG       LYS  69  -9.834  -4.182  10.420
  709   2HG   LYS  69          1HG       LYS  69  -8.192  -3.704   9.988
  710   1HD   LYS  69          2HD       LYS  69  -7.980  -2.459  11.855
  711   2HD   LYS  69          1HD       LYS  69  -9.510  -1.635  11.549
  712   1HE   LYS  69          2HE       LYS  69 -10.409  -2.801  13.271
  713   2HE   LYS  69          1HE       LYS  69 -10.165  -4.290  12.335
  714   1HZ   LYS  69          1HZ       LYS  69  -7.827  -4.271  13.089
  715   2HZ   LYS  69          3HZ       LYS  69  -8.182  -2.958  14.101
  716   3HZ   LYS  69          2HZ       LYS  69  -8.929  -4.460  14.368
  717    QB   LYS  69           QB       LYS  69 -10.097  -1.915   9.343
  718    QD   LYS  69           QD       LYS  69  -8.745  -2.047  11.702
  719    QG   LYS  69           QG       LYS  69  -9.013  -3.943  10.204
  720    QE   LYS  69           QE       LYS  69 -10.287  -3.546  12.803
  721    QZ   LYS  69           QZ       LYS  69  -8.313  -3.896  13.853
  722    H    GLU  70           H        GLU  70  -9.061  -1.410   5.713
  723    HA   GLU  70           HA       GLU  70 -10.505  -0.927   3.912
  724   1HB   GLU  70          2HB       GLU  70 -10.769  -3.664   4.621
  725   2HB   GLU  70          1HB       GLU  70 -12.397  -3.068   4.293
  726   1HG   GLU  70          2HG       GLU  70 -11.763  -2.295   2.107
  727   2HG   GLU  70          1HG       GLU  70 -10.053  -2.576   2.440
  728    QB   GLU  70           QB       GLU  70 -11.583  -3.366   4.457
  729    QG   GLU  70           QG       GLU  70 -10.908  -2.435   2.274
  730    H    ARG  71           H        ARG  71 -12.384   0.305   3.635
  731    HA   ARG  71           HA       ARG  71 -14.232   1.609   4.329
  732   1HB   ARG  71          2HB       ARG  71 -14.697  -1.056   5.703
  733   2HB   ARG  71          1HB       ARG  71 -15.920   0.208   5.580
  734   1HG   ARG  71          2HG       ARG  71 -15.847   0.110   3.149
  735   2HG   ARG  71          1HG       ARG  71 -14.516  -1.046   3.204
  736   1HD   ARG  71          2HD       ARG  71 -16.370  -2.466   2.912
  737   2HD   ARG  71          1HD       ARG  71 -16.207  -2.459   4.679
  738    HE   ARG  71           HE       ARG  71 -18.099  -0.674   3.191
  739   1HH1  ARG  71          1HH1      ARG  71 -18.515   0.631   5.400
  740   2HH1  ARG  71          2HH1      ARG  71 -19.308  -0.383   6.560
  741   1HH2  ARG  71          1HH2      ARG  71 -18.506  -3.335   4.921
  742   2HH2  ARG  71          2HH2      ARG  71 -19.302  -2.630   6.289
  743    QB   ARG  71           QB       ARG  71 -15.308  -0.424   5.641
  744    QG   ARG  71           QG       ARG  71 -15.182  -0.468   3.176
  745    QD   ARG  71           QD       ARG  71 -16.288  -2.462   3.795
  746    QH1  ARG  71           QH1      ARG  71 -18.911   0.124   5.980
  747    QH2  ARG  71           QH2      ARG  71 -18.904  -2.983   5.605
  748    H    ASP  72           H        ASP  72 -11.806   1.928   5.901
  749    HA   ASP  72           HA       ASP  72 -13.029   2.967   8.389
  750   1HB   ASP  72          2HB       ASP  72 -12.254   0.471   8.549
  751   2HB   ASP  72          1HB       ASP  72 -10.628   1.157   8.584
  752    QB   ASP  72           QB       ASP  72 -11.441   0.814   8.567
  753    H    ALA  73           H        ALA  73 -11.850   4.345   6.167
  754    HA   ALA  73           HA       ALA  73  -9.088   5.039   6.852
  755   1HB   ALA  73          1HB       ALA  73  -9.422   5.261   4.590
  756   2HB   ALA  73          3HB       ALA  73 -11.116   5.702   4.783
  757   3HB   ALA  73          2HB       ALA  73  -9.859   6.901   5.064
  758    MB   ALA  73           QB       ALA  73 -10.132   5.954   4.812
  759    H    VAL  74           H        VAL  74 -12.092   5.906   8.123
  760    HA   VAL  74           HA       VAL  74 -12.206   8.634   8.499
  761    HB   VAL  74           HB       VAL  74 -13.202   8.032  10.729
  762   1HG1  VAL  74          3HG1      VAL  74 -11.558   6.232  11.252
  763   2HG1  VAL  74          2HG1      VAL  74 -13.226   5.680  11.399
  764   3HG1  VAL  74          1HG1      VAL  74 -12.274   5.242   9.981
  765   1HG2  VAL  74          1HG2      VAL  74 -14.411   7.789   8.510
  766   2HG2  VAL  74          3HG2      VAL  74 -13.983   6.079   8.549
  767   3HG2  VAL  74          2HG2      VAL  74 -15.021   6.756   9.803
  768    MG1  VAL  74           QG1      VAL  74 -12.353   5.718  10.878
  769    MG2  VAL  74           QG2      VAL  74 -14.472   6.875   8.954
  770    QG   VAL  74           QQG      VAL  74 -13.412   6.296   9.916
  771    H    GLN  75           H        GLN  75 -11.106  10.170   9.691
  772    HA   GLN  75           HA       GLN  75  -9.312  11.138  10.870
  773   1HB   GLN  75          2HB       GLN  75 -10.644   9.556  12.508
  774   2HB   GLN  75          1HB       GLN  75  -9.179   8.577  12.437
  775   1HG   GLN  75          2HG       GLN  75  -7.881  10.697  12.994
  776   2HG   GLN  75          1HG       GLN  75  -9.436  11.451  13.348
  777   1HE2  GLN  75          1HE2      GLN  75  -7.262  10.841  15.293
  778   2HE2  GLN  75          2HE2      GLN  75  -7.945   9.796  16.443
  779    QB   GLN  75           QB       GLN  75  -9.911   9.066  12.472
  780    QG   GLN  75           QG       GLN  75  -8.659  11.074  13.171
  781    QE   GLN  75           QE2      GLN  75  -7.604  10.319  15.868
  782    H    GLY  76           H        GLY  76  -7.612  11.176   9.365
  783   1HA   GLY  76          1HA       GLY  76  -5.644  10.480   8.277
  784   2HA   GLY  76          2HA       GLY  76  -6.130   8.815   8.595
  785    QA   GLY  76           QA       GLY  76  -5.887   9.648   8.436
  786    H    GLY  77           H        GLY  77  -3.469   9.445   8.868
  787   1HA   GLY  77          1HA       GLY  77  -2.984   9.953  11.751
  788   2HA   GLY  77          2HA       GLY  77  -1.744   9.884  10.497
  789    QA   GLY  77           QA       GLY  77  -2.364   9.919  11.124
  790    H    GLN  78           H        GLN  78  -4.220   7.435  10.606
  791    HA   GLN  78           HA       GLN  78  -2.699   5.549  12.241
  792   1HB   GLN  78          2HB       GLN  78  -5.135   5.540  12.176
  793   2HB   GLN  78          1HB       GLN  78  -5.123   5.328  10.426
  794   1HG   GLN  78          2HG       GLN  78  -3.918   3.152  10.754
  795   2HG   GLN  78          1HG       GLN  78  -4.122   3.351  12.496
  796   1HE2  GLN  78          1HE2      GLN  78  -5.902   2.835   9.452
  797   2HE2  GLN  78          2HE2      GLN  78  -7.341   2.314  10.187
  798    QB   GLN  78           QB       GLN  78  -5.129   5.434  11.301
  799    QG   GLN  78           QG       GLN  78  -4.020   3.252  11.625
  800    QE   GLN  78           QE2      GLN  78  -6.622   2.575   9.820
  801    H    GLY  79           H        GLY  79  -1.143   4.155  11.488
  802   1HA   GLY  79          1HA       GLY  79   0.205   2.954   9.985
  803   2HA   GLY  79          2HA       GLY  79  -0.044   4.314   8.888
  804    QA   GLY  79           QA       GLY  79   0.080   3.634   9.437
  805    H    LEU  80           H        LEU  80  -0.142   2.710   7.129
  806    HA   LEU  80           HA       LEU  80  -2.800   1.323   7.029
  807   1HB   LEU  80          2HB       LEU  80  -1.132   2.669   4.880
  808   2HB   LEU  80          1HB       LEU  80  -2.633   1.795   4.570
  809    HG   LEU  80           HG       LEU  80  -2.538   4.021   6.599
  810   1HD1  LEU  80          3HD1      LEU  80  -2.266   4.229   3.696
  811   2HD1  LEU  80          2HD1      LEU  80  -3.687   5.083   4.297
  812   3HD1  LEU  80          1HD1      LEU  80  -2.088   5.477   4.929
  813   1HD2  LEU  80          3HD2      LEU  80  -4.621   2.509   5.048
  814   2HD2  LEU  80          2HD2      LEU  80  -4.561   2.865   6.774
  815   3HD2  LEU  80          1HD2      LEU  80  -4.977   4.137   5.625
  816    MD1  LEU  80           QD1      LEU  80  -2.680   4.930   4.307
  817    MD2  LEU  80           QD2      LEU  80  -4.719   3.170   5.816
  818    QB   LEU  80           QB       LEU  80  -1.883   2.232   4.725
  819    QD   LEU  80           QQD      LEU  80  -3.700   4.050   5.062
  820    H    ILE  81           H        ILE  81   0.296   1.209   5.216
  821    HA   ILE  81           HA       ILE  81   0.293  -1.770   5.605
  822    HB   ILE  81           HB       ILE  81   1.015  -0.094   3.178
  823   1HG1  ILE  81          2HG1      ILE  81  -1.093  -2.238   3.307
  824   2HG1  ILE  81          1HG1      ILE  81  -1.463  -0.606   3.868
  825   1HG2  ILE  81          2HG2      ILE  81   1.128  -3.090   3.640
  826   2HG2  ILE  81          1HG2      ILE  81   1.318  -2.312   2.068
  827   3HG2  ILE  81          3HG2      ILE  81   2.501  -2.022   3.344
  828   1HD1  ILE  81          1HD1      ILE  81  -0.351  -1.285   1.130
  829   2HD1  ILE  81          3HD1      ILE  81  -2.043  -0.920   1.469
  830   3HD1  ILE  81          2HD1      ILE  81  -0.810   0.320   1.697
  831    MG   ILE  81           QG2      ILE  81   1.649  -2.475   3.017
  832    MD   ILE  81           QD1      ILE  81  -1.068  -0.629   1.432
  833    QG   ILE  81           QG1      ILE  81  -1.278  -1.422   3.587
  834    H    LYS  82           H        LYS  82   2.468  -2.713   5.655
  835    HA   LYS  82           HA       LYS  82   4.501  -0.795   6.679
  836   1HB   LYS  82          2HB       LYS  82   3.591  -3.085   7.703
  837   2HB   LYS  82          1HB       LYS  82   4.833  -3.772   6.655
  838   1HG   LYS  82          2HG       LYS  82   6.166  -3.372   8.476
  839   2HG   LYS  82          1HG       LYS  82   6.253  -1.759   7.764
  840   1HD   LYS  82          2HD       LYS  82   5.566  -1.131   9.858
  841   2HD   LYS  82          1HD       LYS  82   3.975  -1.485   9.183
  842   1HE   LYS  82          2HE       LYS  82   4.763  -3.978  10.020
  843   2HE   LYS  82          1HE       LYS  82   5.486  -2.937  11.262
  844   1HZ   LYS  82          2HZ       LYS  82   2.701  -2.599  10.300
  845   2HZ   LYS  82          1HZ       LYS  82   3.092  -3.562  11.644
  846   3HZ   LYS  82          3HZ       LYS  82   3.423  -1.899  11.671
  847    QB   LYS  82           QB       LYS  82   4.212  -3.429   7.179
  848    QD   LYS  82           QD       LYS  82   4.770  -1.308   9.520
  849    QG   LYS  82           QG       LYS  82   6.209  -2.566   8.120
  850    QE   LYS  82           QE       LYS  82   5.124  -3.458  10.641
  851    QZ   LYS  82           QZ       LYS  82   3.072  -2.686  11.205
  852    H    ILE  83           H        ILE  83   6.581  -0.661   5.720
  853    HA   ILE  83           HA       ILE  83   7.006  -2.220   3.200
  854    HB   ILE  83           HB       ILE  83   6.066  -0.002   2.683
  855   1HG1  ILE  83          2HG1      ILE  83   8.986   0.310   2.073
  856   2HG1  ILE  83          1HG1      ILE  83   8.138  -1.102   1.440
  857   1HG2  ILE  83          3HG2      ILE  83   8.085   0.809   4.697
  858   2HG2  ILE  83          2HG2      ILE  83   7.926   1.880   3.304
  859   3HG2  ILE  83          1HG2      ILE  83   6.523   1.531   4.313
  860   1HD1  ILE  83          3HD1      ILE  83   6.390   1.005   0.925
  861   2HD1  ILE  83          2HD1      ILE  83   7.982   1.685   0.584
  862   3HD1  ILE  83          1HD1      ILE  83   7.448   0.226  -0.251
  863    MG   ILE  83           QG2      ILE  83   7.511   1.407   4.105
  864    MD   ILE  83           QD1      ILE  83   7.273   0.972   0.419
  865    QG   ILE  83           QG1      ILE  83   8.562  -0.396   1.757
  866    H    GLY  84           H        GLY  84   8.140  -2.254   6.044
  867   1HA   GLY  84          1HA       GLY  84  10.513  -1.327   6.698
  868   2HA   GLY  84          2HA       GLY  84  10.996  -2.141   5.210
  869    QA   GLY  84           QA       GLY  84  10.755  -1.734   5.954

  No H/Q in entry =         869
  Start of MODEL    7
    1    H1   MET   1          2H        MET   1  24.070  17.879   4.806
    2    H2   MET   1          1H        MET   1  24.302  17.485   6.443
    3    H3   MET   1          3H        MET   1  24.108  16.252   5.294
    4    HA   MET   1           HA       MET   1  21.838  16.652   5.033
    5   1HB   MET   1          2HB       MET   1  23.020  16.771   7.761
    6   2HB   MET   1          1HB       MET   1  21.292  17.104   7.648
    7   1HG   MET   1          2HG       MET   1  22.604  14.682   6.389
    8   2HG   MET   1          1HG       MET   1  21.868  14.664   7.991
    9   1HE   MET   1          2HE       MET   1  21.439  12.885   5.807
   10   2HE   MET   1          1HE       MET   1  19.948  12.554   6.686
   11   3HE   MET   1          3HE       MET   1  19.897  12.917   4.956
   12    QB   MET   1           QB       MET   1  22.156  16.937   7.705
   13    QG   MET   1           QG       MET   1  22.236  14.673   7.190
   14    ME   MET   1           QE       MET   1  20.428  12.785   5.816
   15    H    LYS   2           H        LYS   2  19.988  18.108   5.307
   16    HA   LYS   2           HA       LYS   2  20.806  20.979   5.304
   17   1HB   LYS   2          2HB       LYS   2  19.277  19.415   3.616
   18   2HB   LYS   2          1HB       LYS   2  18.051  20.238   4.580
   19   1HG   LYS   2          2HG       LYS   2  18.618  22.320   3.780
   20   2HG   LYS   2          1HG       LYS   2  20.315  21.890   3.561
   21   1HD   LYS   2          2HD       LYS   2  19.952  21.421   1.394
   22   2HD   LYS   2          1HD       LYS   2  18.700  20.258   1.831
   23   1HE   LYS   2          2HE       LYS   2  16.981  21.807   1.575
   24   2HE   LYS   2          1HE       LYS   2  18.038  23.189   1.924
   25   1HZ   LYS   2          3HZ       LYS   2  18.225  21.453  -0.482
   26   2HZ   LYS   2          2HZ       LYS   2  17.549  23.012  -0.455
   27   3HZ   LYS   2          1HZ       LYS   2  19.206  22.795  -0.143
   28    QB   LYS   2           QB       LYS   2  18.664  19.827   4.098
   29    QD   LYS   2           QD       LYS   2  19.326  20.839   1.612
   30    QG   LYS   2           QG       LYS   2  19.466  22.105   3.671
   31    QE   LYS   2           QE       LYS   2  17.510  22.498   1.750
   32    QZ   LYS   2           QZ       LYS   2  18.327  22.420  -0.360
   33    H    LEU   3           H        LEU   3  20.084  19.040   7.698
   34    HA   LEU   3           HA       LEU   3  18.937  19.250   9.756
   35   1HB   LEU   3          2HB       LEU   3  19.754  21.891   8.745
   36   2HB   LEU   3          1HB       LEU   3  18.463  21.962   9.944
   37    HG   LEU   3           HG       LEU   3  20.682  22.047  11.024
   38   1HD1  LEU   3          1HD1      LEU   3  21.597  20.483   9.085
   39   2HD1  LEU   3          3HD1      LEU   3  22.335  20.454  10.686
   40   3HD1  LEU   3          2HD1      LEU   3  21.181  19.203  10.225
   41   1HD2  LEU   3          1HD2      LEU   3  18.537  20.515  11.760
   42   2HD2  LEU   3          3HD2      LEU   3  19.831  19.317  11.765
   43   3HD2  LEU   3          2HD2      LEU   3  19.964  20.765  12.764
   44    MD1  LEU   3           QD1      LEU   3  21.704  20.047   9.999
   45    MD2  LEU   3           QD2      LEU   3  19.444  20.199  12.096
   46    QB   LEU   3           QB       LEU   3  19.108  21.926   9.344
   47    QD   LEU   3           QQD      LEU   3  20.574  20.123  11.047
   48    H    LYS   4           H        LYS   4  16.979  18.168   8.957
   49    HA   LYS   4           HA       LYS   4  14.798  19.887   7.918
   50   1HB   LYS   4          2HB       LYS   4  15.350  16.952   8.277
   51   2HB   LYS   4          1HB       LYS   4  13.695  17.497   8.003
   52   1HG   LYS   4          2HG       LYS   4  15.119  18.913   6.104
   53   2HG   LYS   4          1HG       LYS   4  15.946  17.354   6.127
   54   1HD   LYS   4          2HD       LYS   4  12.935  17.593   5.960
   55   2HD   LYS   4          1HD       LYS   4  13.963  17.533   4.527
   56   1HE   LYS   4          2HE       LYS   4  14.729  15.334   5.033
   57   2HE   LYS   4          1HE       LYS   4  14.117  15.423   6.697
   58   1HZ   LYS   4          1HZ       LYS   4  12.371  15.698   4.316
   59   2HZ   LYS   4          3HZ       LYS   4  12.641  14.211   5.085
   60   3HZ   LYS   4          2HZ       LYS   4  11.897  15.481   5.933
   61    QB   LYS   4           QB       LYS   4  14.522  17.224   8.140
   62    QD   LYS   4           QD       LYS   4  13.449  17.563   5.243
   63    QG   LYS   4           QG       LYS   4  15.533  18.134   6.115
   64    QE   LYS   4           QE       LYS   4  14.423  15.378   5.865
   65    QZ   LYS   4           QZ       LYS   4  12.303  15.130   5.111
   66    H    VAL   5           H        VAL   5  13.050  20.515   9.176
   67    HA   VAL   5           HA       VAL   5  12.679  19.248  11.851
   68    HB   VAL   5           HB       VAL   5  12.615  21.534  12.847
   69   1HG1  VAL   5          3HG1      VAL   5  14.719  20.175  12.787
   70   2HG1  VAL   5          2HG1      VAL   5  15.162  21.000  11.293
   71   3HG1  VAL   5          1HG1      VAL   5  15.019  21.914  12.794
   72   1HG2  VAL   5          1HG2      VAL   5  12.673  22.247  10.031
   73   2HG2  VAL   5          3HG2      VAL   5  12.296  23.257  11.427
   74   3HG2  VAL   5          2HG2      VAL   5  13.970  23.051  10.915
   75    MG1  VAL   5           QG1      VAL   5  14.967  21.030  12.291
   76    MG2  VAL   5           QG2      VAL   5  12.979  22.852  10.791
   77    QG   VAL   5           QQG      VAL   5  13.973  21.941  11.541
   78    H    THR   6           H        THR   6  10.603  18.474  11.448
   79    HA   THR   6           HA       THR   6   8.565  20.480  10.529
   80    HB   THR   6           HB       THR   6   8.304  17.498  10.203
   81    HG1  THR   6           HG1      THR   6   9.741  19.280   8.530
   82   1HG2  THR   6          1HG2      THR   6   6.896  19.869   9.376
   83   2HG2  THR   6          3HG2      THR   6   7.451  18.990   7.952
   84   3HG2  THR   6          2HG2      THR   6   6.440  18.180   9.149
   85    MG   THR   6           QG2      THR   6   6.929  19.013   8.826
   86    H    VAL   7           H        VAL   7   9.376  19.978  13.298
   87    HA   VAL   7           HA       VAL   7   8.374  19.604  15.400
   88    HB   VAL   7           HB       VAL   7   5.866  19.592  13.686
   89   1HG1  VAL   7          3HG1      VAL   7   7.795  21.599  13.892
   90   2HG1  VAL   7          2HG1      VAL   7   6.126  21.814  13.366
   91   3HG1  VAL   7          1HG1      VAL   7   6.558  22.073  15.056
   92   1HG2  VAL   7          3HG2      VAL   7   5.622  18.856  16.071
   93   2HG2  VAL   7          2HG2      VAL   7   6.285  20.410  16.574
   94   3HG2  VAL   7          1HG2      VAL   7   4.751  20.345  15.708
   95    MG1  VAL   7           QG1      VAL   7   6.827  21.829  14.105
   96    MG2  VAL   7           QG2      VAL   7   5.553  19.870  16.118
   97    QG   VAL   7           QQG      VAL   7   6.190  20.850  15.111
   98    H    ASN   8           H        ASN   8   7.258  17.905  16.676
   99    HA   ASN   8           HA       ASN   8   7.345  15.265  15.271
  100   1HB   ASN   8          2HB       ASN   8   8.321  16.345  17.759
  101   2HB   ASN   8          1HB       ASN   8   7.225  15.005  18.097
  102   1HD2  ASN   8          1HD2      ASN   8   8.909  13.486  18.667
  103   2HD2  ASN   8          2HD2      ASN   8  10.018  12.896  17.525
  104    QB   ASN   8           QB       ASN   8   7.773  15.675  17.928
  105    QD   ASN   8           QD2      ASN   8   9.464  13.191  18.096
  106    H    GLY   9           H        GLY   9   5.220  14.946  14.553
  107   1HA   GLY   9          1HA       GLY   9   2.901  14.604  14.693
  108   2HA   GLY   9          2HA       GLY   9   2.888  15.772  16.016
  109    QA   GLY   9           QA       GLY   9   2.895  15.188  15.355
  110    H    ALA  10           H        ALA  10   1.429  13.221  15.843
  111    HA   ALA  10           HA       ALA  10   1.979  12.221  18.503
  112   1HB   ALA  10          2HB       ALA  10  -0.239  12.332  17.314
  113   2HB   ALA  10          3HB       ALA  10   0.113  10.740  17.988
  114   3HB   ALA  10          1HB       ALA  10   0.315  11.032  16.260
  115    MB   ALA  10           QB       ALA  10   0.063  11.368  17.187
  116    H    GLY  11           H        GLY  11   1.639   9.420  18.097
  117   1HA   GLY  11          1HA       GLY  11   4.103   8.300  18.114
  118   2HA   GLY  11          2HA       GLY  11   3.858   8.517  16.380
  119    QA   GLY  11           QA       GLY  11   3.980   8.408  17.247
  120    H    LYS  12           H        LYS  12   1.300   7.850  15.928
  121    HA   LYS  12           HA       LYS  12   0.581   5.372  17.365
  122   1HB   LYS  12          2HB       LYS  12  -0.738   7.442  16.026
  123   2HB   LYS  12          1HB       LYS  12  -0.925   6.049  14.959
  124   1HG   LYS  12          2HG       LYS  12  -2.774   6.025  16.508
  125   2HG   LYS  12          1HG       LYS  12  -1.680   4.720  16.968
  126   1HD   LYS  12          2HD       LYS  12  -1.693   5.626  19.039
  127   2HD   LYS  12          1HD       LYS  12  -0.690   6.911  18.362
  128   1HE   LYS  12          2HE       LYS  12  -2.475   8.134  19.285
  129   2HE   LYS  12          1HE       LYS  12  -3.028   7.915  17.612
  130   1HZ   LYS  12          3HZ       LYS  12  -4.153   5.878  18.300
  131   2HZ   LYS  12          2HZ       LYS  12  -3.665   6.133  19.906
  132   3HZ   LYS  12          1HZ       LYS  12  -4.743   7.214  19.161
  133    QB   LYS  12           QB       LYS  12  -0.831   6.746  15.492
  134    QD   LYS  12           QD       LYS  12  -1.191   6.268  18.701
  135    QG   LYS  12           QG       LYS  12  -2.227   5.372  16.738
  136    QE   LYS  12           QE       LYS  12  -2.751   8.024  18.449
  137    QZ   LYS  12           QZ       LYS  12  -4.187   6.408  19.122
  138    H    ALA  13           H        ALA  13   1.191   6.265  13.940
  139    HA   ALA  13           HA       ALA  13   1.279   3.594  12.935
  140   1HB   ALA  13          2HB       ALA  13   2.075   4.658  10.963
  141   2HB   ALA  13          1HB       ALA  13   1.103   5.892  11.765
  142   3HB   ALA  13          3HB       ALA  13   2.863   5.943  11.879
  143    MB   ALA  13           QB       ALA  13   2.013   5.498  11.536
  144    H    GLY  14           H        GLY  14   3.833   3.627  11.578
  145   1HA   GLY  14          1HA       GLY  14   5.623   2.077  12.461
  146   2HA   GLY  14          2HA       GLY  14   5.675   3.119  13.884
  147    QA   GLY  14           QA       GLY  14   5.649   2.598  13.172
  148    H    GLU  15           H        GLU  15   7.321   2.448  11.130
  149    HA   GLU  15           HA       GLU  15   8.380   5.249  10.941
  150   1HB   GLU  15          2HB       GLU  15   9.559   2.598  11.334
  151   2HB   GLU  15          1HB       GLU  15  10.323   3.483  10.013
  152   1HG   GLU  15          2HG       GLU  15   9.782   4.932  12.578
  153   2HG   GLU  15          1HG       GLU  15  11.149   3.820  12.510
  154    QB   GLU  15           QB       GLU  15   9.941   3.040  10.674
  155    QG   GLU  15           QG       GLU  15  10.465   4.376  12.544
  156    H    GLY  16           H        GLY  16   8.270   2.221   9.011
  157   1HA   GLY  16          1HA       GLY  16   8.235   1.983   6.656
  158   2HA   GLY  16          2HA       GLY  16   8.416   3.731   6.513
  159    QA   GLY  16           QA       GLY  16   8.326   2.857   6.584
  160    H    GLU  17           H        GLU  17   5.891   3.073   8.645
  161    HA   GLU  17           HA       GLU  17   3.779   2.566   6.697
  162   1HB   GLU  17          2HB       GLU  17   3.809   3.465   9.596
  163   2HB   GLU  17          1HB       GLU  17   2.361   2.961   8.724
  164   1HG   GLU  17          2HG       GLU  17   3.136   0.736   8.491
  165   2HG   GLU  17          1HG       GLU  17   4.793   1.184   8.897
  166    QB   GLU  17           QB       GLU  17   3.085   3.213   9.160
  167    QG   GLU  17           QG       GLU  17   3.965   0.960   8.694
  168    H    ILE  18           H        ILE  18   2.559   4.098   5.624
  169    HA   ILE  18           HA       ILE  18   3.330   6.938   5.889
  170    HB   ILE  18           HB       ILE  18   1.420   5.454   4.054
  171   1HG1  ILE  18          2HG1      ILE  18   3.647   6.309   2.617
  172   2HG1  ILE  18          1HG1      ILE  18   4.330   5.744   4.143
  173   1HG2  ILE  18          2HG2      ILE  18   2.246   8.302   4.311
  174   2HG2  ILE  18          1HG2      ILE  18   2.165   7.648   2.674
  175   3HG2  ILE  18          3HG2      ILE  18   0.736   7.618   3.707
  176   1HD1  ILE  18          1HD1      ILE  18   2.307   4.117   2.598
  177   2HD1  ILE  18          3HD1      ILE  18   4.039   3.981   2.300
  178   3HD1  ILE  18          2HD1      ILE  18   3.383   3.577   3.886
  179    MG   ILE  18           QG2      ILE  18   1.716   7.856   3.564
  180    MD   ILE  18           QD1      ILE  18   3.243   3.891   2.928
  181    QG   ILE  18           QG1      ILE  18   3.989   6.026   3.380
  182    HA   PRO  19           HA       PRO  19  -0.255   7.273   8.632
  183   1HB   PRO  19          2HB       PRO  19   0.324   9.793   9.530
  184   2HB   PRO  19          1HB       PRO  19   1.096   8.332  10.180
  185   1HG   PRO  19          2HG       PRO  19   2.136  10.307   8.214
  186   2HG   PRO  19          1HG       PRO  19   2.981   9.456   9.516
  187   1HD   PRO  19          2HD       PRO  19   3.144   8.740   6.887
  188   2HD   PRO  19          1HD       PRO  19   3.358   7.601   8.235
  189    QB   PRO  19           QB       PRO  19   0.710   9.062   9.855
  190    QG   PRO  19           QG       PRO  19   2.559   9.882   8.865
  191    QD   PRO  19           QD       PRO  19   3.251   8.170   7.561
  192    H    ALA  20           H        ALA  20  -2.222   8.491   8.464
  193    HA   ALA  20           HA       ALA  20  -2.495   9.986   5.902
  194   1HB   ALA  20          1HB       ALA  20  -4.892   9.393   7.490
  195   2HB   ALA  20          3HB       ALA  20  -4.524   8.965   5.820
  196   3HB   ALA  20          2HB       ALA  20  -3.924   7.961   7.139
  197    MB   ALA  20           QB       ALA  20  -4.447   8.773   6.817
  198    HA   PRO  21           HA       PRO  21  -2.674  13.637   8.515
  199   1HB   PRO  21          2HB       PRO  21  -3.004  15.453   6.496
  200   2HB   PRO  21          1HB       PRO  21  -1.432  14.736   6.901
  201   1HG   PRO  21          2HG       PRO  21  -3.317  14.048   4.704
  202   2HG   PRO  21          1HG       PRO  21  -1.547  14.104   4.698
  203   1HD   PRO  21          2HD       PRO  21  -2.986  11.790   4.873
  204   2HD   PRO  21          1HD       PRO  21  -1.347  11.985   5.533
  205    QB   PRO  21           QB       PRO  21  -2.218  15.094   6.699
  206    QG   PRO  21           QG       PRO  21  -2.432  14.076   4.701
  207    QD   PRO  21           QD       PRO  21  -2.166  11.888   5.203
  208    H    LEU  22           H        LEU  22  -5.056  12.451   6.288
  209    HA   LEU  22           HA       LEU  22  -7.158  14.014   7.737
  210   1HB   LEU  22          2HB       LEU  22  -6.545  14.985   5.506
  211   2HB   LEU  22          1HB       LEU  22  -7.012  13.458   4.758
  212    HG   LEU  22           HG       LEU  22  -9.193  14.067   6.359
  213   1HD1  LEU  22          2HD1      LEU  22  -7.839  16.408   6.334
  214   2HD1  LEU  22          1HD1      LEU  22  -8.766  16.588   4.844
  215   3HD1  LEU  22          3HD1      LEU  22  -9.600  16.324   6.375
  216   1HD2  LEU  22          1HD2      LEU  22  -8.491  14.061   3.495
  217   2HD2  LEU  22          3HD2      LEU  22  -9.874  13.336   4.315
  218   3HD2  LEU  22          2HD2      LEU  22  -9.897  15.048   3.891
  219    MD1  LEU  22           QD1      LEU  22  -8.735  16.440   5.851
  220    MD2  LEU  22           QD2      LEU  22  -9.420  14.148   3.900
  221    QB   LEU  22           QB       LEU  22  -6.779  14.221   5.132
  222    QD   LEU  22           QQD      LEU  22  -9.078  15.294   4.876
  223    H    ALA  23           H        ALA  23  -8.951  12.770   8.278
  224    HA   ALA  23           HA       ALA  23  -8.874   9.954   8.326
  225   1HB   ALA  23          2HB       ALA  23 -10.884  12.123   8.636
  226   2HB   ALA  23          3HB       ALA  23 -10.467  10.813   9.741
  227   3HB   ALA  23          1HB       ALA  23 -11.533  10.505   8.370
  228    MB   ALA  23           QB       ALA  23 -10.962  11.147   8.915
  229    H    GLY  24           H        GLY  24  -9.573   8.355   6.886
  230   1HA   GLY  24          1HA       GLY  24  -9.415   8.192   4.297
  231   2HA   GLY  24          2HA       GLY  24 -10.811   9.269   4.329
  232    QA   GLY  24           QA       GLY  24 -10.113   8.731   4.313
  233    H    THR  25           H        THR  25 -11.977   7.522   3.208
  234    HA   THR  25           HA       THR  25 -12.827   5.333   5.081
  235    HB   THR  25           HB       THR  25 -14.985   5.641   3.564
  236    HG1  THR  25           HG1      THR  25 -13.904   8.247   3.524
  237   1HG2  THR  25          3HG2      THR  25 -14.080   6.708   6.063
  238   2HG2  THR  25          2HG2      THR  25 -15.071   7.925   5.260
  239   3HG2  THR  25          1HG2      THR  25 -15.728   6.320   5.571
  240    MG   THR  25           QG2      THR  25 -14.960   6.984   5.631
  241    H    VAL  26           H        VAL  26 -11.719   3.564   4.250
  242    HA   VAL  26           HA       VAL  26 -10.819   3.034   1.675
  243    HB   VAL  26           HB       VAL  26 -10.376   1.658   3.653
  244   1HG1  VAL  26          3HG1      VAL  26 -10.328   0.673   1.290
  245   2HG1  VAL  26          2HG1      VAL  26 -10.438  -0.484   2.617
  246   3HG1  VAL  26          1HG1      VAL  26 -11.878  -0.070   1.685
  247   1HG2  VAL  26          2HG2      VAL  26 -12.677   1.894   4.603
  248   2HG2  VAL  26          1HG2      VAL  26 -13.252   0.748   3.391
  249   3HG2  VAL  26          3HG2      VAL  26 -12.088   0.235   4.609
  250    MG1  VAL  26           QG1      VAL  26 -10.881   0.040   1.864
  251    MG2  VAL  26           QG2      VAL  26 -12.672   0.959   4.201
  252    QG   VAL  26           QQG      VAL  26 -11.777   0.499   3.032
  253    H    SER  27           H        SER  27 -11.751   1.415   0.083
  254    HA   SER  27           HA       SER  27 -14.715   1.319  -0.048
  255   1HB   SER  27          2HB       SER  27 -14.194   3.416  -1.119
  256   2HB   SER  27          1HB       SER  27 -12.866   2.690  -2.021
  257    HG   SER  27           HG       SER  27 -15.613   1.995  -2.249
  258    QB   SER  27           QB       SER  27 -13.530   3.053  -1.570
  259    H    LYS  28           H        LYS  28 -11.615   0.537  -1.636
  260    HA   LYS  28           HA       LYS  28 -12.461  -2.257  -1.993
  261   1HB   LYS  28          2HB       LYS  28 -12.654  -0.194  -4.071
  262   2HB   LYS  28          1HB       LYS  28 -11.707  -1.592  -4.581
  263   1HG   LYS  28          2HG       LYS  28 -13.802  -2.822  -3.341
  264   2HG   LYS  28          1HG       LYS  28 -14.598  -1.388  -3.989
  265   1HD   LYS  28          2HD       LYS  28 -13.152  -2.065  -6.151
  266   2HD   LYS  28          1HD       LYS  28 -13.330  -3.666  -5.430
  267   1HE   LYS  28          2HE       LYS  28 -15.504  -3.783  -6.064
  268   2HE   LYS  28          1HE       LYS  28 -15.848  -2.184  -5.375
  269   1HZ   LYS  28          1HZ       LYS  28 -14.458  -2.677  -7.958
  270   2HZ   LYS  28          3HZ       LYS  28 -16.073  -2.183  -7.800
  271   3HZ   LYS  28          2HZ       LYS  28 -14.819  -1.156  -7.293
  272    QB   LYS  28           QB       LYS  28 -12.181  -0.893  -4.326
  273    QD   LYS  28           QD       LYS  28 -13.241  -2.865  -5.791
  274    QG   LYS  28           QG       LYS  28 -14.200  -2.105  -3.665
  275    QE   LYS  28           QE       LYS  28 -15.676  -2.984  -5.720
  276    QZ   LYS  28           QZ       LYS  28 -15.117  -2.005  -7.683
  277    H    ILE  29           H        ILE  29 -10.606  -3.341  -1.435
  278    HA   ILE  29           HA       ILE  29  -7.977  -2.050  -1.627
  279    HB   ILE  29           HB       ILE  29  -8.691  -3.487   0.263
  280   1HG1  ILE  29          2HG1      ILE  29  -6.622  -5.248  -0.811
  281   2HG1  ILE  29          1HG1      ILE  29  -6.248  -3.546  -1.086
  282   1HG2  ILE  29          1HG2      ILE  29  -9.643  -5.131  -1.832
  283   2HG2  ILE  29          3HG2      ILE  29  -8.361  -6.044  -1.034
  284   3HG2  ILE  29          2HG2      ILE  29  -9.733  -5.448  -0.099
  285   1HD1  ILE  29          2HD1      ILE  29  -7.144  -4.594   1.606
  286   2HD1  ILE  29          1HD1      ILE  29  -5.446  -4.516   1.138
  287   3HD1  ILE  29          3HD1      ILE  29  -6.400  -3.036   1.243
  288    MG   ILE  29           QG2      ILE  29  -9.246  -5.541  -0.988
  289    MD   ILE  29           QD1      ILE  29  -6.330  -4.049   1.329
  290    QG   ILE  29           QG1      ILE  29  -6.435  -4.397  -0.949
  291    H    LEU  30           H        LEU  30  -6.234  -2.838  -2.958
  292    HA   LEU  30           HA       LEU  30  -7.161  -4.373  -5.358
  293   1HB   LEU  30          2HB       LEU  30  -5.685  -1.940  -4.906
  294   2HB   LEU  30          1HB       LEU  30  -4.671  -3.079  -5.792
  295    HG   LEU  30           HG       LEU  30  -5.999  -1.728  -7.357
  296   1HD1  LEU  30          2HD1      LEU  30  -8.024  -2.157  -5.375
  297   2HD1  LEU  30          1HD1      LEU  30  -8.093  -1.119  -6.799
  298   3HD1  LEU  30          3HD1      LEU  30  -8.603  -2.804  -6.910
  299   1HD2  LEU  30          2HD2      LEU  30  -5.569  -4.310  -7.603
  300   2HD2  LEU  30          1HD2      LEU  30  -7.311  -4.433  -7.357
  301   3HD2  LEU  30          3HD2      LEU  30  -6.675  -3.506  -8.716
  302    MD1  LEU  30           QD1      LEU  30  -8.240  -2.027  -6.361
  303    MD2  LEU  30           QD2      LEU  30  -6.518  -4.083  -7.892
  304    QB   LEU  30           QB       LEU  30  -5.178  -2.510  -5.349
  305    QD   LEU  30           QQD      LEU  30  -7.379  -3.055  -7.127
  306    H    VAL  31           H        VAL  31  -4.518  -4.067  -2.989
  307    HA   VAL  31           HA       VAL  31  -3.555  -6.773  -3.867
  308    HB   VAL  31           HB       VAL  31  -1.307  -5.926  -3.181
  309   1HG1  VAL  31          1HG1      VAL  31  -2.860  -3.963  -1.885
  310   2HG1  VAL  31          3HG1      VAL  31  -1.100  -4.038  -1.968
  311   3HG1  VAL  31          2HG1      VAL  31  -2.003  -3.116  -3.172
  312   1HG2  VAL  31          2HG2      VAL  31  -2.830  -5.226  -5.453
  313   2HG2  VAL  31          1HG2      VAL  31  -1.969  -3.761  -4.978
  314   3HG2  VAL  31          3HG2      VAL  31  -1.072  -5.242  -5.313
  315    MG1  VAL  31           QG1      VAL  31  -1.988  -3.705  -2.342
  316    MG2  VAL  31           QG2      VAL  31  -1.957  -4.743  -5.248
  317    QG   VAL  31           QQG      VAL  31  -1.972  -4.224  -3.795
  318    H    LYS  32           H        LYS  32  -2.365  -7.918  -2.034
  319    HA   LYS  32           HA       LYS  32  -3.666  -7.305   0.602
  320   1HB   LYS  32          2HB       LYS  32  -3.599  -9.798   0.899
  321   2HB   LYS  32          1HB       LYS  32  -4.585  -9.295  -0.473
  322   1HG   LYS  32          2HG       LYS  32  -2.807  -9.814  -2.027
  323   2HG   LYS  32          1HG       LYS  32  -1.678 -10.117  -0.706
  324   1HD   LYS  32          2HD       LYS  32  -3.724 -11.812  -0.053
  325   2HD   LYS  32          1HD       LYS  32  -3.785 -11.862  -1.816
  326   1HE   LYS  32          2HE       LYS  32  -1.377 -12.417  -1.894
  327   2HE   LYS  32          1HE       LYS  32  -1.313 -12.373  -0.121
  328   1HZ   LYS  32          1HZ       LYS  32  -3.205 -13.995  -0.165
  329   2HZ   LYS  32          3HZ       LYS  32  -2.930 -14.180  -1.829
  330   3HZ   LYS  32          2HZ       LYS  32  -1.721 -14.613  -0.716
  331    QB   LYS  32           QB       LYS  32  -4.092  -9.546   0.213
  332    QD   LYS  32           QD       LYS  32  -3.755 -11.837  -0.935
  333    QG   LYS  32           QG       LYS  32  -2.242  -9.966  -1.367
  334    QE   LYS  32           QE       LYS  32  -1.345 -12.395  -1.007
  335    QZ   LYS  32           QZ       LYS  32  -2.619 -14.262  -0.903
  336    H    GLU  33           H        GLU  33  -2.210  -9.170   2.113
  337    HA   GLU  33           HA       GLU  33   0.365  -7.782   2.371
  338   1HB   GLU  33          2HB       GLU  33  -1.225  -8.570   4.218
  339   2HB   GLU  33          1HB       GLU  33  -0.660 -10.204   3.870
  340   1HG   GLU  33          2HG       GLU  33   1.716  -8.892   4.058
  341   2HG   GLU  33          1HG       GLU  33   0.746  -7.968   5.206
  342    QB   GLU  33           QB       GLU  33  -0.943  -9.387   4.044
  343    QG   GLU  33           QG       GLU  33   1.231  -8.430   4.632
  344    H    GLY  34           H        GLY  34   2.379  -8.653   1.853
  345   1HA   GLY  34          1HA       GLY  34   2.552 -11.492   1.028
  346   2HA   GLY  34          2HA       GLY  34   3.921 -10.416   1.307
  347    QA   GLY  34           QA       GLY  34   3.237 -10.954   1.167
  348    H    ASP  35           H        ASP  35   1.312  -9.161  -0.588
  349    HA   ASP  35           HA       ASP  35   2.171 -10.082  -3.184
  350   1HB   ASP  35          2HB       ASP  35   0.102  -8.556  -1.993
  351   2HB   ASP  35          1HB       ASP  35   0.845  -7.518  -3.211
  352    QB   ASP  35           QB       ASP  35   0.474  -8.037  -2.602
  353    H    THR  36           H        THR  36   2.889  -8.382  -4.883
  354    HA   THR  36           HA       THR  36   5.063  -6.682  -3.703
  355    HB   THR  36           HB       THR  36   4.842  -8.204  -6.321
  356    HG1  THR  36           HG1      THR  36   6.522  -8.479  -4.054
  357   1HG2  THR  36          3HG2      THR  36   7.022  -6.387  -5.260
  358   2HG2  THR  36          2HG2      THR  36   7.222  -7.474  -6.634
  359   3HG2  THR  36          1HG2      THR  36   6.064  -6.147  -6.721
  360    MG   THR  36           QG2      THR  36   6.769  -6.669  -6.205
  361    H    VAL  37           H        VAL  37   4.990  -4.513  -4.225
  362    HA   VAL  37           HA       VAL  37   3.110  -3.672  -6.409
  363    HB   VAL  37           HB       VAL  37   2.606  -1.731  -4.929
  364   1HG1  VAL  37          3HG1      VAL  37   1.397  -4.020  -4.841
  365   2HG1  VAL  37          2HG1      VAL  37   2.272  -4.270  -3.331
  366   3HG1  VAL  37          1HG1      VAL  37   1.153  -2.916  -3.488
  367   1HG2  VAL  37          3HG2      VAL  37   4.982  -2.325  -3.723
  368   2HG2  VAL  37          2HG2      VAL  37   3.730  -1.328  -2.983
  369   3HG2  VAL  37          1HG2      VAL  37   3.844  -3.041  -2.581
  370    MG1  VAL  37           QG1      VAL  37   1.607  -3.735  -3.887
  371    MG2  VAL  37           QG2      VAL  37   4.185  -2.231  -3.096
  372    QG   VAL  37           QQG      VAL  37   2.896  -2.983  -3.491
  373    H    LYS  38           H        LYS  38   3.774  -1.781  -7.594
  374    HA   LYS  38           HA       LYS  38   6.701  -1.180  -7.365
  375   1HB   LYS  38          2HB       LYS  38   5.396  -2.237  -9.431
  376   2HB   LYS  38          1HB       LYS  38   5.023  -0.544  -9.764
  377   1HG   LYS  38          2HG       LYS  38   7.502  -0.061  -9.552
  378   2HG   LYS  38          1HG       LYS  38   7.764  -1.805  -9.511
  379   1HD   LYS  38          2HD       LYS  38   7.292  -2.063 -11.730
  380   2HD   LYS  38          1HD       LYS  38   6.032  -0.829 -11.708
  381   1HE   LYS  38          2HE       LYS  38   7.668   0.952 -11.803
  382   2HE   LYS  38          1HE       LYS  38   9.001  -0.197 -11.573
  383   1HZ   LYS  38          1HZ       LYS  38   8.335  -1.328 -13.604
  384   2HZ   LYS  38          3HZ       LYS  38   7.070  -0.222 -13.834
  385   3HZ   LYS  38          2HZ       LYS  38   8.682   0.304 -13.924
  386    QB   LYS  38           QB       LYS  38   5.209  -1.391  -9.598
  387    QD   LYS  38           QD       LYS  38   6.662  -1.446 -11.719
  388    QG   LYS  38           QG       LYS  38   7.633  -0.933  -9.531
  389    QE   LYS  38           QE       LYS  38   8.335   0.377 -11.688
  390    QZ   LYS  38           QZ       LYS  38   8.029  -0.415 -13.787
  391    H    ALA  39           H        ALA  39   7.297   1.100  -7.945
  392    HA   ALA  39           HA       ALA  39   5.832   3.042  -6.434
  393   1HB   ALA  39          3HB       ALA  39   8.184   3.289  -6.808
  394   2HB   ALA  39          2HB       ALA  39   7.988   3.156  -8.556
  395   3HB   ALA  39          1HB       ALA  39   7.423   4.597  -7.713
  396    MB   ALA  39           QB       ALA  39   7.865   3.681  -7.692
  397    H    GLY  40           H        GLY  40   3.749   3.575  -7.073
  398   1HA   GLY  40          1HA       GLY  40   3.417   4.494  -9.896
  399   2HA   GLY  40          2HA       GLY  40   2.492   5.120  -8.532
  400    QA   GLY  40           QA       GLY  40   2.954   4.807  -9.214
  401    H    GLN  41           H        GLN  41   2.744   1.840  -8.033
  402    HA   GLN  41           HA       GLN  41   0.538   1.040  -9.834
  403   1HB   GLN  41          2HB       GLN  41   2.693  -0.261  -9.087
  404   2HB   GLN  41          1HB       GLN  41   1.758  -0.617  -7.635
  405   1HG   GLN  41          2HG       GLN  41  -0.102  -1.211  -9.488
  406   2HG   GLN  41          1HG       GLN  41   1.349  -1.560 -10.428
  407   1HE2  GLN  41          1HE2      GLN  41   2.529  -3.461  -9.905
  408   2HE2  GLN  41          2HE2      GLN  41   2.102  -4.511  -8.643
  409    QB   GLN  41           QB       GLN  41   2.225  -0.439  -8.361
  410    QG   GLN  41           QG       GLN  41   0.624  -1.385  -9.958
  411    QE   GLN  41           QE2      GLN  41   2.315  -3.986  -9.274
  412    H    THR  42           H        THR  42  -1.574   1.128  -9.183
  413    HA   THR  42           HA       THR  42  -2.489   2.230  -6.755
  414    HB   THR  42           HB       THR  42  -3.966   0.110  -8.323
  415    HG1  THR  42           HG1      THR  42  -4.443   1.843  -9.788
  416   1HG2  THR  42          3HG2      THR  42  -4.615   2.274  -6.469
  417   2HG2  THR  42          2HG2      THR  42  -5.548   2.360  -7.963
  418   3HG2  THR  42          1HG2      THR  42  -5.596   0.899  -6.977
  419    MG   THR  42           QG2      THR  42  -5.253   1.844  -7.136
  420    H    VAL  43           H        VAL  43  -2.816   1.388  -4.723
  421    HA   VAL  43           HA       VAL  43  -2.324  -1.549  -4.343
  422    HB   VAL  43           HB       VAL  43  -1.759   0.840  -2.554
  423   1HG1  VAL  43          3HG1      VAL  43  -0.330  -0.137  -4.737
  424   2HG1  VAL  43          2HG1      VAL  43   0.316   0.879  -3.449
  425   3HG1  VAL  43          1HG1      VAL  43   0.468  -0.874  -3.348
  426   1HG2  VAL  43          1HG2      VAL  43  -2.309  -1.716  -1.730
  427   2HG2  VAL  43          3HG2      VAL  43  -0.561  -1.790  -1.953
  428   3HG2  VAL  43          2HG2      VAL  43  -1.261  -0.597  -0.859
  429    MG1  VAL  43           QG1      VAL  43   0.151  -0.044  -3.845
  430    MG2  VAL  43           QG2      VAL  43  -1.377  -1.368  -1.514
  431    QG   VAL  43           QQG      VAL  43  -0.613  -0.706  -2.679
  432    H    LEU  44           H        LEU  44  -4.177   1.291  -3.269
  433    HA   LEU  44           HA       LEU  44  -6.386  -0.529  -2.444
  434   1HB   LEU  44          2HB       LEU  44  -4.514   0.791  -0.698
  435   2HB   LEU  44          1HB       LEU  44  -6.125   1.460  -0.432
  436    HG   LEU  44           HG       LEU  44  -6.132  -1.457  -0.728
  437   1HD1  LEU  44          1HD1      LEU  44  -4.165  -0.187   1.029
  438   2HD1  LEU  44          3HD1      LEU  44  -5.277  -1.238   1.905
  439   3HD1  LEU  44          2HD1      LEU  44  -4.325  -1.881   0.567
  440   1HD2  LEU  44          1HD2      LEU  44  -7.953   0.168   0.118
  441   2HD2  LEU  44          3HD2      LEU  44  -7.700  -1.314   1.042
  442   3HD2  LEU  44          2HD2      LEU  44  -7.031   0.211   1.623
  443    MD1  LEU  44           QD1      LEU  44  -4.589  -1.102   1.167
  444    MD2  LEU  44           QD2      LEU  44  -7.561  -0.312   0.928
  445    QB   LEU  44           QB       LEU  44  -5.320   1.125  -0.565
  446    QD   LEU  44           QQD      LEU  44  -6.075  -0.707   1.047
  447    H    VAL  45           H        VAL  45  -8.439   0.659  -2.184
  448    HA   VAL  45           HA       VAL  45  -8.447   3.247  -3.701
  449    HB   VAL  45           HB       VAL  45 -10.587   1.121  -3.339
  450   1HG1  VAL  45          1HG1      VAL  45 -10.444   3.674  -4.960
  451   2HG1  VAL  45          3HG1      VAL  45 -11.602   2.391  -5.312
  452   3HG1  VAL  45          2HG1      VAL  45 -11.653   3.223  -3.757
  453   1HG2  VAL  45          3HG2      VAL  45  -8.623   1.713  -5.564
  454   2HG2  VAL  45          2HG2      VAL  45  -8.848   0.195  -4.695
  455   3HG2  VAL  45          1HG2      VAL  45 -10.085   0.759  -5.820
  456    MG1  VAL  45           QG1      VAL  45 -11.233   3.096  -4.676
  457    MG2  VAL  45           QG2      VAL  45  -9.185   0.889  -5.360
  458    QG   VAL  45           QQG      VAL  45 -10.209   1.992  -5.018
  459    H    LEU  46           H        LEU  46  -8.782   4.959  -2.336
  460    HA   LEU  46           HA       LEU  46 -10.288   4.519   0.200
  461   1HB   LEU  46          2HB       LEU  46  -7.973   5.520   0.124
  462   2HB   LEU  46          1HB       LEU  46  -8.652   6.887  -0.757
  463    HG   LEU  46           HG       LEU  46 -10.297   6.429   1.529
  464   1HD1  LEU  46          2HD1      LEU  46  -8.583   8.555   0.363
  465   2HD1  LEU  46          1HD1      LEU  46 -10.264   8.628   0.891
  466   3HD1  LEU  46          3HD1      LEU  46  -8.962   8.718   2.078
  467   1HD2  LEU  46          3HD2      LEU  46  -7.488   5.820   1.973
  468   2HD2  LEU  46          2HD2      LEU  46  -8.001   7.207   2.934
  469   3HD2  LEU  46          1HD2      LEU  46  -8.850   5.668   3.082
  470    MD1  LEU  46           QD1      LEU  46  -9.270   8.634   1.111
  471    MD2  LEU  46           QD2      LEU  46  -8.113   6.232   2.663
  472    QB   LEU  46           QB       LEU  46  -8.313   6.203  -0.317
  473    QD   LEU  46           QQD      LEU  46  -8.691   7.433   1.887
  474    H    GLU  47           H        GLU  47 -12.020   5.975   0.765
  475    HA   GLU  47           HA       GLU  47 -13.372   7.205  -1.605
  476   1HB   GLU  47          2HB       GLU  47 -14.288   5.317   0.014
  477   2HB   GLU  47          1HB       GLU  47 -14.658   6.688   1.059
  478   1HG   GLU  47          2HG       GLU  47 -15.938   7.741  -0.767
  479   2HG   GLU  47          1HG       GLU  47 -15.565   6.374  -1.818
  480    QB   GLU  47           QB       GLU  47 -14.473   6.002   0.536
  481    QG   GLU  47           QG       GLU  47 -15.752   7.058  -1.292
  482    H    ALA  48           H        ALA  48 -13.923   9.397  -1.537
  483    HA   ALA  48           HA       ALA  48 -13.865  10.947   0.938
  484   1HB   ALA  48          1HB       ALA  48 -11.437  10.437   0.225
  485   2HB   ALA  48          3HB       ALA  48 -11.730  11.541  -1.118
  486   3HB   ALA  48          2HB       ALA  48 -11.835  12.125   0.543
  487    MB   ALA  48           QB       ALA  48 -11.667  11.368  -0.117
  488    H    MET  49           H        MET  49 -13.267  13.459  -0.310
  489    HA   MET  49           HA       MET  49 -15.748  14.272  -1.351
  490   1HB   MET  49          2HB       MET  49 -12.911  15.250  -1.491
  491   2HB   MET  49          1HB       MET  49 -14.150  16.096  -2.419
  492   1HG   MET  49          2HG       MET  49 -15.510  16.242  -0.289
  493   2HG   MET  49          1HG       MET  49 -14.097  15.632   0.573
  494   1HE   MET  49          3HE       MET  49 -15.459  17.817  -1.919
  495   2HE   MET  49          2HE       MET  49 -15.194  19.443  -1.294
  496   3HE   MET  49          1HE       MET  49 -14.058  18.756  -2.453
  497    QB   MET  49           QB       MET  49 -13.530  15.673  -1.955
  498    QG   MET  49           QG       MET  49 -14.804  15.937   0.142
  499    ME   MET  49           QE       MET  49 -14.904  18.672  -1.889
  500    H    LYS  50           H        LYS  50 -13.058  12.713  -2.989
  501    HA   LYS  50           HA       LYS  50 -14.142  13.276  -5.676
  502   1HB   LYS  50          2HB       LYS  50 -11.670  12.466  -4.431
  503   2HB   LYS  50          1HB       LYS  50 -12.081  11.331  -5.717
  504   1HG   LYS  50          2HG       LYS  50 -12.563  14.110  -6.487
  505   2HG   LYS  50          1HG       LYS  50 -10.875  13.808  -6.071
  506   1HD   LYS  50          2HD       LYS  50 -11.466  11.588  -7.560
  507   2HD   LYS  50          1HD       LYS  50 -12.455  12.813  -8.356
  508   1HE   LYS  50          2HE       LYS  50  -9.542  13.315  -7.696
  509   2HE   LYS  50          1HE       LYS  50 -10.048  12.578  -9.230
  510   1HZ   LYS  50          3HZ       LYS  50 -11.606  14.444  -9.522
  511   2HZ   LYS  50          2HZ       LYS  50 -10.980  15.175  -8.122
  512   3HZ   LYS  50          1HZ       LYS  50  -9.991  14.959  -9.487
  513    QB   LYS  50           QB       LYS  50 -11.875  11.899  -5.074
  514    QD   LYS  50           QD       LYS  50 -11.961  12.200  -7.958
  515    QG   LYS  50           QG       LYS  50 -11.719  13.959  -6.279
  516    QE   LYS  50           QE       LYS  50  -9.795  12.947  -8.463
  517    QZ   LYS  50           QZ       LYS  50 -10.859  14.859  -9.044
  518    H    MET  51           H        MET  51 -14.777  10.988  -3.246
  519    HA   MET  51           HA       MET  51 -15.940   8.930  -3.275
  520   1HB   MET  51          2HB       MET  51 -17.111  10.693  -5.015
  521   2HB   MET  51          1HB       MET  51 -16.793   9.323  -6.079
  522   1HG   MET  51          2HG       MET  51 -18.167   7.886  -4.863
  523   2HG   MET  51          1HG       MET  51 -18.013   8.831  -3.381
  524   1HE   MET  51          3HE       MET  51 -18.479  10.389  -6.857
  525   2HE   MET  51          2HE       MET  51 -19.328   8.857  -7.054
  526   3HE   MET  51          1HE       MET  51 -20.231  10.370  -7.106
  527    QB   MET  51           QB       MET  51 -16.952  10.008  -5.547
  528    QG   MET  51           QG       MET  51 -18.090   8.359  -4.122
  529    ME   MET  51           QE       MET  51 -19.346   9.872  -7.006
  530    H    GLU  52           H        GLU  52 -13.137   9.271  -4.623
  531    HA   GLU  52           HA       GLU  52 -12.720   6.525  -5.320
  532   1HB   GLU  52          2HB       GLU  52 -13.936   8.179  -7.320
  533   2HB   GLU  52          1HB       GLU  52 -12.303   7.784  -7.860
  534   1HG   GLU  52          2HG       GLU  52 -14.139   5.660  -6.755
  535   2HG   GLU  52          1HG       GLU  52 -14.187   6.117  -8.457
  536    QB   GLU  52           QB       GLU  52 -13.120   7.981  -7.590
  537    QG   GLU  52           QG       GLU  52 -14.163   5.889  -7.606
  538    H    THR  53           H        THR  53 -10.785   6.844  -4.111
  539    HA   THR  53           HA       THR  53  -8.772   8.678  -5.376
  540    HB   THR  53           HB       THR  53  -8.904   7.778  -2.488
  541    HG1  THR  53           HG1      THR  53 -10.002  10.071  -3.742
  542   1HG2  THR  53          1HG2      THR  53  -7.084   9.349  -4.083
  543   2HG2  THR  53          3HG2      THR  53  -7.779  10.346  -2.805
  544   3HG2  THR  53          2HG2      THR  53  -6.934   8.853  -2.398
  545    MG   THR  53           QG2      THR  53  -7.266   9.516  -3.095
  546    H    GLU  54           H        GLU  54  -7.703   7.124  -6.669
  547    HA   GLU  54           HA       GLU  54  -7.071   4.447  -5.881
  548   1HB   GLU  54          2HB       GLU  54  -5.503   4.603  -7.790
  549   2HB   GLU  54          1HB       GLU  54  -7.050   5.348  -8.193
  550   1HG   GLU  54          2HG       GLU  54  -5.640   7.442  -7.060
  551   2HG   GLU  54          1HG       GLU  54  -4.397   6.574  -7.959
  552    QB   GLU  54           QB       GLU  54  -6.277   4.975  -7.991
  553    QG   GLU  54           QG       GLU  54  -5.018   7.008  -7.509
  554    H    ILE  55           H        ILE  55  -5.531   3.733  -4.442
  555    HA   ILE  55           HA       ILE  55  -3.588   5.729  -3.373
  556    HB   ILE  55           HB       ILE  55  -4.406   2.985  -2.366
  557   1HG1  ILE  55          2HG1      ILE  55  -6.327   4.532  -2.460
  558   2HG1  ILE  55          1HG1      ILE  55  -5.846   4.238  -0.789
  559   1HG2  ILE  55          2HG2      ILE  55  -2.394   4.904  -1.566
  560   2HG2  ILE  55          1HG2      ILE  55  -3.585   4.697  -0.282
  561   3HG2  ILE  55          3HG2      ILE  55  -2.716   3.297  -0.912
  562   1HD1  ILE  55          3HD1      ILE  55  -4.278   6.408  -1.563
  563   2HD1  ILE  55          2HD1      ILE  55  -5.847   6.735  -2.297
  564   3HD1  ILE  55          1HD1      ILE  55  -5.724   6.480  -0.557
  565    MG   ILE  55           QG2      ILE  55  -2.898   4.299  -0.920
  566    MD   ILE  55           QD1      ILE  55  -5.283   6.541  -1.472
  567    QG   ILE  55           QG1      ILE  55  -6.087   4.385  -1.624
  568    H    ASN  56           H        ASN  56  -2.203   5.490  -5.320
  569    HA   ASN  56           HA       ASN  56  -0.994   2.958  -6.028
  570   1HB   ASN  56          2HB       ASN  56  -0.195   5.838  -6.536
  571   2HB   ASN  56          1HB       ASN  56   0.453   4.441  -7.395
  572   1HD2  ASN  56          1HD2      ASN  56  -0.463   4.775  -9.473
  573   2HD2  ASN  56          2HD2      ASN  56  -2.135   4.855  -9.759
  574    QB   ASN  56           QB       ASN  56   0.129   5.140  -6.965
  575    QD   ASN  56           QD2      ASN  56  -1.299   4.815  -9.616
  576    H    ALA  57           H        ALA  57   0.777   2.000  -5.184
  577    HA   ALA  57           HA       ALA  57   1.888   2.585  -2.680
  578   1HB   ALA  57          3HB       ALA  57   3.140   1.310  -5.134
  579   2HB   ALA  57          2HB       ALA  57   3.771   1.149  -3.496
  580   3HB   ALA  57          1HB       ALA  57   2.190   0.485  -3.899
  581    MB   ALA  57           QB       ALA  57   3.034   0.982  -4.176
  582    HA   PRO  58           HA       PRO  58   4.379   6.161  -3.474
  583   1HB   PRO  58          2HB       PRO  58   5.992   6.050  -1.268
  584   2HB   PRO  58          1HB       PRO  58   4.295   6.567  -1.199
  585   1HG   PRO  58          2HG       PRO  58   5.510   3.958  -0.462
  586   2HG   PRO  58          1HG       PRO  58   4.174   4.837   0.295
  587   1HD   PRO  58          2HD       PRO  58   3.853   2.687  -1.379
  588   2HD   PRO  58          1HD       PRO  58   2.621   3.939  -1.112
  589    QB   PRO  58           QB       PRO  58   5.143   6.309  -1.233
  590    QG   PRO  58           QG       PRO  58   4.842   4.398  -0.083
  591    QD   PRO  58           QD       PRO  58   3.237   3.313  -1.246
  592    H    THR  59           H        THR  59   5.893   3.047  -2.708
  593    HA   THR  59           HA       THR  59   8.047   3.673  -4.672
  594    HB   THR  59           HB       THR  59   8.817   4.309  -2.401
  595    HG1  THR  59           HG1      THR  59   9.954   1.932  -3.445
  596   1HG2  THR  59          1HG2      THR  59   7.383   1.974  -1.675
  597   2HG2  THR  59          3HG2      THR  59   9.076   1.674  -1.283
  598   3HG2  THR  59          2HG2      THR  59   8.250   3.080  -0.610
  599    MG   THR  59           QG2      THR  59   8.236   2.242  -1.189
  600    H    ASP  60           H        ASP  60   9.211   1.668  -5.335
  601    HA   ASP  60           HA       ASP  60   7.382  -0.585  -5.644
  602   1HB   ASP  60          2HB       ASP  60   9.286  -1.477  -6.963
  603   2HB   ASP  60          1HB       ASP  60   8.941   0.199  -7.392
  604    QB   ASP  60           QB       ASP  60   9.113  -0.639  -7.178
  605    H    GLY  61           H        GLY  61   7.349  -2.442  -4.406
  606   1HA   GLY  61          1HA       GLY  61   8.931  -2.573  -1.977
  607   2HA   GLY  61          2HA       GLY  61   9.463  -3.758  -3.171
  608    QA   GLY  61           QA       GLY  61   9.197  -3.166  -2.574
  609    H    LYS  62           H        LYS  62   8.639  -5.120  -1.192
  610    HA   LYS  62           HA       LYS  62   5.945  -6.113  -1.916
  611   1HB   LYS  62          2HB       LYS  62   8.101  -7.477  -1.555
  612   2HB   LYS  62          1HB       LYS  62   7.865  -7.174   0.167
  613   1HG   LYS  62          2HG       LYS  62   5.465  -8.065  -0.202
  614   2HG   LYS  62          1HG       LYS  62   6.082  -8.704  -1.725
  615   1HD   LYS  62          2HD       LYS  62   7.205  -9.301   1.029
  616   2HD   LYS  62          1HD       LYS  62   6.245 -10.405   0.044
  617   1HE   LYS  62          2HE       LYS  62   8.162  -9.821  -1.758
  618   2HE   LYS  62          1HE       LYS  62   9.096  -9.597  -0.267
  619   1HZ   LYS  62          1HZ       LYS  62   7.406 -11.962  -0.892
  620   2HZ   LYS  62          3HZ       LYS  62   9.099 -11.924  -0.988
  621   3HZ   LYS  62          2HZ       LYS  62   8.330 -11.740   0.516
  622    QB   LYS  62           QB       LYS  62   7.983  -7.326  -0.694
  623    QD   LYS  62           QD       LYS  62   6.725  -9.853   0.537
  624    QG   LYS  62           QG       LYS  62   5.774  -8.384  -0.964
  625    QE   LYS  62           QE       LYS  62   8.629  -9.709  -1.012
  626    QZ   LYS  62           QZ       LYS  62   8.278 -11.875  -0.455
  627    H    VAL  63           H        VAL  63   4.252  -6.336  -0.321
  628    HA   VAL  63           HA       VAL  63   4.140  -4.177   1.633
  629    HB   VAL  63           HB       VAL  63   2.366  -6.476   0.779
  630   1HG1  VAL  63          1HG1      VAL  63   2.671  -4.420  -0.651
  631   2HG1  VAL  63          3HG1      VAL  63   1.006  -4.706  -0.142
  632   3HG1  VAL  63          2HG1      VAL  63   1.977  -3.476   0.668
  633   1HG2  VAL  63          1HG2      VAL  63   1.864  -4.441   2.972
  634   2HG2  VAL  63          3HG2      VAL  63   0.591  -5.401   2.219
  635   3HG2  VAL  63          2HG2      VAL  63   1.870  -6.196   3.136
  636    MG1  VAL  63           QG1      VAL  63   1.885  -4.201  -0.041
  637    MG2  VAL  63           QG2      VAL  63   1.441  -5.346   2.776
  638    QG   VAL  63           QQG      VAL  63   1.663  -4.773   1.367
  639    H    GLU  64           H        GLU  64   4.760  -4.305   3.743
  640    HA   GLU  64           HA       GLU  64   5.380  -7.004   4.879
  641   1HB   GLU  64          2HB       GLU  64   6.361  -4.201   5.505
  642   2HB   GLU  64          1HB       GLU  64   6.859  -5.644   6.388
  643   1HG   GLU  64          2HG       GLU  64   7.108  -6.021   3.512
  644   2HG   GLU  64          1HG       GLU  64   8.049  -4.636   4.066
  645    QB   GLU  64           QB       GLU  64   6.610  -4.922   5.946
  646    QG   GLU  64           QG       GLU  64   7.578  -5.328   3.789
  647    H    LYS  65           H        LYS  65   2.987  -4.654   4.969
  648    HA   LYS  65           HA       LYS  65   1.683  -5.767   7.279
  649   1HB   LYS  65          2HB       LYS  65   3.801  -4.098   7.892
  650   2HB   LYS  65          1HB       LYS  65   2.421  -3.001   7.969
  651   1HG   LYS  65          2HG       LYS  65   1.585  -3.993   9.831
  652   2HG   LYS  65          1HG       LYS  65   1.938  -5.616   9.235
  653   1HD   LYS  65          2HD       LYS  65   4.425  -4.997   9.694
  654   2HD   LYS  65          1HD       LYS  65   3.755  -3.715  10.704
  655   1HE   LYS  65          2HE       LYS  65   3.671  -5.297  12.345
  656   2HE   LYS  65          1HE       LYS  65   2.277  -5.950  11.460
  657   1HZ   LYS  65          3HZ       LYS  65   3.847  -7.205  10.066
  658   2HZ   LYS  65          2HZ       LYS  65   5.132  -6.661  11.035
  659   3HZ   LYS  65          1HZ       LYS  65   3.932  -7.666  11.696
  660    QB   LYS  65           QB       LYS  65   3.111  -3.550   7.930
  661    QD   LYS  65           QD       LYS  65   4.090  -4.356  10.199
  662    QG   LYS  65           QG       LYS  65   1.762  -4.804   9.533
  663    QE   LYS  65           QE       LYS  65   2.974  -5.624  11.903
  664    QZ   LYS  65           QZ       LYS  65   4.304  -7.177  10.932
  665    H    VAL  66           H        VAL  66  -0.470  -5.116   7.246
  666    HA   VAL  66           HA       VAL  66  -1.183  -2.936   5.315
  667    HB   VAL  66           HB       VAL  66  -2.784  -5.299   6.355
  668   1HG1  VAL  66          3HG1      VAL  66  -0.695  -5.135   4.382
  669   2HG1  VAL  66          2HG1      VAL  66  -1.634  -6.544   4.876
  670   3HG1  VAL  66          1HG1      VAL  66  -2.223  -5.502   3.581
  671   1HG2  VAL  66          3HG2      VAL  66  -3.303  -3.114   4.349
  672   2HG2  VAL  66          2HG2      VAL  66  -4.090  -4.682   4.179
  673   3HG2  VAL  66          1HG2      VAL  66  -4.358  -3.715   5.629
  674    MG1  VAL  66           QG1      VAL  66  -1.517  -5.727   4.279
  675    MG2  VAL  66           QG2      VAL  66  -3.917  -3.837   4.719
  676    QG   VAL  66           QQG      VAL  66  -2.717  -4.782   4.499
  677    H    LEU  67           H        LEU  67  -1.023  -1.229   6.926
  678    HA   LEU  67           HA       LEU  67  -2.088  -1.194   9.522
  679   1HB   LEU  67          2HB       LEU  67  -1.138   0.634   7.530
  680   2HB   LEU  67          1HB       LEU  67  -2.602   1.312   8.237
  681    HG   LEU  67           HG       LEU  67  -0.746   2.070   9.574
  682   1HD1  LEU  67          1HD1      LEU  67   0.064  -0.839   9.544
  683   2HD1  LEU  67          3HD1      LEU  67   0.977   0.552   8.958
  684   3HD1  LEU  67          2HD1      LEU  67   0.735   0.322  10.690
  685   1HD2  LEU  67          2HD2      LEU  67  -2.880   0.710  10.633
  686   2HD2  LEU  67          1HD2      LEU  67  -1.520  -0.126  11.381
  687   3HD2  LEU  67          3HD2      LEU  67  -1.703   1.617  11.582
  688    MD1  LEU  67           QD1      LEU  67   0.592   0.012   9.730
  689    MD2  LEU  67           QD2      LEU  67  -2.035   0.734  11.199
  690    QB   LEU  67           QB       LEU  67  -1.870   0.973   7.884
  691    QD   LEU  67           QQD      LEU  67  -0.721   0.373  10.465
  692    H    VAL  68           H        VAL  68  -3.762   0.019   6.589
  693    HA   VAL  68           HA       VAL  68  -6.353  -0.139   8.034
  694    HB   VAL  68           HB       VAL  68  -5.540   0.953   5.321
  695   1HG1  VAL  68          3HG1      VAL  68  -8.120   0.925   6.867
  696   2HG1  VAL  68          2HG1      VAL  68  -7.760   2.266   5.780
  697   3HG1  VAL  68          1HG1      VAL  68  -7.852   0.621   5.150
  698   1HG2  VAL  68          2HG2      VAL  68  -4.894   1.913   7.837
  699   2HG2  VAL  68          1HG2      VAL  68  -4.959   2.879   6.362
  700   3HG2  VAL  68          3HG2      VAL  68  -6.357   2.815   7.435
  701    MG1  VAL  68           QG1      VAL  68  -7.911   1.271   5.932
  702    MG2  VAL  68           QG2      VAL  68  -5.403   2.536   7.211
  703    QG   VAL  68           QQG      VAL  68  -6.657   1.903   6.572
  704    H    LYS  69           H        LYS  69  -7.923  -1.639   7.510
  705    HA   LYS  69           HA       LYS  69  -7.207  -3.748   5.539
  706   1HB   LYS  69          2HB       LYS  69  -8.305  -3.699   8.095
  707   2HB   LYS  69          1HB       LYS  69  -9.703  -3.999   7.062
  708   1HG   LYS  69          2HG       LYS  69  -9.052  -6.125   6.724
  709   2HG   LYS  69          1HG       LYS  69  -7.472  -5.584   6.152
  710   1HD   LYS  69          2HD       LYS  69  -8.143  -5.693   9.095
  711   2HD   LYS  69          1HD       LYS  69  -7.492  -7.090   8.238
  712   1HE   LYS  69          2HE       LYS  69  -5.622  -5.489   7.426
  713   2HE   LYS  69          1HE       LYS  69  -6.176  -4.414   8.726
  714   1HZ   LYS  69          3HZ       LYS  69  -6.057  -6.376  10.230
  715   2HZ   LYS  69          2HZ       LYS  69  -5.291  -7.237   8.982
  716   3HZ   LYS  69          1HZ       LYS  69  -4.548  -5.863   9.652
  717    QB   LYS  69           QB       LYS  69  -9.004  -3.849   7.578
  718    QD   LYS  69           QD       LYS  69  -7.818  -6.391   8.666
  719    QG   LYS  69           QG       LYS  69  -8.262  -5.854   6.438
  720    QE   LYS  69           QE       LYS  69  -5.899  -4.951   8.076
  721    QZ   LYS  69           QZ       LYS  69  -5.298  -6.492   9.621
  722    H    GLU  70           H        GLU  70  -9.783  -4.602   4.855
  723    HA   GLU  70           HA       GLU  70 -10.584  -2.470   2.961
  724   1HB   GLU  70          2HB       GLU  70 -10.158  -5.030   2.557
  725   2HB   GLU  70          1HB       GLU  70 -11.795  -5.217   3.185
  726   1HG   GLU  70          2HG       GLU  70 -12.365  -3.301   1.476
  727   2HG   GLU  70          1HG       GLU  70 -10.876  -3.826   0.688
  728    QB   GLU  70           QB       GLU  70 -10.976  -5.124   2.871
  729    QG   GLU  70           QG       GLU  70 -11.621  -3.564   1.082
  730    H    ARG  71           H        ARG  71 -12.415  -1.262   3.245
  731    HA   ARG  71           HA       ARG  71 -14.539  -0.583   4.028
  732   1HB   ARG  71          2HB       ARG  71 -14.897  -3.144   3.652
  733   2HB   ARG  71          1HB       ARG  71 -14.803  -3.250   5.409
  734   1HG   ARG  71          2HG       ARG  71 -16.951  -2.601   5.542
  735   2HG   ARG  71          1HG       ARG  71 -16.512  -1.062   4.801
  736   1HD   ARG  71          2HD       ARG  71 -16.578  -2.971   2.695
  737   2HD   ARG  71          1HD       ARG  71 -18.052  -3.207   3.655
  738    HE   ARG  71           HE       ARG  71 -17.473  -0.392   3.237
  739   1HH1  ARG  71          1HH1      ARG  71 -19.960  -0.037   2.975
  740   2HH1  ARG  71          2HH1      ARG  71 -20.543  -0.592   1.441
  741   1HH2  ARG  71          1HH2      ARG  71 -17.726  -2.496   0.761
  742   2HH2  ARG  71          2HH2      ARG  71 -19.278  -1.983   0.188
  743    QB   ARG  71           QB       ARG  71 -14.850  -3.197   4.531
  744    QG   ARG  71           QG       ARG  71 -16.731  -1.832   5.172
  745    QD   ARG  71           QD       ARG  71 -17.315  -3.089   3.175
  746    QH1  ARG  71           QH1      ARG  71 -20.251  -0.315   2.208
  747    QH2  ARG  71           QH2      ARG  71 -18.502  -2.240   0.474
  748    H    ASP  72           H        ASP  72 -11.883  -1.175   5.907
  749    HA   ASP  72           HA       ASP  72 -13.212  -0.549   8.498
  750   1HB   ASP  72          2HB       ASP  72 -10.625  -1.678   7.535
  751   2HB   ASP  72          1HB       ASP  72 -10.579  -0.779   9.053
  752    QB   ASP  72           QB       ASP  72 -10.602  -1.229   8.294
  753    H    ALA  73           H        ALA  73 -13.759   1.691   7.842
  754    HA   ALA  73           HA       ALA  73 -12.038   3.653   6.830
  755   1HB   ALA  73          3HB       ALA  73 -14.339   3.629   8.768
  756   2HB   ALA  73          2HB       ALA  73 -13.529   5.148   8.387
  757   3HB   ALA  73          1HB       ALA  73 -14.298   4.215   7.105
  758    MB   ALA  73           QB       ALA  73 -14.055   4.330   8.087
  759    H    VAL  74           H        VAL  74 -10.744   5.295   7.894
  760    HA   VAL  74           HA       VAL  74  -9.901   4.716  10.698
  761    HB   VAL  74           HB       VAL  74  -7.544   4.779   9.956
  762   1HG1  VAL  74          2HG1      VAL  74  -8.021   6.278   7.976
  763   2HG1  VAL  74          1HG1      VAL  74  -6.963   4.913   7.615
  764   3HG1  VAL  74          3HG1      VAL  74  -8.661   4.864   7.138
  765   1HG2  VAL  74          1HG2      VAL  74  -9.128   2.665   9.824
  766   2HG2  VAL  74          3HG2      VAL  74  -8.866   2.839   8.088
  767   3HG2  VAL  74          2HG2      VAL  74  -7.493   2.591   9.167
  768    MG1  VAL  74           QG1      VAL  74  -7.882   5.352   7.576
  769    MG2  VAL  74           QG2      VAL  74  -8.495   2.698   9.026
  770    QG   VAL  74           QQG      VAL  74  -8.188   4.025   8.301
  771    H    GLN  75           H        GLN  75  -8.775   6.587  11.673
  772    HA   GLN  75           HA       GLN  75  -9.644   9.157  10.433
  773   1HB   GLN  75          2HB       GLN  75  -9.408  10.007  12.718
  774   2HB   GLN  75          1HB       GLN  75 -10.346   8.515  12.745
  775   1HG   GLN  75          2HG       GLN  75  -8.874   7.770  14.290
  776   2HG   GLN  75          1HG       GLN  75  -7.716   7.631  12.968
  777   1HE2  GLN  75          1HE2      GLN  75  -6.054   8.160  14.703
  778   2HE2  GLN  75          2HE2      GLN  75  -5.797   9.789  15.107
  779    QB   GLN  75           QB       GLN  75  -9.877   9.261  12.732
  780    QG   GLN  75           QG       GLN  75  -8.295   7.701  13.629
  781    QE   GLN  75           QE2      GLN  75  -5.925   8.974  14.905
  782    H    GLY  76           H        GLY  76  -8.129  10.914  10.247
  783   1HA   GLY  76          1HA       GLY  76  -6.026  11.887   9.861
  784   2HA   GLY  76          2HA       GLY  76  -5.537  10.277   9.326
  785    QA   GLY  76           QA       GLY  76  -5.782  11.082   9.593
  786    H    GLY  77           H        GLY  77  -3.553  10.077  10.345
  787   1HA   GLY  77          1HA       GLY  77  -3.567  10.361  13.324
  788   2HA   GLY  77          2HA       GLY  77  -2.161  10.765  12.340
  789    QA   GLY  77           QA       GLY  77  -2.864  10.563  12.832
  790    H    GLN  78           H        GLN  78  -3.720   8.053  11.048
  791    HA   GLN  78           HA       GLN  78  -1.945   6.205  12.606
  792   1HB   GLN  78          2HB       GLN  78  -4.723   6.085  11.523
  793   2HB   GLN  78          1HB       GLN  78  -3.794   4.586  11.518
  794   1HG   GLN  78          2HG       GLN  78  -3.229   5.513  14.015
  795   2HG   GLN  78          1HG       GLN  78  -4.867   6.131  13.802
  796   1HE2  GLN  78          1HE2      GLN  78  -6.153   4.647  14.949
  797   2HE2  GLN  78          2HE2      GLN  78  -6.119   2.967  14.708
  798    QB   GLN  78           QB       GLN  78  -4.259   5.335  11.520
  799    QG   GLN  78           QG       GLN  78  -4.048   5.822  13.909
  800    QE   GLN  78           QE2      GLN  78  -6.136   3.807  14.829
  801    H    GLY  79           H        GLY  79  -0.772   4.628  11.393
  802   1HA   GLY  79          1HA       GLY  79   0.407   3.810   9.539
  803   2HA   GLY  79          2HA       GLY  79   0.220   5.423   8.853
  804    QA   GLY  79           QA       GLY  79   0.314   4.617   9.196
  805    H    LEU  80           H        LEU  80  -0.080   4.285   6.772
  806    HA   LEU  80           HA       LEU  80  -2.915   3.376   6.437
  807   1HB   LEU  80          2HB       LEU  80  -0.876   4.661   4.597
  808   2HB   LEU  80          1HB       LEU  80  -2.442   4.073   4.040
  809    HG   LEU  80           HG       LEU  80  -2.206   6.019   6.338
  810   1HD1  LEU  80          2HD1      LEU  80  -1.915   6.473   3.420
  811   2HD1  LEU  80          1HD1      LEU  80  -3.023   7.562   4.256
  812   3HD1  LEU  80          3HD1      LEU  80  -1.341   7.449   4.773
  813   1HD2  LEU  80          2HD2      LEU  80  -4.324   4.568   5.174
  814   2HD2  LEU  80          1HD2      LEU  80  -4.456   5.888   6.335
  815   3HD2  LEU  80          3HD2      LEU  80  -4.517   6.226   4.606
  816    MD1  LEU  80           QD1      LEU  80  -2.093   7.161   4.149
  817    MD2  LEU  80           QD2      LEU  80  -4.432   5.561   5.372
  818    QB   LEU  80           QB       LEU  80  -1.659   4.367   4.318
  819    QD   LEU  80           QQD      LEU  80  -3.263   6.361   4.761
  820    H    ILE  81           H        ILE  81   0.390   2.771   5.199
  821    HA   ILE  81           HA       ILE  81  -0.142  -0.138   5.164
  822    HB   ILE  81           HB       ILE  81   0.475  -0.218   2.723
  823   1HG1  ILE  81          2HG1      ILE  81  -0.179   2.688   2.498
  824   2HG1  ILE  81          1HG1      ILE  81   1.442   2.266   3.051
  825   1HG2  ILE  81          2HG2      ILE  81  -1.919  -0.117   3.653
  826   2HG2  ILE  81          1HG2      ILE  81  -1.916   1.577   3.165
  827   3HG2  ILE  81          3HG2      ILE  81  -1.712   0.310   1.954
  828   1HD1  ILE  81          2HD1      ILE  81   1.729   0.809   1.069
  829   2HD1  ILE  81          1HD1      ILE  81   0.125   1.276   0.505
  830   3HD1  ILE  81          3HD1      ILE  81   1.410   2.480   0.604
  831    MG   ILE  81           QG2      ILE  81  -1.849   0.590   2.924
  832    MD   ILE  81           QD1      ILE  81   1.088   1.522   0.726
  833    QG   ILE  81           QG1      ILE  81   0.631   2.477   2.775
  834    H    LYS  82           H        LYS  82   1.837  -1.349   5.082
  835    HA   LYS  82           HA       LYS  82   4.294   0.304   5.525
  836   1HB   LYS  82          2HB       LYS  82   3.393  -1.204   7.330
  837   2HB   LYS  82          1HB       LYS  82   3.691  -2.577   6.264
  838   1HG   LYS  82          2HG       LYS  82   6.001  -2.370   6.414
  839   2HG   LYS  82          1HG       LYS  82   5.926  -0.650   6.797
  840   1HD   LYS  82          2HD       LYS  82   4.708  -1.478   8.977
  841   2HD   LYS  82          1HD       LYS  82   5.500  -3.010   8.605
  842   1HE   LYS  82          2HE       LYS  82   7.691  -1.976   8.668
  843   2HE   LYS  82          1HE       LYS  82   6.972  -0.359   8.810
  844   1HZ   LYS  82          3HZ       LYS  82   6.336  -2.524  10.724
  845   2HZ   LYS  82          2HZ       LYS  82   7.663  -1.490  10.963
  846   3HZ   LYS  82          1HZ       LYS  82   6.087  -0.857  10.903
  847    QB   LYS  82           QB       LYS  82   3.542  -1.890   6.797
  848    QD   LYS  82           QD       LYS  82   5.104  -2.244   8.791
  849    QG   LYS  82           QG       LYS  82   5.964  -1.510   6.605
  850    QE   LYS  82           QE       LYS  82   7.331  -1.168   8.739
  851    QZ   LYS  82           QZ       LYS  82   6.695  -1.624  10.863
  852    H    ILE  83           H        ILE  83   6.088  -0.039   4.213
  853    HA   ILE  83           HA       ILE  83   6.140  -2.384   2.387
  854    HB   ILE  83           HB       ILE  83   4.867  -0.600   1.245
  855   1HG1  ILE  83          2HG1      ILE  83   7.515  -0.455  -0.118
  856   2HG1  ILE  83          1HG1      ILE  83   6.861  -2.067   0.180
  857   1HG2  ILE  83          2HG2      ILE  83   6.450   1.133   2.620
  858   2HG2  ILE  83          1HG2      ILE  83   7.234   1.171   1.041
  859   3HG2  ILE  83          3HG2      ILE  83   5.526   1.587   1.187
  860   1HD1  ILE  83          1HD1      ILE  83   5.154   0.095  -1.044
  861   2HD1  ILE  83          3HD1      ILE  83   6.217  -0.898  -2.042
  862   3HD1  ILE  83          2HD1      ILE  83   4.927  -1.652  -1.106
  863    MG   ILE  83           QG2      ILE  83   6.403   1.297   1.616
  864    MD   ILE  83           QD1      ILE  83   5.433  -0.818  -1.397
  865    QG   ILE  83           QG1      ILE  83   7.188  -1.261   0.031
  866    H    GLY  84           H        GLY  84   7.831  -1.847   4.599
  867   1HA   GLY  84          1HA       GLY  84  10.084  -1.477   5.185
  868   2HA   GLY  84          2HA       GLY  84  10.245  -0.474   3.744
  869    QA   GLY  84           QA       GLY  84  10.164  -0.976   4.464

  No H/Q in entry =         869
  Start of MODEL    8
    1    H1   MET   1          2H        MET   1  13.444   8.833   5.143
    2    H2   MET   1          1H        MET   1  11.843   8.266   5.106
    3    H3   MET   1          3H        MET   1  12.839   8.074   3.747
    4    HA   MET   1           HA       MET   1  12.825  10.381   3.267
    5   1HB   MET   1          2HB       MET   1  10.354   8.856   3.847
    6   2HB   MET   1          1HB       MET   1  10.120  10.587   3.606
    7   1HG   MET   1          2HG       MET   1  11.418  10.420   1.474
    8   2HG   MET   1          1HG       MET   1  11.492   8.672   1.699
    9   1HE   MET   1          2HE       MET   1  10.807   8.218  -0.263
   10   2HE   MET   1          1HE       MET   1   9.391   7.241   0.117
   11   3HE   MET   1          3HE       MET   1   9.281   8.537  -1.083
   12    QB   MET   1           QB       MET   1  10.237   9.722   3.727
   13    QG   MET   1           QG       MET   1  11.455   9.546   1.587
   14    ME   MET   1           QE       MET   1   9.827   7.999  -0.410
   15    H    LYS   2           H        LYS   2  13.999  11.043   5.454
   16    HA   LYS   2           HA       LYS   2  12.297  13.099   6.720
   17   1HB   LYS   2          2HB       LYS   2  12.134  10.746   7.871
   18   2HB   LYS   2          1HB       LYS   2  13.736  11.139   8.497
   19   1HG   LYS   2          2HG       LYS   2  12.954  12.882   9.802
   20   2HG   LYS   2          1HG       LYS   2  11.593  13.212   8.729
   21   1HD   LYS   2          2HD       LYS   2  11.839  10.780  10.525
   22   2HD   LYS   2          1HD       LYS   2  10.852  12.200  10.873
   23   1HE   LYS   2          2HE       LYS   2  10.078  11.499   8.287
   24   2HE   LYS   2          1HE       LYS   2  10.257   9.941   9.118
   25   1HZ   LYS   2          3HZ       LYS   2   8.921  12.243  10.408
   26   2HZ   LYS   2          2HZ       LYS   2   8.057  11.162   9.421
   27   3HZ   LYS   2          1HZ       LYS   2   8.831  10.602  10.827
   28    QB   LYS   2           QB       LYS   2  12.935  10.943   8.184
   29    QD   LYS   2           QD       LYS   2  11.345  11.490  10.699
   30    QG   LYS   2           QG       LYS   2  12.274  13.047   9.266
   31    QE   LYS   2           QE       LYS   2  10.168  10.720   8.702
   32    QZ   LYS   2           QZ       LYS   2   8.603  11.336  10.219
   33    H    LEU   3           H        LEU   3  13.565  14.822   7.492
   34    HA   LEU   3           HA       LEU   3  16.457  14.498   7.919
   35   1HB   LEU   3          2HB       LEU   3  15.515  14.911   5.345
   36   2HB   LEU   3          1HB       LEU   3  15.921  16.543   5.878
   37    HG   LEU   3           HG       LEU   3  18.047  14.978   6.792
   38   1HD1  LEU   3          3HD1      LEU   3  17.660  16.777   4.392
   39   2HD1  LEU   3          2HD1      LEU   3  18.386  17.182   5.947
   40   3HD1  LEU   3          1HD1      LEU   3  19.238  16.120   4.826
   41   1HD2  LEU   3          3HD2      LEU   3  16.887  13.919   4.257
   42   2HD2  LEU   3          2HD2      LEU   3  18.641  14.087   4.327
   43   3HD2  LEU   3          1HD2      LEU   3  17.804  13.080   5.509
   44    MD1  LEU   3           QD1      LEU   3  18.428  16.693   5.055
   45    MD2  LEU   3           QD2      LEU   3  17.777  13.696   4.698
   46    QB   LEU   3           QB       LEU   3  15.718  15.727   5.612
   47    QD   LEU   3           QQD      LEU   3  18.103  15.194   4.876
   48    H    LYS   4           H        LYS   4  14.691  15.347   9.809
   49    HA   LYS   4           HA       LYS   4  15.492  18.159  10.215
   50   1HB   LYS   4          2HB       LYS   4  12.901  17.319   9.204
   51   2HB   LYS   4          1HB       LYS   4  12.728  18.163  10.745
   52   1HG   LYS   4          2HG       LYS   4  13.638  20.139   9.924
   53   2HG   LYS   4          1HG       LYS   4  14.552  19.313   8.661
   54   1HD   LYS   4          2HD       LYS   4  11.765  18.804   8.237
   55   2HD   LYS   4          1HD       LYS   4  11.990  20.542   8.445
   56   1HE   LYS   4          2HE       LYS   4  13.387  20.720   6.578
   57   2HE   LYS   4          1HE       LYS   4  13.872  19.014   6.657
   58   1HZ   LYS   4          3HZ       LYS   4  11.408  18.538   6.288
   59   2HZ   LYS   4          2HZ       LYS   4  11.291  20.153   5.771
   60   3HZ   LYS   4          1HZ       LYS   4  12.304  19.067   4.948
   61    QB   LYS   4           QB       LYS   4  12.814  17.741   9.974
   62    QD   LYS   4           QD       LYS   4  11.877  19.673   8.341
   63    QG   LYS   4           QG       LYS   4  14.095  19.726   9.292
   64    QE   LYS   4           QE       LYS   4  13.630  19.867   6.617
   65    QZ   LYS   4           QZ       LYS   4  11.667  19.253   5.669
   66    H    VAL   5           H        VAL   5  16.157  18.183  12.320
   67    HA   VAL   5           HA       VAL   5  15.771  16.150  14.232
   68    HB   VAL   5           HB       VAL   5  17.452  17.978  14.292
   69   1HG1  VAL   5          3HG1      VAL   5  16.668  16.714  16.377
   70   2HG1  VAL   5          2HG1      VAL   5  17.465  18.261  16.661
   71   3HG1  VAL   5          1HG1      VAL   5  15.708  18.144  16.756
   72   1HG2  VAL   5          3HG2      VAL   5  14.993  19.651  14.865
   73   2HG2  VAL   5          2HG2      VAL   5  16.631  20.205  15.214
   74   3HG2  VAL   5          1HG2      VAL   5  16.153  19.859  13.553
   75    MG1  VAL   5           QG1      VAL   5  16.613  17.707  16.598
   76    MG2  VAL   5           QG2      VAL   5  15.926  19.905  14.544
   77    QG   VAL   5           QQG      VAL   5  16.270  18.806  15.571
   78    H    THR   6           H        THR   6  14.541  16.481  16.371
   79    HA   THR   6           HA       THR   6  12.453  16.651  17.464
   80    HB   THR   6           HB       THR   6  12.185  19.120  15.729
   81    HG1  THR   6           HG1      THR   6  13.629  20.092  16.996
   82   1HG2  THR   6          1HG2      THR   6  10.742  18.018  17.953
   83   2HG2  THR   6          3HG2      THR   6  11.508  19.525  18.457
   84   3HG2  THR   6          2HG2      THR   6  10.422  19.509  17.067
   85    MG   THR   6           QG2      THR   6  10.891  19.017  17.826
   86    H    VAL   7           H        VAL   7  11.244  14.920  16.616
   87    HA   VAL   7           HA       VAL   7   9.603  15.522  14.175
   88    HB   VAL   7           HB       VAL   7  10.662  12.901  15.282
   89   1HG1  VAL   7          3HG1      VAL   7  11.789  14.908  13.543
   90   2HG1  VAL   7          2HG1      VAL   7  12.518  13.407  14.114
   91   3HG1  VAL   7          1HG1      VAL   7  11.545  13.411  12.643
   92   1HG2  VAL   7          1HG2      VAL   7   8.694  13.592  13.158
   93   2HG2  VAL   7          3HG2      VAL   7   9.857  12.322  12.778
   94   3HG2  VAL   7          2HG2      VAL   7   8.793  12.155  14.175
   95    MG1  VAL   7           QG1      VAL   7  11.950  13.909  13.433
   96    MG2  VAL   7           QG2      VAL   7   9.114  12.690  13.370
   97    QG   VAL   7           QQG      VAL   7  10.532  13.299  13.402
   98    H    ASN   8           H        ASN   8   8.112  16.519  15.888
   99    HA   ASN   8           HA       ASN   8   6.692  14.528  17.578
  100   1HB   ASN   8          2HB       ASN   8   7.003  17.492  17.398
  101   2HB   ASN   8          1HB       ASN   8   5.503  16.882  18.099
  102   1HD2  ASN   8          1HD2      ASN   8   5.761  16.990  20.339
  103   2HD2  ASN   8          2HD2      ASN   8   7.123  16.430  21.184
  104    QB   ASN   8           QB       ASN   8   6.253  17.187  17.748
  105    QD   ASN   8           QD2      ASN   8   6.442  16.710  20.762
  106    H    GLY   9           H        GLY   9   5.861  13.531  15.439
  107   1HA   GLY   9          1HA       GLY   9   4.363  13.767  13.501
  108   2HA   GLY   9          2HA       GLY   9   3.576  15.105  14.338
  109    QA   GLY   9           QA       GLY   9   3.969  14.436  13.919
  110    H    ALA  10           H        ALA  10   2.470  12.512  13.273
  111    HA   ALA  10           HA       ALA  10   0.523  11.977  15.257
  112   1HB   ALA  10          3HB       ALA  10   0.535  11.446  12.772
  113   2HB   ALA  10          2HB       ALA  10   1.565  10.064  13.149
  114   3HB   ALA  10          1HB       ALA  10  -0.072  10.148  13.799
  115    MB   ALA  10           QB       ALA  10   0.676  10.553  13.240
  116    H    GLY  11           H        GLY  11   0.276   9.543  16.088
  117   1HA   GLY  11          1HA       GLY  11   1.770   8.970  18.243
  118   2HA   GLY  11          2HA       GLY  11   2.855   8.400  16.975
  119    QA   GLY  11           QA       GLY  11   2.312   8.685  17.609
  120    H    LYS  12           H        LYS  12   0.697   7.497  15.221
  121    HA   LYS  12           HA       LYS  12  -0.235   5.119  16.799
  122   1HB   LYS  12          2HB       LYS  12  -1.591   6.834  14.705
  123   2HB   LYS  12          1HB       LYS  12  -2.204   5.243  15.153
  124   1HG   LYS  12          2HG       LYS  12  -2.952   5.959  17.187
  125   2HG   LYS  12          1HG       LYS  12  -1.577   7.040  17.422
  126   1HD   LYS  12          2HD       LYS  12  -2.870   8.780  16.822
  127   2HD   LYS  12          1HD       LYS  12  -3.067   8.056  15.225
  128   1HE   LYS  12          2HE       LYS  12  -5.292   8.318  16.093
  129   2HE   LYS  12          1HE       LYS  12  -4.909   6.598  16.305
  130   1HZ   LYS  12          3HZ       LYS  12  -3.950   7.312  18.533
  131   2HZ   LYS  12          2HZ       LYS  12  -4.804   8.764  18.319
  132   3HZ   LYS  12          1HZ       LYS  12  -5.641   7.288  18.402
  133    QB   LYS  12           QB       LYS  12  -1.897   6.039  14.929
  134    QD   LYS  12           QD       LYS  12  -2.968   8.418  16.023
  135    QG   LYS  12           QG       LYS  12  -2.264   6.499  17.304
  136    QE   LYS  12           QE       LYS  12  -5.100   7.458  16.199
  137    QZ   LYS  12           QZ       LYS  12  -4.798   7.788  18.418
  138    H    ALA  13           H        ALA  13   2.160   5.648  14.933
  139    HA   ALA  13           HA       ALA  13   1.567   3.450  12.975
  140   1HB   ALA  13          3HB       ALA  13   2.102   4.984  11.407
  141   2HB   ALA  13          1HB       ALA  13   3.729   5.054  12.085
  142   3HB   ALA  13          2HB       ALA  13   2.485   6.167  12.659
  143    MB   ALA  13           QB       ALA  13   2.772   5.402  12.050
  144    H    GLY  14           H        GLY  14   3.427   2.060  12.492
  145   1HA   GLY  14          1HA       GLY  14   5.019   0.581  13.482
  146   2HA   GLY  14          2HA       GLY  14   5.167   1.692  14.845
  147    QA   GLY  14           QA       GLY  14   5.093   1.136  14.164
  148    H    GLU  15           H        GLU  15   6.657   0.600  12.020
  149    HA   GLU  15           HA       GLU  15   8.305   3.080  11.738
  150   1HB   GLU  15          2HB       GLU  15   9.090   0.313  12.598
  151   2HB   GLU  15          1HB       GLU  15  10.246   1.275  11.676
  152   1HG   GLU  15          2HG       GLU  15   9.467   3.134  13.468
  153   2HG   GLU  15          1HG       GLU  15   9.218   1.683  14.437
  154    QB   GLU  15           QB       GLU  15   9.668   0.794  12.137
  155    QG   GLU  15           QG       GLU  15   9.343   2.409  13.952
  156    H    GLY  16           H        GLY  16   8.486   3.547   9.583
  157   1HA   GLY  16          1HA       GLY  16   8.679   1.309   7.640
  158   2HA   GLY  16          2HA       GLY  16   9.113   2.988   7.315
  159    QA   GLY  16           QA       GLY  16   8.896   2.148   7.477
  160    H    GLU  17           H        GLU  17   6.120   1.980   8.889
  161    HA   GLU  17           HA       GLU  17   4.404   1.866   6.643
  162   1HB   GLU  17          2HB       GLU  17   2.683   1.955   8.270
  163   2HB   GLU  17          1HB       GLU  17   4.059   1.298   9.148
  164   1HG   GLU  17          2HG       GLU  17   3.121   4.186   9.179
  165   2HG   GLU  17          1HG       GLU  17   2.978   3.027  10.499
  166    QB   GLU  17           QB       GLU  17   3.371   1.627   8.709
  167    QG   GLU  17           QG       GLU  17   3.050   3.607   9.839
  168    H    ILE  18           H        ILE  18   2.482   3.698   6.633
  169    HA   ILE  18           HA       ILE  18   3.768   6.395   6.505
  170    HB   ILE  18           HB       ILE  18   2.083   5.080   4.349
  171   1HG1  ILE  18          2HG1      ILE  18   4.551   5.572   3.259
  172   2HG1  ILE  18          1HG1      ILE  18   4.984   5.117   4.906
  173   1HG2  ILE  18          2HG2      ILE  18   3.028   7.814   4.854
  174   2HG2  ILE  18          1HG2      ILE  18   3.463   7.211   3.255
  175   3HG2  ILE  18          3HG2      ILE  18   1.772   7.246   3.753
  176   1HD1  ILE  18          3HD1      ILE  18   2.957   3.317   4.049
  177   2HD1  ILE  18          2HD1      ILE  18   4.147   3.416   2.752
  178   3HD1  ILE  18          1HD1      ILE  18   4.652   2.957   4.378
  179    MG   ILE  18           QG2      ILE  18   2.754   7.424   3.954
  180    MD   ILE  18           QD1      ILE  18   3.918   3.230   3.727
  181    QG   ILE  18           QG1      ILE  18   4.767   5.345   4.083
  182    HA   PRO  19           HA       PRO  19  -0.218   6.926   8.583
  183   1HB   PRO  19          2HB       PRO  19   0.323   9.417   9.580
  184   2HB   PRO  19          1HB       PRO  19   0.902   7.924  10.345
  185   1HG   PRO  19          2HG       PRO  19   2.358   9.842   8.601
  186   2HG   PRO  19          1HG       PRO  19   2.926   8.948  10.020
  187   1HD   PRO  19          2HD       PRO  19   3.492   8.229   7.444
  188   2HD   PRO  19          1HD       PRO  19   3.434   7.083   8.801
  189    QB   PRO  19           QB       PRO  19   0.613   8.670   9.963
  190    QG   PRO  19           QG       PRO  19   2.642   9.395   9.310
  191    QD   PRO  19           QD       PRO  19   3.463   7.656   8.123
  192    H    ALA  20           H        ALA  20  -2.067   7.858   7.705
  193    HA   ALA  20           HA       ALA  20  -1.809   9.425   5.248
  194   1HB   ALA  20          3HB       ALA  20  -4.217   8.618   6.913
  195   2HB   ALA  20          1HB       ALA  20  -3.495   7.639   5.635
  196   3HB   ALA  20          2HB       ALA  20  -4.259   9.179   5.240
  197    MB   ALA  20           QB       ALA  20  -3.990   8.479   5.930
  198    HA   PRO  21           HA       PRO  21  -2.033  13.319   7.381
  199   1HB   PRO  21          2HB       PRO  21  -2.432  14.925   5.206
  200   2HB   PRO  21          1HB       PRO  21  -0.856  14.215   5.606
  201   1HG   PRO  21          2HG       PRO  21  -2.846  13.377   3.567
  202   2HG   PRO  21          1HG       PRO  21  -1.077  13.352   3.500
  203   1HD   PRO  21          2HD       PRO  21  -2.640  11.144   3.973
  204   2HD   PRO  21          1HD       PRO  21  -0.946  11.303   4.482
  205    QB   PRO  21           QB       PRO  21  -1.644  14.570   5.406
  206    QG   PRO  21           QG       PRO  21  -1.962  13.365   3.533
  207    QD   PRO  21           QD       PRO  21  -1.793  11.224   4.228
  208    H    LEU  22           H        LEU  22  -4.538  12.123   5.230
  209    HA   LEU  22           HA       LEU  22  -6.540  13.757   6.749
  210   1HB   LEU  22          2HB       LEU  22  -5.742  14.137   4.117
  211   2HB   LEU  22          1HB       LEU  22  -7.210  13.173   3.954
  212    HG   LEU  22           HG       LEU  22  -7.739  15.583   3.980
  213   1HD1  LEU  22          1HD1      LEU  22  -9.183  13.750   5.121
  214   2HD1  LEU  22          3HD1      LEU  22  -8.612  14.449   6.635
  215   3HD1  LEU  22          2HD1      LEU  22  -9.537  15.435   5.503
  216   1HD2  LEU  22          3HD2      LEU  22  -5.700  15.688   5.886
  217   2HD2  LEU  22          2HD2      LEU  22  -6.765  17.018   5.429
  218   3HD2  LEU  22          1HD2      LEU  22  -7.169  16.000   6.811
  219    MD1  LEU  22           QD1      LEU  22  -9.111  14.545   5.753
  220    MD2  LEU  22           QD2      LEU  22  -6.544  16.235   6.042
  221    QB   LEU  22           QB       LEU  22  -6.476  13.655   4.035
  222    QD   LEU  22           QQD      LEU  22  -7.827  15.390   5.897
  223    H    ALA  23           H        ALA  23  -8.376  12.606   7.342
  224    HA   ALA  23           HA       ALA  23  -8.387   9.771   7.414
  225   1HB   ALA  23          2HB       ALA  23 -10.319  12.013   7.812
  226   2HB   ALA  23          3HB       ALA  23  -9.814  10.758   8.943
  227   3HB   ALA  23          1HB       ALA  23 -10.991  10.388   7.683
  228    MB   ALA  23           QB       ALA  23 -10.375  11.053   8.146
  229    H    GLY  24           H        GLY  24 -10.426   8.545   6.386
  230   1HA   GLY  24          1HA       GLY  24 -10.012   8.359   3.589
  231   2HA   GLY  24          2HA       GLY  24 -11.416   9.398   3.837
  232    QA   GLY  24           QA       GLY  24 -10.714   8.878   3.713
  233    H    THR  25           H        THR  25 -12.734   7.729   2.830
  234    HA   THR  25           HA       THR  25 -13.531   5.609   4.771
  235    HB   THR  25           HB       THR  25 -14.971   6.332   2.230
  236    HG1  THR  25           HG1      THR  25 -14.983   7.804   4.655
  237   1HG2  THR  25          2HG2      THR  25 -15.782   4.497   3.702
  238   2HG2  THR  25          1HG2      THR  25 -15.920   5.654   5.027
  239   3HG2  THR  25          3HG2      THR  25 -16.934   5.830   3.597
  240    MG   THR  25           QG2      THR  25 -16.212   5.327   4.109
  241    H    VAL  26           H        VAL  26 -12.769   3.568   4.373
  242    HA   VAL  26           HA       VAL  26 -11.424   2.868   1.898
  243    HB   VAL  26           HB       VAL  26 -12.416   1.203   4.235
  244   1HG1  VAL  26          1HG1      VAL  26 -10.561   0.654   1.920
  245   2HG1  VAL  26          3HG1      VAL  26 -10.396  -0.225   3.441
  246   3HG1  VAL  26          2HG1      VAL  26 -11.896  -0.331   2.518
  247   1HG2  VAL  26          3HG2      VAL  26 -10.786   3.191   4.618
  248   2HG2  VAL  26          2HG2      VAL  26 -10.344   1.615   5.275
  249   3HG2  VAL  26          1HG2      VAL  26  -9.604   2.186   3.779
  250    MG1  VAL  26           QG1      VAL  26 -10.951   0.032   2.626
  251    MG2  VAL  26           QG2      VAL  26 -10.245   2.331   4.558
  252    QG   VAL  26           QQG      VAL  26 -10.598   1.182   3.592
  253    H    SER  27           H        SER  27 -12.264   1.807   0.127
  254    HA   SER  27           HA       SER  27 -15.150   0.992   0.251
  255   1HB   SER  27          2HB       SER  27 -14.650   2.920  -1.194
  256   2HB   SER  27          1HB       SER  27 -13.408   1.993  -2.029
  257    HG   SER  27           HG       SER  27 -16.207   1.531  -1.967
  258    QB   SER  27           QB       SER  27 -14.029   2.456  -1.612
  259    H    LYS  28           H        LYS  28 -11.895   0.107  -0.798
  260    HA   LYS  28           HA       LYS  28 -12.486  -2.728  -0.699
  261   1HB   LYS  28          2HB       LYS  28 -13.013  -1.211  -3.124
  262   2HB   LYS  28          1HB       LYS  28 -11.814  -2.472  -3.418
  263   1HG   LYS  28          2HG       LYS  28 -13.486  -3.967  -2.030
  264   2HG   LYS  28          1HG       LYS  28 -14.661  -2.742  -2.511
  265   1HD   LYS  28          2HD       LYS  28 -12.853  -4.210  -4.450
  266   2HD   LYS  28          1HD       LYS  28 -14.521  -4.672  -4.111
  267   1HE   LYS  28          2HE       LYS  28 -15.325  -2.495  -4.907
  268   2HE   LYS  28          1HE       LYS  28 -13.654  -1.961  -5.181
  269   1HZ   LYS  28          1HZ       LYS  28 -13.393  -3.999  -6.589
  270   2HZ   LYS  28          3HZ       LYS  28 -15.073  -4.209  -6.499
  271   3HZ   LYS  28          2HZ       LYS  28 -14.431  -2.819  -7.234
  272    QB   LYS  28           QB       LYS  28 -12.414  -1.842  -3.271
  273    QD   LYS  28           QD       LYS  28 -13.687  -4.441  -4.281
  274    QG   LYS  28           QG       LYS  28 -14.074  -3.355  -2.270
  275    QE   LYS  28           QE       LYS  28 -14.489  -2.228  -5.044
  276    QZ   LYS  28           QZ       LYS  28 -14.299  -3.676  -6.774
  277    H    ILE  29           H        ILE  29 -10.534  -3.859  -0.582
  278    HA   ILE  29           HA       ILE  29  -8.046  -2.237  -0.890
  279    HB   ILE  29           HB       ILE  29  -8.519  -3.288   1.281
  280   1HG1  ILE  29          2HG1      ILE  29  -6.370  -5.005   0.066
  281   2HG1  ILE  29          1HG1      ILE  29  -6.151  -3.256   0.131
  282   1HG2  ILE  29          1HG2      ILE  29  -9.408  -5.431  -0.401
  283   2HG2  ILE  29          3HG2      ILE  29  -8.125  -6.042   0.644
  284   3HG2  ILE  29          2HG2      ILE  29  -9.553  -5.286   1.351
  285   1HD1  ILE  29          2HD1      ILE  29  -6.611  -3.323   2.581
  286   2HD1  ILE  29          1HD1      ILE  29  -6.712  -5.081   2.486
  287   3HD1  ILE  29          3HD1      ILE  29  -5.189  -4.266   2.136
  288    MG   ILE  29           QG2      ILE  29  -9.029  -5.586   0.531
  289    MD   ILE  29           QD1      ILE  29  -6.171  -4.223   2.401
  290    QG   ILE  29           QG1      ILE  29  -6.261  -4.131   0.098
  291    H    LEU  30           H        LEU  30  -6.443  -2.865  -2.342
  292    HA   LEU  30           HA       LEU  30  -7.054  -5.245  -4.066
  293   1HB   LEU  30          2HB       LEU  30  -5.641  -2.618  -4.632
  294   2HB   LEU  30          1HB       LEU  30  -5.816  -3.927  -5.802
  295    HG   LEU  30           HG       LEU  30  -8.284  -2.938  -4.436
  296   1HD1  LEU  30          1HD1      LEU  30  -6.732  -1.456  -6.567
  297   2HD1  LEU  30          3HD1      LEU  30  -8.468  -1.235  -6.342
  298   3HD1  LEU  30          2HD1      LEU  30  -7.351  -0.827  -5.040
  299   1HD2  LEU  30          2HD2      LEU  30  -7.493  -4.151  -7.074
  300   2HD2  LEU  30          1HD2      LEU  30  -8.697  -4.711  -5.914
  301   3HD2  LEU  30          3HD2      LEU  30  -9.031  -3.300  -6.918
  302    MD1  LEU  30           QD1      LEU  30  -7.517  -1.173  -5.983
  303    MD2  LEU  30           QD2      LEU  30  -8.407  -4.054  -6.635
  304    QB   LEU  30           QB       LEU  30  -5.729  -3.273  -5.217
  305    QD   LEU  30           QQD      LEU  30  -7.962  -2.614  -6.309
  306    H    VAL  31           H        VAL  31  -4.620  -3.568  -2.159
  307    HA   VAL  31           HA       VAL  31  -2.407  -5.270  -3.069
  308    HB   VAL  31           HB       VAL  31  -2.131  -2.912  -2.388
  309   1HG1  VAL  31          3HG1      VAL  31  -3.899  -3.631  -0.345
  310   2HG1  VAL  31          2HG1      VAL  31  -2.365  -3.361   0.480
  311   3HG1  VAL  31          1HG1      VAL  31  -3.070  -2.084  -0.509
  312   1HG2  VAL  31          2HG2      VAL  31  -0.321  -4.682  -2.010
  313   2HG2  VAL  31          1HG2      VAL  31  -0.171  -3.205  -1.057
  314   3HG2  VAL  31          3HG2      VAL  31  -0.810  -4.673  -0.315
  315    MG1  VAL  31           QG1      VAL  31  -3.111  -3.025  -0.125
  316    MG2  VAL  31           QG2      VAL  31  -0.434  -4.187  -1.128
  317    QG   VAL  31           QQG      VAL  31  -1.772  -3.606  -0.626
  318    H    LYS  32           H        LYS  32  -1.300  -6.789  -1.653
  319    HA   LYS  32           HA       LYS  32  -2.890  -7.737   0.698
  320   1HB   LYS  32          2HB       LYS  32  -2.742  -8.933  -1.837
  321   2HB   LYS  32          1HB       LYS  32  -1.647  -9.880  -0.829
  322   1HG   LYS  32          2HG       LYS  32  -3.704 -10.933  -0.446
  323   2HG   LYS  32          1HG       LYS  32  -3.601  -9.811   0.910
  324   1HD   LYS  32          2HD       LYS  32  -5.729  -9.312   0.151
  325   2HD   LYS  32          1HD       LYS  32  -4.791  -8.167  -0.807
  326   1HE   LYS  32          2HE       LYS  32  -4.647 -10.086  -2.567
  327   2HE   LYS  32          1HE       LYS  32  -6.016 -10.784  -1.677
  328   1HZ   LYS  32          2HZ       LYS  32  -7.001  -8.463  -1.784
  329   2HZ   LYS  32          1HZ       LYS  32  -5.840  -8.131  -2.980
  330   3HZ   LYS  32          3HZ       LYS  32  -6.992  -9.350  -3.233
  331    QB   LYS  32           QB       LYS  32  -2.195  -9.406  -1.333
  332    QD   LYS  32           QD       LYS  32  -5.260  -8.740  -0.328
  333    QG   LYS  32           QG       LYS  32  -3.652 -10.372   0.232
  334    QE   LYS  32           QE       LYS  32  -5.332 -10.435  -2.122
  335    QZ   LYS  32           QZ       LYS  32  -6.611  -8.648  -2.666
  336    H    GLU  33           H        GLU  33  -1.564  -9.055   2.198
  337    HA   GLU  33           HA       GLU  33   1.067  -7.962   2.633
  338   1HB   GLU  33          2HB       GLU  33  -0.607  -8.899   4.308
  339   2HB   GLU  33          1HB       GLU  33  -0.133 -10.508   3.761
  340   1HG   GLU  33          2HG       GLU  33   2.120 -10.200   4.494
  341   2HG   GLU  33          1HG       GLU  33   1.880  -8.469   4.730
  342    QB   GLU  33           QB       GLU  33  -0.370  -9.703   4.035
  343    QG   GLU  33           QG       GLU  33   2.000  -9.334   4.612
  344    H    GLY  34           H        GLY  34   2.908  -8.554   1.569
  345   1HA   GLY  34          1HA       GLY  34   3.221 -11.400   0.755
  346   2HA   GLY  34          2HA       GLY  34   4.543 -10.253   0.971
  347    QA   GLY  34           QA       GLY  34   3.882 -10.827   0.863
  348    H    ASP  35           H        ASP  35   2.111  -8.630  -0.645
  349    HA   ASP  35           HA       ASP  35   2.836  -9.615  -3.345
  350   1HB   ASP  35          2HB       ASP  35   0.604  -8.386  -2.043
  351   2HB   ASP  35          1HB       ASP  35   1.129  -7.315  -3.343
  352    QB   ASP  35           QB       ASP  35   0.866  -7.850  -2.693
  353    H    THR  36           H        THR  36   4.442  -8.625  -4.502
  354    HA   THR  36           HA       THR  36   5.978  -6.426  -3.494
  355    HB   THR  36           HB       THR  36   5.718  -7.386  -6.357
  356    HG1  THR  36           HG1      THR  36   7.039  -8.499  -4.119
  357   1HG2  THR  36          2HG2      THR  36   7.151  -5.345  -5.683
  358   2HG2  THR  36          1HG2      THR  36   8.204  -6.518  -4.891
  359   3HG2  THR  36          3HG2      THR  36   7.930  -6.610  -6.632
  360    MG   THR  36           QG2      THR  36   7.762  -6.158  -5.735
  361    H    VAL  37           H        VAL  37   5.438  -4.281  -3.515
  362    HA   VAL  37           HA       VAL  37   3.225  -3.370  -5.292
  363    HB   VAL  37           HB       VAL  37   3.114  -2.963  -2.859
  364   1HG1  VAL  37          1HG1      VAL  37   2.497  -1.196  -4.784
  365   2HG1  VAL  37          3HG1      VAL  37   2.296  -0.820  -3.072
  366   3HG1  VAL  37          2HG1      VAL  37   3.722  -0.250  -3.939
  367   1HG2  VAL  37          2HG2      VAL  37   5.885  -2.352  -3.248
  368   2HG2  VAL  37          1HG2      VAL  37   5.091  -0.925  -2.582
  369   3HG2  VAL  37          3HG2      VAL  37   4.996  -2.467  -1.730
  370    MG1  VAL  37           QG1      VAL  37   2.838  -0.755  -3.932
  371    MG2  VAL  37           QG2      VAL  37   5.324  -1.914  -2.520
  372    QG   VAL  37           QQG      VAL  37   4.081  -1.335  -3.226
  373    H    LYS  38           H        LYS  38   3.548  -1.680  -6.789
  374    HA   LYS  38           HA       LYS  38   6.403  -0.868  -7.237
  375   1HB   LYS  38          2HB       LYS  38   5.026  -2.401  -8.868
  376   2HB   LYS  38          1HB       LYS  38   4.252  -0.889  -9.343
  377   1HG   LYS  38          2HG       LYS  38   7.153  -0.622  -9.178
  378   2HG   LYS  38          1HG       LYS  38   6.670  -1.871 -10.326
  379   1HD   LYS  38          2HD       LYS  38   4.880   0.202 -10.823
  380   2HD   LYS  38          1HD       LYS  38   6.408   1.032 -10.529
  381   1HE   LYS  38          2HE       LYS  38   7.511  -0.146 -12.287
  382   2HE   LYS  38          1HE       LYS  38   6.206  -1.343 -12.401
  383   1HZ   LYS  38          3HZ       LYS  38   4.713   0.653 -12.839
  384   2HZ   LYS  38          2HZ       LYS  38   6.141   1.520 -13.144
  385   3HZ   LYS  38          1HZ       LYS  38   5.741   0.174 -14.100
  386    QB   LYS  38           QB       LYS  38   4.639  -1.645  -9.106
  387    QD   LYS  38           QD       LYS  38   5.644   0.617 -10.676
  388    QG   LYS  38           QG       LYS  38   6.911  -1.246  -9.752
  389    QE   LYS  38           QE       LYS  38   6.858  -0.744 -12.344
  390    QZ   LYS  38           QZ       LYS  38   5.532   0.782 -13.361
  391    H    ALA  39           H        ALA  39   6.791   1.332  -7.247
  392    HA   ALA  39           HA       ALA  39   4.939   3.239  -6.301
  393   1HB   ALA  39          1HB       ALA  39   7.372   3.532  -6.347
  394   2HB   ALA  39          3HB       ALA  39   7.359   3.536  -8.110
  395   3HB   ALA  39          2HB       ALA  39   6.607   4.860  -7.220
  396    MB   ALA  39           QB       ALA  39   7.113   3.976  -7.226
  397    H    GLY  40           H        GLY  40   3.116   4.007  -7.273
  398   1HA   GLY  40          1HA       GLY  40   3.166   4.479 -10.211
  399   2HA   GLY  40          2HA       GLY  40   2.045   5.234  -9.078
  400    QA   GLY  40           QA       GLY  40   2.605   4.857  -9.645
  401    H    GLN  41           H        GLN  41   1.810   2.373  -7.843
  402    HA   GLN  41           HA       GLN  41  -0.063   1.293  -9.925
  403   1HB   GLN  41          2HB       GLN  41   2.133   0.082  -9.097
  404   2HB   GLN  41          1HB       GLN  41   1.140  -0.332  -7.699
  405   1HG   GLN  41          2HG       GLN  41  -0.496  -0.835  -9.925
  406   2HG   GLN  41          1HG       GLN  41   1.091  -1.461 -10.372
  407   1HE2  GLN  41          1HE2      GLN  41   2.171  -2.700  -8.334
  408   2HE2  GLN  41          2HE2      GLN  41   1.133  -3.796  -7.559
  409    QB   GLN  41           QB       GLN  41   1.637  -0.125  -8.398
  410    QG   GLN  41           QG       GLN  41   0.297  -1.148 -10.148
  411    QE   GLN  41           QE2      GLN  41   1.652  -3.248  -7.947
  412    H    THR  42           H        THR  42  -2.170   1.577  -9.311
  413    HA   THR  42           HA       THR  42  -3.109   2.515  -6.830
  414    HB   THR  42           HB       THR  42  -4.413   0.698  -8.887
  415    HG1  THR  42           HG1      THR  42  -4.167   3.495  -8.576
  416   1HG2  THR  42          3HG2      THR  42  -5.488   2.235  -6.540
  417   2HG2  THR  42          2HG2      THR  42  -6.493   1.992  -7.969
  418   3HG2  THR  42          1HG2      THR  42  -5.883   0.601  -7.072
  419    MG   THR  42           QG2      THR  42  -5.955   1.610  -7.193
  420    H    VAL  43           H        VAL  43  -3.062   1.545  -4.841
  421    HA   VAL  43           HA       VAL  43  -2.986  -1.451  -4.743
  422    HB   VAL  43           HB       VAL  43  -1.873  -0.990  -2.500
  423   1HG1  VAL  43          1HG1      VAL  43  -0.785  -0.325  -5.192
  424   2HG1  VAL  43          3HG1      VAL  43   0.208   0.091  -3.797
  425   3HG1  VAL  43          2HG1      VAL  43  -0.289  -1.580  -4.059
  426   1HG2  VAL  43          1HG2      VAL  43  -2.847   1.461  -2.602
  427   2HG2  VAL  43          3HG2      VAL  43  -1.272   1.169  -1.867
  428   3HG2  VAL  43          2HG2      VAL  43  -1.374   1.790  -3.514
  429    MG1  VAL  43           QG1      VAL  43  -0.288  -0.605  -4.349
  430    MG2  VAL  43           QG2      VAL  43  -1.831   1.473  -2.661
  431    QG   VAL  43           QQG      VAL  43  -1.060   0.434  -3.505
  432    H    LEU  44           H        LEU  44  -4.681   1.416  -3.634
  433    HA   LEU  44           HA       LEU  44  -6.602  -0.393  -2.214
  434   1HB   LEU  44          2HB       LEU  44  -4.750   1.409  -1.058
  435   2HB   LEU  44          1HB       LEU  44  -6.338   2.157  -0.887
  436    HG   LEU  44           HG       LEU  44  -6.506  -0.671  -0.307
  437   1HD1  LEU  44          1HD1      LEU  44  -4.122  -0.417   0.310
  438   2HD1  LEU  44          3HD1      LEU  44  -4.546   0.931   1.364
  439   3HD1  LEU  44          2HD1      LEU  44  -5.128  -0.692   1.732
  440   1HD2  LEU  44          2HD2      LEU  44  -7.693   1.706   0.471
  441   2HD2  LEU  44          1HD2      LEU  44  -7.981   0.132   1.213
  442   3HD2  LEU  44          3HD2      LEU  44  -6.788   1.230   1.908
  443    MD1  LEU  44           QD1      LEU  44  -4.599  -0.059   1.135
  444    MD2  LEU  44           QD2      LEU  44  -7.488   1.023   1.197
  445    QB   LEU  44           QB       LEU  44  -5.544   1.783  -0.972
  446    QD   LEU  44           QQD      LEU  44  -6.043   0.482   1.166
  447    H    VAL  45           H        VAL  45  -8.687   0.854  -1.708
  448    HA   VAL  45           HA       VAL  45  -9.303   2.779  -3.926
  449    HB   VAL  45           HB       VAL  45 -11.053   0.670  -2.613
  450   1HG1  VAL  45          2HG1      VAL  45 -12.154   2.783  -3.550
  451   2HG1  VAL  45          1HG1      VAL  45 -11.585   2.257  -5.135
  452   3HG1  VAL  45          3HG1      VAL  45 -12.716   1.253  -4.226
  453   1HG2  VAL  45          2HG2      VAL  45  -9.164   0.611  -4.863
  454   2HG2  VAL  45          1HG2      VAL  45  -9.900  -0.727  -3.980
  455   3HG2  VAL  45          3HG2      VAL  45 -10.780   0.051  -5.296
  456    MG1  VAL  45           QG1      VAL  45 -12.152   2.098  -4.304
  457    MG2  VAL  45           QG2      VAL  45  -9.948  -0.022  -4.713
  458    QG   VAL  45           QQG      VAL  45 -11.050   1.038  -4.508
  459    H    LEU  46           H        LEU  46  -9.676   4.782  -3.039
  460    HA   LEU  46           HA       LEU  46 -10.767   4.920  -0.255
  461   1HB   LEU  46          2HB       LEU  46  -8.547   5.933  -0.812
  462   2HB   LEU  46          1HB       LEU  46  -9.359   7.000  -1.958
  463    HG   LEU  46           HG       LEU  46 -10.882   7.427   0.250
  464   1HD1  LEU  46          2HD1      LEU  46  -8.316   8.766  -0.635
  465   2HD1  LEU  46          1HD1      LEU  46  -9.970   9.230  -1.033
  466   3HD1  LEU  46          3HD1      LEU  46  -9.364   9.447   0.609
  467   1HD2  LEU  46          3HD2      LEU  46  -8.393   6.191   1.151
  468   2HD2  LEU  46          2HD2      LEU  46  -8.624   7.796   1.844
  469   3HD2  LEU  46          1HD2      LEU  46  -9.856   6.554   2.065
  470    MD1  LEU  46           QD1      LEU  46  -9.217   9.148  -0.353
  471    MD2  LEU  46           QD2      LEU  46  -8.958   6.847   1.687
  472    QB   LEU  46           QB       LEU  46  -8.953   6.466  -1.385
  473    QD   LEU  46           QQD      LEU  46  -9.087   7.997   0.667
  474    H    GLU  47           H        GLU  47 -12.555   6.294   0.176
  475    HA   GLU  47           HA       GLU  47 -13.993   7.393  -2.217
  476   1HB   GLU  47          2HB       GLU  47 -14.814   5.150  -1.309
  477   2HB   GLU  47          1HB       GLU  47 -15.263   6.012   0.163
  478   1HG   GLU  47          2HG       GLU  47 -17.250   6.096  -1.069
  479   2HG   GLU  47          1HG       GLU  47 -16.497   7.638  -1.480
  480    QB   GLU  47           QB       GLU  47 -15.038   5.581  -0.573
  481    QG   GLU  47           QG       GLU  47 -16.874   6.867  -1.275
  482    H    ALA  48           H        ALA  48 -12.436   9.103  -0.764
  483    HA   ALA  48           HA       ALA  48 -13.898  10.264   1.495
  484   1HB   ALA  48          1HB       ALA  48 -11.737  10.830   1.852
  485   2HB   ALA  48          2HB       ALA  48 -11.915  12.027   0.570
  486   3HB   ALA  48          3HB       ALA  48 -11.302  10.416   0.193
  487    MB   ALA  48           QB       ALA  48 -11.652  11.091   0.872
  488    H    MET  49           H        MET  49 -13.689  12.976   1.067
  489    HA   MET  49           HA       MET  49 -16.004  13.597  -0.491
  490   1HB   MET  49          2HB       MET  49 -13.769  15.067   0.862
  491   2HB   MET  49          1HB       MET  49 -14.848  15.974  -0.199
  492   1HG   MET  49          2HG       MET  49 -16.727  15.552   1.128
  493   2HG   MET  49          1HG       MET  49 -16.002  14.127   1.873
  494   1HE   MET  49          2HE       MET  49 -17.559  16.611   2.666
  495   2HE   MET  49          1HE       MET  49 -17.144  16.163   4.318
  496   3HE   MET  49          3HE       MET  49 -16.767  17.783   3.717
  497    QB   MET  49           QB       MET  49 -14.308  15.521   0.332
  498    QG   MET  49           QG       MET  49 -16.365  14.840   1.501
  499    ME   MET  49           QE       MET  49 -17.157  16.853   3.567
  500    H    LYS  50           H        LYS  50 -12.519  13.851  -1.221
  501    HA   LYS  50           HA       LYS  50 -12.909  15.115  -3.805
  502   1HB   LYS  50          2HB       LYS  50 -10.500  14.657  -4.017
  503   2HB   LYS  50          1HB       LYS  50 -10.864  15.274  -2.407
  504   1HG   LYS  50          2HG       LYS  50 -11.185  12.610  -1.984
  505   2HG   LYS  50          1HG       LYS  50  -9.941  12.583  -3.235
  506   1HD   LYS  50          2HD       LYS  50  -9.538  14.578  -1.082
  507   2HD   LYS  50          1HD       LYS  50  -9.392  12.890  -0.591
  508   1HE   LYS  50          2HE       LYS  50  -7.377  12.711  -1.610
  509   2HE   LYS  50          1HE       LYS  50  -8.037  13.350  -3.128
  510   1HZ   LYS  50          3HZ       LYS  50  -7.564  15.118  -0.811
  511   2HZ   LYS  50          2HZ       LYS  50  -6.308  14.763  -1.898
  512   3HZ   LYS  50          1HZ       LYS  50  -7.719  15.534  -2.446
  513    QB   LYS  50           QB       LYS  50 -10.682  14.966  -3.212
  514    QD   LYS  50           QD       LYS  50  -9.465  13.734  -0.837
  515    QG   LYS  50           QG       LYS  50 -10.563  12.597  -2.609
  516    QE   LYS  50           QE       LYS  50  -7.707  13.031  -2.369
  517    QZ   LYS  50           QZ       LYS  50  -7.197  15.138  -1.719
  518    H    MET  51           H        MET  51 -13.229  11.865  -2.688
  519    HA   MET  51           HA       MET  51 -13.582   9.838  -3.851
  520   1HB   MET  51          2HB       MET  51 -15.279  11.510  -4.801
  521   2HB   MET  51          1HB       MET  51 -14.180  11.694  -6.169
  522   1HG   MET  51          2HG       MET  51 -14.455   9.454  -6.847
  523   2HG   MET  51          1HG       MET  51 -15.090   8.962  -5.276
  524   1HE   MET  51          1HE       MET  51 -15.497  11.276  -8.235
  525   2HE   MET  51          3HE       MET  51 -17.216  11.691  -8.296
  526   3HE   MET  51          2HE       MET  51 -16.192  12.352  -7.025
  527    QB   MET  51           QB       MET  51 -14.730  11.602  -5.485
  528    QG   MET  51           QG       MET  51 -14.772   9.208  -6.062
  529    ME   MET  51           QE       MET  51 -16.302  11.773  -7.852
  530    H    GLU  52           H        GLU  52 -11.112   9.647  -3.737
  531    HA   GLU  52           HA       GLU  52  -9.689  10.173  -6.284
  532   1HB   GLU  52          2HB       GLU  52  -8.944  10.467  -3.754
  533   2HB   GLU  52          1HB       GLU  52  -8.530   8.759  -3.906
  534   1HG   GLU  52          2HG       GLU  52  -6.579  10.095  -4.486
  535   2HG   GLU  52          1HG       GLU  52  -7.190   9.313  -5.944
  536    QB   GLU  52           QB       GLU  52  -8.737   9.613  -3.830
  537    QG   GLU  52           QG       GLU  52  -6.885   9.704  -5.215
  538    H    THR  53           H        THR  53 -10.855   7.459  -4.332
  539    HA   THR  53           HA       THR  53 -11.063   5.167  -4.831
  540    HB   THR  53           HB       THR  53 -10.972   6.405  -7.599
  541    HG1  THR  53           HG1      THR  53 -13.186   5.454  -6.136
  542   1HG2  THR  53          2HG2      THR  53 -11.028   3.631  -6.757
  543   2HG2  THR  53          1HG2      THR  53 -12.498   4.053  -7.633
  544   3HG2  THR  53          3HG2      THR  53 -10.923   4.297  -8.386
  545    MG   THR  53           QG2      THR  53 -11.483   3.994  -7.592
  546    H    GLU  54           H        GLU  54  -9.124   5.848  -7.718
  547    HA   GLU  54           HA       GLU  54  -7.333   3.691  -7.328
  548   1HB   GLU  54          2HB       GLU  54  -7.394   6.237  -8.911
  549   2HB   GLU  54          1HB       GLU  54  -5.921   5.268  -8.921
  550   1HG   GLU  54          2HG       GLU  54  -7.212   3.297  -9.644
  551   2HG   GLU  54          1HG       GLU  54  -8.692   4.256  -9.626
  552    QB   GLU  54           QB       GLU  54  -6.658   5.752  -8.916
  553    QG   GLU  54           QG       GLU  54  -7.952   3.777  -9.635
  554    H    ILE  55           H        ILE  55  -6.360   3.652  -5.242
  555    HA   ILE  55           HA       ILE  55  -4.814   6.041  -4.365
  556    HB   ILE  55           HB       ILE  55  -5.561   3.390  -3.085
  557   1HG1  ILE  55          2HG1      ILE  55  -7.408   4.992  -3.281
  558   2HG1  ILE  55          1HG1      ILE  55  -6.906   4.865  -1.598
  559   1HG2  ILE  55          2HG2      ILE  55  -3.655   5.528  -2.257
  560   2HG2  ILE  55          1HG2      ILE  55  -4.702   4.859  -1.007
  561   3HG2  ILE  55          3HG2      ILE  55  -3.622   3.799  -1.913
  562   1HD1  ILE  55          3HD1      ILE  55  -5.269   6.870  -2.618
  563   2HD1  ILE  55          2HD1      ILE  55  -6.829   7.175  -3.382
  564   3HD1  ILE  55          1HD1      ILE  55  -6.707   7.114  -1.625
  565    MG   ILE  55           QG2      ILE  55  -3.993   4.728  -1.725
  566    MD   ILE  55           QD1      ILE  55  -6.269   7.053  -2.542
  567    QG   ILE  55           QG1      ILE  55  -7.157   4.929  -2.439
  568    H    ASN  56           H        ASN  56  -3.063   5.911  -5.891
  569    HA   ASN  56           HA       ASN  56  -1.550   3.572  -6.503
  570   1HB   ASN  56          2HB       ASN  56  -0.713   6.486  -6.393
  571   2HB   ASN  56          1HB       ASN  56   0.074   5.219  -7.333
  572   1HD2  ASN  56          1HD2      ASN  56  -1.047   7.537  -8.601
  573   2HD2  ASN  56          2HD2      ASN  56  -2.375   7.044  -9.535
  574    QB   ASN  56           QB       ASN  56  -0.320   5.852  -6.863
  575    QD   ASN  56           QD2      ASN  56  -1.711   7.291  -9.068
  576    H    ALA  57           H        ALA  57   0.163   2.598  -5.465
  577    HA   ALA  57           HA       ALA  57   0.587   2.817  -2.687
  578   1HB   ALA  57          2HB       ALA  57   1.440   1.255  -4.787
  579   2HB   ALA  57          3HB       ALA  57   2.035   1.112  -3.132
  580   3HB   ALA  57          1HB       ALA  57   2.931   2.067  -4.313
  581    MB   ALA  57           QB       ALA  57   2.135   1.478  -4.077
  582    HA   PRO  58           HA       PRO  58   3.238   6.291  -2.156
  583   1HB   PRO  58          2HB       PRO  58   5.038   5.421  -0.290
  584   2HB   PRO  58          1HB       PRO  58   3.343   5.773   0.097
  585   1HG   PRO  58          2HG       PRO  58   4.682   3.158  -0.334
  586   2HG   PRO  58          1HG       PRO  58   3.392   3.595   0.795
  587   1HD   PRO  58          2HD       PRO  58   2.993   2.252  -1.568
  588   2HD   PRO  58          1HD       PRO  58   1.751   3.215  -0.738
  589    QB   PRO  58           QB       PRO  58   4.190   5.597  -0.096
  590    QG   PRO  58           QG       PRO  58   4.037   3.376   0.231
  591    QD   PRO  58           QD       PRO  58   2.372   2.734  -1.153
  592    H    THR  59           H        THR  59   4.942   3.210  -2.679
  593    HA   THR  59           HA       THR  59   6.668   4.423  -4.705
  594    HB   THR  59           HB       THR  59   7.731   5.201  -2.634
  595    HG1  THR  59           HG1      THR  59   9.609   4.710  -3.419
  596   1HG2  THR  59          1HG2      THR  59   7.480   2.292  -1.900
  597   2HG2  THR  59          3HG2      THR  59   8.715   3.305  -1.152
  598   3HG2  THR  59          2HG2      THR  59   7.009   3.711  -0.966
  599    MG   THR  59           QG2      THR  59   7.735   3.103  -1.339
  600    H    ASP  60           H        ASP  60   8.744   2.482  -4.578
  601    HA   ASP  60           HA       ASP  60   7.220   0.042  -5.368
  602   1HB   ASP  60          2HB       ASP  60   9.342  -0.480  -6.557
  603   2HB   ASP  60          1HB       ASP  60   8.728   1.114  -6.993
  604    QB   ASP  60           QB       ASP  60   9.035   0.317  -6.775
  605    H    GLY  61           H        GLY  61   7.757  -2.001  -4.474
  606   1HA   GLY  61          1HA       GLY  61   9.009  -1.913  -1.814
  607   2HA   GLY  61          2HA       GLY  61   9.859  -2.897  -3.006
  608    QA   GLY  61           QA       GLY  61   9.434  -2.405  -2.410
  609    H    LYS  62           H        LYS  62   8.442  -3.761  -0.546
  610    HA   LYS  62           HA       LYS  62   6.280  -5.443  -1.772
  611   1HB   LYS  62          2HB       LYS  62   8.592  -6.513  -1.434
  612   2HB   LYS  62          1HB       LYS  62   8.288  -6.363   0.298
  613   1HG   LYS  62          2HG       LYS  62   6.363  -7.780   0.176
  614   2HG   LYS  62          1HG       LYS  62   6.352  -7.724  -1.586
  615   1HD   LYS  62          2HD       LYS  62   7.396  -9.763  -1.270
  616   2HD   LYS  62          1HD       LYS  62   8.807  -8.704  -1.282
  617   1HE   LYS  62          2HE       LYS  62   9.293  -9.240   0.866
  618   2HE   LYS  62          1HE       LYS  62   7.641  -8.851   1.384
  619   1HZ   LYS  62          1HZ       LYS  62   8.428 -11.345  -0.027
  620   2HZ   LYS  62          3HZ       LYS  62   8.173 -11.229   1.646
  621   3HZ   LYS  62          2HZ       LYS  62   6.883 -10.966   0.571
  622    QB   LYS  62           QB       LYS  62   8.440  -6.438  -0.568
  623    QD   LYS  62           QD       LYS  62   8.101  -9.234  -1.276
  624    QG   LYS  62           QG       LYS  62   6.357  -7.752  -0.705
  625    QE   LYS  62           QE       LYS  62   8.467  -9.045   1.125
  626    QZ   LYS  62           QZ       LYS  62   7.828 -11.180   0.730
  627    H    VAL  63           H        VAL  63   4.549  -5.951  -0.330
  628    HA   VAL  63           HA       VAL  63   4.174  -4.051   1.865
  629    HB   VAL  63           HB       VAL  63   2.573  -6.275   0.582
  630   1HG1  VAL  63          1HG1      VAL  63   3.038  -3.653  -0.128
  631   2HG1  VAL  63          3HG1      VAL  63   1.645  -4.605  -0.641
  632   3HG1  VAL  63          2HG1      VAL  63   1.519  -3.540   0.759
  633   1HG2  VAL  63          3HG2      VAL  63   1.990  -6.200   2.992
  634   2HG2  VAL  63          2HG2      VAL  63   1.706  -4.465   2.862
  635   3HG2  VAL  63          1HG2      VAL  63   0.668  -5.597   1.993
  636    MG1  VAL  63           QG1      VAL  63   2.068  -3.933  -0.003
  637    MG2  VAL  63           QG2      VAL  63   1.455  -5.421   2.616
  638    QG   VAL  63           QQG      VAL  63   1.761  -4.677   1.306
  639    H    GLU  64           H        GLU  64   5.236  -4.491   3.765
  640    HA   GLU  64           HA       GLU  64   5.839  -7.220   4.631
  641   1HB   GLU  64          2HB       GLU  64   5.991  -4.542   6.061
  642   2HB   GLU  64          1HB       GLU  64   6.819  -6.023   6.545
  643   1HG   GLU  64          2HG       GLU  64   7.724  -5.898   4.037
  644   2HG   GLU  64          1HG       GLU  64   7.406  -4.179   4.270
  645    QB   GLU  64           QB       GLU  64   6.405  -5.282   6.303
  646    QG   GLU  64           QG       GLU  64   7.565  -5.039   4.154
  647    H    LYS  65           H        LYS  65   3.121  -5.132   4.837
  648    HA   LYS  65           HA       LYS  65   1.512  -6.991   6.304
  649   1HB   LYS  65          2HB       LYS  65   3.324  -5.531   7.870
  650   2HB   LYS  65          1HB       LYS  65   1.783  -4.703   8.095
  651   1HG   LYS  65          2HG       LYS  65   0.806  -6.509   9.128
  652   2HG   LYS  65          1HG       LYS  65   1.733  -7.679   8.190
  653   1HD   LYS  65          2HD       LYS  65   3.344  -7.806   9.766
  654   2HD   LYS  65          1HD       LYS  65   3.442  -6.050   9.907
  655   1HE   LYS  65          2HE       LYS  65   1.676  -5.969  11.504
  656   2HE   LYS  65          1HE       LYS  65   1.163  -7.628  11.135
  657   1HZ   LYS  65          2HZ       LYS  65   3.821  -6.869  12.231
  658   2HZ   LYS  65          1HZ       LYS  65   2.546  -7.516  13.150
  659   3HZ   LYS  65          3HZ       LYS  65   3.271  -8.449  11.932
  660    QB   LYS  65           QB       LYS  65   2.554  -5.117   7.983
  661    QD   LYS  65           QD       LYS  65   3.393  -6.928   9.837
  662    QG   LYS  65           QG       LYS  65   1.270  -7.094   8.659
  663    QE   LYS  65           QE       LYS  65   1.419  -6.798  11.320
  664    QZ   LYS  65           QZ       LYS  65   3.213  -7.612  12.438
  665    H    VAL  66           H        VAL  66  -0.597  -5.767   7.068
  666    HA   VAL  66           HA       VAL  66  -1.103  -3.491   5.178
  667    HB   VAL  66           HB       VAL  66  -3.374  -4.481   4.940
  668   1HG1  VAL  66          2HG1      VAL  66  -2.529  -5.935   7.252
  669   2HG1  VAL  66          1HG1      VAL  66  -4.104  -5.968   6.461
  670   3HG1  VAL  66          3HG1      VAL  66  -2.843  -7.096   5.963
  671   1HG2  VAL  66          1HG2      VAL  66  -0.941  -6.167   4.357
  672   2HG2  VAL  66          3HG2      VAL  66  -2.551  -6.673   3.842
  673   3HG2  VAL  66          2HG2      VAL  66  -1.869  -5.160   3.246
  674    MG1  VAL  66           QG1      VAL  66  -3.159  -6.333   6.559
  675    MG2  VAL  66           QG2      VAL  66  -1.787  -6.000   3.815
  676    QG   VAL  66           QQG      VAL  66  -2.473  -6.166   5.187
  677    H    LEU  67           H        LEU  67  -0.786  -1.912   6.856
  678    HA   LEU  67           HA       LEU  67  -1.933  -1.988   9.460
  679   1HB   LEU  67          2HB       LEU  67  -0.582  -0.153   7.665
  680   2HB   LEU  67          1HB       LEU  67  -1.844   0.687   8.566
  681    HG   LEU  67           HG       LEU  67   0.128  -1.152   9.928
  682   1HD1  LEU  67          2HD1      LEU  67   0.559   1.513   8.793
  683   2HD1  LEU  67          1HD1      LEU  67   0.880   1.455  10.527
  684   3HD1  LEU  67          3HD1      LEU  67   1.734   0.364   9.434
  685   1HD2  LEU  67          3HD2      LEU  67  -2.181  -0.117  10.851
  686   2HD2  LEU  67          2HD2      LEU  67  -0.771  -0.349  11.886
  687   3HD2  LEU  67          1HD2      LEU  67  -1.110   1.240  11.200
  688    MD1  LEU  67           QD1      LEU  67   1.058   1.110   9.585
  689    MD2  LEU  67           QD2      LEU  67  -1.354   0.258  11.312
  690    QB   LEU  67           QB       LEU  67  -1.213   0.267   8.116
  691    QD   LEU  67           QQD      LEU  67  -0.148   0.684  10.448
  692    H    VAL  68           H        VAL  68  -3.304  -1.077   6.336
  693    HA   VAL  68           HA       VAL  68  -5.823  -0.195   7.680
  694    HB   VAL  68           HB       VAL  68  -4.696   1.289   6.035
  695   1HG1  VAL  68          3HG1      VAL  68  -4.285  -1.126   4.659
  696   2HG1  VAL  68          2HG1      VAL  68  -5.426  -0.221   3.665
  697   3HG1  VAL  68          1HG1      VAL  68  -3.870   0.493   4.093
  698   1HG2  VAL  68          3HG2      VAL  68  -7.432   0.281   5.843
  699   2HG2  VAL  68          2HG2      VAL  68  -6.844   1.942   5.775
  700   3HG2  VAL  68          1HG2      VAL  68  -6.863   0.953   4.315
  701    MG1  VAL  68           QG1      VAL  68  -4.527  -0.285   4.139
  702    MG2  VAL  68           QG2      VAL  68  -7.046   1.059   5.311
  703    QG   VAL  68           QQG      VAL  68  -5.787   0.387   4.725
  704    H    LYS  69           H        LYS  69  -7.762  -1.287   7.297
  705    HA   LYS  69           HA       LYS  69  -7.574  -3.809   5.679
  706   1HB   LYS  69          2HB       LYS  69  -8.370  -3.191   8.407
  707   2HB   LYS  69          1HB       LYS  69  -9.675  -3.999   7.538
  708   1HG   LYS  69          2HG       LYS  69  -7.534  -5.487   6.736
  709   2HG   LYS  69          1HG       LYS  69  -7.036  -5.042   8.369
  710   1HD   LYS  69          2HD       LYS  69  -9.824  -6.058   7.874
  711   2HD   LYS  69          1HD       LYS  69  -8.484  -7.195   8.032
  712   1HE   LYS  69          2HE       LYS  69  -8.548  -5.079  10.103
  713   2HE   LYS  69          1HE       LYS  69  -9.890  -6.240  10.170
  714   1HZ   LYS  69          3HZ       LYS  69  -7.011  -6.951   9.946
  715   2HZ   LYS  69          2HZ       LYS  69  -7.940  -7.067  11.364
  716   3HZ   LYS  69          1HZ       LYS  69  -8.303  -8.047  10.025
  717    QB   LYS  69           QB       LYS  69  -9.023  -3.595   7.973
  718    QD   LYS  69           QD       LYS  69  -9.154  -6.626   7.953
  719    QG   LYS  69           QG       LYS  69  -7.285  -5.264   7.553
  720    QE   LYS  69           QE       LYS  69  -9.219  -5.659  10.136
  721    QZ   LYS  69           QZ       LYS  69  -7.751  -7.355  10.445
  722    H    GLU  70           H        GLU  70 -10.175  -4.488   5.441
  723    HA   GLU  70           HA       GLU  70 -11.257  -2.394   3.673
  724   1HB   GLU  70          2HB       GLU  70 -11.325  -5.243   3.964
  725   2HB   GLU  70          1HB       GLU  70 -12.986  -4.650   3.996
  726   1HG   GLU  70          2HG       GLU  70 -12.626  -3.429   1.907
  727   2HG   GLU  70          1HG       GLU  70 -10.933  -3.925   1.885
  728    QB   GLU  70           QB       GLU  70 -12.155  -4.946   3.980
  729    QG   GLU  70           QG       GLU  70 -11.779  -3.677   1.896
  730    H    ARG  71           H        ARG  71 -13.421  -1.527   3.940
  731    HA   ARG  71           HA       ARG  71 -15.182  -0.590   5.203
  732   1HB   ARG  71          2HB       ARG  71 -15.494  -3.151   5.382
  733   2HB   ARG  71          1HB       ARG  71 -14.822  -2.990   7.005
  734   1HG   ARG  71          2HG       ARG  71 -16.585  -1.170   7.391
  735   2HG   ARG  71          1HG       ARG  71 -17.345  -1.741   5.905
  736   1HD   ARG  71          2HD       ARG  71 -17.193  -4.107   7.023
  737   2HD   ARG  71          1HD       ARG  71 -17.023  -3.184   8.530
  738    HE   ARG  71           HE       ARG  71 -19.225  -2.386   6.715
  739   1HH1  ARG  71          1HH1      ARG  71 -19.839  -5.061   7.903
  740   2HH1  ARG  71          2HH1      ARG  71 -20.639  -4.632   9.378
  741   1HH2  ARG  71          1HH2      ARG  71 -19.524  -1.349   9.337
  742   2HH2  ARG  71          2HH2      ARG  71 -20.461  -2.530  10.190
  743    QB   ARG  71           QB       ARG  71 -15.158  -3.070   6.194
  744    QG   ARG  71           QG       ARG  71 -16.965  -1.455   6.648
  745    QD   ARG  71           QD       ARG  71 -17.108  -3.645   7.776
  746    QH1  ARG  71           QH1      ARG  71 -20.239  -4.847   8.640
  747    QH2  ARG  71           QH2      ARG  71 -19.992  -1.940   9.763
  748    H    ASP  72           H        ASP  72 -12.337   0.002   5.918
  749    HA   ASP  72           HA       ASP  72 -12.664   0.594   8.840
  750   1HB   ASP  72          2HB       ASP  72 -10.322   0.065   7.010
  751   2HB   ASP  72          1HB       ASP  72 -10.087   0.875   8.559
  752    QB   ASP  72           QB       ASP  72 -10.205   0.470   7.785
  753    H    ALA  73           H        ALA  73 -14.060   2.431   7.727
  754    HA   ALA  73           HA       ALA  73 -12.866   4.554   6.266
  755   1HB   ALA  73          3HB       ALA  73 -15.107   4.528   8.314
  756   2HB   ALA  73          1HB       ALA  73 -15.277   4.224   6.586
  757   3HB   ALA  73          2HB       ALA  73 -14.817   5.828   7.158
  758    MB   ALA  73           QB       ALA  73 -15.067   4.860   7.353
  759    H    VAL  74           H        VAL  74 -12.627   6.845   7.284
  760    HA   VAL  74           HA       VAL  74 -11.352   8.250   8.693
  761    HB   VAL  74           HB       VAL  74 -12.423   6.215  10.676
  762   1HG1  VAL  74          2HG1      VAL  74 -10.500   7.826  11.366
  763   2HG1  VAL  74          1HG1      VAL  74 -11.725   9.090  11.257
  764   3HG1  VAL  74          3HG1      VAL  74 -11.933   7.755  12.391
  765   1HG2  VAL  74          2HG2      VAL  74 -13.622   8.413   9.140
  766   2HG2  VAL  74          1HG2      VAL  74 -14.404   7.089  10.003
  767   3HG2  VAL  74          3HG2      VAL  74 -13.906   8.537  10.876
  768    MG1  VAL  74           QG1      VAL  74 -11.386   8.224  11.672
  769    MG2  VAL  74           QG2      VAL  74 -13.977   8.013  10.007
  770    QG   VAL  74           QQG      VAL  74 -12.682   8.118  10.839
  771    H    GLN  75           H        GLN  75  -9.294   7.533   7.733
  772    HA   GLN  75           HA       GLN  75  -7.719   5.802   9.605
  773   1HB   GLN  75          2HB       GLN  75  -6.638   4.850   7.599
  774   2HB   GLN  75          1HB       GLN  75  -8.384   4.612   7.535
  775   1HG   GLN  75          2HG       GLN  75  -8.615   6.582   6.081
  776   2HG   GLN  75          1HG       GLN  75  -6.872   6.851   6.158
  777   1HE2  GLN  75          1HE2      GLN  75  -9.390   4.895   4.691
  778   2HE2  GLN  75          2HE2      GLN  75  -8.368   4.000   3.672
  779    QB   GLN  75           QB       GLN  75  -7.511   4.731   7.567
  780    QG   GLN  75           QG       GLN  75  -7.744   6.717   6.120
  781    QE   GLN  75           QE2      GLN  75  -8.879   4.447   4.181
  782    H    GLY  76           H        GLY  76  -7.983   8.799   9.265
  783   1HA   GLY  76          1HA       GLY  76  -6.593  10.683   8.847
  784   2HA   GLY  76          2HA       GLY  76  -5.411   9.610   8.096
  785    QA   GLY  76           QA       GLY  76  -6.002  10.146   8.471
  786    H    GLY  77           H        GLY  77  -3.547   9.924   9.251
  787   1HA   GLY  77          1HA       GLY  77  -3.704  10.196  12.198
  788   2HA   GLY  77          2HA       GLY  77  -2.276  10.506  11.213
  789    QA   GLY  77           QA       GLY  77  -2.990  10.351  11.706
  790    H    GLN  78           H        GLN  78  -4.073   7.610  10.567
  791    HA   GLN  78           HA       GLN  78  -2.284   5.970  12.289
  792   1HB   GLN  78          2HB       GLN  78  -4.885   5.654  10.833
  793   2HB   GLN  78          1HB       GLN  78  -3.947   4.204  11.189
  794   1HG   GLN  78          2HG       GLN  78  -4.133   6.054  13.461
  795   2HG   GLN  78          1HG       GLN  78  -5.697   5.426  12.940
  796   1HE2  GLN  78          1HE2      GLN  78  -6.074   3.826  14.536
  797   2HE2  GLN  78          2HE2      GLN  78  -5.028   2.520  14.825
  798    QB   GLN  78           QB       GLN  78  -4.416   4.929  11.011
  799    QG   GLN  78           QG       GLN  78  -4.915   5.740  13.201
  800    QE   GLN  78           QE2      GLN  78  -5.551   3.173  14.681
  801    H    GLY  79           H        GLY  79  -0.939   4.331  11.364
  802   1HA   GLY  79          1HA       GLY  79   0.463   3.389   9.732
  803   2HA   GLY  79          2HA       GLY  79   0.347   4.947   8.912
  804    QA   GLY  79           QA       GLY  79   0.405   4.168   9.322
  805    H    LEU  80           H        LEU  80   0.173   3.988   6.827
  806    HA   LEU  80           HA       LEU  80  -2.537   2.923   6.221
  807   1HB   LEU  80          2HB       LEU  80  -0.252   4.143   4.669
  808   2HB   LEU  80          1HB       LEU  80  -1.602   3.367   3.842
  809    HG   LEU  80           HG       LEU  80  -2.079   5.463   5.956
  810   1HD1  LEU  80          2HD1      LEU  80  -3.698   3.786   4.340
  811   2HD1  LEU  80          1HD1      LEU  80  -4.229   5.082   5.410
  812   3HD1  LEU  80          3HD1      LEU  80  -3.886   5.424   3.714
  813   1HD2  LEU  80          3HD2      LEU  80  -0.544   6.353   4.160
  814   2HD2  LEU  80          2HD2      LEU  80  -1.801   5.978   2.983
  815   3HD2  LEU  80          1HD2      LEU  80  -2.103   7.172   4.245
  816    MD1  LEU  80           QD1      LEU  80  -3.938   4.764   4.488
  817    MD2  LEU  80           QD2      LEU  80  -1.483   6.501   3.796
  818    QB   LEU  80           QB       LEU  80  -0.927   3.755   4.256
  819    QD   LEU  80           QQD      LEU  80  -2.710   5.632   4.142
  820    H    ILE  81           H        ILE  81   0.707   2.236   4.865
  821    HA   ILE  81           HA       ILE  81   0.070  -0.689   5.086
  822    HB   ILE  81           HB       ILE  81   1.402   0.885   2.859
  823   1HG1  ILE  81          2HG1      ILE  81  -0.948  -0.801   2.303
  824   2HG1  ILE  81          1HG1      ILE  81  -1.281   0.546   3.393
  825   1HG2  ILE  81          2HG2      ILE  81   1.770  -1.816   3.607
  826   2HG2  ILE  81          1HG2      ILE  81   0.701  -1.839   2.204
  827   3HG2  ILE  81          3HG2      ILE  81   2.274  -1.046   2.102
  828   1HD1  ILE  81          2HD1      ILE  81   0.416   1.321   1.138
  829   2HD1  ILE  81          1HD1      ILE  81  -1.156   0.706   0.625
  830   3HD1  ILE  81          3HD1      ILE  81  -1.064   2.071   1.737
  831    MG   ILE  81           QG2      ILE  81   1.582  -1.567   2.638
  832    MD   ILE  81           QD1      ILE  81  -0.601   1.366   1.167
  833    QG   ILE  81           QG1      ILE  81  -1.114  -0.127   2.848
  834    H    LYS  82           H        LYS  82   1.852  -2.029   5.636
  835    HA   LYS  82           HA       LYS  82   4.129  -0.643   6.908
  836   1HB   LYS  82          2HB       LYS  82   2.652  -2.706   7.672
  837   2HB   LYS  82          1HB       LYS  82   3.805  -3.619   6.698
  838   1HG   LYS  82          2HG       LYS  82   4.997  -3.630   8.655
  839   2HG   LYS  82          1HG       LYS  82   5.523  -2.050   8.073
  840   1HD   LYS  82          2HD       LYS  82   3.583  -1.032   9.320
  841   2HD   LYS  82          1HD       LYS  82   3.278  -2.619  10.026
  842   1HE   LYS  82          2HE       LYS  82   5.843  -1.008  10.298
  843   2HE   LYS  82          1HE       LYS  82   4.657  -1.327  11.580
  844   1HZ   LYS  82          3HZ       LYS  82   4.989  -3.760  10.986
  845   2HZ   LYS  82          2HZ       LYS  82   6.387  -3.264  10.158
  846   3HZ   LYS  82          1HZ       LYS  82   6.250  -3.005  11.831
  847    QB   LYS  82           QB       LYS  82   3.228  -3.163   7.185
  848    QD   LYS  82           QD       LYS  82   3.431  -1.826   9.673
  849    QG   LYS  82           QG       LYS  82   5.260  -2.840   8.364
  850    QE   LYS  82           QE       LYS  82   5.250  -1.168  10.939
  851    QZ   LYS  82           QZ       LYS  82   5.876  -3.343  10.992
  852    H    ILE  83           H        ILE  83   5.936  -0.216   5.713
  853    HA   ILE  83           HA       ILE  83   6.922  -2.281   3.807
  854    HB   ILE  83           HB       ILE  83   7.213  -0.464   2.100
  855   1HG1  ILE  83          2HG1      ILE  83   5.279   1.247   3.590
  856   2HG1  ILE  83          1HG1      ILE  83   6.953   1.264   4.150
  857   1HG2  ILE  83          3HG2      ILE  83   5.224  -1.964   2.095
  858   2HG2  ILE  83          2HG2      ILE  83   4.365  -0.792   3.095
  859   3HG2  ILE  83          1HG2      ILE  83   4.854  -0.362   1.456
  860   1HD1  ILE  83          2HD1      ILE  83   6.962   1.386   1.289
  861   2HD1  ILE  83          1HD1      ILE  83   5.848   2.613   1.892
  862   3HD1  ILE  83          3HD1      ILE  83   7.526   2.601   2.436
  863    MG   ILE  83           QG2      ILE  83   4.814  -1.039   2.215
  864    MD   ILE  83           QD1      ILE  83   6.779   2.200   1.873
  865    QG   ILE  83           QG1      ILE  83   6.116   1.255   3.870
  866    H    GLY  84           H        GLY  84   9.216  -2.078   3.409
  867   1HA   GLY  84          1HA       GLY  84  11.071  -1.721   5.214
  868   2HA   GLY  84          2HA       GLY  84  10.635  -0.021   5.035
  869    QA   GLY  84           QA       GLY  84  10.853  -0.871   5.125

  No H/Q in entry =         869
  Start of MODEL    9
    1    H1   MET   1          2H        MET   1   4.281   9.178  27.727
    2    H2   MET   1          1H        MET   1   5.755   8.961  28.543
    3    H3   MET   1          3H        MET   1   4.938  10.444  28.653
    4    HA   MET   1           HA       MET   1   5.406  11.004  26.416
    5   1HB   MET   1          2HB       MET   1   7.448  10.066  28.312
    6   2HB   MET   1          1HB       MET   1   8.037  10.172  26.653
    7   1HG   MET   1          2HG       MET   1   6.421  12.441  27.769
    8   2HG   MET   1          1HG       MET   1   8.119  12.296  28.222
    9   1HE   MET   1          1HE       MET   1   8.441  14.433  27.493
   10   2HE   MET   1          3HE       MET   1   9.871  13.820  26.653
   11   3HE   MET   1          2HE       MET   1   8.797  14.963  25.851
   12    QB   MET   1           QB       MET   1   7.742  10.119  27.483
   13    QG   MET   1           QG       MET   1   7.270  12.368  27.995
   14    ME   MET   1           QE       MET   1   9.036  14.406  26.666
   15    H    LYS   2           H        LYS   2   5.364  10.241  24.342
   16    HA   LYS   2           HA       LYS   2   5.488   8.770  22.507
   17   1HB   LYS   2          2HB       LYS   2   7.377   7.215  24.306
   18   2HB   LYS   2          1HB       LYS   2   7.323   7.190  22.547
   19   1HG   LYS   2          2HG       LYS   2   7.646   9.835  22.919
   20   2HG   LYS   2          1HG       LYS   2   8.445   9.249  24.378
   21   1HD   LYS   2          2HD       LYS   2  10.265   8.865  23.107
   22   2HD   LYS   2          1HD       LYS   2   9.361   7.553  22.350
   23   1HE   LYS   2          2HE       LYS   2   9.263  10.443  21.413
   24   2HE   LYS   2          1HE       LYS   2  10.256   9.176  20.665
   25   1HZ   LYS   2          1HZ       LYS   2   8.132   7.832  20.574
   26   2HZ   LYS   2          3HZ       LYS   2   7.305   9.273  20.913
   27   3HZ   LYS   2          2HZ       LYS   2   8.232   9.142  19.495
   28    QB   LYS   2           QB       LYS   2   7.350   7.202  23.427
   29    QD   LYS   2           QD       LYS   2   9.813   8.209  22.728
   30    QG   LYS   2           QG       LYS   2   8.045   9.542  23.648
   31    QE   LYS   2           QE       LYS   2   9.759   9.809  21.039
   32    QZ   LYS   2           QZ       LYS   2   7.890   8.749  20.327
   33    H    LEU   3           H        LEU   3   5.885   6.428  25.191
   34    HA   LEU   3           HA       LEU   3   3.333   5.139  24.283
   35   1HB   LEU   3          2HB       LEU   3   5.362   3.839  23.831
   36   2HB   LEU   3          1HB       LEU   3   5.868   4.006  25.512
   37    HG   LEU   3           HG       LEU   3   3.253   2.990  25.640
   38   1HD1  LEU   3          2HD1      LEU   3   4.763   2.005  23.266
   39   2HD1  LEU   3          1HD1      LEU   3   3.934   0.795  24.244
   40   3HD1  LEU   3          3HD1      LEU   3   3.022   2.121  23.521
   41   1HD2  LEU   3          2HD2      LEU   3   5.925   1.567  25.844
   42   2HD2  LEU   3          1HD2      LEU   3   5.134   2.457  27.144
   43   3HD2  LEU   3          3HD2      LEU   3   4.403   0.981  26.513
   44    MD1  LEU   3           QD1      LEU   3   3.906   1.640  23.677
   45    MD2  LEU   3           QD2      LEU   3   5.154   1.668  26.500
   46    QB   LEU   3           QB       LEU   3   5.615   3.922  24.672
   47    QD   LEU   3           QQD      LEU   3   4.530   1.654  25.089
   48    H    LYS   4           H        LYS   4   1.727   5.331  25.797
   49    HA   LYS   4           HA       LYS   4   2.410   6.056  28.584
   50   1HB   LYS   4          2HB       LYS   4   0.253   6.408  26.700
   51   2HB   LYS   4          1HB       LYS   4  -0.379   5.707  28.192
   52   1HG   LYS   4          2HG       LYS   4   0.339   7.515  29.499
   53   2HG   LYS   4          1HG       LYS   4   1.537   8.025  28.308
   54   1HD   LYS   4          2HD       LYS   4  -0.993   8.098  27.018
   55   2HD   LYS   4          1HD       LYS   4  -1.189   8.890  28.582
   56   1HE   LYS   4          2HE       LYS   4   0.032  10.687  27.920
   57   2HE   LYS   4          1HE       LYS   4   1.310   9.654  27.248
   58   1HZ   LYS   4          2HZ       LYS   4  -1.335  10.107  25.973
   59   2HZ   LYS   4          1HZ       LYS   4   0.094  10.907  25.521
   60   3HZ   LYS   4          3HZ       LYS   4  -0.036   9.227  25.324
   61    QB   LYS   4           QB       LYS   4  -0.063   6.058  27.446
   62    QD   LYS   4           QD       LYS   4  -1.091   8.494  27.800
   63    QG   LYS   4           QG       LYS   4   0.938   7.770  28.904
   64    QE   LYS   4           QE       LYS   4   0.671  10.171  27.584
   65    QZ   LYS   4           QZ       LYS   4  -0.426  10.080  25.606
   66    H    VAL   5           H        VAL   5   0.887   4.881  30.273
   67    HA   VAL   5           HA       VAL   5   1.651   2.143  30.453
   68    HB   VAL   5           HB       VAL   5  -0.648   3.664  31.728
   69   1HG1  VAL   5          3HG1      VAL   5   2.273   3.331  32.443
   70   2HG1  VAL   5          2HG1      VAL   5   1.388   4.834  32.184
   71   3HG1  VAL   5          1HG1      VAL   5   1.063   3.855  33.615
   72   1HG2  VAL   5          1HG2      VAL   5  -0.739   1.155  31.932
   73   2HG2  VAL   5          3HG2      VAL   5   0.832   1.216  32.729
   74   3HG2  VAL   5          2HG2      VAL   5  -0.565   1.990  33.475
   75    MG1  VAL   5           QG1      VAL   5   1.574   4.007  32.748
   76    MG2  VAL   5           QG2      VAL   5  -0.157   1.454  32.712
   77    QG   VAL   5           QQG      VAL   5   0.709   2.730  32.730
   78    H    THR   6           H        THR   6  -1.225   3.691  29.098
   79    HA   THR   6           HA       THR   6  -2.916   1.415  28.851
   80    HB   THR   6           HB       THR   6  -3.634   3.727  28.513
   81    HG1  THR   6           HG1      THR   6  -4.738   3.419  26.549
   82   1HG2  THR   6          2HG2      THR   6  -1.258   3.897  27.015
   83   2HG2  THR   6          1HG2      THR   6  -2.566   4.152  25.859
   84   3HG2  THR   6          3HG2      THR   6  -2.437   5.182  27.285
   85    MG   THR   6           QG2      THR   6  -2.087   4.410  26.720
   86    H    VAL   7           H        VAL   7  -3.431   0.333  26.700
   87    HA   VAL   7           HA       VAL   7  -0.905  -0.198  25.166
   88    HB   VAL   7           HB       VAL   7  -3.248  -2.018  25.814
   89   1HG1  VAL   7          2HG1      VAL   7  -1.757  -1.350  27.751
   90   2HG1  VAL   7          1HG1      VAL   7  -1.787  -3.079  27.409
   91   3HG1  VAL   7          3HG1      VAL   7  -0.416  -2.102  26.887
   92   1HG2  VAL   7          1HG2      VAL   7  -1.326  -2.180  23.769
   93   2HG2  VAL   7          3HG2      VAL   7  -0.762  -3.288  25.020
   94   3HG2  VAL   7          2HG2      VAL   7  -2.376  -3.479  24.334
   95    MG1  VAL   7           QG1      VAL   7  -1.320  -2.177  27.349
   96    MG2  VAL   7           QG2      VAL   7  -1.488  -2.983  24.374
   97    QG   VAL   7           QQG      VAL   7  -1.404  -2.580  25.862
   98    H    ASN   8           H        ASN   8  -1.157   0.867  23.218
   99    HA   ASN   8           HA       ASN   8  -3.618   1.596  21.995
  100   1HB   ASN   8          2HB       ASN   8  -0.790   1.142  21.037
  101   2HB   ASN   8          1HB       ASN   8  -2.052   1.688  19.931
  102   1HD2  ASN   8          1HD2      ASN   8   0.305   2.815  22.077
  103   2HD2  ASN   8          2HD2      ASN   8  -0.314   4.374  22.338
  104    QB   ASN   8           QB       ASN   8  -1.421   1.415  20.484
  105    QD   ASN   8           QD2      ASN   8  -0.005   3.595  22.208
  106    H    GLY   9           H        GLY   9  -3.603   0.635  19.405
  107   1HA   GLY   9          1HA       GLY   9  -4.734  -2.030  19.759
  108   2HA   GLY   9          2HA       GLY   9  -3.241  -2.034  18.820
  109    QA   GLY   9           QA       GLY   9  -3.987  -2.032  19.290
  110    H    ALA  10           H        ALA  10  -5.530   0.638  18.767
  111    HA   ALA  10           HA       ALA  10  -7.142  -0.103  16.558
  112   1HB   ALA  10          3HB       ALA  10  -6.343   2.306  18.039
  113   2HB   ALA  10          1HB       ALA  10  -7.935   1.837  17.443
  114   3HB   ALA  10          2HB       ALA  10  -6.790   2.636  16.365
  115    MB   ALA  10           QB       ALA  10  -7.023   2.260  17.283
  116    H    GLY  11           H        GLY  11  -4.041   1.692  16.586
  117   1HA   GLY  11          1HA       GLY  11  -3.845   2.114  13.792
  118   2HA   GLY  11          2HA       GLY  11  -3.119   0.543  14.138
  119    QA   GLY  11           QA       GLY  11  -3.482   1.328  13.965
  120    H    LYS  12           H        LYS  12  -3.059   3.896  15.417
  121    HA   LYS  12           HA       LYS  12  -1.218   5.209  16.108
  122   1HB   LYS  12          2HB       LYS  12  -1.334   2.847  17.514
  123   2HB   LYS  12          1HB       LYS  12   0.325   2.827  16.915
  124   1HG   LYS  12          2HG       LYS  12  -0.115   5.468  17.768
  125   2HG   LYS  12          1HG       LYS  12  -0.834   4.451  19.018
  126   1HD   LYS  12          2HD       LYS  12   1.182   3.506  19.605
  127   2HD   LYS  12          1HD       LYS  12   1.840   3.641  17.973
  128   1HE   LYS  12          2HE       LYS  12   1.322   6.284  19.029
  129   2HE   LYS  12          1HE       LYS  12   2.361   5.372  20.143
  130   1HZ   LYS  12          1HZ       LYS  12   3.558   4.618  18.038
  131   2HZ   LYS  12          3HZ       LYS  12   2.779   5.910  17.265
  132   3HZ   LYS  12          2HZ       LYS  12   3.835   6.212  18.560
  133    QB   LYS  12           QB       LYS  12  -0.504   2.837  17.214
  134    QD   LYS  12           QD       LYS  12   1.511   3.573  18.789
  135    QG   LYS  12           QG       LYS  12  -0.475   4.960  18.393
  136    QE   LYS  12           QE       LYS  12   1.841   5.828  19.586
  137    QZ   LYS  12           QZ       LYS  12   3.391   5.580  17.954
  138    H    ALA  13           H        ALA  13   1.332   5.285  15.866
  139    HA   ALA  13           HA       ALA  13   1.961   4.398  13.078
  140   1HB   ALA  13          1HB       ALA  13   3.831   6.265  13.752
  141   2HB   ALA  13          3HB       ALA  13   2.267   6.668  13.044
  142   3HB   ALA  13          2HB       ALA  13   2.493   6.760  14.789
  143    MB   ALA  13           QB       ALA  13   2.863   6.564  13.862
  144    H    GLY  14           H        GLY  14   4.253   3.735  12.701
  145   1HA   GLY  14          1HA       GLY  14   5.252   1.599  13.947
  146   2HA   GLY  14          2HA       GLY  14   5.726   2.836  15.112
  147    QA   GLY  14           QA       GLY  14   5.489   2.218  14.530
  148    H    GLU  15           H        GLU  15   6.568   1.271  12.203
  149    HA   GLU  15           HA       GLU  15   8.583   3.385  11.534
  150   1HB   GLU  15          2HB       GLU  15   9.286   1.363  13.050
  151   2HB   GLU  15          1HB       GLU  15   9.227   0.442  11.548
  152   1HG   GLU  15          2HG       GLU  15  10.982   1.634  10.588
  153   2HG   GLU  15          1HG       GLU  15  10.712   3.049  11.606
  154    QB   GLU  15           QB       GLU  15   9.256   0.903  12.299
  155    QG   GLU  15           QG       GLU  15  10.847   2.342  11.097
  156    H    GLY  16           H        GLY  16   9.156   3.428   9.297
  157   1HA   GLY  16          1HA       GLY  16   8.584   1.450   7.366
  158   2HA   GLY  16          2HA       GLY  16   8.729   3.171   7.000
  159    QA   GLY  16           QA       GLY  16   8.656   2.311   7.183
  160    H    GLU  17           H        GLU  17   6.527   4.019   8.663
  161    HA   GLU  17           HA       GLU  17   4.193   2.694   7.329
  162   1HB   GLU  17          2HB       GLU  17   2.939   3.594   9.257
  163   2HB   GLU  17          1HB       GLU  17   4.316   2.639   9.805
  164   1HG   GLU  17          2HG       GLU  17   5.044   4.425  10.964
  165   2HG   GLU  17          1HG       GLU  17   5.276   5.277   9.438
  166    QB   GLU  17           QB       GLU  17   3.628   3.117   9.531
  167    QG   GLU  17           QG       GLU  17   5.160   4.851  10.201
  168    H    ILE  18           H        ILE  18   2.375   4.237   6.804
  169    HA   ILE  18           HA       ILE  18   3.384   6.963   6.064
  170    HB   ILE  18           HB       ILE  18   1.655   5.047   4.460
  171   1HG1  ILE  18          2HG1      ILE  18   4.055   5.841   3.130
  172   2HG1  ILE  18          1HG1      ILE  18   4.495   5.292   4.748
  173   1HG2  ILE  18          1HG2      ILE  18   2.274   7.927   4.232
  174   2HG2  ILE  18          3HG2      ILE  18   2.508   7.004   2.746
  175   3HG2  ILE  18          2HG2      ILE  18   0.937   7.005   3.545
  176   1HD1  ILE  18          1HD1      ILE  18   3.214   3.209   4.388
  177   2HD1  ILE  18          3HD1      ILE  18   2.792   3.754   2.765
  178   3HD1  ILE  18          2HD1      ILE  18   4.472   3.402   3.168
  179    MG   ILE  18           QG2      ILE  18   1.906   7.312   3.508
  180    MD   ILE  18           QD1      ILE  18   3.493   3.455   3.440
  181    QG   ILE  18           QG1      ILE  18   4.275   5.566   3.939
  182    HA   PRO  19           HA       PRO  19  -0.410   7.533   8.517
  183   1HB   PRO  19          2HB       PRO  19   0.161  10.109   9.252
  184   2HB   PRO  19          1HB       PRO  19   0.819   8.693  10.098
  185   1HG   PRO  19          2HG       PRO  19   2.104  10.452   8.067
  186   2HG   PRO  19          1HG       PRO  19   2.791   9.724   9.529
  187   1HD   PRO  19          2HD       PRO  19   3.213   8.733   7.031
  188   2HD   PRO  19          1HD       PRO  19   3.214   7.723   8.494
  189    QB   PRO  19           QB       PRO  19   0.490   9.401   9.675
  190    QG   PRO  19           QG       PRO  19   2.447  10.088   8.798
  191    QD   PRO  19           QD       PRO  19   3.213   8.228   7.763
  192    H    ALA  20           H        ALA  20  -2.228   7.985   7.340
  193    HA   ALA  20           HA       ALA  20  -2.279   9.420   4.882
  194   1HB   ALA  20          1HB       ALA  20  -3.972   7.809   5.471
  195   2HB   ALA  20          2HB       ALA  20  -4.781   9.373   5.365
  196   3HB   ALA  20          3HB       ALA  20  -4.379   8.692   6.942
  197    MB   ALA  20           QB       ALA  20  -4.377   8.625   5.926
  198    HA   PRO  21           HA       PRO  21  -2.260  13.581   6.409
  199   1HB   PRO  21          2HB       PRO  21  -3.191  14.848   4.170
  200   2HB   PRO  21          1HB       PRO  21  -1.536  14.222   4.306
  201   1HG   PRO  21          2HG       PRO  21  -3.892  13.054   2.920
  202   2HG   PRO  21          1HG       PRO  21  -2.189  13.065   2.438
  203   1HD   PRO  21          2HD       PRO  21  -3.439  10.902   3.547
  204   2HD   PRO  21          1HD       PRO  21  -1.693  11.210   3.677
  205    QB   PRO  21           QB       PRO  21  -2.363  14.535   4.238
  206    QG   PRO  21           QG       PRO  21  -3.041  13.060   2.679
  207    QD   PRO  21           QD       PRO  21  -2.566  11.056   3.612
  208    H    LEU  22           H        LEU  22  -5.095  11.982   5.169
  209    HA   LEU  22           HA       LEU  22  -6.806  13.585   6.976
  210   1HB   LEU  22          2HB       LEU  22  -6.646  13.835   4.042
  211   2HB   LEU  22          1HB       LEU  22  -8.286  13.624   4.654
  212    HG   LEU  22           HG       LEU  22  -6.840  15.474   6.336
  213   1HD1  LEU  22          3HD1      LEU  22  -9.400  15.194   4.929
  214   2HD1  LEU  22          2HD1      LEU  22  -9.054  15.927   6.495
  215   3HD1  LEU  22          1HD1      LEU  22  -8.835  16.862   5.016
  216   1HD2  LEU  22          3HD2      LEU  22  -6.096  15.632   3.607
  217   2HD2  LEU  22          2HD2      LEU  22  -7.225  16.955   3.893
  218   3HD2  LEU  22          1HD2      LEU  22  -5.769  16.811   4.877
  219    MD1  LEU  22           QD1      LEU  22  -9.096  15.994   5.480
  220    MD2  LEU  22           QD2      LEU  22  -6.363  16.466   4.125
  221    QB   LEU  22           QB       LEU  22  -7.466  13.729   4.348
  222    QD   LEU  22           QQD      LEU  22  -7.730  16.230   4.803
  223    H    ALA  23           H        ALA  23  -8.793  12.487   7.456
  224    HA   ALA  23           HA       ALA  23  -8.782   9.674   7.527
  225   1HB   ALA  23          3HB       ALA  23 -11.266  11.384   7.334
  226   2HB   ALA  23          2HB       ALA  23 -11.018   9.934   8.306
  227   3HB   ALA  23          1HB       ALA  23 -10.213  11.440   8.747
  228    MB   ALA  23           QB       ALA  23 -10.832  10.919   8.129
  229    H    GLY  24           H        GLY  24 -10.620   8.322   6.411
  230   1HA   GLY  24          1HA       GLY  24 -10.115   8.244   3.603
  231   2HA   GLY  24          2HA       GLY  24 -11.669   9.036   3.873
  232    QA   GLY  24           QA       GLY  24 -10.892   8.640   3.738
  233    H    THR  25           H        THR  25 -12.767   7.228   2.876
  234    HA   THR  25           HA       THR  25 -13.030   4.884   4.719
  235    HB   THR  25           HB       THR  25 -15.234   4.675   3.440
  236    HG1  THR  25           HG1      THR  25 -15.814   6.484   2.234
  237   1HG2  THR  25          2HG2      THR  25 -14.400   6.845   5.279
  238   2HG2  THR  25          1HG2      THR  25 -15.952   7.076   4.473
  239   3HG2  THR  25          3HG2      THR  25 -15.677   5.641   5.462
  240    MG   THR  25           QG2      THR  25 -15.343   6.521   5.071
  241    H    VAL  26           H        VAL  26 -12.521   2.852   3.953
  242    HA   VAL  26           HA       VAL  26 -11.343   2.641   1.250
  243    HB   VAL  26           HB       VAL  26 -11.630   0.643   3.518
  244   1HG1  VAL  26          1HG1      VAL  26 -10.181   0.670   0.891
  245   2HG1  VAL  26          3HG1      VAL  26  -9.459  -0.181   2.257
  246   3HG1  VAL  26          2HG1      VAL  26 -11.054  -0.651   1.670
  247   1HG2  VAL  26          3HG2      VAL  26 -10.088   3.025   3.351
  248   2HG2  VAL  26          2HG2      VAL  26  -9.994   1.763   4.580
  249   3HG2  VAL  26          1HG2      VAL  26  -8.973   1.675   3.145
  250    MG1  VAL  26           QG1      VAL  26 -10.231  -0.054   1.606
  251    MG2  VAL  26           QG2      VAL  26  -9.685   2.154   3.692
  252    QG   VAL  26           QQG      VAL  26  -9.958   1.050   2.649
  253    H    SER  27           H        SER  27 -12.431   1.748  -0.460
  254    HA   SER  27           HA       SER  27 -15.101   0.518   0.056
  255   1HB   SER  27          2HB       SER  27 -13.732   1.967  -2.183
  256   2HB   SER  27          1HB       SER  27 -15.050   0.869  -2.581
  257    HG   SER  27           HG       SER  27 -16.384   2.038  -1.201
  258    QB   SER  27           QB       SER  27 -14.391   1.418  -2.382
  259    H    LYS  28           H        LYS  28 -11.884  -0.208  -1.101
  260    HA   LYS  28           HA       LYS  28 -12.427  -3.066  -1.122
  261   1HB   LYS  28          2HB       LYS  28 -13.486  -2.156  -3.243
  262   2HB   LYS  28          1HB       LYS  28 -11.863  -1.715  -3.776
  263   1HG   LYS  28          2HG       LYS  28 -11.174  -3.941  -3.961
  264   2HG   LYS  28          1HG       LYS  28 -12.414  -4.520  -2.848
  265   1HD   LYS  28          2HD       LYS  28 -13.251  -3.232  -5.426
  266   2HD   LYS  28          1HD       LYS  28 -12.699  -4.908  -5.439
  267   1HE   LYS  28          2HE       LYS  28 -14.367  -5.230  -3.452
  268   2HE   LYS  28          1HE       LYS  28 -15.102  -3.729  -4.051
  269   1HZ   LYS  28          3HZ       LYS  28 -14.415  -5.986  -5.842
  270   2HZ   LYS  28          2HZ       LYS  28 -15.935  -5.859  -5.096
  271   3HZ   LYS  28          1HZ       LYS  28 -15.413  -4.656  -6.174
  272    QB   LYS  28           QB       LYS  28 -12.675  -1.936  -3.510
  273    QD   LYS  28           QD       LYS  28 -12.975  -4.070  -5.433
  274    QG   LYS  28           QG       LYS  28 -11.794  -4.231  -3.405
  275    QE   LYS  28           QE       LYS  28 -14.735  -4.479  -3.751
  276    QZ   LYS  28           QZ       LYS  28 -15.254  -5.500  -5.704
  277    H    ILE  29           H        ILE  29 -10.418  -4.283  -1.798
  278    HA   ILE  29           HA       ILE  29  -7.962  -2.590  -1.454
  279    HB   ILE  29           HB       ILE  29  -8.569  -3.949   0.518
  280   1HG1  ILE  29          2HG1      ILE  29  -6.194  -5.052  -1.020
  281   2HG1  ILE  29          1HG1      ILE  29  -6.179  -3.612  -0.002
  282   1HG2  ILE  29          3HG2      ILE  29  -8.445  -6.219  -1.487
  283   2HG2  ILE  29          2HG2      ILE  29  -8.464  -6.459   0.260
  284   3HG2  ILE  29          1HG2      ILE  29  -9.845  -5.710  -0.543
  285   1HD1  ILE  29          3HD1      ILE  29  -6.881  -6.394   0.975
  286   2HD1  ILE  29          2HD1      ILE  29  -5.302  -5.634   1.175
  287   3HD1  ILE  29          1HD1      ILE  29  -6.719  -4.944   1.966
  288    MG   ILE  29           QG2      ILE  29  -8.918  -6.129  -0.590
  289    MD   ILE  29           QD1      ILE  29  -6.301  -5.657   1.372
  290    QG   ILE  29           QG1      ILE  29  -6.187  -4.332  -0.511
  291    H    LEU  30           H        LEU  30  -6.193  -3.113  -2.791
  292    HA   LEU  30           HA       LEU  30  -6.798  -4.978  -5.045
  293   1HB   LEU  30          2HB       LEU  30  -5.494  -2.399  -4.678
  294   2HB   LEU  30          1HB       LEU  30  -4.458  -3.523  -5.559
  295    HG   LEU  30           HG       LEU  30  -6.738  -4.035  -6.849
  296   1HD1  LEU  30          2HD1      LEU  30  -7.153  -1.457  -5.422
  297   2HD1  LEU  30          1HD1      LEU  30  -7.649  -1.508  -7.112
  298   3HD1  LEU  30          3HD1      LEU  30  -8.337  -2.650  -5.958
  299   1HD2  LEU  30          1HD2      LEU  30  -4.470  -2.262  -7.250
  300   2HD2  LEU  30          3HD2      LEU  30  -5.309  -3.278  -8.421
  301   3HD2  LEU  30          2HD2      LEU  30  -5.903  -1.654  -8.077
  302    MD1  LEU  30           QD1      LEU  30  -7.713  -1.872  -6.164
  303    MD2  LEU  30           QD2      LEU  30  -5.227  -2.398  -7.916
  304    QB   LEU  30           QB       LEU  30  -4.976  -2.961  -5.118
  305    QD   LEU  30           QQD      LEU  30  -6.470  -2.135  -7.040
  306    H    VAL  31           H        VAL  31  -4.008  -4.016  -2.993
  307    HA   VAL  31           HA       VAL  31  -2.464  -6.380  -3.660
  308    HB   VAL  31           HB       VAL  31  -1.056  -5.527  -1.760
  309   1HG1  VAL  31          2HG1      VAL  31  -0.860  -4.603  -4.065
  310   2HG1  VAL  31          1HG1      VAL  31  -2.049  -3.370  -3.646
  311   3HG1  VAL  31          3HG1      VAL  31  -0.487  -3.402  -2.830
  312   1HG2  VAL  31          2HG2      VAL  31  -3.259  -4.679  -0.590
  313   2HG2  VAL  31          1HG2      VAL  31  -1.754  -3.784  -0.377
  314   3HG2  VAL  31          3HG2      VAL  31  -2.960  -3.218  -1.532
  315    MG1  VAL  31           QG1      VAL  31  -1.132  -3.792  -3.514
  316    MG2  VAL  31           QG2      VAL  31  -2.658  -3.894  -0.833
  317    QG   VAL  31           QQG      VAL  31  -1.895  -3.843  -2.173
  318    H    LYS  32           H        LYS  32  -1.608  -7.515  -1.345
  319    HA   LYS  32           HA       LYS  32  -3.911  -8.196   0.378
  320   1HB   LYS  32          2HB       LYS  32  -3.294  -9.636  -1.986
  321   2HB   LYS  32          1HB       LYS  32  -2.787 -10.652  -0.635
  322   1HG   LYS  32          2HG       LYS  32  -5.389  -9.330  -0.230
  323   2HG   LYS  32          1HG       LYS  32  -5.366 -10.478  -1.569
  324   1HD   LYS  32          2HD       LYS  32  -4.006 -11.419   0.877
  325   2HD   LYS  32          1HD       LYS  32  -5.746 -11.182   1.047
  326   1HE   LYS  32          2HE       LYS  32  -6.014 -12.530  -1.111
  327   2HE   LYS  32          1HE       LYS  32  -4.304 -12.971  -0.930
  328   1HZ   LYS  32          1HZ       LYS  32  -6.346 -13.279   1.207
  329   2HZ   LYS  32          3HZ       LYS  32  -5.845 -14.540   0.189
  330   3HZ   LYS  32          2HZ       LYS  32  -4.734 -13.815   1.253
  331    QB   LYS  32           QB       LYS  32  -3.041 -10.144  -1.311
  332    QD   LYS  32           QD       LYS  32  -4.876 -11.301   0.962
  333    QG   LYS  32           QG       LYS  32  -5.377  -9.904  -0.900
  334    QE   LYS  32           QE       LYS  32  -5.159 -12.751  -1.020
  335    QZ   LYS  32           QZ       LYS  32  -5.642 -13.878   0.883
  336    H    GLU  33           H        GLU  33  -1.320  -7.011   0.905
  337    HA   GLU  33           HA       GLU  33   0.421  -7.211   2.486
  338   1HB   GLU  33          2HB       GLU  33  -1.731  -8.299   3.586
  339   2HB   GLU  33          1HB       GLU  33  -0.810  -9.790   3.402
  340   1HG   GLU  33          2HG       GLU  33   0.973  -8.979   4.759
  341   2HG   GLU  33          1HG       GLU  33   0.370  -7.323   4.689
  342    QB   GLU  33           QB       GLU  33  -1.271  -9.044   3.494
  343    QG   GLU  33           QG       GLU  33   0.671  -8.151   4.724
  344    H    GLY  34           H        GLY  34   2.473  -8.138   2.495
  345   1HA   GLY  34          1HA       GLY  34   3.047 -10.851   1.771
  346   2HA   GLY  34          2HA       GLY  34   4.231  -9.546   1.838
  347    QA   GLY  34           QA       GLY  34   3.639 -10.198   1.804
  348    H    ASP  35           H        ASP  35   2.284  -8.099  -0.147
  349    HA   ASP  35           HA       ASP  35   3.094  -9.622  -2.596
  350   1HB   ASP  35          2HB       ASP  35   0.645  -8.576  -1.682
  351   2HB   ASP  35          1HB       ASP  35   1.160  -7.484  -2.968
  352    QB   ASP  35           QB       ASP  35   0.902  -8.030  -2.325
  353    H    THR  36           H        THR  36   4.696  -8.673  -3.795
  354    HA   THR  36           HA       THR  36   6.010  -6.261  -3.101
  355    HB   THR  36           HB       THR  36   5.832  -7.390  -5.898
  356    HG1  THR  36           HG1      THR  36   7.522  -8.840  -5.044
  357   1HG2  THR  36          2HG2      THR  36   7.828  -5.893  -4.244
  358   2HG2  THR  36          1HG2      THR  36   8.418  -6.988  -5.493
  359   3HG2  THR  36          3HG2      THR  36   7.358  -5.647  -5.926
  360    MG   THR  36           QG2      THR  36   7.868  -6.176  -5.221
  361    H    VAL  37           H        VAL  37   6.178  -4.409  -4.892
  362    HA   VAL  37           HA       VAL  37   3.766  -3.758  -6.367
  363    HB   VAL  37           HB       VAL  37   3.010  -3.534  -4.011
  364   1HG1  VAL  37          3HG1      VAL  37   3.325  -0.900  -5.482
  365   2HG1  VAL  37          2HG1      VAL  37   2.028  -2.071  -5.725
  366   3HG1  VAL  37          1HG1      VAL  37   2.164  -1.212  -4.191
  367   1HG2  VAL  37          1HG2      VAL  37   5.590  -2.306  -3.742
  368   2HG2  VAL  37          3HG2      VAL  37   4.354  -1.138  -3.271
  369   3HG2  VAL  37          2HG2      VAL  37   4.431  -2.710  -2.476
  370    MG1  VAL  37           QG1      VAL  37   2.506  -1.394  -5.133
  371    MG2  VAL  37           QG2      VAL  37   4.792  -2.051  -3.163
  372    QG   VAL  37           QQG      VAL  37   3.649  -1.723  -4.148
  373    H    LYS  38           H        LYS  38   3.933  -1.516  -7.291
  374    HA   LYS  38           HA       LYS  38   6.770  -0.538  -7.301
  375   1HB   LYS  38          2HB       LYS  38   4.755  -1.110  -9.448
  376   2HB   LYS  38          1HB       LYS  38   5.929   0.180  -9.719
  377   1HG   LYS  38          2HG       LYS  38   7.652  -1.637  -8.866
  378   2HG   LYS  38          1HG       LYS  38   6.394  -2.762  -9.378
  379   1HD   LYS  38          2HD       LYS  38   7.106  -0.568 -11.267
  380   2HD   LYS  38          1HD       LYS  38   8.274  -1.876 -11.072
  381   1HE   LYS  38          2HE       LYS  38   5.401  -2.638 -11.436
  382   2HE   LYS  38          1HE       LYS  38   6.302  -2.076 -12.859
  383   1HZ   LYS  38          2HZ       LYS  38   8.125  -3.612 -12.107
  384   2HZ   LYS  38          1HZ       LYS  38   7.011  -4.292 -11.020
  385   3HZ   LYS  38          3HZ       LYS  38   6.726  -4.380 -12.689
  386    QB   LYS  38           QB       LYS  38   5.342  -0.465  -9.583
  387    QD   LYS  38           QD       LYS  38   7.690  -1.222 -11.169
  388    QG   LYS  38           QG       LYS  38   7.023  -2.199  -9.122
  389    QE   LYS  38           QE       LYS  38   5.851  -2.357 -12.147
  390    QZ   LYS  38           QZ       LYS  38   7.287  -4.095 -11.939
  391    H    ALA  39           H        ALA  39   6.734   1.834  -8.296
  392    HA   ALA  39           HA       ALA  39   4.995   3.431  -6.548
  393   1HB   ALA  39          2HB       ALA  39   7.432   3.709  -8.178
  394   2HB   ALA  39          3HB       ALA  39   7.012   4.482  -6.649
  395   3HB   ALA  39          1HB       ALA  39   6.416   5.151  -8.168
  396    MB   ALA  39           QB       ALA  39   6.953   4.447  -7.665
  397    H    GLY  40           H        GLY  40   3.042   4.244  -7.197
  398   1HA   GLY  40          1HA       GLY  40   2.633   4.849 -10.081
  399   2HA   GLY  40          2HA       GLY  40   1.665   5.496  -8.757
  400    QA   GLY  40           QA       GLY  40   2.149   5.172  -9.419
  401    H    GLN  41           H        GLN  41   2.456   2.114  -8.715
  402    HA   GLN  41           HA       GLN  41   0.185   1.131 -10.205
  403   1HB   GLN  41          2HB       GLN  41   2.290  -0.098  -9.693
  404   2HB   GLN  41          1HB       GLN  41   1.834  -0.132  -7.991
  405   1HG   GLN  41          2HG       GLN  41  -0.317  -1.284  -8.711
  406   2HG   GLN  41          1HG       GLN  41   0.412  -1.463 -10.307
  407   1HE2  GLN  41          1HE2      GLN  41   0.509  -3.824 -10.069
  408   2HE2  GLN  41          2HE2      GLN  41   1.643  -4.551  -9.036
  409    QB   GLN  41           QB       GLN  41   2.062  -0.115  -8.842
  410    QG   GLN  41           QG       GLN  41   0.047  -1.373  -9.509
  411    QE   GLN  41           QE2      GLN  41   1.076  -4.188  -9.553
  412    H    THR  42           H        THR  42  -1.931   1.052  -9.541
  413    HA   THR  42           HA       THR  42  -2.953   2.173  -7.172
  414    HB   THR  42           HB       THR  42  -4.003  -0.087  -8.909
  415    HG1  THR  42           HG1      THR  42  -4.275   2.731  -8.953
  416   1HG2  THR  42          2HG2      THR  42  -5.174   0.052  -6.736
  417   2HG2  THR  42          1HG2      THR  42  -5.473   1.769  -7.016
  418   3HG2  THR  42          3HG2      THR  42  -6.217   0.562  -8.064
  419    MG   THR  42           QG2      THR  42  -5.621   0.794  -7.272
  420    H    VAL  43           H        VAL  43  -3.238   1.393  -5.089
  421    HA   VAL  43           HA       VAL  43  -2.395  -1.438  -4.563
  422    HB   VAL  43           HB       VAL  43  -1.972   1.096  -2.942
  423   1HG1  VAL  43          1HG1      VAL  43  -0.216  -0.595  -4.714
  424   2HG1  VAL  43          3HG1      VAL  43  -0.421   1.156  -4.715
  425   3HG1  VAL  43          2HG1      VAL  43   0.478   0.374  -3.415
  426   1HG2  VAL  43          1HG2      VAL  43  -2.306  -1.280  -1.803
  427   2HG2  VAL  43          3HG2      VAL  43  -0.647  -1.524  -2.348
  428   3HG2  VAL  43          2HG2      VAL  43  -1.030  -0.193  -1.257
  429    MG1  VAL  43           QG1      VAL  43  -0.053   0.312  -4.282
  430    MG2  VAL  43           QG2      VAL  43  -1.327  -0.999  -1.803
  431    QG   VAL  43           QQG      VAL  43  -0.690  -0.344  -3.042
  432    H    LEU  44           H        LEU  44  -4.512   1.264  -3.592
  433    HA   LEU  44           HA       LEU  44  -6.379  -0.766  -2.421
  434   1HB   LEU  44          2HB       LEU  44  -4.745   1.211  -1.049
  435   2HB   LEU  44          1HB       LEU  44  -6.460   1.455  -0.713
  436    HG   LEU  44           HG       LEU  44  -5.664  -1.369  -0.655
  437   1HD1  LEU  44          1HD1      LEU  44  -4.390   0.640   1.214
  438   2HD1  LEU  44          3HD1      LEU  44  -4.582  -1.060   1.641
  439   3HD1  LEU  44          2HD1      LEU  44  -3.590  -0.606   0.256
  440   1HD2  LEU  44          3HD2      LEU  44  -7.660   0.300   0.380
  441   2HD2  LEU  44          2HD2      LEU  44  -7.436  -1.412   0.741
  442   3HD2  LEU  44          1HD2      LEU  44  -6.718  -0.189   1.788
  443    MD1  LEU  44           QD1      LEU  44  -4.187  -0.342   1.037
  444    MD2  LEU  44           QD2      LEU  44  -7.272  -0.433   0.970
  445    QB   LEU  44           QB       LEU  44  -5.602   1.333  -0.881
  446    QD   LEU  44           QQD      LEU  44  -5.729  -0.388   1.003
  447    H    VAL  45           H        VAL  45  -8.508   0.460  -1.769
  448    HA   VAL  45           HA       VAL  45  -9.131   2.531  -3.855
  449    HB   VAL  45           HB       VAL  45 -10.880   0.297  -2.768
  450   1HG1  VAL  45          1HG1      VAL  45  -9.393   0.561  -5.400
  451   2HG1  VAL  45          3HG1      VAL  45  -9.048  -0.604  -4.122
  452   3HG1  VAL  45          2HG1      VAL  45 -10.560  -0.706  -5.025
  453   1HG2  VAL  45          1HG2      VAL  45 -11.885   2.522  -3.683
  454   2HG2  VAL  45          3HG2      VAL  45 -11.359   1.927  -5.257
  455   3HG2  VAL  45          2HG2      VAL  45 -12.517   0.998  -4.305
  456    MG1  VAL  45           QG1      VAL  45  -9.667  -0.250  -4.849
  457    MG2  VAL  45           QG2      VAL  45 -11.920   1.816  -4.415
  458    QG   VAL  45           QQG      VAL  45 -10.794   0.783  -4.632
  459    H    LEU  46           H        LEU  46 -10.455   4.264  -3.126
  460    HA   LEU  46           HA       LEU  46 -11.524   4.141  -0.352
  461   1HB   LEU  46          2HB       LEU  46  -9.170   5.673  -1.330
  462   2HB   LEU  46          1HB       LEU  46 -10.271   6.541  -0.260
  463    HG   LEU  46           HG       LEU  46  -9.767   3.844   0.706
  464   1HD1  LEU  46          3HD1      LEU  46  -7.431   5.639   0.068
  465   2HD1  LEU  46          2HD1      LEU  46  -7.367   4.531   1.438
  466   3HD1  LEU  46          1HD1      LEU  46  -7.591   3.903  -0.195
  467   1HD2  LEU  46          3HD2      LEU  46 -10.674   5.965   1.879
  468   2HD2  LEU  46          2HD2      LEU  46  -9.527   4.969   2.774
  469   3HD2  LEU  46          1HD2      LEU  46  -8.986   6.458   1.999
  470    MD1  LEU  46           QD1      LEU  46  -7.463   4.691   0.437
  471    MD2  LEU  46           QD2      LEU  46  -9.729   5.797   2.217
  472    QB   LEU  46           QB       LEU  46  -9.720   6.107  -0.795
  473    QD   LEU  46           QQD      LEU  46  -8.596   5.244   1.327
  474    H    GLU  47           H        GLU  47 -12.412   6.607   0.052
  475    HA   GLU  47           HA       GLU  47 -13.454   7.938  -2.324
  476   1HB   GLU  47          2HB       GLU  47 -14.710   5.653  -1.859
  477   2HB   GLU  47          1HB       GLU  47 -15.540   6.603  -0.625
  478   1HG   GLU  47          2HG       GLU  47 -16.907   7.337  -2.262
  479   2HG   GLU  47          1HG       GLU  47 -15.534   8.255  -2.880
  480    QB   GLU  47           QB       GLU  47 -15.125   6.128  -1.242
  481    QG   GLU  47           QG       GLU  47 -16.221   7.796  -2.571
  482    H    ALA  48           H        ALA  48 -13.140   9.991  -1.486
  483    HA   ALA  48           HA       ALA  48 -14.813  10.901   0.719
  484   1HB   ALA  48          1HB       ALA  48 -11.836  11.015   1.187
  485   2HB   ALA  48          3HB       ALA  48 -13.141  11.169   2.365
  486   3HB   ALA  48          2HB       ALA  48 -12.768   9.594   1.664
  487    MB   ALA  48           QB       ALA  48 -12.581  10.592   1.739
  488    H    MET  49           H        MET  49 -13.455  13.198   1.436
  489    HA   MET  49           HA       MET  49 -13.860  14.931  -0.814
  490   1HB   MET  49          2HB       MET  49 -13.825  15.247   1.820
  491   2HB   MET  49          1HB       MET  49 -12.134  15.654   1.530
  492   1HG   MET  49          2HG       MET  49 -13.272  17.129  -0.419
  493   2HG   MET  49          1HG       MET  49 -14.597  17.125   0.746
  494   1HE   MET  49          2HE       MET  49 -14.531  19.323   0.557
  495   2HE   MET  49          1HE       MET  49 -14.281  19.920   2.197
  496   3HE   MET  49          3HE       MET  49 -13.227  20.463   0.884
  497    QB   MET  49           QB       MET  49 -12.979  15.450   1.675
  498    QG   MET  49           QG       MET  49 -13.934  17.127   0.163
  499    ME   MET  49           QE       MET  49 -14.013  19.902   1.213
  500    H    LYS  50           H        LYS  50 -10.947  13.447   0.582
  501    HA   LYS  50           HA       LYS  50  -9.355  14.636  -1.669
  502   1HB   LYS  50          2HB       LYS  50  -8.996  14.398   1.221
  503   2HB   LYS  50          1HB       LYS  50  -7.608  13.775   0.326
  504   1HG   LYS  50          2HG       LYS  50  -7.687  15.924  -1.042
  505   2HG   LYS  50          1HG       LYS  50  -8.835  16.535   0.150
  506   1HD   LYS  50          2HD       LYS  50  -6.876  17.284   1.113
  507   2HD   LYS  50          1HD       LYS  50  -6.954  15.680   1.845
  508   1HE   LYS  50          2HE       LYS  50  -4.898  15.315   0.947
  509   2HE   LYS  50          1HE       LYS  50  -5.705  15.257  -0.633
  510   1HZ   LYS  50          2HZ       LYS  50  -5.561  17.683  -0.737
  511   2HZ   LYS  50          1HZ       LYS  50  -4.713  17.703   0.736
  512   3HZ   LYS  50          3HZ       LYS  50  -4.019  16.978  -0.633
  513    QB   LYS  50           QB       LYS  50  -8.302  14.087   0.774
  514    QD   LYS  50           QD       LYS  50  -6.915  16.482   1.479
  515    QG   LYS  50           QG       LYS  50  -8.261  16.230  -0.446
  516    QE   LYS  50           QE       LYS  50  -5.301  15.286   0.157
  517    QZ   LYS  50           QZ       LYS  50  -4.765  17.455  -0.211
  518    H    MET  51           H        MET  51 -10.889  11.876  -1.090
  519    HA   MET  51           HA       MET  51  -8.605  10.143  -1.982
  520   1HB   MET  51          2HB       MET  51 -10.823   9.851  -0.018
  521   2HB   MET  51          1HB       MET  51 -10.430   8.415  -0.966
  522   1HG   MET  51          2HG       MET  51  -8.980   8.205   0.859
  523   2HG   MET  51          1HG       MET  51  -7.955   8.997  -0.337
  524   1HE   MET  51          1HE       MET  51  -6.525  10.434   0.214
  525   2HE   MET  51          3HE       MET  51  -6.494  11.646   1.502
  526   3HE   MET  51          2HE       MET  51  -6.322   9.937   1.893
  527    QB   MET  51           QB       MET  51 -10.626   9.133  -0.492
  528    QG   MET  51           QG       MET  51  -8.467   8.601   0.261
  529    ME   MET  51           QE       MET  51  -6.447  10.673   1.203
  530    H    GLU  52           H        GLU  52  -9.142   8.578  -3.657
  531    HA   GLU  52           HA       GLU  52 -11.829   8.813  -4.906
  532   1HB   GLU  52          2HB       GLU  52 -10.745   9.371  -7.084
  533   2HB   GLU  52          1HB       GLU  52 -10.475  10.615  -5.863
  534   1HG   GLU  52          2HG       GLU  52  -8.263  10.384  -6.195
  535   2HG   GLU  52          1HG       GLU  52  -8.381   8.752  -5.536
  536    QB   GLU  52           QB       GLU  52 -10.610   9.993  -6.474
  537    QG   GLU  52           QG       GLU  52  -8.322   9.568  -5.866
  538    H    THR  53           H        THR  53 -12.098   6.574  -4.430
  539    HA   THR  53           HA       THR  53 -11.731   4.239  -4.598
  540    HB   THR  53           HB       THR  53 -13.003   4.954  -6.558
  541    HG1  THR  53           HG1      THR  53 -12.666   3.135  -7.647
  542   1HG2  THR  53          1HG2      THR  53 -10.260   5.476  -7.699
  543   2HG2  THR  53          3HG2      THR  53 -11.681   5.280  -8.721
  544   3HG2  THR  53          2HG2      THR  53 -11.609   6.599  -7.555
  545    MG   THR  53           QG2      THR  53 -11.183   5.785  -7.992
  546    H    GLU  54           H        GLU  54  -9.993   3.589  -7.255
  547    HA   GLU  54           HA       GLU  54  -7.828   2.310  -6.242
  548   1HB   GLU  54          2HB       GLU  54  -7.861   4.144  -8.656
  549   2HB   GLU  54          1HB       GLU  54  -6.730   2.814  -8.402
  550   1HG   GLU  54          2HG       GLU  54  -8.223   1.352  -9.230
  551   2HG   GLU  54          1HG       GLU  54  -9.405   1.843  -8.016
  552    QB   GLU  54           QB       GLU  54  -7.296   3.479  -8.529
  553    QG   GLU  54           QG       GLU  54  -8.814   1.597  -8.623
  554    H    ILE  55           H        ILE  55  -5.960   2.785  -5.187
  555    HA   ILE  55           HA       ILE  55  -5.075   5.648  -5.039
  556    HB   ILE  55           HB       ILE  55  -4.879   3.522  -2.880
  557   1HG1  ILE  55          2HG1      ILE  55  -7.249   4.043  -3.369
  558   2HG1  ILE  55          1HG1      ILE  55  -6.769   4.670  -1.792
  559   1HG2  ILE  55          2HG2      ILE  55  -3.258   5.409  -2.781
  560   2HG2  ILE  55          1HG2      ILE  55  -4.610   6.541  -2.768
  561   3HG2  ILE  55          3HG2      ILE  55  -4.383   5.422  -1.424
  562   1HD1  ILE  55          2HD1      ILE  55  -6.746   6.332  -4.325
  563   2HD1  ILE  55          1HD1      ILE  55  -8.095   6.302  -3.191
  564   3HD1  ILE  55          3HD1      ILE  55  -6.520   6.903  -2.672
  565    MG   ILE  55           QG2      ILE  55  -4.084   5.791  -2.324
  566    MD   ILE  55           QD1      ILE  55  -7.120   6.512  -3.396
  567    QG   ILE  55           QG1      ILE  55  -7.009   4.356  -2.581
  568    H    ASN  56           H        ASN  56  -3.275   5.616  -6.357
  569    HA   ASN  56           HA       ASN  56  -1.569   3.440  -6.937
  570   1HB   ASN  56          2HB       ASN  56  -0.955   6.406  -6.788
  571   2HB   ASN  56          1HB       ASN  56  -0.062   5.214  -7.733
  572   1HD2  ASN  56          1HD2      ASN  56  -2.261   7.595  -8.185
  573   2HD2  ASN  56          2HD2      ASN  56  -3.156   6.948  -9.474
  574    QB   ASN  56           QB       ASN  56  -0.509   5.810  -7.261
  575    QD   ASN  56           QD2      ASN  56  -2.709   7.272  -8.829
  576    H    ALA  57           H        ALA  57   0.335   2.678  -5.990
  577    HA   ALA  57           HA       ALA  57   0.694   2.927  -3.165
  578   1HB   ALA  57          2HB       ALA  57   1.564   1.314  -5.207
  579   2HB   ALA  57          3HB       ALA  57   2.215   1.271  -3.567
  580   3HB   ALA  57          1HB       ALA  57   3.036   2.205  -4.818
  581    MB   ALA  57           QB       ALA  57   2.272   1.597  -4.531
  582    HA   PRO  58           HA       PRO  58   3.019   6.665  -2.886
  583   1HB   PRO  58          2HB       PRO  58   4.480   6.170  -0.625
  584   2HB   PRO  58          1HB       PRO  58   2.744   6.538  -0.592
  585   1HG   PRO  58          2HG       PRO  58   4.126   3.913  -0.375
  586   2HG   PRO  58          1HG       PRO  58   2.690   4.507   0.473
  587   1HD   PRO  58          2HD       PRO  58   2.592   2.786  -1.645
  588   2HD   PRO  58          1HD       PRO  58   1.281   3.910  -1.227
  589    QB   PRO  58           QB       PRO  58   3.612   6.354  -0.608
  590    QG   PRO  58           QG       PRO  58   3.408   4.210   0.049
  591    QD   PRO  58           QD       PRO  58   1.936   3.348  -1.436
  592    H    THR  59           H        THR  59   4.763   3.583  -2.654
  593    HA   THR  59           HA       THR  59   6.849   4.582  -4.465
  594    HB   THR  59           HB       THR  59   7.562   5.492  -2.310
  595    HG1  THR  59           HG1      THR  59   9.536   4.226  -2.097
  596   1HG2  THR  59          2HG2      THR  59   6.251   3.881  -0.926
  597   2HG2  THR  59          1HG2      THR  59   7.445   2.638  -1.301
  598   3HG2  THR  59          3HG2      THR  59   7.916   4.062  -0.373
  599    MG   THR  59           QG2      THR  59   7.204   3.527  -0.867
  600    H    ASP  60           H        ASP  60   8.126   2.831  -5.308
  601    HA   ASP  60           HA       ASP  60   6.863   0.279  -5.467
  602   1HB   ASP  60          2HB       ASP  60   8.962  -0.337  -6.614
  603   2HB   ASP  60          1HB       ASP  60   8.430   1.268  -7.117
  604    QB   ASP  60           QB       ASP  60   8.696   0.465  -6.866
  605    H    GLY  61           H        GLY  61   7.678  -1.788  -4.626
  606   1HA   GLY  61          1HA       GLY  61   8.736  -1.507  -1.872
  607   2HA   GLY  61          2HA       GLY  61   9.638  -2.538  -2.984
  608    QA   GLY  61           QA       GLY  61   9.187  -2.023  -2.428
  609    H    LYS  62           H        LYS  62   7.994  -3.151  -0.497
  610    HA   LYS  62           HA       LYS  62   5.913  -4.935  -1.686
  611   1HB   LYS  62          2HB       LYS  62   7.997  -6.208  -1.524
  612   2HB   LYS  62          1HB       LYS  62   8.193  -5.716   0.160
  613   1HG   LYS  62          2HG       LYS  62   6.551  -7.142   0.915
  614   2HG   LYS  62          1HG       LYS  62   5.623  -7.034  -0.581
  615   1HD   LYS  62          2HD       LYS  62   6.833  -8.695  -1.618
  616   2HD   LYS  62          1HD       LYS  62   8.311  -8.315  -0.734
  617   1HE   LYS  62          2HE       LYS  62   6.939  -9.169   1.356
  618   2HE   LYS  62          1HE       LYS  62   5.984 -10.013   0.120
  619   1HZ   LYS  62          3HZ       LYS  62   8.129 -10.773  -0.847
  620   2HZ   LYS  62          2HZ       LYS  62   8.925 -10.140   0.514
  621   3HZ   LYS  62          1HZ       LYS  62   7.812 -11.412   0.691
  622    QB   LYS  62           QB       LYS  62   8.095  -5.962  -0.682
  623    QD   LYS  62           QD       LYS  62   7.572  -8.505  -1.176
  624    QG   LYS  62           QG       LYS  62   6.087  -7.088   0.167
  625    QE   LYS  62           QE       LYS  62   6.462  -9.591   0.738
  626    QZ   LYS  62           QZ       LYS  62   8.289 -10.775   0.119
  627    H    VAL  63           H        VAL  63   4.342  -5.666  -0.060
  628    HA   VAL  63           HA       VAL  63   3.901  -3.640   2.030
  629    HB   VAL  63           HB       VAL  63   2.388  -6.044   0.974
  630   1HG1  VAL  63          1HG1      VAL  63   2.540  -3.981  -0.426
  631   2HG1  VAL  63          3HG1      VAL  63   0.890  -4.340   0.086
  632   3HG1  VAL  63          2HG1      VAL  63   1.810  -3.073   0.899
  633   1HG2  VAL  63          3HG2      VAL  63   1.552  -4.073   3.128
  634   2HG2  VAL  63          2HG2      VAL  63   0.489  -5.262   2.377
  635   3HG2  VAL  63          1HG2      VAL  63   1.850  -5.795   3.363
  636    MG1  VAL  63           QG1      VAL  63   1.747  -3.798   0.186
  637    MG2  VAL  63           QG2      VAL  63   1.297  -5.043   2.956
  638    QG   VAL  63           QQG      VAL  63   1.522  -4.421   1.571
  639    H    GLU  64           H        GLU  64   4.747  -3.893   4.038
  640    HA   GLU  64           HA       GLU  64   5.627  -6.561   4.971
  641   1HB   GLU  64          2HB       GLU  64   5.891  -3.695   5.893
  642   2HB   GLU  64          1HB       GLU  64   6.396  -5.034   6.924
  643   1HG   GLU  64          2HG       GLU  64   7.411  -5.446   4.261
  644   2HG   GLU  64          1HG       GLU  64   7.866  -3.836   4.821
  645    QB   GLU  64           QB       GLU  64   6.144  -4.364   6.409
  646    QG   GLU  64           QG       GLU  64   7.638  -4.641   4.541
  647    H    LYS  65           H        LYS  65   2.835  -4.586   5.150
  648    HA   LYS  65           HA       LYS  65   1.395  -6.382   6.859
  649   1HB   LYS  65          2HB       LYS  65   3.073  -4.333   8.105
  650   2HB   LYS  65          1HB       LYS  65   1.385  -4.196   8.599
  651   1HG   LYS  65          2HG       LYS  65   1.766  -6.907   8.725
  652   2HG   LYS  65          1HG       LYS  65   3.354  -6.307   9.205
  653   1HD   LYS  65          2HD       LYS  65   2.165  -4.766  10.833
  654   2HD   LYS  65          1HD       LYS  65   0.681  -5.649  10.467
  655   1HE   LYS  65          2HE       LYS  65   3.200  -7.069  11.375
  656   2HE   LYS  65          1HE       LYS  65   1.976  -6.480  12.518
  657   1HZ   LYS  65          3HZ       LYS  65   0.318  -7.627  10.986
  658   2HZ   LYS  65          2HZ       LYS  65   1.655  -8.451  10.336
  659   3HZ   LYS  65          1HZ       LYS  65   1.264  -8.624  11.980
  660    QB   LYS  65           QB       LYS  65   2.229  -4.264   8.352
  661    QD   LYS  65           QD       LYS  65   1.423  -5.208  10.650
  662    QG   LYS  65           QG       LYS  65   2.560  -6.607   8.965
  663    QE   LYS  65           QE       LYS  65   2.588  -6.774  11.947
  664    QZ   LYS  65           QZ       LYS  65   1.079  -8.234  11.101
  665    H    VAL  66           H        VAL  66  -0.805  -5.472   7.366
  666    HA   VAL  66           HA       VAL  66  -1.487  -3.166   5.567
  667    HB   VAL  66           HB       VAL  66  -2.968  -5.749   6.165
  668   1HG1  VAL  66          1HG1      VAL  66  -0.927  -5.349   4.413
  669   2HG1  VAL  66          3HG1      VAL  66  -2.232  -6.502   4.138
  670   3HG1  VAL  66          2HG1      VAL  66  -2.302  -4.900   3.404
  671   1HG2  VAL  66          3HG2      VAL  66  -3.990  -3.195   5.412
  672   2HG2  VAL  66          2HG2      VAL  66  -4.084  -4.241   3.996
  673   3HG2  VAL  66          1HG2      VAL  66  -4.862  -4.726   5.502
  674    MG1  VAL  66           QG1      VAL  66  -1.820  -5.584   3.985
  675    MG2  VAL  66           QG2      VAL  66  -4.312  -4.054   4.970
  676    QG   VAL  66           QQG      VAL  66  -3.066  -4.819   4.477
  677    H    LEU  67           H        LEU  67  -1.549  -1.612   7.272
  678    HA   LEU  67           HA       LEU  67  -2.878  -2.061   9.798
  679   1HB   LEU  67          2HB       LEU  67  -1.692   0.181   8.234
  680   2HB   LEU  67          1HB       LEU  67  -2.825   0.626   9.510
  681    HG   LEU  67           HG       LEU  67  -0.844  -1.436  10.264
  682   1HD1  LEU  67          3HD1      LEU  67   0.031   0.920   8.900
  683   2HD1  LEU  67          2HD1      LEU  67   0.450   1.089  10.604
  684   3HD1  LEU  67          1HD1      LEU  67   1.017  -0.309   9.691
  685   1HD2  LEU  67          3HD2      LEU  67  -1.995   1.090  11.469
  686   2HD2  LEU  67          2HD2      LEU  67  -2.302  -0.578  11.954
  687   3HD2  LEU  67          1HD2      LEU  67  -0.727   0.154  12.262
  688    MD1  LEU  67           QD1      LEU  67   0.500   0.566   9.732
  689    MD2  LEU  67           QD2      LEU  67  -1.674   0.222  11.895
  690    QB   LEU  67           QB       LEU  67  -2.259   0.403   8.872
  691    QD   LEU  67           QQD      LEU  67  -0.587   0.394  10.813
  692    H    VAL  68           H        VAL  68  -3.902  -0.698   6.680
  693    HA   VAL  68           HA       VAL  68  -6.615  -0.142   7.758
  694    HB   VAL  68           HB       VAL  68  -5.357   0.332   5.035
  695   1HG1  VAL  68          3HG1      VAL  68  -8.002   0.939   6.271
  696   2HG1  VAL  68          2HG1      VAL  68  -7.281   2.195   5.263
  697   3HG1  VAL  68          1HG1      VAL  68  -7.600   0.596   4.589
  698   1HG2  VAL  68          1HG2      VAL  68  -4.269   1.479   7.039
  699   2HG2  VAL  68          3HG2      VAL  68  -4.871   2.556   5.779
  700   3HG2  VAL  68          2HG2      VAL  68  -5.796   2.332   7.264
  701    MG1  VAL  68           QG1      VAL  68  -7.628   1.243   5.374
  702    MG2  VAL  68           QG2      VAL  68  -4.979   2.122   6.694
  703    QG   VAL  68           QQG      VAL  68  -6.303   1.683   6.034
  704    H    LYS  69           H        LYS  69  -8.263  -1.591   7.433
  705    HA   LYS  69           HA       LYS  69  -7.769  -3.927   5.657
  706   1HB   LYS  69          2HB       LYS  69  -9.226  -3.303   8.119
  707   2HB   LYS  69          1HB       LYS  69 -10.197  -4.240   6.982
  708   1HG   LYS  69          2HG       LYS  69  -9.105  -6.006   7.944
  709   2HG   LYS  69          1HG       LYS  69  -7.847  -5.572   6.784
  710   1HD   LYS  69          2HD       LYS  69  -6.613  -5.599   8.749
  711   2HD   LYS  69          1HD       LYS  69  -7.106  -3.906   8.706
  712   1HE   LYS  69          2HE       LYS  69  -9.168  -4.647  10.075
  713   2HE   LYS  69          1HE       LYS  69  -8.264  -6.145  10.375
  714   1HZ   LYS  69          3HZ       LYS  69  -7.042  -3.474  10.744
  715   2HZ   LYS  69          2HZ       LYS  69  -7.880  -4.253  12.001
  716   3HZ   LYS  69          1HZ       LYS  69  -6.494  -4.969  11.329
  717    QB   LYS  69           QB       LYS  69  -9.712  -3.771   7.550
  718    QD   LYS  69           QD       LYS  69  -6.859  -4.752   8.728
  719    QG   LYS  69           QG       LYS  69  -8.476  -5.789   7.364
  720    QE   LYS  69           QE       LYS  69  -8.716  -5.396  10.225
  721    QZ   LYS  69           QZ       LYS  69  -7.139  -4.232  11.358
  722    H    GLU  70           H        GLU  70 -10.254  -4.662   4.867
  723    HA   GLU  70           HA       GLU  70 -10.938  -2.613   2.866
  724   1HB   GLU  70          2HB       GLU  70 -10.798  -5.325   2.880
  725   2HB   GLU  70          1HB       GLU  70 -12.524  -5.106   3.171
  726   1HG   GLU  70          2HG       GLU  70 -11.793  -3.255   1.146
  727   2HG   GLU  70          1HG       GLU  70 -11.073  -4.804   0.707
  728    QB   GLU  70           QB       GLU  70 -11.661  -5.215   3.026
  729    QG   GLU  70           QG       GLU  70 -11.433  -4.029   0.926
  730    H    ARG  71           H        ARG  71 -12.733  -1.295   2.963
  731    HA   ARG  71           HA       ARG  71 -14.634  -0.237   3.894
  732   1HB   ARG  71          2HB       ARG  71 -15.045  -3.203   4.070
  733   2HB   ARG  71          1HB       ARG  71 -16.246  -2.140   4.807
  734   1HG   ARG  71          2HG       ARG  71 -16.798  -1.133   2.756
  735   2HG   ARG  71          1HG       ARG  71 -15.296  -1.652   1.990
  736   1HD   ARG  71          2HD       ARG  71 -17.054  -3.075   1.126
  737   2HD   ARG  71          1HD       ARG  71 -16.132  -4.058   2.282
  738    HE   ARG  71           HE       ARG  71 -18.601  -2.590   3.127
  739   1HH1  ARG  71          1HH1      ARG  71 -20.131  -4.567   3.017
  740   2HH1  ARG  71          2HH1      ARG  71 -19.595  -5.886   4.003
  741   1HH2  ARG  71          1HH2      ARG  71 -16.377  -4.648   4.369
  742   2HH2  ARG  71          2HH2      ARG  71 -17.469  -5.931   4.769
  743    QB   ARG  71           QB       ARG  71 -15.646  -2.672   4.438
  744    QG   ARG  71           QG       ARG  71 -16.047  -1.393   2.373
  745    QD   ARG  71           QD       ARG  71 -16.593  -3.566   1.704
  746    QH1  ARG  71           QH1      ARG  71 -19.863  -5.227   3.510
  747    QH2  ARG  71           QH2      ARG  71 -16.923  -5.290   4.569
  748    H    ASP  72           H        ASP  72 -12.354  -0.299   5.628
  749    HA   ASP  72           HA       ASP  72 -13.509  -0.930   8.310
  750   1HB   ASP  72          2HB       ASP  72 -11.138  -1.592   7.206
  751   2HB   ASP  72          1HB       ASP  72 -10.691  -0.042   7.919
  752    QB   ASP  72           QB       ASP  72 -10.915  -0.817   7.563
  753    H    ALA  73           H        ALA  73 -12.491   1.704   6.248
  754    HA   ALA  73           HA       ALA  73 -12.630   4.045   6.541
  755   1HB   ALA  73          1HB       ALA  73 -14.259   3.364   9.000
  756   2HB   ALA  73          2HB       ALA  73 -14.905   3.171   7.371
  757   3HB   ALA  73          3HB       ALA  73 -14.422   4.767   7.945
  758    MB   ALA  73           QB       ALA  73 -14.529   3.767   8.105
  759    H    VAL  74           H        VAL  74 -10.793   5.067   7.226
  760    HA   VAL  74           HA       VAL  74  -9.935   4.667  10.075
  761    HB   VAL  74           HB       VAL  74  -7.623   4.929   9.159
  762   1HG1  VAL  74          1HG1      VAL  74  -8.863   6.098   7.025
  763   2HG1  VAL  74          3HG1      VAL  74  -7.217   5.465   6.978
  764   3HG1  VAL  74          2HG1      VAL  74  -8.557   4.482   6.387
  765   1HG2  VAL  74          3HG2      VAL  74  -8.938   2.694   9.329
  766   2HG2  VAL  74          2HG2      VAL  74  -9.048   2.797   7.572
  767   3HG2  VAL  74          1HG2      VAL  74  -7.470   2.717   8.353
  768    MG1  VAL  74           QG1      VAL  74  -8.212   5.348   6.797
  769    MG2  VAL  74           QG2      VAL  74  -8.485   2.736   8.418
  770    QG   VAL  74           QQG      VAL  74  -8.349   4.042   7.607
  771    H    GLN  75           H        GLN  75  -8.214   6.595  10.525
  772    HA   GLN  75           HA       GLN  75  -9.514   9.143   9.607
  773   1HB   GLN  75          2HB       GLN  75  -9.373   7.971  12.156
  774   2HB   GLN  75          1HB       GLN  75  -8.166   9.256  12.186
  775   1HG   GLN  75          2HG       GLN  75  -9.940  10.794  11.212
  776   2HG   GLN  75          1HG       GLN  75 -11.109   9.510  11.526
  777   1HE2  GLN  75          1HE2      GLN  75 -11.590   8.984  13.777
  778   2HE2  GLN  75          2HE2      GLN  75 -11.138  10.022  15.043
  779    QB   GLN  75           QB       GLN  75  -8.770   8.614  12.171
  780    QG   GLN  75           QG       GLN  75 -10.524  10.152  11.369
  781    QE   GLN  75           QE2      GLN  75 -11.364   9.503  14.410
  782    H    GLY  76           H        GLY  76  -8.005  11.034   9.677
  783   1HA   GLY  76          1HA       GLY  76  -5.993  12.032   8.991
  784   2HA   GLY  76          2HA       GLY  76  -5.490  10.441   8.419
  785    QA   GLY  76           QA       GLY  76  -5.741  11.236   8.705
  786    H    GLY  77           H        GLY  77  -3.376  10.570   9.275
  787   1HA   GLY  77          1HA       GLY  77  -3.064  11.083  12.172
  788   2HA   GLY  77          2HA       GLY  77  -1.750  10.892  11.011
  789    QA   GLY  77           QA       GLY  77  -2.407  10.988  11.592
  790    H    GLN  78           H        GLN  78  -2.731   8.443   9.834
  791    HA   GLN  78           HA       GLN  78  -1.985   6.571  12.025
  792   1HB   GLN  78          2HB       GLN  78  -4.514   6.898  11.805
  793   2HB   GLN  78          1HB       GLN  78  -4.378   6.130  10.222
  794   1HG   GLN  78          2HG       GLN  78  -4.224   4.078  11.142
  795   2HG   GLN  78          1HG       GLN  78  -2.967   4.607  12.260
  796   1HE2  GLN  78          1HE2      GLN  78  -6.335   3.823  11.985
  797   2HE2  GLN  78          2HE2      GLN  78  -6.776   4.232  13.572
  798    QB   GLN  78           QB       GLN  78  -4.446   6.514  11.013
  799    QG   GLN  78           QG       GLN  78  -3.595   4.343  11.701
  800    QE   GLN  78           QE2      GLN  78  -6.556   4.028  12.779
  801    H    GLY  79           H        GLY  79  -0.562   5.051  11.242
  802   1HA   GLY  79          1HA       GLY  79   0.642   3.736   9.713
  803   2HA   GLY  79          2HA       GLY  79   0.517   5.133   8.643
  804    QA   GLY  79           QA       GLY  79   0.580   4.434   9.178
  805    H    LEU  80           H        LEU  80  -0.558   4.756   6.769
  806    HA   LEU  80           HA       LEU  80  -3.031   3.268   6.610
  807   1HB   LEU  80          2HB       LEU  80  -1.042   4.463   4.685
  808   2HB   LEU  80          1HB       LEU  80  -2.414   3.531   4.087
  809    HG   LEU  80           HG       LEU  80  -2.787   5.783   6.059
  810   1HD1  LEU  80          3HD1      LEU  80  -4.474   3.968   4.452
  811   2HD1  LEU  80          2HD1      LEU  80  -4.846   4.815   5.953
  812   3HD1  LEU  80          1HD1      LEU  80  -4.970   5.660   4.410
  813   1HD2  LEU  80          1HD2      LEU  80  -2.201   5.892   3.151
  814   2HD2  LEU  80          3HD2      LEU  80  -3.552   6.880   3.704
  815   3HD2  LEU  80          2HD2      LEU  80  -1.947   7.114   4.396
  816    MD1  LEU  80           QD1      LEU  80  -4.763   4.814   4.938
  817    MD2  LEU  80           QD2      LEU  80  -2.567   6.629   3.750
  818    QB   LEU  80           QB       LEU  80  -1.728   3.997   4.386
  819    QD   LEU  80           QQD      LEU  80  -3.665   5.721   4.344
  820    H    ILE  81           H        ILE  81   0.194   2.570   5.188
  821    HA   ILE  81           HA       ILE  81  -0.339  -0.342   5.613
  822    HB   ILE  81           HB       ILE  81   0.500  -0.693   3.271
  823   1HG1  ILE  81          2HG1      ILE  81   0.003   2.195   2.689
  824   2HG1  ILE  81          1HG1      ILE  81   1.544   1.772   3.437
  825   1HG2  ILE  81          2HG2      ILE  81  -2.007  -0.125   4.086
  826   2HG2  ILE  81          1HG2      ILE  81  -1.765   1.212   2.961
  827   3HG2  ILE  81          3HG2      ILE  81  -1.609  -0.454   2.400
  828   1HD1  ILE  81          3HD1      ILE  81   1.856   0.036   1.639
  829   2HD1  ILE  81          2HD1      ILE  81   0.415   0.675   0.848
  830   3HD1  ILE  81          1HD1      ILE  81   1.842   1.694   1.038
  831    MG   ILE  81           QG2      ILE  81  -1.794   0.211   3.149
  832    MD   ILE  81           QD1      ILE  81   1.371   0.802   1.175
  833    QG   ILE  81           QG1      ILE  81   0.774   1.983   3.063
  834    H    LYS  82           H        LYS  82   1.755  -1.618   5.249
  835    HA   LYS  82           HA       LYS  82   4.081  -0.017   6.257
  836   1HB   LYS  82          2HB       LYS  82   2.792  -2.123   7.385
  837   2HB   LYS  82          1HB       LYS  82   4.009  -2.984   6.441
  838   1HG   LYS  82          2HG       LYS  82   5.638  -2.401   7.883
  839   2HG   LYS  82          1HG       LYS  82   5.186  -0.700   7.787
  840   1HD   LYS  82          2HD       LYS  82   3.530  -0.948   9.501
  841   2HD   LYS  82          1HD       LYS  82   3.651  -2.707   9.450
  842   1HE   LYS  82          2HE       LYS  82   5.843  -0.803  10.356
  843   2HE   LYS  82          1HE       LYS  82   4.892  -1.878  11.399
  844   1HZ   LYS  82          2HZ       LYS  82   5.652  -3.678   9.719
  845   2HZ   LYS  82          1HZ       LYS  82   6.897  -2.578   9.356
  846   3HZ   LYS  82          3HZ       LYS  82   6.727  -3.174  10.934
  847    QB   LYS  82           QB       LYS  82   3.401  -2.554   6.913
  848    QD   LYS  82           QD       LYS  82   3.590  -1.828   9.476
  849    QG   LYS  82           QG       LYS  82   5.412  -1.551   7.835
  850    QE   LYS  82           QE       LYS  82   5.368  -1.340  10.878
  851    QZ   LYS  82           QZ       LYS  82   6.425  -3.144  10.003
  852    H    ILE  83           H        ILE  83   6.066  -0.209   5.166
  853    HA   ILE  83           HA       ILE  83   6.211  -2.102   2.859
  854    HB   ILE  83           HB       ILE  83   7.105  -0.176   1.507
  855   1HG1  ILE  83          2HG1      ILE  83   6.114   1.435   3.885
  856   2HG1  ILE  83          1HG1      ILE  83   7.805   1.227   3.424
  857   1HG2  ILE  83          3HG2      ILE  83   4.685  -0.932   1.497
  858   2HG2  ILE  83          2HG2      ILE  83   4.347   0.373   2.632
  859   3HG2  ILE  83          1HG2      ILE  83   4.939   0.744   1.013
  860   1HD1  ILE  83          1HD1      ILE  83   5.789   2.316   1.464
  861   2HD1  ILE  83          3HD1      ILE  83   6.591   3.375   2.624
  862   3HD1  ILE  83          2HD1      ILE  83   7.545   2.480   1.442
  863    MG   ILE  83           QG2      ILE  83   4.657   0.062   1.714
  864    MD   ILE  83           QD1      ILE  83   6.642   2.724   1.843
  865    QG   ILE  83           QG1      ILE  83   6.960   1.331   3.655
  866    H    GLY  84           H        GLY  84   8.484  -2.361   2.090
  867   1HA   GLY  84          1HA       GLY  84  10.493  -1.641   4.185
  868   2HA   GLY  84          2HA       GLY  84  10.887  -1.872   2.481
  869    QA   GLY  84           QA       GLY  84  10.690  -1.756   3.333

  No H/Q in entry =         869
  Start of MODEL   10
    1    H1   MET   1          2H        MET   1  -9.864  20.438  36.118
    2    H2   MET   1          1H        MET   1  -8.765  19.983  37.330
    3    H3   MET   1          3H        MET   1  -8.330  19.841  35.696
    4    HA   MET   1           HA       MET   1  -8.878  17.659  36.535
    5   1HB   MET   1          2HB       MET   1 -10.544  19.190  38.131
    6   2HB   MET   1          1HB       MET   1 -11.683  18.361  37.070
    7   1HG   MET   1          2HG       MET   1 -11.232  16.317  37.971
    8   2HG   MET   1          1HG       MET   1  -9.509  16.660  38.130
    9   1HE   MET   1          2HE       MET   1 -12.789  16.466  39.240
   10   2HE   MET   1          1HE       MET   1 -12.669  16.338  40.993
   11   3HE   MET   1          3HE       MET   1 -13.076  17.888  40.241
   12    QB   MET   1           QB       MET   1 -11.113  18.775  37.601
   13    QG   MET   1           QG       MET   1 -10.371  16.489  38.051
   14    ME   MET   1           QE       MET   1 -12.845  16.898  40.158
   15    H    LYS   2           H        LYS   2  -8.858  18.961  33.999
   16    HA   LYS   2           HA       LYS   2 -11.390  18.440  32.617
   17   1HB   LYS   2          2HB       LYS   2  -9.264  20.092  32.242
   18   2HB   LYS   2          1HB       LYS   2  -8.846  18.789  31.128
   19   1HG   LYS   2          2HG       LYS   2 -10.163  20.133  29.759
   20   2HG   LYS   2          1HG       LYS   2 -11.369  19.013  30.393
   21   1HD   LYS   2          2HD       LYS   2 -12.127  20.599  32.015
   22   2HD   LYS   2          1HD       LYS   2 -10.747  21.657  31.724
   23   1HE   LYS   2          2HE       LYS   2 -11.857  21.422  29.197
   24   2HE   LYS   2          1HE       LYS   2 -13.282  21.477  30.255
   25   1HZ   LYS   2          3HZ       LYS   2 -10.972  23.325  30.502
   26   2HZ   LYS   2          2HZ       LYS   2 -12.389  23.707  29.648
   27   3HZ   LYS   2          1HZ       LYS   2 -12.452  23.422  31.322
   28    QB   LYS   2           QB       LYS   2  -9.055  19.441  31.685
   29    QD   LYS   2           QD       LYS   2 -11.437  21.128  31.870
   30    QG   LYS   2           QG       LYS   2 -10.766  19.573  30.076
   31    QE   LYS   2           QE       LYS   2 -12.569  21.449  29.726
   32    QZ   LYS   2           QZ       LYS   2 -11.938  23.485  30.490
   33    H    LEU   3           H        LEU   3 -11.222  17.027  30.539
   34    HA   LEU   3           HA       LEU   3 -10.249  14.358  31.347
   35   1HB   LEU   3          2HB       LEU   3 -12.234  15.572  29.573
   36   2HB   LEU   3          1HB       LEU   3 -11.380  14.235  28.803
   37    HG   LEU   3           HG       LEU   3 -11.820  12.943  30.999
   38   1HD1  LEU   3          1HD1      LEU   3 -12.987  15.473  31.625
   39   2HD1  LEU   3          3HD1      LEU   3 -14.291  14.287  31.535
   40   3HD1  LEU   3          2HD1      LEU   3 -12.932  14.024  32.629
   41   1HD2  LEU   3          1HD2      LEU   3 -12.973  12.622  28.759
   42   2HD2  LEU   3          3HD2      LEU   3 -13.931  12.151  30.164
   43   3HD2  LEU   3          2HD2      LEU   3 -14.253  13.682  29.353
   44    MD1  LEU   3           QD1      LEU   3 -13.403  14.595  31.930
   45    MD2  LEU   3           QD2      LEU   3 -13.719  12.818  29.425
   46    QB   LEU   3           QB       LEU   3 -11.807  14.903  29.188
   47    QD   LEU   3           QQD      LEU   3 -13.561  13.707  30.678
   48    H    LYS   4           H        LYS   4  -9.488  13.125  29.098
   49    HA   LYS   4           HA       LYS   4  -7.056  14.635  28.230
   50   1HB   LYS   4          2HB       LYS   4  -7.800  11.708  28.453
   51   2HB   LYS   4          1HB       LYS   4  -6.324  12.249  27.651
   52   1HG   LYS   4          2HG       LYS   4  -6.966  13.228  30.421
   53   2HG   LYS   4          1HG       LYS   4  -6.239  11.636  30.198
   54   1HD   LYS   4          2HD       LYS   4  -5.088  14.144  28.957
   55   2HD   LYS   4          1HD       LYS   4  -4.592  13.550  30.542
   56   1HE   LYS   4          2HE       LYS   4  -4.516  11.304  28.815
   57   2HE   LYS   4          1HE       LYS   4  -3.728  12.635  27.946
   58   1HZ   LYS   4          2HZ       LYS   4  -3.197  12.158  30.813
   59   2HZ   LYS   4          1HZ       LYS   4  -2.326  11.319  29.618
   60   3HZ   LYS   4          3HZ       LYS   4  -2.254  13.013  29.687
   61    QB   LYS   4           QB       LYS   4  -7.062  11.978  28.052
   62    QD   LYS   4           QD       LYS   4  -4.840  13.847  29.750
   63    QG   LYS   4           QG       LYS   4  -6.602  12.432  30.310
   64    QE   LYS   4           QE       LYS   4  -4.122  11.969  28.380
   65    QZ   LYS   4           QZ       LYS   4  -2.592  12.164  30.039
   66    H    VAL   5           H        VAL   5  -8.972  15.631  26.759
   67    HA   VAL   5           HA       VAL   5  -9.512  13.931  24.384
   68    HB   VAL   5           HB       VAL   5 -10.368  16.754  25.105
   69   1HG1  VAL   5          1HG1      VAL   5 -11.466  14.748  23.111
   70   2HG1  VAL   5          3HG1      VAL   5 -12.159  16.332  23.456
   71   3HG1  VAL   5          2HG1      VAL   5 -10.567  16.210  22.707
   72   1HG2  VAL   5          1HG2      VAL   5 -11.678  14.063  25.584
   73   2HG2  VAL   5          3HG2      VAL   5 -11.164  15.226  26.806
   74   3HG2  VAL   5          2HG2      VAL   5 -12.520  15.604  25.743
   75    MG1  VAL   5           QG1      VAL   5 -11.397  15.763  23.091
   76    MG2  VAL   5           QG2      VAL   5 -11.787  14.964  26.044
   77    QG   VAL   5           QQG      VAL   5 -11.592  15.364  24.568
   78    H    THR   6           H        THR   6  -7.357  13.897  23.459
   79    HA   THR   6           HA       THR   6  -6.715  16.344  21.921
   80    HB   THR   6           HB       THR   6  -5.581  16.587  24.111
   81    HG1  THR   6           HG1      THR   6  -3.955  15.960  21.882
   82   1HG2  THR   6          2HG2      THR   6  -5.021  13.769  23.616
   83   2HG2  THR   6          1HG2      THR   6  -3.564  14.668  24.041
   84   3HG2  THR   6          3HG2      THR   6  -4.954  14.675  25.127
   85    MG   THR   6           QG2      THR   6  -4.513  14.371  24.262
   86    H    VAL   7           H        VAL   7  -7.624  13.681  21.168
   87    HA   VAL   7           HA       VAL   7  -5.322  12.142  20.227
   88    HB   VAL   7           HB       VAL   7  -8.295  12.030  19.622
   89   1HG1  VAL   7          2HG1      VAL   7  -7.407  11.725  22.043
   90   2HG1  VAL   7          1HG1      VAL   7  -8.476  10.482  21.394
   91   3HG1  VAL   7          3HG1      VAL   7  -6.735  10.207  21.449
   92   1HG2  VAL   7          1HG2      VAL   7  -6.541  10.888  18.038
   93   2HG2  VAL   7          3HG2      VAL   7  -6.370   9.734  19.362
   94   3HG2  VAL   7          2HG2      VAL   7  -7.937   9.961  18.586
   95    MG1  VAL   7           QG1      VAL   7  -7.539  10.805  21.629
   96    MG2  VAL   7           QG2      VAL   7  -6.949  10.195  18.662
   97    QG   VAL   7           QQG      VAL   7  -7.244  10.500  20.145
   98    H    ASN   8           H        ASN   8  -4.113  13.324  18.717
   99    HA   ASN   8           HA       ASN   8  -5.591  14.271  16.281
  100   1HB   ASN   8          2HB       ASN   8  -4.542  15.980  17.868
  101   2HB   ASN   8          1HB       ASN   8  -2.976  15.331  17.381
  102   1HD2  ASN   8          1HD2      ASN   8  -6.012  16.526  15.822
  103   2HD2  ASN   8          2HD2      ASN   8  -5.215  17.313  14.546
  104    QB   ASN   8           QB       ASN   8  -3.759  15.655  17.624
  105    QD   ASN   8           QD2      ASN   8  -5.613  16.920  15.184
  106    H    GLY   9           H        GLY   9  -2.240  13.446  17.270
  107   1HA   GLY   9          1HA       GLY   9  -0.649  12.745  15.475
  108   2HA   GLY   9          2HA       GLY   9  -2.004  11.910  14.713
  109    QA   GLY   9           QA       GLY   9  -1.326  12.328  15.094
  110    H    ALA  10           H        ALA  10   0.306  10.484  15.293
  111    HA   ALA  10           HA       ALA  10   0.954   8.459  16.332
  112   1HB   ALA  10          3HB       ALA  10   0.001  10.305  18.507
  113   2HB   ALA  10          1HB       ALA  10   1.644   9.778  18.143
  114   3HB   ALA  10          2HB       ALA  10   0.514   8.668  18.919
  115    MB   ALA  10           QB       ALA  10   0.719   9.584  18.523
  116    H    GLY  11           H        GLY  11  -0.104   6.826  18.181
  117   1HA   GLY  11          1HA       GLY  11  -3.005   6.549  17.524
  118   2HA   GLY  11          2HA       GLY  11  -2.232   5.859  18.952
  119    QA   GLY  11           QA       GLY  11  -2.618   6.204  18.238
  120    H    LYS  12           H        LYS  12  -1.218   5.778  15.528
  121    HA   LYS  12           HA       LYS  12  -0.957   2.819  15.761
  122   1HB   LYS  12          2HB       LYS  12  -3.181   4.040  14.684
  123   2HB   LYS  12          1HB       LYS  12  -2.183   3.768  13.255
  124   1HG   LYS  12          2HG       LYS  12  -2.778   1.601  13.268
  125   2HG   LYS  12          1HG       LYS  12  -2.025   1.418  14.853
  126   1HD   LYS  12          2HD       LYS  12  -4.169   2.357  15.851
  127   2HD   LYS  12          1HD       LYS  12  -4.889   2.184  14.250
  128   1HE   LYS  12          2HE       LYS  12  -3.802  -0.289  14.525
  129   2HE   LYS  12          1HE       LYS  12  -4.166   0.084  16.222
  130   1HZ   LYS  12          1HZ       LYS  12  -6.094   0.569  14.023
  131   2HZ   LYS  12          3HZ       LYS  12  -6.060  -0.884  14.896
  132   3HZ   LYS  12          2HZ       LYS  12  -6.396   0.576  15.695
  133    QB   LYS  12           QB       LYS  12  -2.682   3.904  13.970
  134    QD   LYS  12           QD       LYS  12  -4.529   2.270  15.051
  135    QG   LYS  12           QG       LYS  12  -2.401   1.510  14.061
  136    QE   LYS  12           QE       LYS  12  -3.984  -0.103  15.374
  137    QZ   LYS  12           QZ       LYS  12  -6.183   0.087  14.872
  138    H    ALA  13           H        ALA  13   1.032   2.291  14.960
  139    HA   ALA  13           HA       ALA  13   2.033   3.255  12.429
  140   1HB   ALA  13          2HB       ALA  13   3.572   4.886  13.141
  141   2HB   ALA  13          3HB       ALA  13   3.555   4.306  14.807
  142   3HB   ALA  13          1HB       ALA  13   2.177   5.207  14.173
  143    MB   ALA  13           QB       ALA  13   3.101   4.800  14.040
  144    H    GLY  14           H        GLY  14   4.854   3.120  13.285
  145   1HA   GLY  14          1HA       GLY  14   5.055   0.182  13.480
  146   2HA   GLY  14          2HA       GLY  14   5.816   1.097  14.781
  147    QA   GLY  14           QA       GLY  14   5.436   0.639  14.130
  148    H    GLU  15           H        GLU  15   6.730  -0.531  12.228
  149    HA   GLU  15           HA       GLU  15   8.963   1.344  11.599
  150   1HB   GLU  15          2HB       GLU  15   8.598  -1.499  12.055
  151   2HB   GLU  15          1HB       GLU  15   9.414  -1.218  10.516
  152   1HG   GLU  15          2HG       GLU  15  10.283   0.254  12.996
  153   2HG   GLU  15          1HG       GLU  15  10.867  -1.379  12.672
  154    QB   GLU  15           QB       GLU  15   9.006  -1.359  11.285
  155    QG   GLU  15           QG       GLU  15  10.575  -0.562  12.834
  156    H    GLY  16           H        GLY  16   9.136   2.213   9.562
  157   1HA   GLY  16          1HA       GLY  16   8.360   0.932   7.145
  158   2HA   GLY  16          2HA       GLY  16   8.647   2.664   7.313
  159    QA   GLY  16           QA       GLY  16   8.504   1.798   7.229
  160    H    GLU  17           H        GLU  17   6.506   2.750   9.467
  161    HA   GLU  17           HA       GLU  17   4.005   1.977   8.205
  162   1HB   GLU  17          2HB       GLU  17   3.054   3.193  10.121
  163   2HB   GLU  17          1HB       GLU  17   4.408   2.197  10.654
  164   1HG   GLU  17          2HG       GLU  17   5.204   4.097  11.602
  165   2HG   GLU  17          1HG       GLU  17   5.653   4.560   9.960
  166    QB   GLU  17           QB       GLU  17   3.731   2.695  10.387
  167    QG   GLU  17           QG       GLU  17   5.429   4.328  10.781
  168    H    ILE  18           H        ILE  18   2.360   3.539   7.470
  169    HA   ILE  18           HA       ILE  18   3.505   6.129   6.484
  170    HB   ILE  18           HB       ILE  18   1.678   4.193   5.025
  171   1HG1  ILE  18          2HG1      ILE  18   4.604   4.844   4.550
  172   2HG1  ILE  18          1HG1      ILE  18   4.024   3.376   5.337
  173   1HG2  ILE  18          3HG2      ILE  18   1.852   6.876   4.641
  174   2HG2  ILE  18          2HG2      ILE  18   3.170   6.326   3.605
  175   3HG2  ILE  18          1HG2      ILE  18   1.531   5.730   3.339
  176   1HD1  ILE  18          3HD1      ILE  18   2.506   3.404   3.055
  177   2HD1  ILE  18          2HD1      ILE  18   4.020   4.102   2.479
  178   3HD1  ILE  18          1HD1      ILE  18   4.014   2.509   3.236
  179    MG   ILE  18           QG2      ILE  18   2.184   6.311   3.861
  180    MD   ILE  18           QD1      ILE  18   3.513   3.338   2.923
  181    QG   ILE  18           QG1      ILE  18   4.314   4.110   4.943
  182    HA   PRO  19           HA       PRO  19  -0.315   7.082   8.774
  183   1HB   PRO  19          2HB       PRO  19   0.402   9.645   9.405
  184   2HB   PRO  19          1HB       PRO  19   0.938   8.235  10.340
  185   1HG   PRO  19          2HG       PRO  19   2.407   9.824   8.301
  186   2HG   PRO  19          1HG       PRO  19   2.995   9.087   9.799
  187   1HD   PRO  19          2HD       PRO  19   3.391   8.017   7.311
  188   2HD   PRO  19          1HD       PRO  19   3.358   7.062   8.809
  189    QB   PRO  19           QB       PRO  19   0.670   8.940   9.872
  190    QG   PRO  19           QG       PRO  19   2.701   9.455   9.050
  191    QD   PRO  19           QD       PRO  19   3.374   7.539   8.060
  192    H    ALA  20           H        ALA  20  -2.122   7.814   7.713
  193    HA   ALA  20           HA       ALA  20  -1.904   9.152   5.134
  194   1HB   ALA  20          3HB       ALA  20  -3.811   7.700   6.729
  195   2HB   ALA  20          2HB       ALA  20  -4.556   9.191   6.154
  196   3HB   ALA  20          1HB       ALA  20  -3.869   8.047   5.002
  197    MB   ALA  20           QB       ALA  20  -4.079   8.312   5.962
  198    HA   PRO  21           HA       PRO  21  -1.888  13.147   7.236
  199   1HB   PRO  21          2HB       PRO  21  -1.406  14.648   5.000
  200   2HB   PRO  21          1HB       PRO  21  -0.130  13.779   5.876
  201   1HG   PRO  21          2HG       PRO  21  -1.549  13.036   3.368
  202   2HG   PRO  21          1HG       PRO  21   0.154  12.828   3.807
  203   1HD   PRO  21          2HD       PRO  21  -1.683  10.811   3.882
  204   2HD   PRO  21          1HD       PRO  21  -0.236  10.865   4.914
  205    QB   PRO  21           QB       PRO  21  -0.768  14.213   5.438
  206    QG   PRO  21           QG       PRO  21  -0.698  12.932   3.588
  207    QD   PRO  21           QD       PRO  21  -0.959  10.838   4.398
  208    H    LEU  22           H        LEU  22  -3.881  12.023   4.620
  209    HA   LEU  22           HA       LEU  22  -5.819  14.254   5.149
  210   1HB   LEU  22          2HB       LEU  22  -5.095  12.668   2.680
  211   2HB   LEU  22          1HB       LEU  22  -6.577  13.620   2.771
  212    HG   LEU  22           HG       LEU  22  -3.887  14.825   3.425
  213   1HD1  LEU  22          2HD1      LEU  22  -5.934  16.019   4.142
  214   2HD1  LEU  22          1HD1      LEU  22  -5.078  16.912   2.885
  215   3HD1  LEU  22          3HD1      LEU  22  -6.525  15.989   2.482
  216   1HD2  LEU  22          3HD2      LEU  22  -5.217  14.422   0.747
  217   2HD2  LEU  22          2HD2      LEU  22  -4.119  15.774   1.026
  218   3HD2  LEU  22          1HD2      LEU  22  -3.540  14.116   1.195
  219    MD1  LEU  22           QD1      LEU  22  -5.846  16.307   3.170
  220    MD2  LEU  22           QD2      LEU  22  -4.292  14.771   0.989
  221    QB   LEU  22           QB       LEU  22  -5.836  13.144   2.725
  222    QD   LEU  22           QQD      LEU  22  -5.069  15.539   2.079
  223    H    ALA  23           H        ALA  23  -5.335  11.161   6.030
  224    HA   ALA  23           HA       ALA  23  -6.758   9.372   6.634
  225   1HB   ALA  23          3HB       ALA  23  -9.025  11.329   6.566
  226   2HB   ALA  23          2HB       ALA  23  -8.593  10.164   7.818
  227   3HB   ALA  23          1HB       ALA  23  -7.672  11.658   7.649
  228    MB   ALA  23           QB       ALA  23  -8.430  11.050   7.344
  229    H    GLY  24           H        GLY  24  -9.635   9.274   5.988
  230   1HA   GLY  24          1HA       GLY  24  -9.365   8.463   3.142
  231   2HA   GLY  24          2HA       GLY  24 -10.687   9.547   3.580
  232    QA   GLY  24           QA       GLY  24 -10.026   9.005   3.361
  233    H    THR  25           H        THR  25 -11.734   7.411   2.592
  234    HA   THR  25           HA       THR  25 -12.340   5.582   4.894
  235    HB   THR  25           HB       THR  25 -14.290   6.110   2.682
  236    HG1  THR  25           HG1      THR  25 -14.368   8.140   3.133
  237   1HG2  THR  25          1HG2      THR  25 -14.285   4.818   5.189
  238   2HG2  THR  25          3HG2      THR  25 -15.270   6.268   5.393
  239   3HG2  THR  25          2HG2      THR  25 -15.672   5.097   4.136
  240    MG   THR  25           QG2      THR  25 -15.075   5.394   4.906
  241    H    VAL  26           H        VAL  26 -11.284   3.684   4.385
  242    HA   VAL  26           HA       VAL  26 -10.603   2.795   1.759
  243    HB   VAL  26           HB       VAL  26 -11.093   1.171   4.276
  244   1HG1  VAL  26          1HG1      VAL  26  -9.702   0.700   1.672
  245   2HG1  VAL  26          3HG1      VAL  26  -8.991   0.004   3.128
  246   3HG1  VAL  26          2HG1      VAL  26 -10.637  -0.421   2.660
  247   1HG2  VAL  26          3HG2      VAL  26  -9.242   3.305   3.772
  248   2HG2  VAL  26          2HG2      VAL  26  -9.393   2.304   5.216
  249   3HG2  VAL  26          1HG2      VAL  26  -8.343   1.793   3.894
  250    MG1  VAL  26           QG1      VAL  26  -9.777   0.094   2.487
  251    MG2  VAL  26           QG2      VAL  26  -8.993   2.467   4.294
  252    QG   VAL  26           QQG      VAL  26  -9.385   1.281   3.390
  253    H    SER  27           H        SER  27 -11.771   1.618   0.253
  254    HA   SER  27           HA       SER  27 -14.554   0.804   1.025
  255   1HB   SER  27          2HB       SER  27 -13.462   2.449  -1.045
  256   2HB   SER  27          1HB       SER  27 -14.169   1.026  -1.803
  257    HG   SER  27           HG       SER  27 -15.440   2.687   0.122
  258    QB   SER  27           QB       SER  27 -13.815   1.737  -1.424
  259    H    LYS  28           H        LYS  28 -11.691  -0.102  -0.902
  260    HA   LYS  28           HA       LYS  28 -12.251  -2.950  -0.448
  261   1HB   LYS  28          2HB       LYS  28 -13.376  -1.598  -2.653
  262   2HB   LYS  28          1HB       LYS  28 -12.022  -2.520  -3.308
  263   1HG   LYS  28          2HG       LYS  28 -13.561  -4.059  -1.361
  264   2HG   LYS  28          1HG       LYS  28 -14.548  -3.531  -2.723
  265   1HD   LYS  28          2HD       LYS  28 -11.866  -4.573  -3.427
  266   2HD   LYS  28          1HD       LYS  28 -12.995  -5.762  -2.777
  267   1HE   LYS  28          2HE       LYS  28 -14.621  -4.423  -4.525
  268   2HE   LYS  28          1HE       LYS  28 -13.062  -4.339  -5.368
  269   1HZ   LYS  28          1HZ       LYS  28 -14.193  -6.810  -4.167
  270   2HZ   LYS  28          3HZ       LYS  28 -14.279  -6.427  -5.817
  271   3HZ   LYS  28          2HZ       LYS  28 -12.768  -6.690  -5.084
  272    QB   LYS  28           QB       LYS  28 -12.699  -2.059  -2.981
  273    QD   LYS  28           QD       LYS  28 -12.430  -5.167  -3.102
  274    QG   LYS  28           QG       LYS  28 -14.055  -3.795  -2.042
  275    QE   LYS  28           QE       LYS  28 -13.841  -4.381  -4.947
  276    QZ   LYS  28           QZ       LYS  28 -13.747  -6.642  -5.022
  277    H    ILE  29           H        ILE  29 -10.334  -4.126  -0.613
  278    HA   ILE  29           HA       ILE  29  -7.849  -2.633  -1.059
  279    HB   ILE  29           HB       ILE  29  -8.143  -4.304   0.735
  280   1HG1  ILE  29          2HG1      ILE  29  -6.196  -5.210  -1.412
  281   2HG1  ILE  29          1HG1      ILE  29  -5.885  -3.949  -0.219
  282   1HG2  ILE  29          3HG2      ILE  29  -9.271  -5.814  -1.447
  283   2HG2  ILE  29          2HG2      ILE  29  -7.956  -6.733  -0.714
  284   3HG2  ILE  29          1HG2      ILE  29  -9.305  -6.178   0.278
  285   1HD1  ILE  29          3HD1      ILE  29  -6.838  -6.376   1.058
  286   2HD1  ILE  29          2HD1      ILE  29  -5.398  -6.692   0.090
  287   3HD1  ILE  29          1HD1      ILE  29  -5.357  -5.469   1.359
  288    MG   ILE  29           QG2      ILE  29  -8.844  -6.241  -0.628
  289    MD   ILE  29           QD1      ILE  29  -5.864  -6.179   0.836
  290    QG   ILE  29           QG1      ILE  29  -6.040  -4.579  -0.816
  291    H    LEU  30           H        LEU  30  -6.342  -3.067  -2.752
  292    HA   LEU  30           HA       LEU  30  -7.535  -4.389  -5.153
  293   1HB   LEU  30          2HB       LEU  30  -6.271  -1.931  -4.675
  294   2HB   LEU  30          1HB       LEU  30  -5.066  -2.893  -5.533
  295    HG   LEU  30           HG       LEU  30  -6.498  -1.662  -7.122
  296   1HD1  LEU  30          2HD1      LEU  30  -8.499  -2.013  -5.348
  297   2HD1  LEU  30          1HD1      LEU  30  -8.794  -1.690  -7.057
  298   3HD1  LEU  30          3HD1      LEU  30  -8.859  -3.344  -6.448
  299   1HD2  LEU  30          1HD2      LEU  30  -5.629  -4.077  -7.507
  300   2HD2  LEU  30          3HD2      LEU  30  -7.305  -4.565  -7.255
  301   3HD2  LEU  30          2HD2      LEU  30  -6.894  -3.477  -8.580
  302    MD1  LEU  30           QD1      LEU  30  -8.717  -2.349  -6.284
  303    MD2  LEU  30           QD2      LEU  30  -6.609  -4.040  -7.780
  304    QB   LEU  30           QB       LEU  30  -5.668  -2.412  -5.104
  305    QD   LEU  30           QQD      LEU  30  -7.663  -3.195  -7.032
  306    H    VAL  31           H        VAL  31  -4.467  -4.160  -3.315
  307    HA   VAL  31           HA       VAL  31  -3.501  -6.619  -4.706
  308    HB   VAL  31           HB       VAL  31  -1.321  -5.904  -3.799
  309   1HG1  VAL  31          1HG1      VAL  31  -2.412  -4.956  -1.673
  310   2HG1  VAL  31          3HG1      VAL  31  -1.083  -4.024  -2.361
  311   3HG1  VAL  31          2HG1      VAL  31  -2.749  -3.513  -2.628
  312   1HG2  VAL  31          3HG2      VAL  31  -3.046  -3.880  -5.213
  313   2HG2  VAL  31          2HG2      VAL  31  -1.364  -3.514  -4.831
  314   3HG2  VAL  31          1HG2      VAL  31  -1.755  -4.883  -5.872
  315    MG1  VAL  31           QG1      VAL  31  -2.081  -4.164  -2.220
  316    MG2  VAL  31           QG2      VAL  31  -2.055  -4.093  -5.305
  317    QG   VAL  31           QQG      VAL  31  -2.068  -4.128  -3.763
  318    H    LYS  32           H        LYS  32  -1.700  -7.414  -2.636
  319    HA   LYS  32           HA       LYS  32  -3.393  -8.005  -0.267
  320   1HB   LYS  32          2HB       LYS  32  -2.515  -9.896  -2.418
  321   2HB   LYS  32          1HB       LYS  32  -2.556 -10.493  -0.758
  322   1HG   LYS  32          2HG       LYS  32  -4.947  -9.234  -0.840
  323   2HG   LYS  32          1HG       LYS  32  -4.795  -9.692  -2.538
  324   1HD   LYS  32          2HD       LYS  32  -4.190 -11.730  -0.420
  325   2HD   LYS  32          1HD       LYS  32  -5.873 -11.374  -0.815
  326   1HE   LYS  32          2HE       LYS  32  -5.720 -12.324  -2.906
  327   2HE   LYS  32          1HE       LYS  32  -4.032 -11.816  -3.122
  328   1HZ   LYS  32          1HZ       LYS  32  -4.884 -13.862  -1.148
  329   2HZ   LYS  32          3HZ       LYS  32  -4.337 -14.251  -2.706
  330   3HZ   LYS  32          2HZ       LYS  32  -3.297 -13.472  -1.612
  331    QB   LYS  32           QB       LYS  32  -2.535 -10.194  -1.588
  332    QD   LYS  32           QD       LYS  32  -5.032 -11.552  -0.617
  333    QG   LYS  32           QG       LYS  32  -4.871  -9.463  -1.689
  334    QE   LYS  32           QE       LYS  32  -4.876 -12.070  -3.014
  335    QZ   LYS  32           QZ       LYS  32  -4.173 -13.861  -1.822
  336    H    GLU  33           H        GLU  33  -1.940  -9.543   1.230
  337    HA   GLU  33           HA       GLU  33   0.470  -8.084   1.846
  338   1HB   GLU  33          2HB       GLU  33  -1.232 -10.085   2.961
  339   2HB   GLU  33          1HB       GLU  33   0.417 -10.709   3.008
  340   1HG   GLU  33          2HG       GLU  33   1.180  -8.970   4.365
  341   2HG   GLU  33          1HG       GLU  33  -0.116  -7.881   3.870
  342    QB   GLU  33           QB       GLU  33  -0.407 -10.397   2.985
  343    QG   GLU  33           QG       GLU  33   0.532  -8.425   4.117
  344    H    GLY  34           H        GLY  34   2.648  -8.694   1.504
  345   1HA   GLY  34          1HA       GLY  34   3.273 -11.220   0.148
  346   2HA   GLY  34          2HA       GLY  34   4.441 -10.005   0.664
  347    QA   GLY  34           QA       GLY  34   3.857 -10.613   0.406
  348    H    ASP  35           H        ASP  35   2.030  -8.388  -0.989
  349    HA   ASP  35           HA       ASP  35   3.003  -8.941  -3.713
  350   1HB   ASP  35          2HB       ASP  35   0.636  -8.135  -2.574
  351   2HB   ASP  35          1HB       ASP  35   1.276  -6.605  -3.179
  352    QB   ASP  35           QB       ASP  35   0.956  -7.370  -2.876
  353    H    THR  36           H        THR  36   4.232  -7.461  -4.953
  354    HA   THR  36           HA       THR  36   5.726  -5.431  -3.371
  355    HB   THR  36           HB       THR  36   6.126  -6.631  -6.131
  356    HG1  THR  36           HG1      THR  36   6.833  -8.213  -4.963
  357   1HG2  THR  36          3HG2      THR  36   7.337  -4.365  -4.797
  358   2HG2  THR  36          2HG2      THR  36   8.538  -5.621  -5.099
  359   3HG2  THR  36          1HG2      THR  36   7.598  -4.959  -6.436
  360    MG   THR  36           QG2      THR  36   7.824  -4.981  -5.444
  361    H    VAL  37           H        VAL  37   4.613  -3.486  -3.380
  362    HA   VAL  37           HA       VAL  37   3.030  -2.620  -5.689
  363    HB   VAL  37           HB       VAL  37   2.632  -0.660  -4.227
  364   1HG1  VAL  37          2HG1      VAL  37   2.193  -3.437  -3.507
  365   2HG1  VAL  37          1HG1      VAL  37   2.296  -2.425  -2.067
  366   3HG1  VAL  37          3HG1      VAL  37   1.112  -2.057  -3.320
  367   1HG2  VAL  37          3HG2      VAL  37   5.176  -1.395  -3.200
  368   2HG2  VAL  37          2HG2      VAL  37   4.172  -0.028  -2.715
  369   3HG2  VAL  37          1HG2      VAL  37   4.019  -1.574  -1.880
  370    MG1  VAL  37           QG1      VAL  37   1.867  -2.640  -2.964
  371    MG2  VAL  37           QG2      VAL  37   4.456  -0.999  -2.598
  372    QG   VAL  37           QQG      VAL  37   3.161  -1.819  -2.781
  373    H    LYS  38           H        LYS  38   3.498  -0.605  -6.860
  374    HA   LYS  38           HA       LYS  38   6.423   0.067  -6.920
  375   1HB   LYS  38          2HB       LYS  38   4.713  -1.088  -8.871
  376   2HB   LYS  38          1HB       LYS  38   5.051   0.557  -9.410
  377   1HG   LYS  38          2HG       LYS  38   7.479   0.143  -9.089
  378   2HG   LYS  38          1HG       LYS  38   7.117  -1.519  -8.625
  379   1HD   LYS  38          2HD       LYS  38   5.790  -1.491 -10.937
  380   2HD   LYS  38          1HD       LYS  38   6.958  -0.224 -11.313
  381   1HE   LYS  38          2HE       LYS  38   8.179  -2.093 -11.978
  382   2HE   LYS  38          1HE       LYS  38   8.659  -2.026 -10.270
  383   1HZ   LYS  38          3HZ       LYS  38   6.201  -3.431 -11.116
  384   2HZ   LYS  38          2HZ       LYS  38   7.707  -4.220 -11.137
  385   3HZ   LYS  38          1HZ       LYS  38   7.083  -3.612  -9.678
  386    QB   LYS  38           QB       LYS  38   4.882  -0.265  -9.140
  387    QD   LYS  38           QD       LYS  38   6.374  -0.858 -11.125
  388    QG   LYS  38           QG       LYS  38   7.298  -0.688  -8.857
  389    QE   LYS  38           QE       LYS  38   8.419  -2.059 -11.124
  390    QZ   LYS  38           QZ       LYS  38   6.997  -3.754 -10.644
  391    H    ALA  39           H        ALA  39   6.893   2.304  -7.478
  392    HA   ALA  39           HA       ALA  39   5.217   4.257  -6.265
  393   1HB   ALA  39          3HB       ALA  39   7.682   4.377  -6.720
  394   2HB   ALA  39          2HB       ALA  39   7.315   4.604  -8.430
  395   3HB   ALA  39          1HB       ALA  39   6.815   5.818  -7.252
  396    MB   ALA  39           QB       ALA  39   7.271   4.933  -7.467
  397    H    GLY  40           H        GLY  40   3.166   4.650  -7.024
  398   1HA   GLY  40          1HA       GLY  40   2.909   5.483  -9.864
  399   2HA   GLY  40          2HA       GLY  40   1.755   5.851  -8.580
  400    QA   GLY  40           QA       GLY  40   2.332   5.667  -9.222
  401    H    GLN  41           H        GLN  41   1.660   3.114  -7.561
  402    HA   GLN  41           HA       GLN  41   0.189   1.810  -9.831
  403   1HB   GLN  41          2HB       GLN  41   2.402   0.792  -9.119
  404   2HB   GLN  41          1HB       GLN  41   1.664   0.462  -7.550
  405   1HG   GLN  41          2HG       GLN  41  -0.236  -0.629  -9.044
  406   2HG   GLN  41          1HG       GLN  41   1.074  -0.766 -10.217
  407   1HE2  GLN  41          1HE2      GLN  41  -0.301  -2.208  -7.413
  408   2HE2  GLN  41          2HE2      GLN  41   0.954  -3.302  -7.085
  409    QB   GLN  41           QB       GLN  41   2.033   0.627  -8.335
  410    QG   GLN  41           QG       GLN  41   0.419  -0.697  -9.631
  411    QE   GLN  41           QE2      GLN  41   0.327  -2.755  -7.249
  412    H    THR  42           H        THR  42  -1.975   1.943  -9.340
  413    HA   THR  42           HA       THR  42  -3.182   2.569  -6.899
  414    HB   THR  42           HB       THR  42  -4.128   0.720  -9.114
  415    HG1  THR  42           HG1      THR  42  -4.063   2.534 -10.153
  416   1HG2  THR  42          1HG2      THR  42  -5.511   2.012  -6.781
  417   2HG2  THR  42          3HG2      THR  42  -6.395   1.728  -8.280
  418   3HG2  THR  42          2HG2      THR  42  -5.683   0.372  -7.405
  419    MG   THR  42           QG2      THR  42  -5.863   1.371  -7.489
  420    H    VAL  43           H        VAL  43  -2.858   1.532  -4.975
  421    HA   VAL  43           HA       VAL  43  -2.579  -1.443  -4.975
  422    HB   VAL  43           HB       VAL  43  -0.730  -0.065  -4.069
  423   1HG1  VAL  43          1HG1      VAL  43  -2.928   0.966  -2.257
  424   2HG1  VAL  43          3HG1      VAL  43  -1.213   1.157  -1.891
  425   3HG1  VAL  43          2HG1      VAL  43  -1.894   1.904  -3.336
  426   1HG2  VAL  43          1HG2      VAL  43  -2.351  -1.688  -2.096
  427   2HG2  VAL  43          3HG2      VAL  43  -0.972  -2.220  -3.057
  428   3HG2  VAL  43          2HG2      VAL  43  -0.735  -1.082  -1.731
  429    MG1  VAL  43           QG1      VAL  43  -2.012   1.342  -2.495
  430    MG2  VAL  43           QG2      VAL  43  -1.353  -1.663  -2.295
  431    QG   VAL  43           QQG      VAL  43  -1.682  -0.160  -2.395
  432    H    LEU  44           H        LEU  44  -4.521   1.237  -3.741
  433    HA   LEU  44           HA       LEU  44  -6.422  -0.782  -2.613
  434   1HB   LEU  44          2HB       LEU  44  -4.865   1.344  -1.232
  435   2HB   LEU  44          1HB       LEU  44  -6.542   1.146  -0.726
  436    HG   LEU  44           HG       LEU  44  -5.432  -1.461  -0.990
  437   1HD1  LEU  44          1HD1      LEU  44  -3.480   0.522  -0.163
  438   2HD1  LEU  44          3HD1      LEU  44  -3.793  -0.629   1.135
  439   3HD1  LEU  44          2HD1      LEU  44  -3.259  -1.204  -0.444
  440   1HD2  LEU  44          1HD2      LEU  44  -7.230  -0.432   0.575
  441   2HD2  LEU  44          3HD2      LEU  44  -6.188  -1.693   1.233
  442   3HD2  LEU  44          2HD2      LEU  44  -5.870   0.000   1.611
  443    MD1  LEU  44           QD1      LEU  44  -3.511  -0.437   0.176
  444    MD2  LEU  44           QD2      LEU  44  -6.430  -0.708   1.140
  445    QB   LEU  44           QB       LEU  44  -5.703   1.245  -0.979
  446    QD   LEU  44           QQD      LEU  44  -4.970  -0.573   0.658
  447    H    VAL  45           H        VAL  45  -8.508   0.450  -1.893
  448    HA   VAL  45           HA       VAL  45  -9.158   2.516  -3.967
  449    HB   VAL  45           HB       VAL  45 -10.887   0.431  -2.599
  450   1HG1  VAL  45          2HG1      VAL  45 -11.447   2.714  -4.435
  451   2HG1  VAL  45          1HG1      VAL  45 -12.314   1.208  -4.739
  452   3HG1  VAL  45          3HG1      VAL  45 -12.461   2.010  -3.175
  453   1HG2  VAL  45          3HG2      VAL  45  -9.629   0.595  -5.349
  454   2HG2  VAL  45          2HG2      VAL  45  -9.403  -0.665  -4.136
  455   3HG2  VAL  45          1HG2      VAL  45 -10.952  -0.507  -4.965
  456    MG1  VAL  45           QG1      VAL  45 -12.074   1.977  -4.117
  457    MG2  VAL  45           QG2      VAL  45  -9.995  -0.192  -4.816
  458    QG   VAL  45           QQG      VAL  45 -11.034   0.893  -4.467
  459    H    LEU  46           H        LEU  46 -10.205   4.404  -3.243
  460    HA   LEU  46           HA       LEU  46 -10.862   4.549  -0.319
  461   1HB   LEU  46          2HB       LEU  46  -8.595   5.464  -0.931
  462   2HB   LEU  46          1HB       LEU  46  -9.407   6.648  -1.954
  463    HG   LEU  46           HG       LEU  46 -10.745   7.320   0.110
  464   1HD1  LEU  46          2HD1      LEU  46  -8.364   8.223  -0.863
  465   2HD1  LEU  46          1HD1      LEU  46  -9.218   8.976   0.485
  466   3HD1  LEU  46          3HD1      LEU  46  -7.910   7.833   0.797
  467   1HD2  LEU  46          3HD2      LEU  46 -10.275   5.283   1.425
  468   2HD2  LEU  46          2HD2      LEU  46  -8.562   5.698   1.457
  469   3HD2  LEU  46          1HD2      LEU  46  -9.734   6.725   2.284
  470    MD1  LEU  46           QD1      LEU  46  -8.497   8.344   0.140
  471    MD2  LEU  46           QD2      LEU  46  -9.524   5.902   1.722
  472    QB   LEU  46           QB       LEU  46  -9.001   6.056  -1.443
  473    QD   LEU  46           QQD      LEU  46  -9.010   7.123   0.931
  474    H    GLU  47           H        GLU  47 -12.394   6.285   0.195
  475    HA   GLU  47           HA       GLU  47 -13.778   7.627  -2.050
  476   1HB   GLU  47          2HB       GLU  47 -14.659   5.251  -1.770
  477   2HB   GLU  47          1HB       GLU  47 -15.242   5.743  -0.179
  478   1HG   GLU  47          2HG       GLU  47 -16.617   7.498  -1.188
  479   2HG   GLU  47          1HG       GLU  47 -15.993   7.095  -2.789
  480    QB   GLU  47           QB       GLU  47 -14.950   5.497  -0.974
  481    QG   GLU  47           QG       GLU  47 -16.305   7.297  -1.988
  482    H    ALA  48           H        ALA  48 -12.689   9.324  -0.553
  483    HA   ALA  48           HA       ALA  48 -14.434   9.910   1.817
  484   1HB   ALA  48          3HB       ALA  48 -11.676  11.006   1.233
  485   2HB   ALA  48          1HB       ALA  48 -11.903   9.440   2.013
  486   3HB   ALA  48          2HB       ALA  48 -12.500  10.907   2.789
  487    MB   ALA  48           QB       ALA  48 -12.026  10.451   2.012
  488    H    MET  49           H        MET  49 -15.857  10.812  -0.084
  489    HA   MET  49           HA       MET  49 -16.764  12.718  -1.142
  490   1HB   MET  49          2HB       MET  49 -15.812  13.432   1.320
  491   2HB   MET  49          1HB       MET  49 -14.917  14.542   0.282
  492   1HG   MET  49          2HG       MET  49 -17.063  15.223  -0.786
  493   2HG   MET  49          1HG       MET  49 -17.927  14.179   0.342
  494   1HE   MET  49          1HE       MET  49 -15.016  16.553   0.209
  495   2HE   MET  49          3HE       MET  49 -16.286  17.727  -0.165
  496   3HE   MET  49          2HE       MET  49 -15.382  17.852   1.342
  497    QB   MET  49           QB       MET  49 -15.365  13.987   0.801
  498    QG   MET  49           QG       MET  49 -17.495  14.701  -0.222
  499    ME   MET  49           QE       MET  49 -15.561  17.377   0.462
  500    H    LYS  50           H        LYS  50 -13.960  11.490  -1.935
  501    HA   LYS  50           HA       LYS  50 -13.215  13.743  -3.772
  502   1HB   LYS  50          2HB       LYS  50 -11.667  12.032  -1.909
  503   2HB   LYS  50          1HB       LYS  50 -10.920  12.311  -3.484
  504   1HG   LYS  50          2HG       LYS  50 -12.103  14.693  -2.165
  505   2HG   LYS  50          1HG       LYS  50 -10.658  14.026  -1.406
  506   1HD   LYS  50          2HD       LYS  50  -9.598  14.028  -3.728
  507   2HD   LYS  50          1HD       LYS  50 -10.970  15.008  -4.249
  508   1HE   LYS  50          2HE       LYS  50 -10.218  16.870  -3.145
  509   2HE   LYS  50          1HE       LYS  50  -9.615  15.926  -1.768
  510   1HZ   LYS  50          2HZ       LYS  50  -7.848  15.070  -3.234
  511   2HZ   LYS  50          1HZ       LYS  50  -8.373  16.123  -4.460
  512   3HZ   LYS  50          3HZ       LYS  50  -7.750  16.752  -3.014
  513    QB   LYS  50           QB       LYS  50 -11.293  12.171  -2.696
  514    QD   LYS  50           QD       LYS  50 -10.284  14.518  -3.989
  515    QG   LYS  50           QG       LYS  50 -11.380  14.360  -1.786
  516    QE   LYS  50           QE       LYS  50  -9.917  16.398  -2.457
  517    QZ   LYS  50           QZ       LYS  50  -7.990  15.981  -3.569
  518    H    MET  51           H        MET  51 -14.216  10.469  -3.497
  519    HA   MET  51           HA       MET  51 -14.431   8.745  -5.088
  520   1HB   MET  51          2HB       MET  51 -15.227  11.170  -6.132
  521   2HB   MET  51          1HB       MET  51 -14.084  10.598  -7.349
  522   1HG   MET  51          2HG       MET  51 -15.295   8.545  -7.643
  523   2HG   MET  51          1HG       MET  51 -16.309   8.873  -6.237
  524   1HE   MET  51          3HE       MET  51 -16.822   8.041  -9.157
  525   2HE   MET  51          2HE       MET  51 -18.383   8.288  -8.380
  526   3HE   MET  51          1HE       MET  51 -18.047   9.056  -9.929
  527    QB   MET  51           QB       MET  51 -14.656  10.884  -6.741
  528    QG   MET  51           QG       MET  51 -15.802   8.709  -6.940
  529    ME   MET  51           QE       MET  51 -17.750   8.462  -9.155
  530    H    GLU  52           H        GLU  52 -11.638   9.772  -4.279
  531    HA   GLU  52           HA       GLU  52  -9.802   9.709  -6.416
  532   1HB   GLU  52          2HB       GLU  52  -9.762   9.762  -3.655
  533   2HB   GLU  52          1HB       GLU  52  -9.017   8.202  -4.008
  534   1HG   GLU  52          2HG       GLU  52  -7.105   9.240  -4.569
  535   2HG   GLU  52          1HG       GLU  52  -7.955  10.114  -5.845
  536    QB   GLU  52           QB       GLU  52  -9.390   8.982  -3.832
  537    QG   GLU  52           QG       GLU  52  -7.530   9.677  -5.207
  538    H    THR  53           H        THR  53 -11.300   7.011  -4.648
  539    HA   THR  53           HA       THR  53 -11.399   4.711  -5.135
  540    HB   THR  53           HB       THR  53 -11.227   5.996  -7.876
  541    HG1  THR  53           HG1      THR  53 -13.017   6.682  -6.828
  542   1HG2  THR  53          1HG2      THR  53 -11.476   3.179  -7.025
  543   2HG2  THR  53          3HG2      THR  53 -12.675   3.707  -8.205
  544   3HG2  THR  53          2HG2      THR  53 -10.955   3.847  -8.572
  545    MG   THR  53           QG2      THR  53 -11.702   3.578  -7.934
  546    H    GLU  54           H        GLU  54  -9.463   5.197  -8.035
  547    HA   GLU  54           HA       GLU  54  -7.581   3.184  -7.357
  548   1HB   GLU  54          2HB       GLU  54  -7.714   5.478  -9.300
  549   2HB   GLU  54          1HB       GLU  54  -6.264   4.478  -9.216
  550   1HG   GLU  54          2HG       GLU  54  -8.108   2.524  -9.291
  551   2HG   GLU  54          1HG       GLU  54  -8.998   3.773 -10.162
  552    QB   GLU  54           QB       GLU  54  -6.989   4.978  -9.258
  553    QG   GLU  54           QG       GLU  54  -8.553   3.149  -9.727
  554    H    ILE  55           H        ILE  55  -6.387   3.385  -5.472
  555    HA   ILE  55           HA       ILE  55  -5.024   5.989  -4.918
  556    HB   ILE  55           HB       ILE  55  -5.647   3.514  -3.275
  557   1HG1  ILE  55          2HG1      ILE  55  -7.530   5.052  -3.675
  558   2HG1  ILE  55          1HG1      ILE  55  -7.030   5.109  -1.988
  559   1HG2  ILE  55          1HG2      ILE  55  -3.581   5.504  -2.898
  560   2HG2  ILE  55          3HG2      ILE  55  -4.769   5.606  -1.597
  561   3HG2  ILE  55          2HG2      ILE  55  -3.940   4.082  -1.919
  562   1HD1  ILE  55          2HD1      ILE  55  -5.428   7.020  -3.257
  563   2HD1  ILE  55          1HD1      ILE  55  -7.027   7.234  -3.971
  564   3HD1  ILE  55          3HD1      ILE  55  -6.820   7.340  -2.223
  565    MG   ILE  55           QG2      ILE  55  -4.097   5.064  -2.138
  566    MD   ILE  55           QD1      ILE  55  -6.425   7.198  -3.150
  567    QG   ILE  55           QG1      ILE  55  -7.280   5.081  -2.831
  568    H    ASN  56           H        ASN  56  -3.111   5.944  -6.092
  569    HA   ASN  56           HA       ASN  56  -1.568   3.566  -6.633
  570   1HB   ASN  56          2HB       ASN  56   0.081   5.256  -7.424
  571   2HB   ASN  56          1HB       ASN  56  -1.547   5.594  -8.015
  572   1HD2  ASN  56          1HD2      ASN  56   1.029   7.246  -6.933
  573   2HD2  ASN  56          2HD2      ASN  56   0.271   8.497  -6.073
  574    QB   ASN  56           QB       ASN  56  -0.733   5.425  -7.720
  575    QD   ASN  56           QD2      ASN  56   0.650   7.872  -6.503
  576    H    ALA  57           H        ALA  57   0.046   2.631  -5.439
  577    HA   ALA  57           HA       ALA  57   0.412   3.074  -2.684
  578   1HB   ALA  57          1HB       ALA  57   1.316   1.350  -4.656
  579   2HB   ALA  57          2HB       ALA  57   1.796   1.291  -2.959
  580   3HB   ALA  57          3HB       ALA  57   2.797   2.151  -4.129
  581    MB   ALA  57           QB       ALA  57   1.970   1.597  -3.915
  582    HA   PRO  58           HA       PRO  58   3.190   6.468  -2.352
  583   1HB   PRO  58          2HB       PRO  58   5.101   5.632  -0.586
  584   2HB   PRO  58          1HB       PRO  58   3.431   5.990  -0.103
  585   1HG   PRO  58          2HG       PRO  58   4.754   3.373  -0.538
  586   2HG   PRO  58          1HG       PRO  58   3.502   3.830   0.625
  587   1HD   PRO  58          2HD       PRO  58   3.051   2.438  -1.717
  588   2HD   PRO  58          1HD       PRO  58   1.820   3.356  -0.824
  589    QB   PRO  58           QB       PRO  58   4.266   5.811  -0.345
  590    QG   PRO  58           QG       PRO  58   4.128   3.601   0.043
  591    QD   PRO  58           QD       PRO  58   2.435   2.897  -1.271
  592    H    THR  59           H        THR  59   5.147   3.469  -2.572
  593    HA   THR  59           HA       THR  59   6.566   4.479  -4.930
  594    HB   THR  59           HB       THR  59   8.770   4.143  -3.438
  595    HG1  THR  59           HG1      THR  59   8.320   4.115  -1.407
  596   1HG2  THR  59          1HG2      THR  59   7.381   6.285  -4.534
  597   2HG2  THR  59          3HG2      THR  59   7.625   6.763  -2.855
  598   3HG2  THR  59          2HG2      THR  59   9.010   6.343  -3.862
  599    MG   THR  59           QG2      THR  59   8.005   6.464  -3.751
  600    H    ASP  60           H        ASP  60   8.766   2.845  -4.925
  601    HA   ASP  60           HA       ASP  60   7.621   0.215  -5.385
  602   1HB   ASP  60          2HB       ASP  60  10.226   1.632  -5.635
  603   2HB   ASP  60          1HB       ASP  60  10.303  -0.127  -5.525
  604    QB   ASP  60           QB       ASP  60  10.265   0.753  -5.580
  605    H    GLY  61           H        GLY  61   7.358  -1.359  -3.841
  606   1HA   GLY  61          1HA       GLY  61   8.127  -1.036  -1.119
  607   2HA   GLY  61          2HA       GLY  61   9.334  -2.052  -1.909
  608    QA   GLY  61           QA       GLY  61   8.731  -1.544  -1.514
  609    H    LYS  62           H        LYS  62   8.359  -3.593  -0.212
  610    HA   LYS  62           HA       LYS  62   6.138  -5.129  -1.504
  611   1HB   LYS  62          2HB       LYS  62   8.366  -6.198  -1.270
  612   2HB   LYS  62          1HB       LYS  62   8.296  -5.940   0.474
  613   1HG   LYS  62          2HG       LYS  62   6.194  -7.299   0.541
  614   2HG   LYS  62          1HG       LYS  62   6.411  -7.648  -1.175
  615   1HD   LYS  62          2HD       LYS  62   8.407  -8.869  -0.791
  616   2HD   LYS  62          1HD       LYS  62   8.587  -8.217   0.839
  617   1HE   LYS  62          2HE       LYS  62   7.709 -10.336   1.311
  618   2HE   LYS  62          1HE       LYS  62   6.214  -9.387   1.195
  619   1HZ   LYS  62          2HZ       LYS  62   6.277  -9.883  -1.252
  620   2HZ   LYS  62          1HZ       LYS  62   7.489 -11.026  -0.922
  621   3HZ   LYS  62          3HZ       LYS  62   5.942 -11.218  -0.256
  622    QB   LYS  62           QB       LYS  62   8.331  -6.069  -0.398
  623    QD   LYS  62           QD       LYS  62   8.497  -8.543   0.024
  624    QG   LYS  62           QG       LYS  62   6.302  -7.474  -0.317
  625    QE   LYS  62           QE       LYS  62   6.961  -9.861   1.253
  626    QZ   LYS  62           QZ       LYS  62   6.570 -10.709  -0.810
  627    H    VAL  63           H        VAL  63   4.422  -5.922  -0.146
  628    HA   VAL  63           HA       VAL  63   3.844  -4.208   2.174
  629    HB   VAL  63           HB       VAL  63   2.400  -6.342   0.590
  630   1HG1  VAL  63          1HG1      VAL  63   2.749  -3.839  -0.088
  631   2HG1  VAL  63          3HG1      VAL  63   1.144  -4.552  -0.247
  632   3HG1  VAL  63          2HG1      VAL  63   1.519  -3.522   1.135
  633   1HG2  VAL  63          3HG2      VAL  63   1.488  -4.946   3.125
  634   2HG2  VAL  63          2HG2      VAL  63   0.382  -5.736   2.002
  635   3HG2  VAL  63          1HG2      VAL  63   1.606  -6.684   2.848
  636    MG1  VAL  63           QG1      VAL  63   1.804  -3.971   0.267
  637    MG2  VAL  63           QG2      VAL  63   1.159  -5.789   2.658
  638    QG   VAL  63           QQG      VAL  63   1.481  -4.880   1.462
  639    H    GLU  64           H        GLU  64   4.943  -4.802   4.024
  640    HA   GLU  64           HA       GLU  64   5.433  -7.633   4.666
  641   1HB   GLU  64          2HB       GLU  64   5.901  -5.046   6.191
  642   2HB   GLU  64          1HB       GLU  64   6.573  -6.620   6.618
  643   1HG   GLU  64          2HG       GLU  64   7.038  -5.677   3.832
  644   2HG   GLU  64          1HG       GLU  64   7.924  -4.847   5.113
  645    QB   GLU  64           QB       GLU  64   6.237  -5.833   6.405
  646    QG   GLU  64           QG       GLU  64   7.481  -5.262   4.473
  647    H    LYS  65           H        LYS  65   2.880  -5.387   5.108
  648    HA   LYS  65           HA       LYS  65   1.223  -7.199   6.574
  649   1HB   LYS  65          2HB       LYS  65   3.171  -5.662   8.086
  650   2HB   LYS  65          1HB       LYS  65   1.531  -5.255   8.593
  651   1HG   LYS  65          2HG       LYS  65   1.161  -7.315   9.488
  652   2HG   LYS  65          1HG       LYS  65   2.016  -8.140   8.183
  653   1HD   LYS  65          2HD       LYS  65   3.358  -8.488  10.118
  654   2HD   LYS  65          1HD       LYS  65   4.171  -7.209   9.216
  655   1HE   LYS  65          2HE       LYS  65   3.347  -5.508  10.682
  656   2HE   LYS  65          1HE       LYS  65   2.174  -6.616  11.421
  657   1HZ   LYS  65          2HZ       LYS  65   4.058  -8.012  12.129
  658   2HZ   LYS  65          1HZ       LYS  65   5.136  -6.838  11.540
  659   3HZ   LYS  65          3HZ       LYS  65   4.102  -6.466  12.832
  660    QB   LYS  65           QB       LYS  65   2.351  -5.458   8.340
  661    QD   LYS  65           QD       LYS  65   3.764  -7.848   9.667
  662    QG   LYS  65           QG       LYS  65   1.589  -7.728   8.836
  663    QE   LYS  65           QE       LYS  65   2.760  -6.062  11.052
  664    QZ   LYS  65           QZ       LYS  65   4.432  -7.105  12.167
  665    H    VAL  66           H        VAL  66  -0.879  -6.207   7.063
  666    HA   VAL  66           HA       VAL  66  -1.265  -3.595   5.641
  667    HB   VAL  66           HB       VAL  66  -3.613  -4.498   5.351
  668   1HG1  VAL  66          3HG1      VAL  66  -2.860  -6.261   7.344
  669   2HG1  VAL  66          2HG1      VAL  66  -4.267  -6.452   6.298
  670   3HG1  VAL  66          1HG1      VAL  66  -2.750  -7.253   5.890
  671   1HG2  VAL  66          3HG2      VAL  66  -1.633  -4.785   3.720
  672   2HG2  VAL  66          2HG2      VAL  66  -1.558  -6.446   4.307
  673   3HG2  VAL  66          1HG2      VAL  66  -3.016  -5.860   3.507
  674    MG1  VAL  66           QG1      VAL  66  -3.292  -6.655   6.511
  675    MG2  VAL  66           QG2      VAL  66  -2.069  -5.697   3.845
  676    QG   VAL  66           QQG      VAL  66  -2.681  -6.176   5.178
  677    H    LEU  67           H        LEU  67  -0.985  -2.217   7.464
  678    HA   LEU  67           HA       LEU  67  -2.008  -2.580  10.073
  679   1HB   LEU  67          2HB       LEU  67  -1.132  -0.356   8.313
  680   2HB   LEU  67          1HB       LEU  67  -2.110   0.115   9.704
  681    HG   LEU  67           HG       LEU  67   0.040  -1.860  10.243
  682   1HD1  LEU  67          2HD1      LEU  67   0.580   1.026   9.493
  683   2HD1  LEU  67          1HD1      LEU  67   1.714   0.033  10.408
  684   3HD1  LEU  67          3HD1      LEU  67   1.278  -0.417   8.760
  685   1HD2  LEU  67          1HD2      LEU  67  -1.593   0.085  11.624
  686   2HD2  LEU  67          3HD2      LEU  67  -0.587  -1.197  12.302
  687   3HD2  LEU  67          2HD2      LEU  67   0.112   0.385  11.957
  688    MD1  LEU  67           QD1      LEU  67   1.191   0.214   9.554
  689    MD2  LEU  67           QD2      LEU  67  -0.689  -0.242  11.961
  690    QB   LEU  67           QB       LEU  67  -1.621  -0.121   9.009
  691    QD   LEU  67           QQD      LEU  67   0.251  -0.014  10.757
  692    H    VAL  68           H        VAL  68  -3.467  -0.289   7.746
  693    HA   VAL  68           HA       VAL  68  -5.996  -0.193   9.085
  694    HB   VAL  68           HB       VAL  68  -6.678   0.973   7.001
  695   1HG1  VAL  68          1HG1      VAL  68  -3.972   1.535   8.208
  696   2HG1  VAL  68          3HG1      VAL  68  -4.633   2.576   6.948
  697   3HG1  VAL  68          2HG1      VAL  68  -5.494   2.383   8.475
  698   1HG2  VAL  68          3HG2      VAL  68  -5.385  -0.688   5.536
  699   2HG2  VAL  68          2HG2      VAL  68  -5.286   1.009   5.065
  700   3HG2  VAL  68          1HG2      VAL  68  -3.945   0.252   5.926
  701    MG1  VAL  68           QG1      VAL  68  -4.699   2.165   7.877
  702    MG2  VAL  68           QG2      VAL  68  -4.872   0.191   5.509
  703    QG   VAL  68           QQG      VAL  68  -4.786   1.178   6.693
  704    H    LYS  69           H        LYS  69  -8.087  -0.914   8.059
  705    HA   LYS  69           HA       LYS  69  -7.775  -3.602   6.757
  706   1HB   LYS  69          2HB       LYS  69  -9.744  -2.481   8.772
  707   2HB   LYS  69          1HB       LYS  69  -9.995  -4.020   7.950
  708   1HG   LYS  69          2HG       LYS  69  -7.821  -4.829   8.829
  709   2HG   LYS  69          1HG       LYS  69  -7.615  -3.302   9.688
  710   1HD   LYS  69          2HD       LYS  69  -9.942  -3.829  10.726
  711   2HD   LYS  69          1HD       LYS  69  -9.638  -5.479  10.183
  712   1HE   LYS  69          2HE       LYS  69  -7.815  -5.761  11.628
  713   2HE   LYS  69          1HE       LYS  69  -7.524  -4.015  11.756
  714   1HZ   LYS  69          1HZ       LYS  69  -9.809  -3.883  12.771
  715   2HZ   LYS  69          3HZ       LYS  69  -9.770  -5.573  12.906
  716   3HZ   LYS  69          2HZ       LYS  69  -8.625  -4.630  13.735
  717    QB   LYS  69           QB       LYS  69  -9.870  -3.251   8.361
  718    QD   LYS  69           QD       LYS  69  -9.790  -4.654  10.455
  719    QG   LYS  69           QG       LYS  69  -7.718  -4.065   9.258
  720    QE   LYS  69           QE       LYS  69  -7.669  -4.888  11.692
  721    QZ   LYS  69           QZ       LYS  69  -9.401  -4.695  13.137
  722    H    GLU  70           H        GLU  70 -10.184  -4.124   5.790
  723    HA   GLU  70           HA       GLU  70 -10.616  -2.051   3.736
  724   1HB   GLU  70          2HB       GLU  70 -10.555  -4.727   3.665
  725   2HB   GLU  70          1HB       GLU  70 -12.277  -4.524   3.993
  726   1HG   GLU  70          2HG       GLU  70 -11.833  -2.639   2.032
  727   2HG   GLU  70          1HG       GLU  70 -10.761  -3.951   1.541
  728    QB   GLU  70           QB       GLU  70 -11.416  -4.626   3.829
  729    QG   GLU  70           QG       GLU  70 -11.297  -3.295   1.786
  730    H    ARG  71           H        ARG  71 -12.557  -0.875   3.504
  731    HA   ARG  71           HA       ARG  71 -14.544   0.187   4.212
  732   1HB   ARG  71          2HB       ARG  71 -14.910  -2.528   4.215
  733   2HB   ARG  71          1HB       ARG  71 -15.338  -2.125   5.877
  734   1HG   ARG  71          2HG       ARG  71 -16.884  -0.368   5.020
  735   2HG   ARG  71          1HG       ARG  71 -16.510  -0.881   3.373
  736   1HD   ARG  71          2HD       ARG  71 -18.317  -2.265   3.659
  737   2HD   ARG  71          1HD       ARG  71 -17.167  -3.278   4.555
  738    HE   ARG  71           HE       ARG  71 -18.703  -1.128   5.956
  739   1HH1  ARG  71          1HH1      ARG  71 -16.714  -3.732   6.457
  740   2HH1  ARG  71          2HH1      ARG  71 -17.749  -4.558   7.573
  741   1HH2  ARG  71          1HH2      ARG  71 -20.457  -2.464   7.021
  742   2HH2  ARG  71          2HH2      ARG  71 -19.868  -3.839   7.894
  743    QB   ARG  71           QB       ARG  71 -15.124  -2.327   5.046
  744    QG   ARG  71           QG       ARG  71 -16.697  -0.625   4.196
  745    QD   ARG  71           QD       ARG  71 -17.742  -2.772   4.107
  746    QH1  ARG  71           QH1      ARG  71 -17.232  -4.145   7.015
  747    QH2  ARG  71           QH2      ARG  71 -20.162  -3.152   7.458
  748    H    ASP  72           H        ASP  72 -12.100   0.422   5.877
  749    HA   ASP  72           HA       ASP  72 -13.388   0.844   8.557
  750   1HB   ASP  72          2HB       ASP  72 -11.631  -0.945   8.379
  751   2HB   ASP  72          1HB       ASP  72 -10.478   0.296   7.886
  752    QB   ASP  72           QB       ASP  72 -11.054  -0.325   8.132
  753    H    ALA  73           H        ALA  73 -13.995   3.037   7.904
  754    HA   ALA  73           HA       ALA  73 -12.375   5.016   6.758
  755   1HB   ALA  73          2HB       ALA  73 -14.210   5.534   9.097
  756   2HB   ALA  73          3HB       ALA  73 -14.852   4.969   7.556
  757   3HB   ALA  73          1HB       ALA  73 -13.987   6.504   7.642
  758    MB   ALA  73           QB       ALA  73 -14.350   5.669   8.098
  759    H    VAL  74           H        VAL  74 -10.840   6.485   7.587
  760    HA   VAL  74           HA       VAL  74  -9.929   6.028  10.408
  761    HB   VAL  74           HB       VAL  74  -8.510   4.885   8.719
  762   1HG1  VAL  74          1HG1      VAL  74  -7.682   6.418  10.816
  763   2HG1  VAL  74          3HG1      VAL  74  -6.597   5.432   9.836
  764   3HG1  VAL  74          2HG1      VAL  74  -6.774   7.153   9.496
  765   1HG2  VAL  74          3HG2      VAL  74  -9.031   6.512   6.874
  766   2HG2  VAL  74          2HG2      VAL  74  -7.973   7.677   7.668
  767   3HG2  VAL  74          1HG2      VAL  74  -7.310   6.167   7.045
  768    MG1  VAL  74           QG1      VAL  74  -7.018   6.335  10.049
  769    MG2  VAL  74           QG2      VAL  74  -8.105   6.785   7.196
  770    QG   VAL  74           QQG      VAL  74  -7.561   6.560   8.622
  771    H    GLN  75           H        GLN  75  -8.828   7.924  11.342
  772    HA   GLN  75           HA       GLN  75  -9.896  10.473  10.232
  773   1HB   GLN  75          2HB       GLN  75 -10.066   9.451  12.677
  774   2HB   GLN  75          1HB       GLN  75  -8.476  10.193  12.858
  775   1HG   GLN  75          2HG       GLN  75  -9.330  12.369  12.348
  776   2HG   GLN  75          1HG       GLN  75 -10.871  11.708  11.797
  777   1HE2  GLN  75          1HE2      GLN  75 -10.119  13.603  14.138
  778   2HE2  GLN  75          2HE2      GLN  75 -10.889  12.904  15.479
  779    QB   GLN  75           QB       GLN  75  -9.271   9.822  12.768
  780    QG   GLN  75           QG       GLN  75 -10.100  12.038  12.073
  781    QE   GLN  75           QE2      GLN  75 -10.504  13.253  14.808
  782    H    GLY  76           H        GLY  76  -7.384   8.993   9.247
  783   1HA   GLY  76          1HA       GLY  76  -5.711  11.373   9.024
  784   2HA   GLY  76          2HA       GLY  76  -5.371   9.798   8.304
  785    QA   GLY  76           QA       GLY  76  -5.541  10.586   8.664
  786    H    GLY  77           H        GLY  77  -3.135  10.560   9.195
  787   1HA   GLY  77          1HA       GLY  77  -2.619  10.544  12.006
  788   2HA   GLY  77          2HA       GLY  77  -1.414  10.227  10.757
  789    QA   GLY  77           QA       GLY  77  -2.016  10.385  11.382
  790    H    GLN  78           H        GLN  78  -2.853   7.960   9.620
  791    HA   GLN  78           HA       GLN  78  -2.421   5.967  11.822
  792   1HB   GLN  78          2HB       GLN  78  -4.768   6.654  10.351
  793   2HB   GLN  78          1HB       GLN  78  -4.272   5.043   9.829
  794   1HG   GLN  78          2HG       GLN  78  -4.124   5.504  12.746
  795   2HG   GLN  78          1HG       GLN  78  -5.754   5.528  12.071
  796   1HE2  GLN  78          1HE2      GLN  78  -2.817   3.565  11.310
  797   2HE2  GLN  78          2HE2      GLN  78  -3.609   2.070  11.434
  798    QB   GLN  78           QB       GLN  78  -4.520   5.849  10.090
  799    QG   GLN  78           QG       GLN  78  -4.939   5.516  12.408
  800    QE   GLN  78           QE2      GLN  78  -3.213   2.818  11.372
  801    H    GLY  79           H        GLY  79  -0.929   4.417  11.274
  802   1HA   GLY  79          1HA       GLY  79   0.507   3.098   9.969
  803   2HA   GLY  79          2HA       GLY  79   0.557   4.473   8.863
  804    QA   GLY  79           QA       GLY  79   0.532   3.785   9.416
  805    H    LEU  80           H        LEU  80  -0.337   4.142   6.875
  806    HA   LEU  80           HA       LEU  80  -2.743   2.630   6.407
  807   1HB   LEU  80          2HB       LEU  80  -0.497   3.699   4.681
  808   2HB   LEU  80          1HB       LEU  80  -1.914   2.902   3.996
  809    HG   LEU  80           HG       LEU  80  -2.268   5.148   5.962
  810   1HD1  LEU  80          3HD1      LEU  80  -3.940   3.460   4.400
  811   2HD1  LEU  80          2HD1      LEU  80  -4.427   4.804   5.431
  812   3HD1  LEU  80          1HD1      LEU  80  -4.072   5.084   3.726
  813   1HD2  LEU  80          3HD2      LEU  80  -0.728   5.564   3.767
  814   2HD2  LEU  80          2HD2      LEU  80  -2.329   5.810   3.069
  815   3HD2  LEU  80          1HD2      LEU  80  -1.802   6.791   4.437
  816    MD1  LEU  80           QD1      LEU  80  -4.147   4.449   4.519
  817    MD2  LEU  80           QD2      LEU  80  -1.620   6.055   3.758
  818    QB   LEU  80           QB       LEU  80  -1.205   3.301   4.339
  819    QD   LEU  80           QQD      LEU  80  -2.883   5.252   4.138
  820    H    ILE  81           H        ILE  81   0.475   1.907   5.020
  821    HA   ILE  81           HA       ILE  81  -0.005  -0.988   5.634
  822    HB   ILE  81           HB       ILE  81   0.913   0.332   3.059
  823   1HG1  ILE  81          2HG1      ILE  81  -1.448  -1.503   3.483
  824   2HG1  ILE  81          1HG1      ILE  81  -1.585   0.238   3.735
  825   1HG2  ILE  81          3HG2      ILE  81   0.915  -2.533   3.986
  826   2HG2  ILE  81          2HG2      ILE  81   0.709  -2.153   2.276
  827   3HG2  ILE  81          1HG2      ILE  81   2.173  -1.648   3.122
  828   1HD1  ILE  81          2HD1      ILE  81  -0.301   0.132   1.312
  829   2HD1  ILE  81          1HD1      ILE  81  -1.347  -1.284   1.220
  830   3HD1  ILE  81          3HD1      ILE  81  -2.045   0.309   1.509
  831    MG   ILE  81           QG2      ILE  81   1.266  -2.111   3.128
  832    MD   ILE  81           QD1      ILE  81  -1.231  -0.281   1.347
  833    QG   ILE  81           QG1      ILE  81  -1.516  -0.633   3.609
  834    H    LYS  82           H        LYS  82   2.019  -2.261   5.656
  835    HA   LYS  82           HA       LYS  82   4.333  -0.616   6.581
  836   1HB   LYS  82          2HB       LYS  82   3.307  -2.340   8.061
  837   2HB   LYS  82          1HB       LYS  82   3.691  -3.572   6.857
  838   1HG   LYS  82          2HG       LYS  82   5.996  -3.396   7.218
  839   2HG   LYS  82          1HG       LYS  82   5.863  -1.778   7.906
  840   1HD   LYS  82          2HD       LYS  82   4.552  -4.106   9.287
  841   2HD   LYS  82          1HD       LYS  82   6.276  -3.808   9.508
  842   1HE   LYS  82          2HE       LYS  82   5.920  -1.761  10.588
  843   2HE   LYS  82          1HE       LYS  82   4.323  -1.538   9.845
  844   1HZ   LYS  82          1HZ       LYS  82   4.924  -3.802  11.657
  845   2HZ   LYS  82          3HZ       LYS  82   4.334  -2.322  12.239
  846   3HZ   LYS  82          2HZ       LYS  82   3.403  -3.238  11.152
  847    QB   LYS  82           QB       LYS  82   3.499  -2.956   7.459
  848    QD   LYS  82           QD       LYS  82   5.414  -3.957   9.398
  849    QG   LYS  82           QG       LYS  82   5.929  -2.587   7.562
  850    QE   LYS  82           QE       LYS  82   5.122  -1.650  10.217
  851    QZ   LYS  82           QZ       LYS  82   4.221  -3.121  11.682
  852    H    ILE  83           H        ILE  83   5.908  -0.307   5.052
  853    HA   ILE  83           HA       ILE  83   6.367  -2.485   3.037
  854    HB   ILE  83           HB       ILE  83   6.826   0.510   2.836
  855   1HG1  ILE  83          2HG1      ILE  83   4.666  -1.193   1.555
  856   2HG1  ILE  83          1HG1      ILE  83   4.413  -0.203   2.992
  857   1HG2  ILE  83          2HG2      ILE  83   7.380  -1.826   1.077
  858   2HG2  ILE  83          1HG2      ILE  83   6.728  -0.385   0.296
  859   3HG2  ILE  83          3HG2      ILE  83   8.234  -0.288   1.208
  860   1HD1  ILE  83          3HD1      ILE  83   5.110   1.805   1.718
  861   2HD1  ILE  83          2HD1      ILE  83   5.314   0.807   0.278
  862   3HD1  ILE  83          1HD1      ILE  83   3.711   1.024   0.982
  863    MG   ILE  83           QG2      ILE  83   7.447  -0.833   0.860
  864    MD   ILE  83           QD1      ILE  83   4.712   1.212   0.993
  865    QG   ILE  83           QG1      ILE  83   4.540  -0.698   2.273
  866    H    GLY  84           H        GLY  84   7.635  -2.403   5.654
  867   1HA   GLY  84          1HA       GLY  84  10.219  -1.189   5.590
  868   2HA   GLY  84          2HA       GLY  84  10.347  -2.828   4.950
  869    QA   GLY  84           QA       GLY  84  10.283  -2.008   5.270

  No H/Q in entry =         869
  Start of MODEL   11
    1    H1   MET   1          3H        MET   1  -6.128  22.968   4.794
    2    H2   MET   1          2H        MET   1  -6.659  21.425   4.325
    3    H3   MET   1          1H        MET   1  -5.974  21.660   5.862
    4    HA   MET   1           HA       MET   1  -4.242  20.690   4.646
    5   1HB   MET   1          2HB       MET   1  -3.821  21.504   2.308
    6   2HB   MET   1          1HB       MET   1  -5.433  20.817   2.518
    7   1HG   MET   1          2HG       MET   1  -6.444  22.794   2.087
    8   2HG   MET   1          1HG       MET   1  -5.333  23.679   3.132
    9   1HE   MET   1          1HE       MET   1  -6.171  22.245  -0.252
   10   2HE   MET   1          3HE       MET   1  -4.769  22.562  -1.282
   11   3HE   MET   1          2HE       MET   1  -4.675  21.349  -0.009
   12    QB   MET   1           QB       MET   1  -4.627  21.161   2.413
   13    QG   MET   1           QG       MET   1  -5.888  23.237   2.610
   14    ME   MET   1           QE       MET   1  -5.205  22.052  -0.514
   15    H    LYS   2           H        LYS   2  -3.992  22.501   6.637
   16    HA   LYS   2           HA       LYS   2  -1.837  24.323   5.642
   17   1HB   LYS   2          2HB       LYS   2  -4.392  24.914   7.040
   18   2HB   LYS   2          1HB       LYS   2  -2.975  25.790   7.619
   19   1HG   LYS   2          2HG       LYS   2  -2.681  25.976   4.891
   20   2HG   LYS   2          1HG       LYS   2  -4.433  26.060   5.078
   21   1HD   LYS   2          2HD       LYS   2  -3.497  27.688   7.122
   22   2HD   LYS   2          1HD       LYS   2  -2.394  28.034   5.790
   23   1HE   LYS   2          2HE       LYS   2  -4.046  28.981   4.495
   24   2HE   LYS   2          1HE       LYS   2  -5.298  27.884   5.111
   25   1HZ   LYS   2          1HZ       LYS   2  -3.997  30.021   6.715
   26   2HZ   LYS   2          3HZ       LYS   2  -5.517  30.175   5.979
   27   3HZ   LYS   2          2HZ       LYS   2  -5.282  29.023   7.205
   28    QB   LYS   2           QB       LYS   2  -3.684  25.352   7.330
   29    QD   LYS   2           QD       LYS   2  -2.946  27.861   6.456
   30    QG   LYS   2           QG       LYS   2  -3.557  26.018   4.985
   31    QE   LYS   2           QE       LYS   2  -4.672  28.433   4.803
   32    QZ   LYS   2           QZ       LYS   2  -4.932  29.740   6.633
   33    H    LEU   3           H        LEU   3  -1.289  21.856   6.804
   34    HA   LEU   3           HA       LEU   3  -0.714  22.404   9.682
   35   1HB   LEU   3          2HB       LEU   3  -1.308  20.092   7.971
   36   2HB   LEU   3          1HB       LEU   3   0.037  19.804   9.075
   37    HG   LEU   3           HG       LEU   3  -1.759  21.081  10.712
   38   1HD1  LEU   3          2HD1      LEU   3  -0.946  18.275  10.177
   39   2HD1  LEU   3          1HD1      LEU   3  -0.865  19.204  11.674
   40   3HD1  LEU   3          3HD1      LEU   3  -2.392  18.485  11.165
   41   1HD2  LEU   3          2HD2      LEU   3  -3.246  19.491   8.621
   42   2HD2  LEU   3          1HD2      LEU   3  -3.895  19.697  10.248
   43   3HD2  LEU   3          3HD2      LEU   3  -3.604  21.108   9.230
   44    MD1  LEU   3           QD1      LEU   3  -1.401  18.655  11.006
   45    MD2  LEU   3           QD2      LEU   3  -3.582  20.098   9.366
   46    QB   LEU   3           QB       LEU   3  -0.636  19.948   8.523
   47    QD   LEU   3           QQD      LEU   3  -2.491  19.377  10.186
   48    H    LYS   4           H        LYS   4   0.822  21.848   6.565
   49    HA   LYS   4           HA       LYS   4   3.081  21.956   5.902
   50   1HB   LYS   4          2HB       LYS   4   3.060  23.638   8.430
   51   2HB   LYS   4          1HB       LYS   4   4.390  23.614   7.272
   52   1HG   LYS   4          2HG       LYS   4   1.536  24.275   6.508
   53   2HG   LYS   4          1HG       LYS   4   2.730  25.499   6.939
   54   1HD   LYS   4          2HD       LYS   4   4.227  24.488   5.136
   55   2HD   LYS   4          1HD       LYS   4   2.815  23.573   4.608
   56   1HE   LYS   4          2HE       LYS   4   2.316  26.463   5.010
   57   2HE   LYS   4          1HE       LYS   4   3.418  26.071   3.675
   58   1HZ   LYS   4          2HZ       LYS   4   1.820  24.404   2.914
   59   2HZ   LYS   4          1HZ       LYS   4   0.748  24.854   4.153
   60   3HZ   LYS   4          3HZ       LYS   4   1.130  25.957   2.922
   61    QB   LYS   4           QB       LYS   4   3.725  23.626   7.851
   62    QD   LYS   4           QD       LYS   4   3.521  24.031   4.872
   63    QG   LYS   4           QG       LYS   4   2.133  24.887   6.723
   64    QE   LYS   4           QE       LYS   4   2.867  26.267   4.342
   65    QZ   LYS   4           QZ       LYS   4   1.232  25.072   3.330
   66    H    VAL   5           H        VAL   5   3.988  22.196   9.309
   67    HA   VAL   5           HA       VAL   5   4.847  19.331   9.272
   68    HB   VAL   5           HB       VAL   5   7.029  20.143  10.221
   69   1HG1  VAL   5          2HG1      VAL   5   5.795  22.401  10.867
   70   2HG1  VAL   5          1HG1      VAL   5   7.514  22.400  10.469
   71   3HG1  VAL   5          3HG1      VAL   5   6.329  22.893   9.259
   72   1HG2  VAL   5          1HG2      VAL   5   6.591  19.724   7.742
   73   2HG2  VAL   5          3HG2      VAL   5   6.408  21.470   7.573
   74   3HG2  VAL   5          2HG2      VAL   5   7.946  20.792   8.108
   75    MG1  VAL   5           QG1      VAL   5   6.546  22.565  10.198
   76    MG2  VAL   5           QG2      VAL   5   6.982  20.662   7.808
   77    QG   VAL   5           QQG      VAL   5   6.764  21.613   9.003
   78    H    THR   6           H        THR   6   2.658  20.882  10.663
   79    HA   THR   6           HA       THR   6   3.555  20.754  13.504
   80    HB   THR   6           HB       THR   6   0.875  21.658  12.448
   81    HG1  THR   6           HG1      THR   6   1.906  23.125  11.382
   82   1HG2  THR   6          3HG2      THR   6   1.270  21.453  14.905
   83   2HG2  THR   6          2HG2      THR   6   2.590  22.613  14.757
   84   3HG2  THR   6          1HG2      THR   6   0.935  23.108  14.401
   85    MG   THR   6           QG2      THR   6   1.598  22.391  14.688
   86    H    VAL   7           H        VAL   7   2.550  19.329  14.977
   87    HA   VAL   7           HA       VAL   7   0.552  17.403  13.844
   88    HB   VAL   7           HB       VAL   7   1.819  15.612  14.976
   89   1HG1  VAL   7          3HG1      VAL   7   3.098  17.929  16.215
   90   2HG1  VAL   7          2HG1      VAL   7   3.068  16.249  16.750
   91   3HG1  VAL   7          1HG1      VAL   7   4.276  16.779  15.581
   92   1HG2  VAL   7          1HG2      VAL   7   3.517  17.411  13.219
   93   2HG2  VAL   7          3HG2      VAL   7   3.881  15.723  13.576
   94   3HG2  VAL   7          2HG2      VAL   7   2.429  16.139  12.666
   95    MG1  VAL   7           QG1      VAL   7   3.481  16.985  16.182
   96    MG2  VAL   7           QG2      VAL   7   3.276  16.424  13.154
   97    QG   VAL   7           QQG      VAL   7   3.378  16.705  14.668
   98    H    ASN   8           H        ASN   8  -1.003  16.672  15.371
   99    HA   ASN   8           HA       ASN   8  -0.760  17.490  18.203
  100   1HB   ASN   8          2HB       ASN   8  -1.621  19.423  16.733
  101   2HB   ASN   8          1HB       ASN   8  -3.084  18.459  16.528
  102   1HD2  ASN   8          1HD2      ASN   8  -1.767  20.862  18.454
  103   2HD2  ASN   8          2HD2      ASN   8  -2.698  20.626  19.852
  104    QB   ASN   8           QB       ASN   8  -2.353  18.941  16.630
  105    QD   ASN   8           QD2      ASN   8  -2.232  20.744  19.153
  106    H    GLY   9           H        GLY   9  -0.969  15.184  18.581
  107   1HA   GLY   9          1HA       GLY   9  -3.727  14.145  18.063
  108   2HA   GLY   9          2HA       GLY   9  -2.813  13.777  19.527
  109    QA   GLY   9           QA       GLY   9  -3.270  13.961  18.795
  110    H    ALA  10           H        ALA  10  -2.196  11.671  19.435
  111    HA   ALA  10           HA       ALA  10  -1.182  10.609  16.817
  112   1HB   ALA  10          1HB       ALA  10   0.728  10.914  18.156
  113   2HB   ALA  10          3HB       ALA  10  -0.130  10.490  19.638
  114   3HB   ALA  10          2HB       ALA  10   0.306   9.232  18.480
  115    MB   ALA  10           QB       ALA  10   0.301  10.212  18.758
  116    H    GLY  11           H        GLY  11  -1.306   8.164  16.746
  117   1HA   GLY  11          1HA       GLY  11  -3.660   6.957  16.809
  118   2HA   GLY  11          2HA       GLY  11  -3.368   7.010  18.548
  119    QA   GLY  11           QA       GLY  11  -3.514   6.984  17.678
  120    H    LYS  12           H        LYS  12  -2.479   5.495  15.540
  121    HA   LYS  12           HA       LYS  12  -0.565   3.714  17.010
  122   1HB   LYS  12          2HB       LYS  12  -3.096   3.163  15.546
  123   2HB   LYS  12          1HB       LYS  12  -1.778   2.021  15.278
  124   1HG   LYS  12          2HG       LYS  12  -1.537   1.746  17.732
  125   2HG   LYS  12          1HG       LYS  12  -2.897   2.845  17.974
  126   1HD   LYS  12          2HD       LYS  12  -3.940   1.047  16.176
  127   2HD   LYS  12          1HD       LYS  12  -2.896   0.017  17.156
  128   1HE   LYS  12          2HE       LYS  12  -4.930  -0.005  18.362
  129   2HE   LYS  12          1HE       LYS  12  -4.012   1.274  19.182
  130   1HZ   LYS  12          2HZ       LYS  12  -4.999   2.825  17.474
  131   2HZ   LYS  12          1HZ       LYS  12  -6.082   1.577  17.083
  132   3HZ   LYS  12          3HZ       LYS  12  -6.078   2.236  18.646
  133    QB   LYS  12           QB       LYS  12  -2.437   2.592  15.412
  134    QD   LYS  12           QD       LYS  12  -3.418   0.532  16.666
  135    QG   LYS  12           QG       LYS  12  -2.217   2.296  17.853
  136    QE   LYS  12           QE       LYS  12  -4.471   0.635  18.772
  137    QZ   LYS  12           QZ       LYS  12  -5.719   2.213  17.735
  138    H    ALA  13           H        ALA  13   1.381   3.769  15.962
  139    HA   ALA  13           HA       ALA  13   1.592   3.410  13.082
  140   1HB   ALA  13          1HB       ALA  13   2.735   5.725  12.854
  141   2HB   ALA  13          2HB       ALA  13   1.939   6.119  14.377
  142   3HB   ALA  13          3HB       ALA  13   0.975   5.700  12.960
  143    MB   ALA  13           QB       ALA  13   1.883   5.848  13.397
  144    H    GLY  14           H        GLY  14   3.846   3.153  12.438
  145   1HA   GLY  14          1HA       GLY  14   5.571   1.751  13.963
  146   2HA   GLY  14          2HA       GLY  14   5.907   3.385  14.537
  147    QA   GLY  14           QA       GLY  14   5.739   2.568  14.250
  148    H    GLU  15           H        GLU  15   8.051   2.335  13.456
  149    HA   GLU  15           HA       GLU  15   8.743   3.966  11.239
  150   1HB   GLU  15          2HB       GLU  15  10.210   2.767  12.944
  151   2HB   GLU  15          1HB       GLU  15   9.964   1.298  12.001
  152   1HG   GLU  15          2HG       GLU  15  11.404   1.963  10.387
  153   2HG   GLU  15          1HG       GLU  15  10.740   3.598  10.355
  154    QB   GLU  15           QB       GLU  15  10.087   2.033  12.472
  155    QG   GLU  15           QG       GLU  15  11.072   2.781  10.371
  156    H    GLY  16           H        GLY  16   8.711   3.594   9.010
  157   1HA   GLY  16          1HA       GLY  16   7.998   0.926   7.977
  158   2HA   GLY  16          2HA       GLY  16   8.457   2.324   7.005
  159    QA   GLY  16           QA       GLY  16   8.228   1.625   7.491
  160    H    GLU  17           H        GLU  17   5.881   1.777   9.437
  161    HA   GLU  17           HA       GLU  17   3.725   1.822   7.527
  162   1HB   GLU  17          2HB       GLU  17   3.916   2.315  10.513
  163   2HB   GLU  17          1HB       GLU  17   2.387   2.151   9.649
  164   1HG   GLU  17          2HG       GLU  17   2.631  -0.101   9.379
  165   2HG   GLU  17          1HG       GLU  17   4.372   0.019   9.121
  166    QB   GLU  17           QB       GLU  17   3.152   2.233  10.081
  167    QG   GLU  17           QG       GLU  17   3.502  -0.041   9.250
  168    H    ILE  18           H        ILE  18   2.693   3.569   6.616
  169    HA   ILE  18           HA       ILE  18   3.542   6.297   7.492
  170    HB   ILE  18           HB       ILE  18   2.250   5.233   4.959
  171   1HG1  ILE  18          2HG1      ILE  18   4.964   6.459   5.017
  172   2HG1  ILE  18          1HG1      ILE  18   4.808   4.852   5.726
  173   1HG2  ILE  18          2HG2      ILE  18   1.740   7.656   5.641
  174   2HG2  ILE  18          1HG2      ILE  18   3.459   7.969   5.398
  175   3HG2  ILE  18          3HG2      ILE  18   2.463   7.424   4.049
  176   1HD1  ILE  18          2HD1      ILE  18   3.649   4.115   3.614
  177   2HD1  ILE  18          1HD1      ILE  18   4.048   5.684   2.914
  178   3HD1  ILE  18          3HD1      ILE  18   5.336   4.574   3.382
  179    MG   ILE  18           QG2      ILE  18   2.554   7.683   5.029
  180    MD   ILE  18           QD1      ILE  18   4.345   4.791   3.303
  181    QG   ILE  18           QG1      ILE  18   4.886   5.655   5.371
  182    HA   PRO  19           HA       PRO  19  -0.627   6.461   9.171
  183   1HB   PRO  19          2HB       PRO  19  -0.420   8.961  10.265
  184   2HB   PRO  19          1HB       PRO  19   0.260   7.511  11.031
  185   1HG   PRO  19          2HG       PRO  19   1.618   9.626   9.442
  186   2HG   PRO  19          1HG       PRO  19   2.181   8.752  10.875
  187   1HD   PRO  19          2HD       PRO  19   2.992   8.178   8.328
  188   2HD   PRO  19          1HD       PRO  19   2.965   6.990   9.649
  189    QB   PRO  19           QB       PRO  19  -0.080   8.236  10.648
  190    QG   PRO  19           QG       PRO  19   1.899   9.189  10.158
  191    QD   PRO  19           QD       PRO  19   2.979   7.584   8.989
  192    H    ALA  20           H        ALA  20  -2.560   7.652   8.610
  193    HA   ALA  20           HA       ALA  20  -2.261   9.323   6.145
  194   1HB   ALA  20          3HB       ALA  20  -3.755   7.056   6.751
  195   2HB   ALA  20          2HB       ALA  20  -4.931   8.364   6.880
  196   3HB   ALA  20          1HB       ALA  20  -4.035   8.129   5.380
  197    MB   ALA  20           QB       ALA  20  -4.240   7.850   6.337
  198    HA   PRO  21           HA       PRO  21  -3.562  12.379   9.291
  199   1HB   PRO  21          2HB       PRO  21  -2.417  14.525   8.038
  200   2HB   PRO  21          1HB       PRO  21  -1.518  13.440   9.118
  201   1HG   PRO  21          2HG       PRO  21  -1.589  13.519   6.144
  202   2HG   PRO  21          1HG       PRO  21  -0.229  13.207   7.234
  203   1HD   PRO  21          2HD       PRO  21  -1.575  11.245   5.897
  204   2HD   PRO  21          1HD       PRO  21  -0.738  10.988   7.443
  205    QB   PRO  21           QB       PRO  21  -1.968  13.982   8.578
  206    QG   PRO  21           QG       PRO  21  -0.909  13.363   6.689
  207    QD   PRO  21           QD       PRO  21  -1.156  11.116   6.670
  208    H    LEU  22           H        LEU  22  -4.330  11.836   6.026
  209    HA   LEU  22           HA       LEU  22  -6.188  14.167   5.895
  210   1HB   LEU  22          2HB       LEU  22  -4.443  13.340   4.095
  211   2HB   LEU  22          1HB       LEU  22  -5.711  12.182   3.693
  212    HG   LEU  22           HG       LEU  22  -7.154  14.497   3.870
  213   1HD1  LEU  22          1HD1      LEU  22  -5.703  13.360   1.461
  214   2HD1  LEU  22          3HD1      LEU  22  -7.294  12.877   2.049
  215   3HD1  LEU  22          2HD1      LEU  22  -7.056  14.489   1.374
  216   1HD2  LEU  22          1HD2      LEU  22  -4.499  15.364   3.862
  217   2HD2  LEU  22          3HD2      LEU  22  -5.020  15.556   2.188
  218   3HD2  LEU  22          2HD2      LEU  22  -5.915  16.346   3.487
  219    MD1  LEU  22           QD1      LEU  22  -6.684  13.575   1.628
  220    MD2  LEU  22           QD2      LEU  22  -5.145  15.755   3.179
  221    QB   LEU  22           QB       LEU  22  -5.077  12.761   3.894
  222    QD   LEU  22           QQD      LEU  22  -5.915  14.665   2.403
  223    H    ALA  23           H        ALA  23  -6.308  11.064   7.047
  224    HA   ALA  23           HA       ALA  23  -8.070   9.529   7.398
  225   1HB   ALA  23          1HB       ALA  23  -9.710  12.003   6.768
  226   2HB   ALA  23          3HB       ALA  23 -10.206  10.634   7.763
  227   3HB   ALA  23          2HB       ALA  23  -8.928  11.713   8.322
  228    MB   ALA  23           QB       ALA  23  -9.615  11.450   7.618
  229    H    GLY  24           H        GLY  24 -10.275   8.788   6.272
  230   1HA   GLY  24          1HA       GLY  24  -9.615   8.239   3.493
  231   2HA   GLY  24          2HA       GLY  24 -10.992   9.330   3.653
  232    QA   GLY  24           QA       GLY  24 -10.304   8.784   3.573
  233    H    THR  25           H        THR  25 -11.954   7.290   2.525
  234    HA   THR  25           HA       THR  25 -13.186   5.613   4.662
  235    HB   THR  25           HB       THR  25 -14.844   5.171   2.807
  236    HG1  THR  25           HG1      THR  25 -13.558   7.267   1.440
  237   1HG2  THR  25          1HG2      THR  25 -14.749   7.218   4.504
  238   2HG2  THR  25          3HG2      THR  25 -14.543   8.136   3.013
  239   3HG2  THR  25          2HG2      THR  25 -15.977   7.136   3.243
  240    MG   THR  25           QG2      THR  25 -15.090   7.497   3.587
  241    H    VAL  26           H        VAL  26 -12.119   3.687   4.942
  242    HA   VAL  26           HA       VAL  26 -10.557   2.449   2.795
  243    HB   VAL  26           HB       VAL  26 -11.353   1.593   5.597
  244   1HG1  VAL  26          1HG1      VAL  26  -9.544   0.377   3.517
  245   2HG1  VAL  26          3HG1      VAL  26  -9.221   0.134   5.233
  246   3HG1  VAL  26          2HG1      VAL  26 -10.744  -0.417   4.538
  247   1HG2  VAL  26          3HG2      VAL  26  -8.938   2.988   4.429
  248   2HG2  VAL  26          2HG2      VAL  26  -9.994   3.550   5.725
  249   3HG2  VAL  26          1HG2      VAL  26  -8.899   2.196   6.004
  250    MG1  VAL  26           QG1      VAL  26  -9.836   0.031   4.429
  251    MG2  VAL  26           QG2      VAL  26  -9.277   2.912   5.386
  252    QG   VAL  26           QQG      VAL  26  -9.556   1.471   4.908
  253    H    SER  27           H        SER  27 -12.018   1.779   1.154
  254    HA   SER  27           HA       SER  27 -14.395   0.182   1.885
  255   1HB   SER  27          2HB       SER  27 -13.319   1.674  -0.410
  256   2HB   SER  27          1HB       SER  27 -14.125   0.176  -0.867
  257    HG   SER  27           HG       SER  27 -15.141   2.500   0.236
  258    QB   SER  27           QB       SER  27 -13.722   0.925  -0.638
  259    H    LYS  28           H        LYS  28 -11.293  -0.270   0.171
  260    HA   LYS  28           HA       LYS  28 -11.113  -3.050   0.956
  261   1HB   LYS  28          2HB       LYS  28 -12.754  -2.373  -1.276
  262   2HB   LYS  28          1HB       LYS  28 -11.318  -3.181  -1.906
  263   1HG   LYS  28          2HG       LYS  28 -12.075  -4.633   0.395
  264   2HG   LYS  28          1HG       LYS  28 -13.564  -4.327  -0.497
  265   1HD   LYS  28          2HD       LYS  28 -12.978  -5.740  -2.163
  266   2HD   LYS  28          1HD       LYS  28 -11.337  -5.095  -2.239
  267   1HE   LYS  28          2HE       LYS  28 -10.575  -6.923  -1.146
  268   2HE   LYS  28          1HE       LYS  28 -11.630  -6.542   0.229
  269   1HZ   LYS  28          1HZ       LYS  28 -13.478  -7.561  -0.952
  270   2HZ   LYS  28          3HZ       LYS  28 -12.466  -7.941  -2.259
  271   3HZ   LYS  28          2HZ       LYS  28 -12.217  -8.682  -0.750
  272    QB   LYS  28           QB       LYS  28 -12.036  -2.777  -1.591
  273    QD   LYS  28           QD       LYS  28 -12.157  -5.417  -2.201
  274    QG   LYS  28           QG       LYS  28 -12.819  -4.480  -0.051
  275    QE   LYS  28           QE       LYS  28 -11.102  -6.733  -0.459
  276    QZ   LYS  28           QZ       LYS  28 -12.720  -8.061  -1.320
  277    H    ILE  29           H        ILE  29  -9.254  -4.131  -0.302
  278    HA   ILE  29           HA       ILE  29  -7.307  -2.096  -1.326
  279    HB   ILE  29           HB       ILE  29  -6.954  -2.679   1.079
  280   1HG1  ILE  29          2HG1      ILE  29  -4.787  -3.898  -0.648
  281   2HG1  ILE  29          1HG1      ILE  29  -5.064  -2.159  -0.555
  282   1HG2  ILE  29          2HG2      ILE  29  -7.798  -5.146   0.480
  283   2HG2  ILE  29          1HG2      ILE  29  -6.066  -5.419   0.290
  284   3HG2  ILE  29          3HG2      ILE  29  -6.705  -4.845   1.830
  285   1HD1  ILE  29          1HD1      ILE  29  -4.849  -3.637   2.025
  286   2HD1  ILE  29          3HD1      ILE  29  -3.365  -3.414   1.100
  287   3HD1  ILE  29          2HD1      ILE  29  -4.303  -2.012   1.613
  288    MG   ILE  29           QG2      ILE  29  -6.856  -5.137   0.867
  289    MD   ILE  29           QD1      ILE  29  -4.173  -3.021   1.579
  290    QG   ILE  29           QG1      ILE  29  -4.926  -3.029  -0.601
  291    H    LEU  30           H        LEU  30  -6.596  -2.720  -3.328
  292    HA   LEU  30           HA       LEU  30  -7.251  -5.276  -4.490
  293   1HB   LEU  30          2HB       LEU  30  -5.682  -2.827  -5.184
  294   2HB   LEU  30          1HB       LEU  30  -5.422  -4.272  -6.163
  295    HG   LEU  30           HG       LEU  30  -8.043  -4.372  -6.224
  296   1HD1  LEU  30          2HD1      LEU  30  -8.276  -2.520  -4.549
  297   2HD1  LEU  30          1HD1      LEU  30  -7.570  -1.417  -5.731
  298   3HD1  LEU  30          3HD1      LEU  30  -9.118  -2.195  -6.066
  299   1HD2  LEU  30          2HD2      LEU  30  -6.169  -2.614  -7.769
  300   2HD2  LEU  30          1HD2      LEU  30  -7.034  -4.058  -8.295
  301   3HD2  LEU  30          3HD2      LEU  30  -7.895  -2.529  -8.118
  302    MD1  LEU  30           QD1      LEU  30  -8.321  -2.044  -5.449
  303    MD2  LEU  30           QD2      LEU  30  -7.033  -3.067  -8.061
  304    QB   LEU  30           QB       LEU  30  -5.552  -3.549  -5.674
  305    QD   LEU  30           QQD      LEU  30  -7.677  -2.556  -6.755
  306    H    VAL  31           H        VAL  31  -4.012  -3.880  -3.791
  307    HA   VAL  31           HA       VAL  31  -3.089  -6.653  -3.139
  308    HB   VAL  31           HB       VAL  31  -1.585  -4.563  -4.751
  309   1HG1  VAL  31          3HG1      VAL  31  -3.157  -6.995  -5.659
  310   2HG1  VAL  31          2HG1      VAL  31  -3.541  -5.310  -6.013
  311   3HG1  VAL  31          1HG1      VAL  31  -2.091  -6.047  -6.696
  312   1HG2  VAL  31          3HG2      VAL  31  -0.805  -6.989  -3.457
  313   2HG2  VAL  31          2HG2      VAL  31  -0.752  -7.264  -5.198
  314   3HG2  VAL  31          1HG2      VAL  31   0.174  -5.942  -4.486
  315    MG1  VAL  31           QG1      VAL  31  -2.930  -6.117  -6.123
  316    MG2  VAL  31           QG2      VAL  31  -0.461  -6.731  -4.380
  317    QG   VAL  31           QQG      VAL  31  -1.695  -6.424  -5.252
  318    H    LYS  32           H        LYS  32  -0.490  -4.484  -3.132
  319    HA   LYS  32           HA       LYS  32   0.721  -3.524  -1.353
  320   1HB   LYS  32          2HB       LYS  32  -1.408  -2.105  -1.644
  321   2HB   LYS  32          1HB       LYS  32  -2.029  -2.955  -0.229
  322   1HG   LYS  32          2HG       LYS  32  -0.684  -1.809   1.193
  323   2HG   LYS  32          1HG       LYS  32   0.706  -1.928   0.114
  324   1HD   LYS  32          2HD       LYS  32  -0.546  -0.188  -1.349
  325   2HD   LYS  32          1HD       LYS  32  -1.516   0.108   0.094
  326   1HE   LYS  32          2HE       LYS  32   0.127   1.472   0.848
  327   2HE   LYS  32          1HE       LYS  32   1.201   0.062   0.940
  328   1HZ   LYS  32          1HZ       LYS  32   1.524   0.326  -1.512
  329   2HZ   LYS  32          3HZ       LYS  32   0.730   1.822  -1.404
  330   3HZ   LYS  32          2HZ       LYS  32   2.192   1.576  -0.574
  331    QB   LYS  32           QB       LYS  32  -1.719  -2.530  -0.937
  332    QD   LYS  32           QD       LYS  32  -1.031  -0.040  -0.627
  333    QG   LYS  32           QG       LYS  32   0.011  -1.869   0.654
  334    QE   LYS  32           QE       LYS  32   0.664   0.767   0.894
  335    QZ   LYS  32           QZ       LYS  32   1.482   1.241  -1.163
  336    H    GLU  33           H        GLU  33   0.528  -6.258  -1.067
  337    HA   GLU  33           HA       GLU  33   0.761  -6.610   1.806
  338   1HB   GLU  33          2HB       GLU  33  -1.169  -8.255   1.913
  339   2HB   GLU  33          1HB       GLU  33  -1.655  -6.576   1.684
  340   1HG   GLU  33          2HG       GLU  33  -2.579  -7.026  -0.327
  341   2HG   GLU  33          1HG       GLU  33  -1.152  -7.914  -0.859
  342    QB   GLU  33           QB       GLU  33  -1.412  -7.416   1.799
  343    QG   GLU  33           QG       GLU  33  -1.865  -7.470  -0.593
  344    H    GLY  34           H        GLY  34   2.701  -7.708   1.482
  345   1HA   GLY  34          1HA       GLY  34   2.650 -10.461   0.720
  346   2HA   GLY  34          2HA       GLY  34   4.115  -9.495   0.914
  347    QA   GLY  34           QA       GLY  34   3.383  -9.978   0.817
  348    H    ASP  35           H        ASP  35   2.927  -7.545  -1.134
  349    HA   ASP  35           HA       ASP  35   3.665  -9.140  -3.565
  350   1HB   ASP  35          2HB       ASP  35   1.177  -8.014  -2.827
  351   2HB   ASP  35          1HB       ASP  35   1.821  -6.973  -4.096
  352    QB   ASP  35           QB       ASP  35   1.499  -7.493  -3.462
  353    H    THR  36           H        THR  36   5.081  -8.073  -4.956
  354    HA   THR  36           HA       THR  36   6.415  -5.672  -3.981
  355    HB   THR  36           HB       THR  36   6.591  -7.300  -6.539
  356    HG1  THR  36           HG1      THR  36   8.359  -7.192  -4.336
  357   1HG2  THR  36          1HG2      THR  36   8.407  -5.131  -5.450
  358   2HG2  THR  36          3HG2      THR  36   8.801  -6.180  -6.811
  359   3HG2  THR  36          2HG2      THR  36   7.453  -5.051  -6.930
  360    MG   THR  36           QG2      THR  36   8.220  -5.454  -6.397
  361    H    VAL  37           H        VAL  37   4.680  -4.084  -4.020
  362    HA   VAL  37           HA       VAL  37   3.125  -3.482  -6.363
  363    HB   VAL  37           HB       VAL  37   2.614  -1.430  -5.080
  364   1HG1  VAL  37          3HG1      VAL  37   1.784  -3.806  -4.430
  365   2HG1  VAL  37          2HG1      VAL  37   2.909  -3.666  -3.078
  366   3HG1  VAL  37          1HG1      VAL  37   1.589  -2.509  -3.250
  367   1HG2  VAL  37          3HG2      VAL  37   5.260  -1.891  -4.084
  368   2HG2  VAL  37          2HG2      VAL  37   4.205  -0.511  -3.779
  369   3HG2  VAL  37          1HG2      VAL  37   4.143  -1.919  -2.719
  370    MG1  VAL  37           QG1      VAL  37   2.094  -3.327  -3.586
  371    MG2  VAL  37           QG2      VAL  37   4.536  -1.440  -3.527
  372    QG   VAL  37           QQG      VAL  37   3.315  -2.384  -3.557
  373    H    LYS  38           H        LYS  38   3.406  -0.881  -6.997
  374    HA   LYS  38           HA       LYS  38   6.266  -0.331  -7.601
  375   1HB   LYS  38          2HB       LYS  38   4.973  -1.799  -9.353
  376   2HB   LYS  38          1HB       LYS  38   4.209  -0.273  -9.799
  377   1HG   LYS  38          2HG       LYS  38   6.242   0.692 -10.479
  378   2HG   LYS  38          1HG       LYS  38   7.205  -0.468  -9.561
  379   1HD   LYS  38          2HD       LYS  38   7.432  -1.217 -11.784
  380   2HD   LYS  38          1HD       LYS  38   6.157  -2.250 -11.135
  381   1HE   LYS  38          2HE       LYS  38   5.252  -1.518 -13.197
  382   2HE   LYS  38          1HE       LYS  38   4.543  -0.379 -12.033
  383   1HZ   LYS  38          3HZ       LYS  38   7.176   0.143 -13.265
  384   2HZ   LYS  38          2HZ       LYS  38   5.744   0.588 -14.063
  385   3HZ   LYS  38          1HZ       LYS  38   6.108   1.243 -12.540
  386    QB   LYS  38           QB       LYS  38   4.591  -1.036  -9.576
  387    QD   LYS  38           QD       LYS  38   6.794  -1.734 -11.459
  388    QG   LYS  38           QG       LYS  38   6.723   0.112 -10.020
  389    QE   LYS  38           QE       LYS  38   4.898  -0.949 -12.615
  390    QZ   LYS  38           QZ       LYS  38   6.343   0.658 -13.289
  391    H    ALA  39           H        ALA  39   6.594   1.916  -8.251
  392    HA   ALA  39           HA       ALA  39   4.938   3.821  -6.916
  393   1HB   ALA  39          3HB       ALA  39   7.388   3.947  -7.633
  394   2HB   ALA  39          2HB       ALA  39   6.799   4.323  -9.253
  395   3HB   ALA  39          1HB       ALA  39   6.441   5.409  -7.910
  396    MB   ALA  39           QB       ALA  39   6.876   4.560  -8.265
  397    H    GLY  40           H        GLY  40   2.749   3.592  -7.649
  398   1HA   GLY  40          1HA       GLY  40   2.298   4.551 -10.448
  399   2HA   GLY  40          2HA       GLY  40   1.231   4.944  -9.099
  400    QA   GLY  40           QA       GLY  40   1.765   4.748  -9.774
  401    H    GLN  41           H        GLN  41   1.307   2.247  -7.965
  402    HA   GLN  41           HA       GLN  41  -0.151   0.725 -10.099
  403   1HB   GLN  41          2HB       GLN  41   2.076  -0.007  -8.802
  404   2HB   GLN  41          1HB       GLN  41   0.897  -0.549  -7.607
  405   1HG   GLN  41          2HG       GLN  41  -0.149  -1.388 -10.067
  406   2HG   GLN  41          1HG       GLN  41   1.578  -1.727 -10.174
  407   1HE2  GLN  41          1HE2      GLN  41   2.525  -3.012  -8.302
  408   2HE2  GLN  41          2HE2      GLN  41   1.527  -4.131  -7.505
  409    QB   GLN  41           QB       GLN  41   1.487  -0.278  -8.205
  410    QG   GLN  41           QG       GLN  41   0.714  -1.557 -10.121
  411    QE   GLN  41           QE2      GLN  41   2.026  -3.571  -7.903
  412    H    THR  42           H        THR  42  -2.324   1.097  -9.758
  413    HA   THR  42           HA       THR  42  -3.626   1.895  -7.396
  414    HB   THR  42           HB       THR  42  -4.980  -0.043  -9.222
  415    HG1  THR  42           HG1      THR  42  -3.911   2.456 -10.033
  416   1HG2  THR  42          3HG2      THR  42  -5.613   2.251  -7.576
  417   2HG2  THR  42          2HG2      THR  42  -6.191   2.491  -9.224
  418   3HG2  THR  42          1HG2      THR  42  -6.702   1.074  -8.306
  419    MG   THR  42           QG2      THR  42  -6.169   1.939  -8.369
  420    H    VAL  43           H        VAL  43  -3.364   0.832  -5.449
  421    HA   VAL  43           HA       VAL  43  -3.829  -2.132  -5.440
  422    HB   VAL  43           HB       VAL  43  -2.095  -2.182  -3.633
  423   1HG1  VAL  43          2HG1      VAL  43  -2.392   0.181  -2.916
  424   2HG1  VAL  43          1HG1      VAL  43  -0.708  -0.187  -3.289
  425   3HG1  VAL  43          3HG1      VAL  43  -1.689   0.714  -4.443
  426   1HG2  VAL  43          1HG2      VAL  43  -1.733  -1.699  -6.448
  427   2HG2  VAL  43          3HG2      VAL  43  -0.394  -0.975  -5.558
  428   3HG2  VAL  43          2HG2      VAL  43  -0.754  -2.692  -5.368
  429    MG1  VAL  43           QG1      VAL  43  -1.596   0.236  -3.549
  430    MG2  VAL  43           QG2      VAL  43  -0.960  -1.789  -5.791
  431    QG   VAL  43           QQG      VAL  43  -1.278  -0.776  -4.670
  432    H    LEU  44           H        LEU  44  -4.902   0.874  -4.290
  433    HA   LEU  44           HA       LEU  44  -6.277  -0.484  -1.996
  434   1HB   LEU  44          2HB       LEU  44  -4.294   1.479  -1.898
  435   2HB   LEU  44          1HB       LEU  44  -5.794   2.375  -1.651
  436    HG   LEU  44           HG       LEU  44  -5.916  -0.062  -0.138
  437   1HD1  LEU  44          2HD1      LEU  44  -3.431   0.041  -0.250
  438   2HD1  LEU  44          1HD1      LEU  44  -3.490   1.666   0.431
  439   3HD1  LEU  44          3HD1      LEU  44  -4.035   0.290   1.388
  440   1HD2  LEU  44          1HD2      LEU  44  -7.058   2.206   0.193
  441   2HD2  LEU  44          3HD2      LEU  44  -6.430   1.432   1.648
  442   3HD2  LEU  44          2HD2      LEU  44  -5.536   2.753   0.896
  443    MD1  LEU  44           QD1      LEU  44  -3.652   0.666   0.523
  444    MD2  LEU  44           QD2      LEU  44  -6.341   2.130   0.913
  445    QB   LEU  44           QB       LEU  44  -5.044   1.927  -1.774
  446    QD   LEU  44           QQD      LEU  44  -4.997   1.398   0.718
  447    H    VAL  45           H        VAL  45  -8.322   0.658  -1.368
  448    HA   VAL  45           HA       VAL  45  -9.580   2.052  -3.709
  449    HB   VAL  45           HB       VAL  45 -10.742   0.072  -1.726
  450   1HG1  VAL  45          3HG1      VAL  45 -11.991   2.061  -3.359
  451   2HG1  VAL  45          2HG1      VAL  45 -12.363   0.479  -4.043
  452   3HG1  VAL  45          1HG1      VAL  45 -12.764   0.829  -2.362
  453   1HG2  VAL  45          1HG2      VAL  45  -9.654  -0.122  -4.506
  454   2HG2  VAL  45          3HG2      VAL  45  -9.549  -1.278  -3.179
  455   3HG2  VAL  45          2HG2      VAL  45 -11.051  -1.117  -4.090
  456    MG1  VAL  45           QG1      VAL  45 -12.373   1.123  -3.255
  457    MG2  VAL  45           QG2      VAL  45 -10.085  -0.839  -3.925
  458    QG   VAL  45           QQG      VAL  45 -11.229   0.142  -3.590
  459    H    LEU  46           H        LEU  46  -9.715   4.187  -3.038
  460    HA   LEU  46           HA       LEU  46 -10.889   4.682  -0.314
  461   1HB   LEU  46          2HB       LEU  46  -8.454   5.606  -1.646
  462   2HB   LEU  46          1HB       LEU  46  -9.439   6.944  -1.056
  463    HG   LEU  46           HG       LEU  46  -7.841   6.163   0.670
  464   1HD1  LEU  46          3HD1      LEU  46  -8.348   3.661  -0.315
  465   2HD1  LEU  46          2HD1      LEU  46  -7.602   3.973   1.252
  466   3HD1  LEU  46          1HD1      LEU  46  -9.334   3.658   1.148
  467   1HD2  LEU  46          1HD2      LEU  46 -10.758   6.225   0.944
  468   2HD2  LEU  46          3HD2      LEU  46  -9.970   5.296   2.220
  469   3HD2  LEU  46          2HD2      LEU  46  -9.520   6.979   1.950
  470    MD1  LEU  46           QD1      LEU  46  -8.428   3.764   0.695
  471    MD2  LEU  46           QD2      LEU  46 -10.083   6.166   1.705
  472    QB   LEU  46           QB       LEU  46  -8.947   6.275  -1.351
  473    QD   LEU  46           QQD      LEU  46  -9.255   4.965   1.200
  474    H    GLU  47           H        GLU  47 -12.318   6.542  -0.192
  475    HA   GLU  47           HA       GLU  47 -13.130   7.768  -2.788
  476   1HB   GLU  47          2HB       GLU  47 -14.479   5.719  -2.372
  477   2HB   GLU  47          1HB       GLU  47 -14.981   6.385  -0.818
  478   1HG   GLU  47          2HG       GLU  47 -16.456   7.836  -1.772
  479   2HG   GLU  47          1HG       GLU  47 -15.382   8.187  -3.127
  480    QB   GLU  47           QB       GLU  47 -14.730   6.052  -1.595
  481    QG   GLU  47           QG       GLU  47 -15.919   8.011  -2.449
  482    H    ALA  48           H        ALA  48 -11.858   9.476  -1.378
  483    HA   ALA  48           HA       ALA  48 -13.732  11.403  -0.364
  484   1HB   ALA  48          2HB       ALA  48 -12.667  11.123   2.070
  485   2HB   ALA  48          1HB       ALA  48 -14.071  10.175   1.577
  486   3HB   ALA  48          3HB       ALA  48 -12.460   9.459   1.526
  487    MB   ALA  48           QB       ALA  48 -13.066  10.252   1.724
  488    H    MET  49           H        MET  49 -12.705  13.399  -0.252
  489    HA   MET  49           HA       MET  49 -10.963  14.977  -0.481
  490   1HB   MET  49          2HB       MET  49 -10.189  12.894   1.450
  491   2HB   MET  49          1HB       MET  49  -8.823  13.793   0.791
  492   1HG   MET  49          2HG       MET  49  -9.337  15.595   2.039
  493   2HG   MET  49          1HG       MET  49 -10.979  15.613   1.400
  494   1HE   MET  49          3HE       MET  49 -10.665  16.777   3.727
  495   2HE   MET  49          2HE       MET  49 -12.328  16.229   3.930
  496   3HE   MET  49          1HE       MET  49 -11.164  15.992   5.231
  497    QB   MET  49           QB       MET  49  -9.506  13.344   1.121
  498    QG   MET  49           QG       MET  49 -10.158  15.604   1.720
  499    ME   MET  49           QE       MET  49 -11.386  16.333   4.296
  500    H    LYS  50           H        LYS  50 -10.936  14.388  -2.856
  501    HA   LYS  50           HA       LYS  50  -9.762  13.818  -4.826
  502   1HB   LYS  50          2HB       LYS  50  -8.273  15.412  -3.473
  503   2HB   LYS  50          1HB       LYS  50  -7.360  13.980  -2.997
  504   1HG   LYS  50          2HG       LYS  50  -6.185  14.606  -4.897
  505   2HG   LYS  50          1HG       LYS  50  -7.370  13.509  -5.605
  506   1HD   LYS  50          2HD       LYS  50  -8.768  15.333  -6.304
  507   2HD   LYS  50          1HD       LYS  50  -7.826  16.492  -5.367
  508   1HE   LYS  50          2HE       LYS  50  -6.063  16.498  -6.892
  509   2HE   LYS  50          1HE       LYS  50  -6.435  14.866  -7.480
  510   1HZ   LYS  50          3HZ       LYS  50  -8.257  17.183  -7.826
  511   2HZ   LYS  50          2HZ       LYS  50  -7.135  16.701  -9.007
  512   3HZ   LYS  50          1HZ       LYS  50  -8.388  15.652  -8.545
  513    QB   LYS  50           QB       LYS  50  -7.817  14.696  -3.235
  514    QD   LYS  50           QD       LYS  50  -8.297  15.913  -5.835
  515    QG   LYS  50           QG       LYS  50  -6.777  14.058  -5.251
  516    QE   LYS  50           QE       LYS  50  -6.249  15.682  -7.186
  517    QZ   LYS  50           QZ       LYS  50  -7.927  16.512  -8.459
  518    H    MET  51           H        MET  51 -10.793  11.518  -4.042
  519    HA   MET  51           HA       MET  51  -8.593   9.563  -4.430
  520   1HB   MET  51          2HB       MET  51 -10.110  10.062  -1.962
  521   2HB   MET  51          1HB       MET  51 -10.134   8.371  -2.462
  522   1HG   MET  51          2HG       MET  51  -8.031   8.115  -1.701
  523   2HG   MET  51          1HG       MET  51  -7.477   9.345  -2.835
  524   1HE   MET  51          1HE       MET  51  -7.289   8.180   0.367
  525   2HE   MET  51          3HE       MET  51  -5.853   9.089  -0.122
  526   3HE   MET  51          2HE       MET  51  -6.739   9.549   1.330
  527    QB   MET  51           QB       MET  51 -10.122   9.217  -2.212
  528    QG   MET  51           QG       MET  51  -7.754   8.730  -2.268
  529    ME   MET  51           QE       MET  51  -6.627   8.939   0.525
  530    H    GLU  52           H        GLU  52  -9.523   9.055  -6.469
  531    HA   GLU  52           HA       GLU  52 -12.382   8.371  -6.663
  532   1HB   GLU  52          2HB       GLU  52 -10.017   8.498  -8.542
  533   2HB   GLU  52          1HB       GLU  52 -11.595   7.911  -9.071
  534   1HG   GLU  52          2HG       GLU  52 -12.158  10.277  -7.684
  535   2HG   GLU  52          1HG       GLU  52 -10.711  10.646  -8.623
  536    QB   GLU  52           QB       GLU  52 -10.806   8.205  -8.806
  537    QG   GLU  52           QG       GLU  52 -11.435  10.461  -8.154
  538    H    THR  53           H        THR  53 -11.363   6.598  -4.857
  539    HA   THR  53           HA       THR  53 -11.294   4.281  -4.422
  540    HB   THR  53           HB       THR  53 -11.839   3.798  -7.341
  541    HG1  THR  53           HG1      THR  53 -13.833   4.589  -7.154
  542   1HG2  THR  53          1HG2      THR  53 -11.718   2.089  -5.305
  543   2HG2  THR  53          3HG2      THR  53 -13.375   2.638  -5.054
  544   3HG2  THR  53          2HG2      THR  53 -12.913   1.897  -6.587
  545    MG   THR  53           QG2      THR  53 -12.669   2.208  -5.649
  546    H    GLU  54           H        GLU  54 -10.054   4.542  -7.783
  547    HA   GLU  54           HA       GLU  54  -8.017   2.610  -7.518
  548   1HB   GLU  54          2HB       GLU  54  -8.679   4.917  -9.269
  549   2HB   GLU  54          1HB       GLU  54  -7.024   4.315  -9.374
  550   1HG   GLU  54          2HG       GLU  54  -7.923   2.825 -10.848
  551   2HG   GLU  54          1HG       GLU  54  -8.417   1.971  -9.386
  552    QB   GLU  54           QB       GLU  54  -7.851   4.616  -9.322
  553    QG   GLU  54           QG       GLU  54  -8.170   2.398 -10.117
  554    H    ILE  55           H        ILE  55  -6.729   2.803  -5.636
  555    HA   ILE  55           HA       ILE  55  -5.294   5.378  -5.182
  556    HB   ILE  55           HB       ILE  55  -5.731   2.845  -3.571
  557   1HG1  ILE  55          2HG1      ILE  55  -7.616   4.423  -3.661
  558   2HG1  ILE  55          1HG1      ILE  55  -6.900   4.418  -2.051
  559   1HG2  ILE  55          3HG2      ILE  55  -3.704   4.977  -3.277
  560   2HG2  ILE  55          2HG2      ILE  55  -4.633   4.637  -1.817
  561   3HG2  ILE  55          1HG2      ILE  55  -3.727   3.346  -2.605
  562   1HD1  ILE  55          1HD1      ILE  55  -5.420   6.350  -3.340
  563   2HD1  ILE  55          3HD1      ILE  55  -7.022   6.581  -4.037
  564   3HD1  ILE  55          2HD1      ILE  55  -6.800   6.670  -2.290
  565    MG   ILE  55           QG2      ILE  55  -4.021   4.320  -2.566
  566    MD   ILE  55           QD1      ILE  55  -6.414   6.534  -3.222
  567    QG   ILE  55           QG1      ILE  55  -7.258   4.420  -2.856
  568    H    ASN  56           H        ASN  56  -3.612   5.327  -6.728
  569    HA   ASN  56           HA       ASN  56  -2.051   2.973  -7.346
  570   1HB   ASN  56          2HB       ASN  56  -1.570   5.950  -7.678
  571   2HB   ASN  56          1HB       ASN  56  -0.599   4.694  -8.447
  572   1HD2  ASN  56          1HD2      ASN  56  -3.267   6.694  -8.958
  573   2HD2  ASN  56          2HD2      ASN  56  -4.021   5.807 -10.194
  574    QB   ASN  56           QB       ASN  56  -1.085   5.322  -8.062
  575    QD   ASN  56           QD2      ASN  56  -3.644   6.251  -9.576
  576    H    ALA  57           H        ALA  57  -0.318   2.143  -6.238
  577    HA   ALA  57           HA       ALA  57   0.399   2.858  -3.621
  578   1HB   ALA  57          1HB       ALA  57   1.609   1.356  -5.896
  579   2HB   ALA  57          3HB       ALA  57   2.668   1.735  -4.537
  580   3HB   ALA  57          2HB       ALA  57   1.199   0.795  -4.275
  581    MB   ALA  57           QB       ALA  57   1.825   1.295  -4.903
  582    HA   PRO  58           HA       PRO  58   2.857   6.483  -4.071
  583   1HB   PRO  58          2HB       PRO  58   4.561   6.225  -1.948
  584   2HB   PRO  58          1HB       PRO  58   2.846   6.645  -1.763
  585   1HG   PRO  58          2HG       PRO  58   4.212   4.041  -1.349
  586   2HG   PRO  58          1HG       PRO  58   2.864   4.765  -0.459
  587   1HD   PRO  58          2HD       PRO  58   2.588   2.787  -2.343
  588   2HD   PRO  58          1HD       PRO  58   1.304   3.932  -1.897
  589    QB   PRO  58           QB       PRO  58   3.703   6.435  -1.856
  590    QG   PRO  58           QG       PRO  58   3.538   4.403  -0.904
  591    QD   PRO  58           QD       PRO  58   1.946   3.359  -2.120
  592    H    THR  59           H        THR  59   4.821   3.599  -3.246
  593    HA   THR  59           HA       THR  59   6.663   4.316  -5.489
  594    HB   THR  59           HB       THR  59   8.555   3.829  -3.936
  595    HG1  THR  59           HG1      THR  59   7.962   3.760  -1.684
  596   1HG2  THR  59          1HG2      THR  59   7.415   6.147  -4.255
  597   2HG2  THR  59          3HG2      THR  59   6.796   5.889  -2.624
  598   3HG2  THR  59          2HG2      THR  59   8.535   5.939  -2.910
  599    MG   THR  59           QG2      THR  59   7.582   5.992  -3.263
  600    H    ASP  60           H        ASP  60   8.418   2.289  -5.405
  601    HA   ASP  60           HA       ASP  60   6.707  -0.132  -5.730
  602   1HB   ASP  60          2HB       ASP  60   8.621  -0.882  -7.121
  603   2HB   ASP  60          1HB       ASP  60   8.038   0.701  -7.637
  604    QB   ASP  60           QB       ASP  60   8.330  -0.091  -7.379
  605    H    GLY  61           H        GLY  61   7.398  -2.147  -4.794
  606   1HA   GLY  61          1HA       GLY  61   8.937  -1.810  -2.295
  607   2HA   GLY  61          2HA       GLY  61   9.604  -2.946  -3.467
  608    QA   GLY  61           QA       GLY  61   9.271  -2.378  -2.881
  609    H    LYS  62           H        LYS  62   9.215  -4.598  -1.780
  610    HA   LYS  62           HA       LYS  62   6.567  -5.845  -2.115
  611   1HB   LYS  62          2HB       LYS  62   9.062  -6.804  -2.031
  612   2HB   LYS  62          1HB       LYS  62   8.697  -6.902  -0.308
  613   1HG   LYS  62          2HG       LYS  62   6.449  -7.994  -1.162
  614   2HG   LYS  62          1HG       LYS  62   7.406  -8.339  -2.602
  615   1HD   LYS  62          2HD       LYS  62   8.937  -9.678  -1.416
  616   2HD   LYS  62          1HD       LYS  62   8.464  -8.998   0.141
  617   1HE   LYS  62          2HE       LYS  62   6.158 -10.039  -0.250
  618   2HE   LYS  62          1HE       LYS  62   6.905 -10.942  -1.583
  619   1HZ   LYS  62          2HZ       LYS  62   8.702 -11.534   0.066
  620   2HZ   LYS  62          1HZ       LYS  62   7.659 -10.968   1.282
  621   3HZ   LYS  62          3HZ       LYS  62   7.195 -12.281   0.314
  622    QB   LYS  62           QB       LYS  62   8.879  -6.853  -1.170
  623    QD   LYS  62           QD       LYS  62   8.701  -9.338  -0.637
  624    QG   LYS  62           QG       LYS  62   6.928  -8.166  -1.882
  625    QE   LYS  62           QE       LYS  62   6.531 -10.490  -0.917
  626    QZ   LYS  62           QZ       LYS  62   7.852 -11.594   0.554
  627    H    VAL  63           H        VAL  63   4.923  -5.407  -0.720
  628    HA   VAL  63           HA       VAL  63   5.095  -3.803   1.601
  629    HB   VAL  63           HB       VAL  63   3.183  -5.949   0.650
  630   1HG1  VAL  63          1HG1      VAL  63   3.593  -3.114   0.216
  631   2HG1  VAL  63          3HG1      VAL  63   2.504  -4.220  -0.623
  632   3HG1  VAL  63          2HG1      VAL  63   1.979  -3.417   0.857
  633   1HG2  VAL  63          1HG2      VAL  63   3.008  -4.229   3.139
  634   2HG2  VAL  63          3HG2      VAL  63   1.587  -4.942   2.376
  635   3HG2  VAL  63          2HG2      VAL  63   2.854  -5.983   3.026
  636    MG1  VAL  63           QG1      VAL  63   2.692  -3.584   0.150
  637    MG2  VAL  63           QG2      VAL  63   2.483  -5.051   2.847
  638    QG   VAL  63           QQG      VAL  63   2.587  -4.318   1.498
  639    H    GLU  64           H        GLU  64   4.916  -4.456   3.878
  640    HA   GLU  64           HA       GLU  64   6.272  -7.072   4.433
  641   1HB   GLU  64          2HB       GLU  64   6.356  -4.442   5.950
  642   2HB   GLU  64          1HB       GLU  64   7.289  -5.888   6.336
  643   1HG   GLU  64          2HG       GLU  64   7.592  -5.074   3.542
  644   2HG   GLU  64          1HG       GLU  64   8.121  -3.827   4.672
  645    QB   GLU  64           QB       GLU  64   6.823  -5.165   6.143
  646    QG   GLU  64           QG       GLU  64   7.857  -4.451   4.107
  647    H    LYS  65           H        LYS  65   3.458  -5.135   4.971
  648    HA   LYS  65           HA       LYS  65   2.089  -7.194   6.432
  649   1HB   LYS  65          2HB       LYS  65   3.959  -5.794   7.948
  650   2HB   LYS  65          1HB       LYS  65   2.437  -4.998   8.341
  651   1HG   LYS  65          2HG       LYS  65   1.441  -7.268   8.772
  652   2HG   LYS  65          1HG       LYS  65   3.053  -7.955   8.566
  653   1HD   LYS  65          2HD       LYS  65   3.892  -6.512  10.397
  654   2HD   LYS  65          1HD       LYS  65   2.265  -5.869  10.621
  655   1HE   LYS  65          2HE       LYS  65   1.515  -8.309  10.961
  656   2HE   LYS  65          1HE       LYS  65   3.242  -8.687  11.131
  657   1HZ   LYS  65          1HZ       LYS  65   1.821  -6.559  12.645
  658   2HZ   LYS  65          3HZ       LYS  65   2.184  -8.095  13.267
  659   3HZ   LYS  65          2HZ       LYS  65   3.441  -7.033  12.843
  660    QB   LYS  65           QB       LYS  65   3.198  -5.396   8.144
  661    QD   LYS  65           QD       LYS  65   3.078  -6.190  10.509
  662    QG   LYS  65           QG       LYS  65   2.247  -7.612   8.669
  663    QE   LYS  65           QE       LYS  65   2.378  -8.498  11.046
  664    QZ   LYS  65           QZ       LYS  65   2.482  -7.229  12.918
  665    H    VAL  66           H        VAL  66  -0.115  -6.634   6.753
  666    HA   VAL  66           HA       VAL  66  -0.982  -4.129   5.407
  667    HB   VAL  66           HB       VAL  66  -2.515  -6.542   6.439
  668   1HG1  VAL  66          2HG1      VAL  66  -0.815  -6.147   4.111
  669   2HG1  VAL  66          1HG1      VAL  66  -1.573  -7.627   4.700
  670   3HG1  VAL  66          3HG1      VAL  66  -2.468  -6.539   3.639
  671   1HG2  VAL  66          1HG2      VAL  66  -3.263  -4.282   4.560
  672   2HG2  VAL  66          3HG2      VAL  66  -4.245  -5.724   4.822
  673   3HG2  VAL  66          2HG2      VAL  66  -3.955  -4.600   6.151
  674    MG1  VAL  66           QG1      VAL  66  -1.618  -6.771   4.150
  675    MG2  VAL  66           QG2      VAL  66  -3.821  -4.869   5.177
  676    QG   VAL  66           QQG      VAL  66  -2.720  -5.820   4.664
  677    H    LEU  67           H        LEU  67  -2.653  -2.782   6.495
  678    HA   LEU  67           HA       LEU  67  -2.718  -3.085   9.473
  679   1HB   LEU  67          2HB       LEU  67  -1.248  -1.200   7.918
  680   2HB   LEU  67          1HB       LEU  67  -2.548  -0.321   8.723
  681    HG   LEU  67           HG       LEU  67  -0.706  -2.249  10.159
  682   1HD1  LEU  67          3HD1      LEU  67  -0.206   0.432   9.202
  683   2HD1  LEU  67          2HD1      LEU  67  -0.212   0.413  10.965
  684   3HD1  LEU  67          1HD1      LEU  67   0.878  -0.650  10.075
  685   1HD2  LEU  67          1HD2      LEU  67  -2.842  -0.282  10.973
  686   2HD2  LEU  67          3HD2      LEU  67  -2.677  -1.978  11.428
  687   3HD2  LEU  67          2HD2      LEU  67  -1.584  -0.772  12.107
  688    MD1  LEU  67           QD1      LEU  67   0.153   0.065  10.081
  689    MD2  LEU  67           QD2      LEU  67  -2.368  -1.011  11.503
  690    QB   LEU  67           QB       LEU  67  -1.898  -0.760   8.321
  691    QD   LEU  67           QQD      LEU  67  -1.107  -0.473  10.792
  692    H    VAL  68           H        VAL  68  -3.882  -0.657   7.112
  693    HA   VAL  68           HA       VAL  68  -6.307  -0.007   8.322
  694    HB   VAL  68           HB       VAL  68  -6.972   0.676   6.047
  695   1HG1  VAL  68          2HG1      VAL  68  -4.556   1.353   7.383
  696   2HG1  VAL  68          1HG1      VAL  68  -4.196   1.304   5.658
  697   3HG1  VAL  68          3HG1      VAL  68  -5.482   2.349   6.261
  698   1HG2  VAL  68          3HG2      VAL  68  -5.262  -1.565   5.354
  699   2HG2  VAL  68          2HG2      VAL  68  -6.429  -0.705   4.348
  700   3HG2  VAL  68          1HG2      VAL  68  -4.774  -0.111   4.484
  701    MG1  VAL  68           QG1      VAL  68  -4.745   1.669   6.434
  702    MG2  VAL  68           QG2      VAL  68  -5.488  -0.794   4.729
  703    QG   VAL  68           QQG      VAL  68  -5.116   0.438   5.581
  704    H    LYS  69           H        LYS  69  -8.505  -0.758   7.982
  705    HA   LYS  69           HA       LYS  69  -8.692  -3.612   7.062
  706   1HB   LYS  69          2HB       LYS  69  -9.466  -2.190   9.537
  707   2HB   LYS  69          1HB       LYS  69 -10.699  -3.280   8.898
  708   1HG   LYS  69          2HG       LYS  69  -8.639  -4.931   8.647
  709   2HG   LYS  69          1HG       LYS  69  -7.953  -3.912   9.915
  710   1HD   LYS  69          2HD       LYS  69 -10.760  -4.948  10.202
  711   2HD   LYS  69          1HD       LYS  69  -9.397  -6.002  10.584
  712   1HE   LYS  69          2HE       LYS  69  -8.555  -3.910  11.973
  713   2HE   LYS  69          1HE       LYS  69 -10.278  -3.483  11.958
  714   1HZ   LYS  69          1HZ       LYS  69  -9.182  -6.136  12.730
  715   2HZ   LYS  69          3HZ       LYS  69  -9.729  -4.958  13.821
  716   3HZ   LYS  69          2HZ       LYS  69 -10.821  -5.688  12.744
  717    QB   LYS  69           QB       LYS  69 -10.082  -2.735   9.218
  718    QD   LYS  69           QD       LYS  69 -10.078  -5.475  10.393
  719    QG   LYS  69           QG       LYS  69  -8.296  -4.422   9.281
  720    QE   LYS  69           QE       LYS  69  -9.417  -3.697  11.966
  721    QZ   LYS  69           QZ       LYS  69  -9.911  -5.594  13.098
  722    H    GLU  70           H        GLU  70 -10.607  -4.148   5.900
  723    HA   GLU  70           HA       GLU  70 -11.833  -2.040   4.361
  724   1HB   GLU  70          2HB       GLU  70 -12.615  -4.935   4.846
  725   2HB   GLU  70          1HB       GLU  70 -13.211  -3.928   3.525
  726   1HG   GLU  70          2HG       GLU  70 -11.416  -4.530   2.311
  727   2HG   GLU  70          1HG       GLU  70 -10.389  -3.706   3.484
  728    QB   GLU  70           QB       GLU  70 -12.913  -4.431   4.186
  729    QG   GLU  70           QG       GLU  70 -10.903  -4.118   2.897
  730    H    ARG  71           H        ARG  71 -12.487  -0.772   6.423
  731    HA   ARG  71           HA       ARG  71 -15.335  -0.971   6.813
  732   1HB   ARG  71          2HB       ARG  71 -13.861  -2.836   8.226
  733   2HB   ARG  71          1HB       ARG  71 -14.065  -1.541   9.406
  734   1HG   ARG  71          2HG       ARG  71 -16.382  -2.615   7.788
  735   2HG   ARG  71          1HG       ARG  71 -15.916  -3.316   9.338
  736   1HD   ARG  71          2HD       ARG  71 -16.019  -0.825  10.189
  737   2HD   ARG  71          1HD       ARG  71 -17.053  -0.591   8.766
  738    HE   ARG  71           HE       ARG  71 -18.348  -2.639   9.668
  739   1HH1  ARG  71          1HH1      ARG  71 -17.755   0.210  11.259
  740   2HH1  ARG  71          2HH1      ARG  71 -18.157  -0.363  12.843
  741   1HH2  ARG  71          1HH2      ARG  71 -18.351  -3.689  11.879
  742   2HH2  ARG  71          2HH2      ARG  71 -18.494  -2.571  13.195
  743    QB   ARG  71           QB       ARG  71 -13.963  -2.188   8.816
  744    QG   ARG  71           QG       ARG  71 -16.149  -2.965   8.563
  745    QD   ARG  71           QD       ARG  71 -16.536  -0.708   9.478
  746    QH1  ARG  71           QH1      ARG  71 -17.956  -0.076  12.051
  747    QH2  ARG  71           QH2      ARG  71 -18.423  -3.130  12.537
  748    H    ASP  72           H        ASP  72 -12.229   0.108   8.170
  749    HA   ASP  72           HA       ASP  72 -13.069   2.215   9.829
  750   1HB   ASP  72          2HB       ASP  72 -10.762   1.439   9.619
  751   2HB   ASP  72          1HB       ASP  72 -10.701   1.984   7.943
  752    QB   ASP  72           QB       ASP  72 -10.732   1.711   8.781
  753    H    ALA  73           H        ALA  73 -13.637   4.392   9.442
  754    HA   ALA  73           HA       ALA  73 -13.928   5.230   6.581
  755   1HB   ALA  73          2HB       ALA  73 -15.961   4.398   8.319
  756   2HB   ALA  73          1HB       ALA  73 -16.065   6.158   8.329
  757   3HB   ALA  73          3HB       ALA  73 -16.178   5.276   6.806
  758    MB   ALA  73           QB       ALA  73 -16.068   5.278   7.818
  759    H    VAL  74           H        VAL  74 -13.289   7.313   6.231
  760    HA   VAL  74           HA       VAL  74 -12.119   9.322   6.718
  761    HB   VAL  74           HB       VAL  74 -14.554   9.787   6.737
  762   1HG1  VAL  74          1HG1      VAL  74 -14.216   9.116   9.659
  763   2HG1  VAL  74          3HG1      VAL  74 -15.534  10.146   9.101
  764   3HG1  VAL  74          2HG1      VAL  74 -15.405   8.487   8.518
  765   1HG2  VAL  74          1HG2      VAL  74 -12.506  11.308   8.178
  766   2HG2  VAL  74          3HG2      VAL  74 -13.689  11.862   6.994
  767   3HG2  VAL  74          2HG2      VAL  74 -14.145  11.710   8.691
  768    MG1  VAL  74           QG1      VAL  74 -15.051   9.250   9.093
  769    MG2  VAL  74           QG2      VAL  74 -13.447  11.627   7.955
  770    QG   VAL  74           QQG      VAL  74 -14.249  10.438   8.524
  771    H    GLN  75           H        GLN  75 -10.877   7.362   8.259
  772    HA   GLN  75           HA       GLN  75 -10.560   8.697  10.930
  773   1HB   GLN  75          2HB       GLN  75 -11.383   6.173  10.424
  774   2HB   GLN  75          1HB       GLN  75  -9.641   5.904  10.442
  775   1HG   GLN  75          2HG       GLN  75  -9.849   5.785  12.693
  776   2HG   GLN  75          1HG       GLN  75 -10.022   7.540  12.638
  777   1HE2  GLN  75          1HE2      GLN  75 -11.548   4.761  13.754
  778   2HE2  GLN  75          2HE2      GLN  75 -13.132   5.360  13.873
  779    QB   GLN  75           QB       GLN  75 -10.512   6.039  10.433
  780    QG   GLN  75           QG       GLN  75  -9.935   6.662  12.666
  781    QE   GLN  75           QE2      GLN  75 -12.340   5.060  13.814
  782    H    GLY  76           H        GLY  76  -8.838  10.106  10.386
  783   1HA   GLY  76          1HA       GLY  76  -6.738  10.631   9.283
  784   2HA   GLY  76          2HA       GLY  76  -6.440   8.901   9.103
  785    QA   GLY  76           QA       GLY  76  -6.589   9.766   9.193
  786    H    GLY  77           H        GLY  77  -4.330   9.252  10.109
  787   1HA   GLY  77          1HA       GLY  77  -4.506   9.731  13.058
  788   2HA   GLY  77          2HA       GLY  77  -3.080  10.113  12.092
  789    QA   GLY  77           QA       GLY  77  -3.793   9.922  12.575
  790    H    GLN  78           H        GLN  78  -4.700   7.186  11.254
  791    HA   GLN  78           HA       GLN  78  -2.941   5.546  13.009
  792   1HB   GLN  78          2HB       GLN  78  -5.432   5.190  12.778
  793   2HB   GLN  78          1HB       GLN  78  -5.152   4.741  11.094
  794   1HG   GLN  78          2HG       GLN  78  -4.111   2.754  11.649
  795   2HG   GLN  78          1HG       GLN  78  -3.521   3.373  13.192
  796   1HE2  GLN  78          1HE2      GLN  78  -5.054   0.856  12.749
  797   2HE2  GLN  78          2HE2      GLN  78  -6.472   1.004  13.671
  798    QB   GLN  78           QB       GLN  78  -5.292   4.965  11.936
  799    QG   GLN  78           QG       GLN  78  -3.816   3.064  12.421
  800    QE   GLN  78           QE2      GLN  78  -5.763   0.930  13.210
  801    H    GLY  79           H        GLY  79  -1.622   3.849  12.041
  802   1HA   GLY  79          1HA       GLY  79  -0.094   3.034  10.457
  803   2HA   GLY  79          2HA       GLY  79  -0.150   4.643   9.734
  804    QA   GLY  79           QA       GLY  79  -0.122   3.839  10.096
  805    H    LEU  80           H        LEU  80  -0.021   3.414   7.659
  806    HA   LEU  80           HA       LEU  80  -2.756   2.568   6.778
  807   1HB   LEU  80          2HB       LEU  80  -0.421   3.997   5.558
  808   2HB   LEU  80          1HB       LEU  80  -1.493   3.087   4.493
  809    HG   LEU  80           HG       LEU  80  -2.645   4.984   6.524
  810   1HD1  LEU  80          1HD1      LEU  80  -3.782   3.206   4.801
  811   2HD1  LEU  80          3HD1      LEU  80  -4.581   4.680   5.350
  812   3HD1  LEU  80          2HD1      LEU  80  -3.749   4.654   3.795
  813   1HD2  LEU  80          2HD2      LEU  80  -1.374   5.642   3.869
  814   2HD2  LEU  80          1HD2      LEU  80  -2.684   6.627   4.519
  815   3HD2  LEU  80          3HD2      LEU  80  -1.175   6.464   5.417
  816    MD1  LEU  80           QD1      LEU  80  -4.037   4.180   4.648
  817    MD2  LEU  80           QD2      LEU  80  -1.744   6.244   4.602
  818    QB   LEU  80           QB       LEU  80  -0.957   3.542   5.026
  819    QD   LEU  80           QQD      LEU  80  -2.891   5.212   4.625
  820    H    ILE  81           H        ILE  81   0.568   1.938   5.603
  821    HA   ILE  81           HA       ILE  81   0.040  -0.995   5.828
  822    HB   ILE  81           HB       ILE  81   0.885   0.575   3.372
  823   1HG1  ILE  81          2HG1      ILE  81  -1.544   0.553   3.868
  824   2HG1  ILE  81          1HG1      ILE  81  -1.178  -0.372   2.411
  825   1HG2  ILE  81          3HG2      ILE  81   2.146  -1.565   3.620
  826   2HG2  ILE  81          2HG2      ILE  81   0.611  -2.427   3.714
  827   3HG2  ILE  81          1HG2      ILE  81   1.058  -1.580   2.232
  828   1HD1  ILE  81          1HD1      ILE  81  -0.933  -2.169   4.588
  829   2HD1  ILE  81          3HD1      ILE  81  -2.431  -1.273   4.841
  830   3HD1  ILE  81          2HD1      ILE  81  -2.178  -2.161   3.338
  831    MG   ILE  81           QG2      ILE  81   1.272  -1.857   3.189
  832    MD   ILE  81           QD1      ILE  81  -1.847  -1.868   4.256
  833    QG   ILE  81           QG1      ILE  81  -1.361   0.090   3.139
  834    H    LYS  82           H        LYS  82   1.966  -2.228   6.086
  835    HA   LYS  82           HA       LYS  82   4.312  -0.702   7.012
  836   1HB   LYS  82          2HB       LYS  82   3.179  -2.789   8.051
  837   2HB   LYS  82          1HB       LYS  82   4.009  -3.699   6.790
  838   1HG   LYS  82          2HG       LYS  82   5.825  -3.725   8.122
  839   2HG   LYS  82          1HG       LYS  82   5.965  -1.988   7.845
  840   1HD   LYS  82          2HD       LYS  82   5.562  -1.666  10.035
  841   2HD   LYS  82          1HD       LYS  82   3.932  -2.291   9.777
  842   1HE   LYS  82          2HE       LYS  82   4.635  -4.550  10.291
  843   2HE   LYS  82          1HE       LYS  82   6.340  -4.060  10.327
  844   1HZ   LYS  82          2HZ       LYS  82   5.666  -2.402  12.064
  845   2HZ   LYS  82          1HZ       LYS  82   4.170  -3.200  12.156
  846   3HZ   LYS  82          3HZ       LYS  82   5.595  -4.026  12.558
  847    QB   LYS  82           QB       LYS  82   3.594  -3.244   7.421
  848    QD   LYS  82           QD       LYS  82   4.747  -1.979   9.906
  849    QG   LYS  82           QG       LYS  82   5.895  -2.856   7.984
  850    QE   LYS  82           QE       LYS  82   5.488  -4.305  10.309
  851    QZ   LYS  82           QZ       LYS  82   5.144  -3.209  12.260
  852    H    ILE  83           H        ILE  83   5.170   0.147   5.011
  853    HA   ILE  83           HA       ILE  83   6.354  -1.943   3.210
  854    HB   ILE  83           HB       ILE  83   5.983  -0.301   1.390
  855   1HG1  ILE  83          2HG1      ILE  83   4.559   1.331   3.515
  856   2HG1  ILE  83          1HG1      ILE  83   6.161   1.712   2.885
  857   1HG2  ILE  83          1HG2      ILE  83   3.988  -1.720   2.857
  858   2HG2  ILE  83          3HG2      ILE  83   3.279  -0.195   2.327
  859   3HG2  ILE  83          2HG2      ILE  83   3.982  -1.299   1.145
  860   1HD1  ILE  83          3HD1      ILE  83   5.127   1.737   0.568
  861   2HD1  ILE  83          2HD1      ILE  83   3.551   1.641   1.353
  862   3HD1  ILE  83          1HD1      ILE  83   4.593   3.036   1.634
  863    MG   ILE  83           QG2      ILE  83   3.750  -1.071   2.110
  864    MD   ILE  83           QD1      ILE  83   4.424   2.138   1.185
  865    QG   ILE  83           QG1      ILE  83   5.360   1.522   3.200
  866    H    GLY  84           H        GLY  84   7.767  -0.995   5.459
  867   1HA   GLY  84          1HA       GLY  84   9.588   0.423   6.106
  868   2HA   GLY  84          2HA       GLY  84   9.535   1.177   4.512
  869    QA   GLY  84           QA       GLY  84   9.562   0.800   5.309

  No H/Q in entry =         869
  Start of MODEL   12
    1    H1   MET   1          1H        MET   1  11.147  10.443  36.568
    2    H2   MET   1          3H        MET   1  12.158  11.034  35.342
    3    H3   MET   1          2H        MET   1  10.959  12.036  36.008
    4    HA   MET   1           HA       MET   1   9.215  10.677  35.072
    5   1HB   MET   1          2HB       MET   1   9.696  11.281  32.746
    6   2HB   MET   1          1HB       MET   1  10.316  12.537  33.819
    7   1HG   MET   1          2HG       MET   1  12.397  12.231  33.021
    8   2HG   MET   1          1HG       MET   1  12.344  10.529  33.478
    9   1HE   MET   1          2HE       MET   1  12.328  13.163  31.283
   10   2HE   MET   1          1HE       MET   1  12.890  12.412  29.793
   11   3HE   MET   1          3HE       MET   1  11.186  12.847  29.982
   12    QB   MET   1           QB       MET   1  10.006  11.909  33.282
   13    QG   MET   1           QG       MET   1  12.371  11.380  33.250
   14    ME   MET   1           QE       MET   1  12.135  12.807  30.353
   15    H    LYS   2           H        LYS   2   8.816   8.955  33.331
   16    HA   LYS   2           HA       LYS   2  10.679   6.656  33.786
   17   1HB   LYS   2          2HB       LYS   2   7.814   7.079  33.817
   18   2HB   LYS   2          1HB       LYS   2   8.230   5.814  32.660
   19   1HG   LYS   2          2HG       LYS   2   9.065   4.408  34.282
   20   2HG   LYS   2          1HG       LYS   2   9.586   5.739  35.316
   21   1HD   LYS   2          2HD       LYS   2   6.657   5.484  34.880
   22   2HD   LYS   2          1HD       LYS   2   7.412   4.229  35.864
   23   1HE   LYS   2          2HE       LYS   2   7.990   7.149  36.393
   24   2HE   LYS   2          1HE       LYS   2   6.573   6.350  37.102
   25   1HZ   LYS   2          3HZ       LYS   2   8.064   4.572  37.884
   26   2HZ   LYS   2          2HZ       LYS   2   9.400   5.458  37.320
   27   3HZ   LYS   2          1HZ       LYS   2   8.437   6.075  38.576
   28    QB   LYS   2           QB       LYS   2   8.022   6.446  33.239
   29    QD   LYS   2           QD       LYS   2   7.035   4.857  35.372
   30    QG   LYS   2           QG       LYS   2   9.326   5.073  34.799
   31    QE   LYS   2           QE       LYS   2   7.282   6.749  36.747
   32    QZ   LYS   2           QZ       LYS   2   8.633   5.368  37.927
   33    H    LEU   3           H        LEU   3  11.145   5.275  31.930
   34    HA   LEU   3           HA       LEU   3  11.188   6.787  29.364
   35   1HB   LEU   3          2HB       LEU   3  13.119   5.500  30.716
   36   2HB   LEU   3          1HB       LEU   3  12.520   4.144  29.760
   37    HG   LEU   3           HG       LEU   3  12.656   5.898  27.780
   38   1HD1  LEU   3          1HD1      LEU   3  14.005   3.725  28.272
   39   2HD1  LEU   3          3HD1      LEU   3  14.692   4.897  27.149
   40   3HD1  LEU   3          2HD1      LEU   3  15.275   4.822  28.813
   41   1HD2  LEU   3          2HD2      LEU   3  14.201   7.114  30.010
   42   2HD2  LEU   3          1HD2      LEU   3  14.971   7.138  28.425
   43   3HD2  LEU   3          3HD2      LEU   3  13.391   7.890  28.648
   44    MD1  LEU   3           QD1      LEU   3  14.657   4.481  28.078
   45    MD2  LEU   3           QD2      LEU   3  14.188   7.381  29.028
   46    QB   LEU   3           QB       LEU   3  12.819   4.822  30.238
   47    QD   LEU   3           QQD      LEU   3  14.423   5.931  28.553
   48    H    LYS   4           H        LYS   4   9.793   3.942  30.864
   49    HA   LYS   4           HA       LYS   4   9.016   2.605  28.406
   50   1HB   LYS   4          2HB       LYS   4   9.147   2.065  31.129
   51   2HB   LYS   4          1HB       LYS   4   7.413   2.104  30.809
   52   1HG   LYS   4          2HG       LYS   4   7.494   0.134  29.719
   53   2HG   LYS   4          1HG       LYS   4   8.826   0.687  28.703
   54   1HD   LYS   4          2HD       LYS   4   9.356  -0.057  31.566
   55   2HD   LYS   4          1HD       LYS   4   9.209  -1.325  30.348
   56   1HE   LYS   4          2HE       LYS   4  11.243  -0.832  29.453
   57   2HE   LYS   4          1HE       LYS   4  10.921   0.913  29.492
   58   1HZ   LYS   4          3HZ       LYS   4  11.602  -0.768  31.848
   59   2HZ   LYS   4          2HZ       LYS   4  12.663   0.308  31.070
   60   3HZ   LYS   4          1HZ       LYS   4  11.290   0.899  31.877
   61    QB   LYS   4           QB       LYS   4   8.280   2.085  30.969
   62    QD   LYS   4           QD       LYS   4   9.283  -0.691  30.957
   63    QG   LYS   4           QG       LYS   4   8.160   0.410  29.211
   64    QE   LYS   4           QE       LYS   4  11.082   0.041  29.473
   65    QZ   LYS   4           QZ       LYS   4  11.852   0.146  31.598
   66    H    VAL   5           H        VAL   5   7.682   3.801  27.041
   67    HA   VAL   5           HA       VAL   5   5.086   4.735  28.201
   68    HB   VAL   5           HB       VAL   5   6.694   6.615  27.963
   69   1HG1  VAL   5          1HG1      VAL   5   7.741   5.345  25.878
   70   2HG1  VAL   5          3HG1      VAL   5   6.576   6.322  24.984
   71   3HG1  VAL   5          2HG1      VAL   5   7.801   7.104  25.984
   72   1HG2  VAL   5          1HG2      VAL   5   4.067   6.465  27.005
   73   2HG2  VAL   5          3HG2      VAL   5   4.958   7.938  27.390
   74   3HG2  VAL   5          2HG2      VAL   5   4.953   7.315  25.739
   75    MG1  VAL   5           QG1      VAL   5   7.373   6.257  25.616
   76    MG2  VAL   5           QG2      VAL   5   4.659   7.239  26.712
   77    QG   VAL   5           QQG      VAL   5   6.016   6.748  26.164
   78    H    THR   6           H        THR   6   3.361   4.059  26.976
   79    HA   THR   6           HA       THR   6   3.731   3.512  24.078
   80    HB   THR   6           HB       THR   6   2.505   1.243  24.681
   81    HG1  THR   6           HG1      THR   6   2.398   1.911  26.929
   82   1HG2  THR   6          2HG2      THR   6   5.074   1.938  24.022
   83   2HG2  THR   6          1HG2      THR   6   5.316   1.072  25.540
   84   3HG2  THR   6          3HG2      THR   6   4.499   0.278  24.194
   85    MG   THR   6           QG2      THR   6   4.963   1.096  24.585
   86    H    VAL   7           H        VAL   7   1.919   4.235  23.014
   87    HA   VAL   7           HA       VAL   7  -0.398   5.180  24.528
   88    HB   VAL   7           HB       VAL   7  -1.133   5.871  22.252
   89   1HG1  VAL   7          3HG1      VAL   7   0.998   6.826  23.699
   90   2HG1  VAL   7          2HG1      VAL   7   1.731   6.550  22.120
   91   3HG1  VAL   7          1HG1      VAL   7   0.330   7.610  22.268
   92   1HG2  VAL   7          1HG2      VAL   7   0.492   3.693  21.476
   93   2HG2  VAL   7          3HG2      VAL   7  -0.400   4.788  20.420
   94   3HG2  VAL   7          2HG2      VAL   7   1.277   5.139  20.840
   95    MG1  VAL   7           QG1      VAL   7   1.020   6.996  22.695
   96    MG2  VAL   7           QG2      VAL   7   0.456   4.540  20.912
   97    QG   VAL   7           QQG      VAL   7   0.738   5.768  21.804
   98    H    ASN   8           H        ASN   8  -2.524   4.308  24.399
   99    HA   ASN   8           HA       ASN   8  -2.637   1.440  23.577
  100   1HB   ASN   8          2HB       ASN   8  -3.319   2.739  25.881
  101   2HB   ASN   8          1HB       ASN   8  -4.870   2.721  25.043
  102   1HD2  ASN   8          1HD2      ASN   8  -4.937   1.172  27.237
  103   2HD2  ASN   8          2HD2      ASN   8  -4.768  -0.477  26.872
  104    QB   ASN   8           QB       ASN   8  -4.094   2.730  25.462
  105    QD   ASN   8           QD2      ASN   8  -4.852   0.347  27.054
  106    H    GLY   9           H        GLY   9  -2.744   3.343  21.465
  107   1HA   GLY   9          1HA       GLY   9  -5.622   3.147  20.670
  108   2HA   GLY   9          2HA       GLY   9  -4.289   2.946  19.531
  109    QA   GLY   9           QA       GLY   9  -4.955   3.046  20.100
  110    H    ALA  10           H        ALA  10  -2.727   5.150  20.712
  111    HA   ALA  10           HA       ALA  10  -4.368   7.440  19.679
  112   1HB   ALA  10          1HB       ALA  10  -3.614   6.981  22.289
  113   2HB   ALA  10          2HB       ALA  10  -3.988   8.570  21.621
  114   3HB   ALA  10          3HB       ALA  10  -2.313   8.023  21.712
  115    MB   ALA  10           QB       ALA  10  -3.305   7.858  21.874
  116    H    GLY  11           H        GLY  11  -2.644   6.003  17.996
  117   1HA   GLY  11          1HA       GLY  11  -0.551   8.050  17.492
  118   2HA   GLY  11          2HA       GLY  11  -1.145   6.879  16.313
  119    QA   GLY  11           QA       GLY  11  -0.848   7.464  16.902
  120    H    LYS  12           H        LYS  12   0.371   5.359  15.859
  121    HA   LYS  12           HA       LYS  12   2.606   4.857  17.695
  122   1HB   LYS  12          2HB       LYS  12   0.477   3.567  18.452
  123   2HB   LYS  12          1HB       LYS  12   0.783   2.542  17.049
  124   1HG   LYS  12          2HG       LYS  12   3.259   2.552  18.068
  125   2HG   LYS  12          1HG       LYS  12   2.364   2.838  19.561
  126   1HD   LYS  12          2HD       LYS  12   0.904   0.831  18.311
  127   2HD   LYS  12          1HD       LYS  12   2.579   0.395  17.970
  128   1HE   LYS  12          2HE       LYS  12   2.672   1.158  20.641
  129   2HE   LYS  12          1HE       LYS  12   1.130   0.287  20.513
  130   1HZ   LYS  12          3HZ       LYS  12   3.742  -0.675  19.468
  131   2HZ   LYS  12          2HZ       LYS  12   2.981  -1.244  20.876
  132   3HZ   LYS  12          1HZ       LYS  12   2.265  -1.501  19.357
  133    QB   LYS  12           QB       LYS  12   0.630   3.054  17.750
  134    QD   LYS  12           QD       LYS  12   1.742   0.613  18.140
  135    QG   LYS  12           QG       LYS  12   2.812   2.695  18.815
  136    QE   LYS  12           QE       LYS  12   1.901   0.722  20.577
  137    QZ   LYS  12           QZ       LYS  12   2.996  -1.140  19.900
  138    H    ALA  13           H        ALA  13   0.798   3.791  14.812
  139    HA   ALA  13           HA       ALA  13   1.575   3.014  12.721
  140   1HB   ALA  13          3HB       ALA  13   3.612   4.157  11.973
  141   2HB   ALA  13          1HB       ALA  13   4.040   4.531  13.643
  142   3HB   ALA  13          2HB       ALA  13   2.623   5.279  12.907
  143    MB   ALA  13           QB       ALA  13   3.425   4.656  12.841
  144    H    GLY  14           H        GLY  14   4.053   2.108  11.876
  145   1HA   GLY  14          1HA       GLY  14   4.536  -0.387  12.192
  146   2HA   GLY  14          2HA       GLY  14   4.768   0.016  13.894
  147    QA   GLY  14           QA       GLY  14   4.652  -0.186  13.043
  148    H    GLU  15           H        GLU  15   6.037   2.634  13.077
  149    HA   GLU  15           HA       GLU  15   8.214   3.439  12.633
  150   1HB   GLU  15          2HB       GLU  15   8.280   1.323  14.373
  151   2HB   GLU  15          1HB       GLU  15   9.387   0.769  13.116
  152   1HG   GLU  15          2HG       GLU  15  10.032   3.473  13.520
  153   2HG   GLU  15          1HG       GLU  15   9.797   2.806  15.137
  154    QB   GLU  15           QB       GLU  15   8.833   1.046  13.745
  155    QG   GLU  15           QG       GLU  15   9.914   3.140  14.329
  156    H    GLY  16           H        GLY  16   6.649   1.967  10.452
  157   1HA   GLY  16          1HA       GLY  16   8.397   0.418   8.839
  158   2HA   GLY  16          2HA       GLY  16   8.615   2.111   8.392
  159    QA   GLY  16           QA       GLY  16   8.506   1.264   8.615
  160    H    GLU  17           H        GLU  17   6.090   3.134   8.567
  161    HA   GLU  17           HA       GLU  17   4.654   1.629   6.424
  162   1HB   GLU  17          2HB       GLU  17   2.546   1.992   7.720
  163   2HB   GLU  17          1HB       GLU  17   3.698   0.974   8.586
  164   1HG   GLU  17          2HG       GLU  17   4.420   2.843   9.949
  165   2HG   GLU  17          1HG       GLU  17   3.448   3.967   8.999
  166    QB   GLU  17           QB       GLU  17   3.122   1.483   8.153
  167    QG   GLU  17           QG       GLU  17   3.934   3.405   9.474
  168    H    ILE  18           H        ILE  18   2.610   3.185   5.850
  169    HA   ILE  18           HA       ILE  18   3.688   5.980   5.646
  170    HB   ILE  18           HB       ILE  18   2.135   4.295   3.651
  171   1HG1  ILE  18          2HG1      ILE  18   4.493   5.100   2.478
  172   2HG1  ILE  18          1HG1      ILE  18   4.991   4.826   4.148
  173   1HG2  ILE  18          3HG2      ILE  18   3.214   7.124   3.455
  174   2HG2  ILE  18          2HG2      ILE  18   2.507   6.214   2.119
  175   3HG2  ILE  18          1HG2      ILE  18   1.511   6.665   3.505
  176   1HD1  ILE  18          1HD1      ILE  18   3.978   2.574   4.081
  177   2HD1  ILE  18          3HD1      ILE  18   3.493   2.844   2.407
  178   3HD1  ILE  18          2HD1      ILE  18   5.204   2.756   2.827
  179    MG   ILE  18           QG2      ILE  18   2.411   6.668   3.026
  180    MD   ILE  18           QD1      ILE  18   4.225   2.724   3.105
  181    QG   ILE  18           QG1      ILE  18   4.742   4.963   3.313
  182    HA   PRO  19           HA       PRO  19  -0.394   6.211   7.724
  183   1HB   PRO  19          2HB       PRO  19   0.205   8.442   9.192
  184   2HB   PRO  19          1HB       PRO  19   0.618   6.797   9.717
  185   1HG   PRO  19          2HG       PRO  19   2.340   8.868   8.450
  186   2HG   PRO  19          1HG       PRO  19   2.723   7.714   9.738
  187   1HD   PRO  19          2HD       PRO  19   3.489   7.374   7.146
  188   2HD   PRO  19          1HD       PRO  19   3.196   6.025   8.266
  189    QB   PRO  19           QB       PRO  19   0.411   7.620   9.455
  190    QG   PRO  19           QG       PRO  19   2.531   8.291   9.094
  191    QD   PRO  19           QD       PRO  19   3.342   6.700   7.706
  192    H    ALA  20           H        ALA  20  -2.090   7.356   6.845
  193    HA   ALA  20           HA       ALA  20  -1.570   9.330   4.760
  194   1HB   ALA  20          2HB       ALA  20  -3.819   7.800   5.922
  195   2HB   ALA  20          1HB       ALA  20  -4.267   9.366   5.245
  196   3HB   ALA  20          3HB       ALA  20  -3.465   8.165   4.234
  197    MB   ALA  20           QB       ALA  20  -3.850   8.444   5.134
  198    HA   PRO  21           HA       PRO  21  -1.714  12.860   7.424
  199   1HB   PRO  21          2HB       PRO  21  -2.240  14.784   5.550
  200   2HB   PRO  21          1HB       PRO  21  -0.645  14.026   5.733
  201   1HG   PRO  21          2HG       PRO  21  -2.781  13.479   3.737
  202   2HG   PRO  21          1HG       PRO  21  -1.024  13.511   3.530
  203   1HD   PRO  21          2HD       PRO  21  -2.479  11.211   3.755
  204   2HD   PRO  21          1HD       PRO  21  -0.772  11.348   4.228
  205    QB   PRO  21           QB       PRO  21  -1.443  14.405   5.642
  206    QG   PRO  21           QG       PRO  21  -1.902  13.495   3.634
  207    QD   PRO  21           QD       PRO  21  -1.625  11.280   3.992
  208    H    LEU  22           H        LEU  22  -4.327  12.217   5.122
  209    HA   LEU  22           HA       LEU  22  -6.232  13.596   6.988
  210   1HB   LEU  22          2HB       LEU  22  -5.893  14.597   4.714
  211   2HB   LEU  22          1HB       LEU  22  -6.458  13.085   4.005
  212    HG   LEU  22           HG       LEU  22  -8.244  14.161   6.080
  213   1HD1  LEU  22          3HD1      LEU  22  -8.340  12.418   3.884
  214   2HD1  LEU  22          2HD1      LEU  22  -9.704  12.929   4.879
  215   3HD1  LEU  22          1HD1      LEU  22  -9.313  13.806   3.400
  216   1HD2  LEU  22          2HD2      LEU  22  -7.379  15.814   3.757
  217   2HD2  LEU  22          1HD2      LEU  22  -9.109  15.757   4.093
  218   3HD2  LEU  22          3HD2      LEU  22  -7.987  16.321   5.332
  219    MD1  LEU  22           QD1      LEU  22  -9.119  13.051   4.054
  220    MD2  LEU  22           QD2      LEU  22  -8.158  15.964   4.394
  221    QB   LEU  22           QB       LEU  22  -6.176  13.841   4.360
  222    QD   LEU  22           QQD      LEU  22  -8.639  14.508   4.224
  223    H    ALA  23           H        ALA  23  -8.332  12.535   7.227
  224    HA   ALA  23           HA       ALA  23  -8.224   9.715   7.616
  225   1HB   ALA  23          2HB       ALA  23 -10.069  11.937   7.867
  226   2HB   ALA  23          3HB       ALA  23 -10.007  10.441   8.797
  227   3HB   ALA  23          1HB       ALA  23 -10.911  10.501   7.284
  228    MB   ALA  23           QB       ALA  23 -10.329  10.960   7.983
  229    H    GLY  24           H        GLY  24 -10.014   8.269   6.509
  230   1HA   GLY  24          1HA       GLY  24  -9.381   7.483   3.997
  231   2HA   GLY  24          2HA       GLY  24 -10.430   8.860   3.654
  232    QA   GLY  24           QA       GLY  24  -9.906   8.171   3.826
  233    H    THR  25           H        THR  25 -12.138   7.601   2.785
  234    HA   THR  25           HA       THR  25 -14.037   6.548   4.683
  235    HB   THR  25           HB       THR  25 -14.094   5.909   1.748
  236    HG1  THR  25           HG1      THR  25 -14.508   8.486   2.852
  237   1HG2  THR  25          2HG2      THR  25 -15.944   6.126   3.946
  238   2HG2  THR  25          1HG2      THR  25 -16.395   7.269   2.681
  239   3HG2  THR  25          3HG2      THR  25 -16.242   5.553   2.305
  240    MG   THR  25           QG2      THR  25 -16.193   6.316   2.977
  241    H    VAL  26           H        VAL  26 -14.729   4.237   2.801
  242    HA   VAL  26           HA       VAL  26 -14.041   2.007   4.185
  243    HB   VAL  26           HB       VAL  26 -14.179   0.833   1.950
  244   1HG1  VAL  26          1HG1      VAL  26 -14.082   3.703   1.002
  245   2HG1  VAL  26          3HG1      VAL  26 -13.078   2.352   0.479
  246   3HG1  VAL  26          2HG1      VAL  26 -14.782   2.410   0.030
  247   1HG2  VAL  26          1HG2      VAL  26 -16.102   2.100   3.407
  248   2HG2  VAL  26          3HG2      VAL  26 -16.310   2.882   1.840
  249   3HG2  VAL  26          2HG2      VAL  26 -16.439   1.128   1.974
  250    MG1  VAL  26           QG1      VAL  26 -13.981   2.822   0.504
  251    MG2  VAL  26           QG2      VAL  26 -16.284   2.037   2.407
  252    QG   VAL  26           QQG      VAL  26 -15.132   2.429   1.455
  253    H    SER  27           H        SER  27 -11.902   3.385   1.629
  254    HA   SER  27           HA       SER  27  -9.586   3.055   1.290
  255   1HB   SER  27          2HB       SER  27 -10.122   3.095   4.094
  256   2HB   SER  27          1HB       SER  27  -8.905   1.854   3.803
  257    HG   SER  27           HG       SER  27  -7.612   3.518   3.735
  258    QB   SER  27           QB       SER  27  -9.513   2.475   3.949
  259    H    LYS  28           H        LYS  28 -11.378   0.971   0.468
  260    HA   LYS  28           HA       LYS  28 -10.738  -1.648   1.302
  261   1HB   LYS  28          2HB       LYS  28 -11.845  -0.262  -1.055
  262   2HB   LYS  28          1HB       LYS  28 -11.147  -1.842  -1.414
  263   1HG   LYS  28          2HG       LYS  28 -12.651  -2.062   1.009
  264   2HG   LYS  28          1HG       LYS  28 -13.664  -1.272  -0.199
  265   1HD   LYS  28          2HD       LYS  28 -13.039  -3.097  -1.815
  266   2HD   LYS  28          1HD       LYS  28 -12.224  -3.923  -0.487
  267   1HE   LYS  28          2HE       LYS  28 -14.197  -4.776   0.223
  268   2HE   LYS  28          1HE       LYS  28 -14.883  -3.144   0.347
  269   1HZ   LYS  28          3HZ       LYS  28 -14.504  -4.475  -2.267
  270   2HZ   LYS  28          2HZ       LYS  28 -15.922  -4.705  -1.358
  271   3HZ   LYS  28          1HZ       LYS  28 -15.496  -3.149  -1.893
  272    QB   LYS  28           QB       LYS  28 -11.496  -1.052  -1.235
  273    QD   LYS  28           QD       LYS  28 -12.632  -3.510  -1.151
  274    QG   LYS  28           QG       LYS  28 -13.157  -1.667   0.405
  275    QE   LYS  28           QE       LYS  28 -14.540  -3.960   0.285
  276    QZ   LYS  28           QZ       LYS  28 -15.307  -4.110  -1.839
  277    H    ILE  29           H        ILE  29  -8.615  -2.300   1.554
  278    HA   ILE  29           HA       ILE  29  -6.376  -1.336   0.073
  279    HB   ILE  29           HB       ILE  29  -6.351  -2.477   2.284
  280   1HG1  ILE  29          2HG1      ILE  29  -4.743  -3.902   0.139
  281   2HG1  ILE  29          1HG1      ILE  29  -4.294  -2.380   0.912
  282   1HG2  ILE  29          1HG2      ILE  29  -8.048  -4.264   1.254
  283   2HG2  ILE  29          3HG2      ILE  29  -6.547  -5.133   0.929
  284   3HG2  ILE  29          2HG2      ILE  29  -6.966  -4.684   2.583
  285   1HD1  ILE  29          2HD1      ILE  29  -4.939  -4.435   2.875
  286   2HD1  ILE  29          1HD1      ILE  29  -3.628  -4.940   1.809
  287   3HD1  ILE  29          3HD1      ILE  29  -3.488  -3.444   2.732
  288    MG   ILE  29           QG2      ILE  29  -7.187  -4.694   1.588
  289    MD   ILE  29           QD1      ILE  29  -4.018  -4.273   2.472
  290    QG   ILE  29           QG1      ILE  29  -4.518  -3.141   0.525
  291    H    LEU  30           H        LEU  30  -5.946  -1.688  -2.063
  292    HA   LEU  30           HA       LEU  30  -7.253  -3.907  -3.508
  293   1HB   LEU  30          2HB       LEU  30  -6.421  -1.286  -4.049
  294   2HB   LEU  30          1HB       LEU  30  -5.306  -2.301  -4.965
  295    HG   LEU  30           HG       LEU  30  -7.299  -1.774  -6.312
  296   1HD1  LEU  30          2HD1      LEU  30  -8.683  -1.805  -4.002
  297   2HD1  LEU  30          1HD1      LEU  30  -9.456  -2.049  -5.568
  298   3HD1  LEU  30          3HD1      LEU  30  -9.042  -3.438  -4.562
  299   1HD2  LEU  30          1HD2      LEU  30  -7.055  -4.638  -5.352
  300   2HD2  LEU  30          3HD2      LEU  30  -8.022  -4.163  -6.749
  301   3HD2  LEU  30          2HD2      LEU  30  -6.276  -3.911  -6.758
  302    MD1  LEU  30           QD1      LEU  30  -9.061  -2.430  -4.711
  303    MD2  LEU  30           QD2      LEU  30  -7.118  -4.237  -6.286
  304    QB   LEU  30           QB       LEU  30  -5.863  -1.793  -4.507
  305    QD   LEU  30           QQD      LEU  30  -8.089  -3.334  -5.499
  306    H    VAL  31           H        VAL  31  -4.197  -3.222  -2.019
  307    HA   VAL  31           HA       VAL  31  -2.734  -5.221  -3.636
  308    HB   VAL  31           HB       VAL  31  -1.734  -3.057  -2.928
  309   1HG1  VAL  31          1HG1      VAL  31  -2.292  -4.194  -0.180
  310   2HG1  VAL  31          3HG1      VAL  31  -1.089  -2.932  -0.447
  311   3HG1  VAL  31          2HG1      VAL  31  -2.784  -2.631  -0.830
  312   1HG2  VAL  31          3HG2      VAL  31  -0.461  -5.347  -3.126
  313   2HG2  VAL  31          2HG2      VAL  31   0.368  -3.952  -2.434
  314   3HG2  VAL  31          1HG2      VAL  31  -0.302  -5.196  -1.375
  315    MG1  VAL  31           QG1      VAL  31  -2.055  -3.252  -0.486
  316    MG2  VAL  31           QG2      VAL  31  -0.132  -4.832  -2.312
  317    QG   VAL  31           QQG      VAL  31  -1.093  -4.042  -1.399
  318    H    LYS  32           H        LYS  32  -1.428  -6.882  -2.331
  319    HA   LYS  32           HA       LYS  32  -3.077  -7.948  -0.058
  320   1HB   LYS  32          2HB       LYS  32  -3.227  -9.115  -2.310
  321   2HB   LYS  32          1HB       LYS  32  -1.516  -9.509  -2.137
  322   1HG   LYS  32          2HG       LYS  32  -2.016 -10.661   0.004
  323   2HG   LYS  32          1HG       LYS  32  -3.730 -10.315  -0.227
  324   1HD   LYS  32          2HD       LYS  32  -3.324 -11.466  -2.574
  325   2HD   LYS  32          1HD       LYS  32  -1.959 -12.205  -1.736
  326   1HE   LYS  32          2HE       LYS  32  -3.315 -13.467  -0.362
  327   2HE   LYS  32          1HE       LYS  32  -4.587 -12.230  -0.313
  328   1HZ   LYS  32          3HZ       LYS  32  -3.905 -13.625  -2.827
  329   2HZ   LYS  32          2HZ       LYS  32  -5.012 -14.302  -1.729
  330   3HZ   LYS  32          1HZ       LYS  32  -5.327 -12.788  -2.433
  331    QB   LYS  32           QB       LYS  32  -2.372  -9.312  -2.224
  332    QD   LYS  32           QD       LYS  32  -2.642 -11.835  -2.155
  333    QG   LYS  32           QG       LYS  32  -2.873 -10.488  -0.111
  334    QE   LYS  32           QE       LYS  32  -3.951 -12.848  -0.338
  335    QZ   LYS  32           QZ       LYS  32  -4.748 -13.572  -2.330
  336    H    GLU  33           H        GLU  33  -1.814  -9.232   1.512
  337    HA   GLU  33           HA       GLU  33   0.714  -8.014   2.203
  338   1HB   GLU  33          2HB       GLU  33  -1.059  -9.039   3.713
  339   2HB   GLU  33          1HB       GLU  33  -0.482 -10.620   3.185
  340   1HG   GLU  33          2HG       GLU  33   1.861  -9.323   3.863
  341   2HG   GLU  33          1HG       GLU  33   0.727  -8.729   5.076
  342    QB   GLU  33           QB       GLU  33  -0.771  -9.830   3.449
  343    QG   GLU  33           QG       GLU  33   1.294  -9.026   4.470
  344    H    GLY  34           H        GLY  34   2.808  -8.819   1.906
  345   1HA   GLY  34          1HA       GLY  34   3.273 -11.517   0.882
  346   2HA   GLY  34          2HA       GLY  34   4.509 -10.293   1.176
  347    QA   GLY  34           QA       GLY  34   3.891 -10.905   1.029
  348    H    ASP  35           H        ASP  35   2.710  -8.398  -0.494
  349    HA   ASP  35           HA       ASP  35   3.360  -9.519  -3.194
  350   1HB   ASP  35          2HB       ASP  35   1.010  -8.562  -2.129
  351   2HB   ASP  35          1HB       ASP  35   1.639  -7.133  -2.949
  352    QB   ASP  35           QB       ASP  35   1.324  -7.848  -2.539
  353    H    THR  36           H        THR  36   4.363  -8.046  -4.729
  354    HA   THR  36           HA       THR  36   6.081  -6.013  -3.405
  355    HB   THR  36           HB       THR  36   6.225  -6.853  -6.290
  356    HG1  THR  36           HG1      THR  36   7.311  -8.348  -4.150
  357   1HG2  THR  36          1HG2      THR  36   7.811  -5.340  -4.515
  358   2HG2  THR  36          3HG2      THR  36   8.679  -6.855  -4.768
  359   3HG2  THR  36          2HG2      THR  36   8.232  -5.852  -6.149
  360    MG   THR  36           QG2      THR  36   8.241  -6.016  -5.144
  361    H    VAL  37           H        VAL  37   5.125  -3.998  -3.345
  362    HA   VAL  37           HA       VAL  37   3.208  -3.139  -5.394
  363    HB   VAL  37           HB       VAL  37   3.173  -1.096  -3.970
  364   1HG1  VAL  37          2HG1      VAL  37   2.863  -3.856  -2.902
  365   2HG1  VAL  37          1HG1      VAL  37   2.850  -2.551  -1.717
  366   3HG1  VAL  37          3HG1      VAL  37   1.674  -2.559  -3.031
  367   1HG2  VAL  37          2HG2      VAL  37   5.780  -1.732  -3.419
  368   2HG2  VAL  37          1HG2      VAL  37   4.811  -0.608  -2.465
  369   3HG2  VAL  37          3HG2      VAL  37   4.972  -2.288  -1.953
  370    MG1  VAL  37           QG1      VAL  37   2.462  -2.989  -2.550
  371    MG2  VAL  37           QG2      VAL  37   5.188  -1.543  -2.612
  372    QG   VAL  37           QQG      VAL  37   3.825  -2.266  -2.581
  373    H    LYS  38           H        LYS  38   3.566  -1.222  -6.742
  374    HA   LYS  38           HA       LYS  38   6.471  -0.728  -7.323
  375   1HB   LYS  38          2HB       LYS  38   5.042  -2.054  -8.974
  376   2HB   LYS  38          1HB       LYS  38   4.136  -0.564  -9.245
  377   1HG   LYS  38          2HG       LYS  38   6.250   0.582  -9.870
  378   2HG   LYS  38          1HG       LYS  38   7.116  -0.941  -9.667
  379   1HD   LYS  38          2HD       LYS  38   5.122  -1.750 -11.320
  380   2HD   LYS  38          1HD       LYS  38   5.300  -0.075 -11.846
  381   1HE   LYS  38          2HE       LYS  38   7.564  -0.384 -12.471
  382   2HE   LYS  38          1HE       LYS  38   7.712  -1.871 -11.514
  383   1HZ   LYS  38          3HZ       LYS  38   5.924  -2.817 -12.952
  384   2HZ   LYS  38          2HZ       LYS  38   6.077  -1.455 -13.957
  385   3HZ   LYS  38          1HZ       LYS  38   7.384  -2.523 -13.763
  386    QB   LYS  38           QB       LYS  38   4.589  -1.309  -9.110
  387    QD   LYS  38           QD       LYS  38   5.211  -0.912 -11.583
  388    QG   LYS  38           QG       LYS  38   6.683  -0.179  -9.768
  389    QE   LYS  38           QE       LYS  38   7.638  -1.128 -11.993
  390    QZ   LYS  38           QZ       LYS  38   6.462  -2.265 -13.557
  391    H    ALA  39           H        ALA  39   6.933   1.465  -8.167
  392    HA   ALA  39           HA       ALA  39   5.628   3.548  -6.656
  393   1HB   ALA  39          2HB       ALA  39   8.039   3.324  -7.586
  394   2HB   ALA  39          1HB       ALA  39   7.360   3.918  -9.102
  395   3HB   ALA  39          3HB       ALA  39   7.288   4.919  -7.651
  396    MB   ALA  39           QB       ALA  39   7.563   4.054  -8.113
  397    H    GLY  40           H        GLY  40   3.427   3.779  -7.222
  398   1HA   GLY  40          1HA       GLY  40   2.941   4.676 -10.034
  399   2HA   GLY  40          2HA       GLY  40   2.016   5.239  -8.641
  400    QA   GLY  40           QA       GLY  40   2.479   4.957  -9.338
  401    H    GLN  41           H        GLN  41   1.441   2.859  -7.350
  402    HA   GLN  41           HA       GLN  41  -0.313   1.496  -9.360
  403   1HB   GLN  41          2HB       GLN  41   1.899   0.320  -8.655
  404   2HB   GLN  41          1HB       GLN  41   1.096   0.061  -7.106
  405   1HG   GLN  41          2HG       GLN  41  -0.789  -1.044  -8.293
  406   2HG   GLN  41          1HG       GLN  41   0.079  -0.844  -9.816
  407   1HE2  GLN  41          1HE2      GLN  41   1.330  -1.800  -6.575
  408   2HE2  GLN  41          2HE2      GLN  41   1.971  -3.282  -7.096
  409    QB   GLN  41           QB       GLN  41   1.498   0.191  -7.880
  410    QG   GLN  41           QG       GLN  41  -0.355  -0.944  -9.054
  411    QE   GLN  41           QE2      GLN  41   1.650  -2.541  -6.836
  412    H    THR  42           H        THR  42  -2.374   1.961  -8.656
  413    HA   THR  42           HA       THR  42  -3.105   2.896  -6.100
  414    HB   THR  42           HB       THR  42  -4.439   2.993  -8.207
  415    HG1  THR  42           HG1      THR  42  -5.836   1.656  -6.141
  416   1HG2  THR  42          2HG2      THR  42  -3.924   0.461  -8.633
  417   2HG2  THR  42          1HG2      THR  42  -5.359   0.194  -7.644
  418   3HG2  THR  42          3HG2      THR  42  -5.479   1.123  -9.138
  419    MG   THR  42           QG2      THR  42  -4.921   0.593  -8.471
  420    H    VAL  43           H        VAL  43  -2.509   1.751  -4.278
  421    HA   VAL  43           HA       VAL  43  -3.075  -1.181  -4.200
  422    HB   VAL  43           HB       VAL  43  -1.548  -1.071  -2.215
  423   1HG1  VAL  43          1HG1      VAL  43  -2.249   1.505  -1.997
  424   2HG1  VAL  43          3HG1      VAL  43  -0.698   0.912  -1.402
  425   3HG1  VAL  43          2HG1      VAL  43  -0.792   1.716  -2.968
  426   1HG2  VAL  43          2HG2      VAL  43  -0.917  -0.620  -4.978
  427   2HG2  VAL  43          1HG2      VAL  43   0.243   0.259  -3.983
  428   3HG2  VAL  43          3HG2      VAL  43   0.031  -1.478  -3.765
  429    MG1  VAL  43           QG1      VAL  43  -1.246   1.378  -2.122
  430    MG2  VAL  43           QG2      VAL  43  -0.215  -0.613  -4.242
  431    QG   VAL  43           QQG      VAL  43  -0.730   0.382  -3.182
  432    H    LEU  44           H        LEU  44  -4.611   1.670  -3.409
  433    HA   LEU  44           HA       LEU  44  -6.253   0.280  -1.350
  434   1HB   LEU  44          2HB       LEU  44  -4.186   1.910  -0.615
  435   2HB   LEU  44          1HB       LEU  44  -5.511   3.072  -0.699
  436    HG   LEU  44           HG       LEU  44  -6.270   0.562   0.613
  437   1HD1  LEU  44          2HD1      LEU  44  -3.705   1.328   1.199
  438   2HD1  LEU  44          1HD1      LEU  44  -4.622   2.231   2.405
  439   3HD1  LEU  44          3HD1      LEU  44  -4.767   0.475   2.319
  440   1HD2  LEU  44          2HD2      LEU  44  -7.572   2.711   0.557
  441   2HD2  LEU  44          1HD2      LEU  44  -7.278   2.112   2.189
  442   3HD2  LEU  44          3HD2      LEU  44  -6.316   3.445   1.553
  443    MD1  LEU  44           QD1      LEU  44  -4.365   1.345   1.974
  444    MD2  LEU  44           QD2      LEU  44  -7.055   2.756   1.433
  445    QB   LEU  44           QB       LEU  44  -4.849   2.491  -0.657
  446    QD   LEU  44           QQD      LEU  44  -5.710   2.050   1.704
  447    H    VAL  45           H        VAL  45  -8.355   1.317  -1.066
  448    HA   VAL  45           HA       VAL  45  -9.072   3.172  -3.315
  449    HB   VAL  45           HB       VAL  45 -10.611   0.952  -1.934
  450   1HG1  VAL  45          3HG1      VAL  45  -8.861   0.231  -3.543
  451   2HG1  VAL  45          2HG1      VAL  45 -10.484  -0.144  -4.124
  452   3HG1  VAL  45          1HG1      VAL  45  -9.609   1.239  -4.783
  453   1HG2  VAL  45          3HG2      VAL  45 -11.561   3.271  -3.317
  454   2HG2  VAL  45          2HG2      VAL  45 -11.862   1.862  -4.334
  455   3HG2  VAL  45          1HG2      VAL  45 -12.499   1.916  -2.690
  456    MG1  VAL  45           QG1      VAL  45  -9.651   0.442  -4.150
  457    MG2  VAL  45           QG2      VAL  45 -11.974   2.350  -3.447
  458    QG   VAL  45           QQG      VAL  45 -10.813   1.396  -3.798
  459    H    LEU  46           H        LEU  46  -9.026   5.152  -2.187
  460    HA   LEU  46           HA       LEU  46 -10.588   5.330   0.357
  461   1HB   LEU  46          2HB       LEU  46  -8.262   6.064   0.430
  462   2HB   LEU  46          1HB       LEU  46  -8.517   7.111  -0.966
  463    HG   LEU  46           HG       LEU  46 -10.305   7.491   1.398
  464   1HD1  LEU  46          2HD1      LEU  46  -9.313   8.983  -0.955
  465   2HD1  LEU  46          1HD1      LEU  46 -10.867   9.091  -0.127
  466   3HD1  LEU  46          3HD1      LEU  46  -9.461   9.937   0.522
  467   1HD2  LEU  46          2HD2      LEU  46  -7.400   8.350   1.259
  468   2HD2  LEU  46          1HD2      LEU  46  -8.577   9.052   2.371
  469   3HD2  LEU  46          3HD2      LEU  46  -8.152   7.345   2.497
  470    MD1  LEU  46           QD1      LEU  46  -9.881   9.337  -0.187
  471    MD2  LEU  46           QD2      LEU  46  -8.043   8.249   2.042
  472    QB   LEU  46           QB       LEU  46  -8.389   6.588  -0.268
  473    QD   LEU  46           QQD      LEU  46  -8.962   8.793   0.928
  474    H    GLU  47           H        GLU  47 -12.209   6.974   0.551
  475    HA   GLU  47           HA       GLU  47 -13.098   8.194  -2.046
  476   1HB   GLU  47          2HB       GLU  47 -14.325   6.259  -0.403
  477   2HB   GLU  47          1HB       GLU  47 -15.199   7.758  -0.086
  478   1HG   GLU  47          2HG       GLU  47 -15.662   8.065  -2.439
  479   2HG   GLU  47          1HG       GLU  47 -14.617   6.709  -2.868
  480    QB   GLU  47           QB       GLU  47 -14.762   7.009  -0.244
  481    QG   GLU  47           QG       GLU  47 -15.140   7.387  -2.654
  482    H    ALA  48           H        ALA  48 -14.270  10.269  -1.762
  483    HA   ALA  48           HA       ALA  48 -14.470  11.591   0.793
  484   1HB   ALA  48          2HB       ALA  48 -12.027  11.456   0.648
  485   2HB   ALA  48          1HB       ALA  48 -12.061  12.202  -0.950
  486   3HB   ALA  48          3HB       ALA  48 -12.532  13.135   0.470
  487    MB   ALA  48           QB       ALA  48 -12.207  12.264   0.056
  488    H    MET  49           H        MET  49 -13.321  12.802  -2.381
  489    HA   MET  49           HA       MET  49 -15.410  14.864  -2.394
  490   1HB   MET  49          2HB       MET  49 -13.308  14.029  -4.418
  491   2HB   MET  49          1HB       MET  49 -14.239  15.524  -4.475
  492   1HG   MET  49          2HG       MET  49 -12.647  16.473  -3.194
  493   2HG   MET  49          1HG       MET  49 -13.178  15.429  -1.875
  494   1HE   MET  49          2HE       MET  49 -10.731  16.906  -2.887
  495   2HE   MET  49          1HE       MET  49  -9.595  15.977  -1.911
  496   3HE   MET  49          3HE       MET  49  -9.443  15.996  -3.673
  497    QB   MET  49           QB       MET  49 -13.773  14.776  -4.447
  498    QG   MET  49           QG       MET  49 -12.912  15.951  -2.535
  499    ME   MET  49           QE       MET  49  -9.923  16.293  -2.824
  500    H    LYS  50           H        LYS  50 -16.781  12.480  -2.395
  501    HA   LYS  50           HA       LYS  50 -18.339  11.185  -3.624
  502   1HB   LYS  50          2HB       LYS  50 -18.206  13.933  -4.802
  503   2HB   LYS  50          1HB       LYS  50 -19.182  12.723  -5.637
  504   1HG   LYS  50          2HG       LYS  50 -20.637  12.455  -3.825
  505   2HG   LYS  50          1HG       LYS  50 -19.466  13.085  -2.666
  506   1HD   LYS  50          2HD       LYS  50 -19.672  15.327  -3.851
  507   2HD   LYS  50          1HD       LYS  50 -21.047  14.645  -4.721
  508   1HE   LYS  50          2HE       LYS  50 -21.298  14.102  -1.881
  509   2HE   LYS  50          1HE       LYS  50 -21.122  15.843  -2.176
  510   1HZ   LYS  50          2HZ       LYS  50 -22.793  15.665  -3.932
  511   2HZ   LYS  50          1HZ       LYS  50 -23.001  14.015  -3.579
  512   3HZ   LYS  50          3HZ       LYS  50 -23.429  15.187  -2.430
  513    QB   LYS  50           QB       LYS  50 -18.694  13.328  -5.220
  514    QD   LYS  50           QD       LYS  50 -20.360  14.986  -4.286
  515    QG   LYS  50           QG       LYS  50 -20.052  12.770  -3.245
  516    QE   LYS  50           QE       LYS  50 -21.210  14.973  -2.029
  517    QZ   LYS  50           QZ       LYS  50 -23.074  14.956  -3.314
  518    H    MET  51           H        MET  51 -15.548  10.704  -4.318
  519    HA   MET  51           HA       MET  51 -15.958   9.480  -6.959
  520   1HB   MET  51          2HB       MET  51 -15.085  12.080  -6.873
  521   2HB   MET  51          1HB       MET  51 -13.556  11.200  -6.892
  522   1HG   MET  51          2HG       MET  51 -15.204   9.898  -8.773
  523   2HG   MET  51          1HG       MET  51 -15.437  11.623  -9.053
  524   1HE   MET  51          2HE       MET  51 -14.812  11.343 -11.151
  525   2HE   MET  51          1HE       MET  51 -13.608  12.628 -11.117
  526   3HE   MET  51          3HE       MET  51 -13.218  11.063 -11.844
  527    QB   MET  51           QB       MET  51 -14.321  11.640  -6.882
  528    QG   MET  51           QG       MET  51 -15.321  10.761  -8.913
  529    ME   MET  51           QE       MET  51 -13.880  11.678 -11.371
  530    H    GLU  52           H        GLU  52 -14.749   7.613  -7.050
  531    HA   GLU  52           HA       GLU  52 -13.291   6.625  -4.826
  532   1HB   GLU  52          2HB       GLU  52 -13.987   5.888  -7.548
  533   2HB   GLU  52          1HB       GLU  52 -12.356   5.345  -7.154
  534   1HG   GLU  52          2HG       GLU  52 -13.620   3.559  -6.359
  535   2HG   GLU  52          1HG       GLU  52 -13.487   4.551  -4.907
  536    QB   GLU  52           QB       GLU  52 -13.172   5.617  -7.351
  537    QG   GLU  52           QG       GLU  52 -13.554   4.055  -5.633
  538    H    THR  53           H        THR  53 -11.229   7.060  -4.141
  539    HA   THR  53           HA       THR  53  -9.438   8.623  -5.949
  540    HB   THR  53           HB       THR  53  -9.436   8.105  -2.957
  541    HG1  THR  53           HG1      THR  53 -10.617   9.830  -2.853
  542   1HG2  THR  53          3HG2      THR  53  -7.183   8.554  -4.073
  543   2HG2  THR  53          2HG2      THR  53  -7.815  10.148  -4.485
  544   3HG2  THR  53          1HG2      THR  53  -7.647   9.676  -2.795
  545    MG   THR  53           QG2      THR  53  -7.548   9.459  -3.784
  546    H    GLU  54           H        GLU  54  -8.173   7.188  -7.118
  547    HA   GLU  54           HA       GLU  54  -7.412   4.565  -6.237
  548   1HB   GLU  54          2HB       GLU  54  -5.863   4.742  -8.186
  549   2HB   GLU  54          1HB       GLU  54  -7.493   5.286  -8.581
  550   1HG   GLU  54          2HG       GLU  54  -6.357   7.607  -7.670
  551   2HG   GLU  54          1HG       GLU  54  -4.978   6.824  -8.445
  552    QB   GLU  54           QB       GLU  54  -6.678   5.014  -8.384
  553    QG   GLU  54           QG       GLU  54  -5.667   7.215  -8.058
  554    H    ILE  55           H        ILE  55  -6.280   4.460  -4.289
  555    HA   ILE  55           HA       ILE  55  -4.212   6.388  -3.569
  556    HB   ILE  55           HB       ILE  55  -4.930   3.664  -2.441
  557   1HG1  ILE  55          2HG1      ILE  55  -6.878   5.178  -2.534
  558   2HG1  ILE  55          1HG1      ILE  55  -6.346   4.949  -0.868
  559   1HG2  ILE  55          3HG2      ILE  55  -3.118   5.871  -1.612
  560   2HG2  ILE  55          2HG2      ILE  55  -4.097   5.141  -0.339
  561   3HG2  ILE  55          1HG2      ILE  55  -3.002   4.140  -1.293
  562   1HD1  ILE  55          3HD1      ILE  55  -4.854   7.129  -1.892
  563   2HD1  ILE  55          2HD1      ILE  55  -6.529   7.398  -2.373
  564   3HD1  ILE  55          1HD1      ILE  55  -6.124   7.178  -0.670
  565    MG   ILE  55           QG2      ILE  55  -3.406   5.051  -1.081
  566    MD   ILE  55           QD1      ILE  55  -5.836   7.235  -1.645
  567    QG   ILE  55           QG1      ILE  55  -6.612   5.064  -1.701
  568    H    ASN  56           H        ASN  56  -2.600   6.263  -5.210
  569    HA   ASN  56           HA       ASN  56  -1.411   3.738  -6.053
  570   1HB   ASN  56          2HB       ASN  56  -0.564   6.638  -6.343
  571   2HB   ASN  56          1HB       ASN  56   0.116   5.287  -7.250
  572   1HD2  ASN  56          1HD2      ASN  56  -1.162   7.396  -8.646
  573   2HD2  ASN  56          2HD2      ASN  56  -2.617   6.822  -9.307
  574    QB   ASN  56           QB       ASN  56  -0.224   5.963  -6.796
  575    QD   ASN  56           QD2      ASN  56  -1.889   7.109  -8.977
  576    H    ALA  57           H        ALA  57   0.311   2.705  -5.130
  577    HA   ALA  57           HA       ALA  57   1.290   3.197  -2.549
  578   1HB   ALA  57          1HB       ALA  57   1.966   1.611  -4.907
  579   2HB   ALA  57          3HB       ALA  57   3.397   2.031  -3.966
  580   3HB   ALA  57          2HB       ALA  57   2.061   1.168  -3.204
  581    MB   ALA  57           QB       ALA  57   2.475   1.603  -4.025
  582    HA   PRO  58           HA       PRO  58   4.207   6.471  -2.921
  583   1HB   PRO  58          2HB       PRO  58   6.276   5.666  -1.331
  584   2HB   PRO  58          1HB       PRO  58   4.705   6.175  -0.684
  585   1HG   PRO  58          2HG       PRO  58   5.818   3.449  -1.018
  586   2HG   PRO  58          1HG       PRO  58   4.739   4.086   0.231
  587   1HD   PRO  58          2HD       PRO  58   3.948   2.527  -1.914
  588   2HD   PRO  58          1HD       PRO  58   2.877   3.574  -0.960
  589    QB   PRO  58           QB       PRO  58   5.490   5.920  -1.007
  590    QG   PRO  58           QG       PRO  58   5.279   3.768  -0.394
  591    QD   PRO  58           QD       PRO  58   3.412   3.050  -1.437
  592    H    THR  59           H        THR  59   6.071   3.397  -2.981
  593    HA   THR  59           HA       THR  59   7.238   4.158  -5.596
  594    HB   THR  59           HB       THR  59   9.547   3.662  -4.401
  595    HG1  THR  59           HG1      THR  59   9.534   3.951  -2.280
  596   1HG2  THR  59          2HG2      THR  59   8.237   5.936  -5.212
  597   2HG2  THR  59          1HG2      THR  59   8.581   6.298  -3.521
  598   3HG2  THR  59          3HG2      THR  59   9.898   5.891  -4.621
  599    MG   THR  59           QG2      THR  59   8.905   6.042  -4.452
  600    H    ASP  60           H        ASP  60   9.254   2.278  -5.726
  601    HA   ASP  60           HA       ASP  60   7.756  -0.218  -5.965
  602   1HB   ASP  60          2HB       ASP  60   9.487   0.647  -7.560
  603   2HB   ASP  60          1HB       ASP  60  10.708   0.398  -6.311
  604    QB   ASP  60           QB       ASP  60  10.098   0.522  -6.936
  605    H    GLY  61           H        GLY  61   7.561  -1.691  -4.335
  606   1HA   GLY  61          1HA       GLY  61   8.678  -1.454  -1.764
  607   2HA   GLY  61          2HA       GLY  61   9.761  -2.507  -2.676
  608    QA   GLY  61           QA       GLY  61   9.219  -1.980  -2.220
  609    H    LYS  62           H        LYS  62   8.379  -3.533  -0.482
  610    HA   LYS  62           HA       LYS  62   6.161  -5.124  -1.714
  611   1HB   LYS  62          2HB       LYS  62   8.574  -6.146  -1.565
  612   2HB   LYS  62          1HB       LYS  62   8.193  -6.329   0.149
  613   1HG   LYS  62          2HG       LYS  62   6.057  -7.499  -0.552
  614   2HG   LYS  62          1HG       LYS  62   6.682  -7.496  -2.201
  615   1HD   LYS  62          2HD       LYS  62   7.721  -9.432  -1.680
  616   2HD   LYS  62          1HD       LYS  62   8.812  -8.463  -0.687
  617   1HE   LYS  62          2HE       LYS  62   6.955  -8.676   1.145
  618   2HE   LYS  62          1HE       LYS  62   6.396 -10.051   0.170
  619   1HZ   LYS  62          2HZ       LYS  62   8.796 -10.772   0.132
  620   2HZ   LYS  62          1HZ       LYS  62   9.079  -9.635   1.363
  621   3HZ   LYS  62          3HZ       LYS  62   8.009 -10.924   1.630
  622    QB   LYS  62           QB       LYS  62   8.383  -6.238  -0.708
  623    QD   LYS  62           QD       LYS  62   8.266  -8.948  -1.183
  624    QG   LYS  62           QG       LYS  62   6.370  -7.497  -1.376
  625    QE   LYS  62           QE       LYS  62   6.675  -9.363   0.658
  626    QZ   LYS  62           QZ       LYS  62   8.628 -10.444   1.041
  627    H    VAL  63           H        VAL  63   4.605  -5.922  -0.178
  628    HA   VAL  63           HA       VAL  63   4.276  -4.195   2.165
  629    HB   VAL  63           HB       VAL  63   2.737  -6.455   0.867
  630   1HG1  VAL  63          3HG1      VAL  63   2.631  -3.477   0.974
  631   2HG1  VAL  63          2HG1      VAL  63   2.321  -4.563  -0.382
  632   3HG1  VAL  63          1HG1      VAL  63   1.099  -4.344   0.871
  633   1HG2  VAL  63          1HG2      VAL  63   2.145  -4.984   3.447
  634   2HG2  VAL  63          3HG2      VAL  63   0.878  -5.752   2.490
  635   3HG2  VAL  63          2HG2      VAL  63   2.178  -6.727   3.176
  636    MG1  VAL  63           QG1      VAL  63   2.017  -4.128   0.488
  637    MG2  VAL  63           QG2      VAL  63   1.734  -5.821   3.038
  638    QG   VAL  63           QQG      VAL  63   1.875  -4.974   1.763
  639    H    GLU  64           H        GLU  64   5.050  -4.666   4.159
  640    HA   GLU  64           HA       GLU  64   6.179  -7.338   4.725
  641   1HB   GLU  64          2HB       GLU  64   6.203  -4.585   5.920
  642   2HB   GLU  64          1HB       GLU  64   6.634  -5.952   6.947
  643   1HG   GLU  64          2HG       GLU  64   7.896  -5.456   4.240
  644   2HG   GLU  64          1HG       GLU  64   8.588  -4.866   5.751
  645    QB   GLU  64           QB       GLU  64   6.419  -5.269   6.433
  646    QG   GLU  64           QG       GLU  64   8.242  -5.161   4.995
  647    H    LYS  65           H        LYS  65   3.223  -5.633   5.207
  648    HA   LYS  65           HA       LYS  65   1.902  -7.819   6.494
  649   1HB   LYS  65          2HB       LYS  65   3.554  -6.164   8.167
  650   2HB   LYS  65          1HB       LYS  65   1.868  -5.914   8.620
  651   1HG   LYS  65          2HG       LYS  65   2.646  -8.729   8.128
  652   2HG   LYS  65          1HG       LYS  65   3.377  -7.978   9.547
  653   1HD   LYS  65          2HD       LYS  65   0.955  -7.150  10.057
  654   2HD   LYS  65          1HD       LYS  65   0.461  -8.424   8.942
  655   1HE   LYS  65          2HE       LYS  65   1.900 -10.023  10.335
  656   2HE   LYS  65          1HE       LYS  65   1.984  -8.725  11.544
  657   1HZ   LYS  65          1HZ       LYS  65  -0.505  -8.580  11.309
  658   2HZ   LYS  65          3HZ       LYS  65  -0.439 -10.050  10.464
  659   3HZ   LYS  65          2HZ       LYS  65   0.076  -9.977  12.082
  660    QB   LYS  65           QB       LYS  65   2.711  -6.039   8.394
  661    QD   LYS  65           QD       LYS  65   0.708  -7.787   9.500
  662    QG   LYS  65           QG       LYS  65   3.011  -8.354   8.837
  663    QE   LYS  65           QE       LYS  65   1.942  -9.374  10.940
  664    QZ   LYS  65           QZ       LYS  65  -0.289  -9.536  11.285
  665    H    VAL  66           H        VAL  66  -0.314  -7.070   7.337
  666    HA   VAL  66           HA       VAL  66  -1.290  -4.869   5.591
  667    HB   VAL  66           HB       VAL  66  -2.695  -6.996   7.242
  668   1HG1  VAL  66          3HG1      VAL  66  -1.575  -6.888   4.485
  669   2HG1  VAL  66          2HG1      VAL  66  -1.764  -8.266   5.569
  670   3HG1  VAL  66          1HG1      VAL  66  -3.152  -7.657   4.668
  671   1HG2  VAL  66          2HG2      VAL  66  -3.715  -4.621   6.165
  672   2HG2  VAL  66          1HG2      VAL  66  -4.151  -5.863   4.992
  673   3HG2  VAL  66          3HG2      VAL  66  -4.650  -6.025   6.675
  674    MG1  VAL  66           QG1      VAL  66  -2.164  -7.604   4.907
  675    MG2  VAL  66           QG2      VAL  66  -4.172  -5.503   5.944
  676    QG   VAL  66           QQG      VAL  66  -3.168  -6.553   5.426
  677    H    LEU  67           H        LEU  67  -2.357  -3.050   6.446
  678    HA   LEU  67           HA       LEU  67  -2.406  -2.804   9.436
  679   1HB   LEU  67          2HB       LEU  67  -0.895  -1.383   7.421
  680   2HB   LEU  67          1HB       LEU  67  -1.968  -0.265   8.263
  681    HG   LEU  67           HG       LEU  67  -0.427  -2.237   9.901
  682   1HD1  LEU  67          1HD1      LEU  67   1.189  -1.225   8.248
  683   2HD1  LEU  67          3HD1      LEU  67   0.759   0.362   8.885
  684   3HD1  LEU  67          2HD1      LEU  67   1.540  -0.826   9.929
  685   1HD2  LEU  67          1HD2      LEU  67  -1.620   0.504  10.188
  686   2HD2  LEU  67          3HD2      LEU  67  -1.816  -0.910  11.223
  687   3HD2  LEU  67          2HD2      LEU  67  -0.316   0.015  11.269
  688    MD1  LEU  67           QD1      LEU  67   1.163  -0.563   9.021
  689    MD2  LEU  67           QD2      LEU  67  -1.251  -0.131  10.893
  690    QB   LEU  67           QB       LEU  67  -1.431  -0.824   7.842
  691    QD   LEU  67           QQD      LEU  67  -0.044  -0.347   9.957
  692    H    VAL  68           H        VAL  68  -3.557  -1.244   6.415
  693    HA   VAL  68           HA       VAL  68  -5.729   0.204   7.466
  694    HB   VAL  68           HB       VAL  68  -4.838   0.306   5.153
  695   1HG1  VAL  68          2HG1      VAL  68  -7.500   0.511   5.953
  696   2HG1  VAL  68          1HG1      VAL  68  -6.822   1.123   4.444
  697   3HG1  VAL  68          3HG1      VAL  68  -7.574  -0.472   4.491
  698   1HG2  VAL  68          3HG2      VAL  68  -4.570  -2.205   4.968
  699   2HG2  VAL  68          2HG2      VAL  68  -6.313  -2.304   4.714
  700   3HG2  VAL  68          1HG2      VAL  68  -5.302  -1.441   3.556
  701    MG1  VAL  68           QG1      VAL  68  -7.299   0.387   4.963
  702    MG2  VAL  68           QG2      VAL  68  -5.395  -1.983   4.412
  703    QG   VAL  68           QQG      VAL  68  -6.347  -0.798   4.688
  704    H    LYS  69           H        LYS  69  -8.006  -0.331   7.631
  705    HA   LYS  69           HA       LYS  69  -8.486  -3.164   8.373
  706   1HB   LYS  69          2HB       LYS  69 -10.191  -0.666   8.634
  707   2HB   LYS  69          1HB       LYS  69 -10.486  -2.211   9.431
  708   1HG   LYS  69          2HG       LYS  69  -7.793  -1.459   9.990
  709   2HG   LYS  69          1HG       LYS  69  -8.816  -0.058  10.311
  710   1HD   LYS  69          2HD       LYS  69 -10.308  -1.497  11.688
  711   2HD   LYS  69          1HD       LYS  69  -9.211  -2.853  11.420
  712   1HE   LYS  69          2HE       LYS  69  -7.418  -1.739  12.594
  713   2HE   LYS  69          1HE       LYS  69  -8.343  -0.227  12.676
  714   1HZ   LYS  69          3HZ       LYS  69  -9.381  -2.778  13.765
  715   2HZ   LYS  69          2HZ       LYS  69  -8.457  -1.709  14.708
  716   3HZ   LYS  69          1HZ       LYS  69  -9.947  -1.207  14.063
  717    QB   LYS  69           QB       LYS  69 -10.339  -1.438   9.032
  718    QD   LYS  69           QD       LYS  69  -9.759  -2.175  11.554
  719    QG   LYS  69           QG       LYS  69  -8.304  -0.758  10.150
  720    QE   LYS  69           QE       LYS  69  -7.881  -0.983  12.635
  721    QZ   LYS  69           QZ       LYS  69  -9.261  -1.898  14.179
  722    H    GLU  70           H        GLU  70  -8.980  -1.105   5.680
  723    HA   GLU  70           HA       GLU  70 -10.167  -1.412   3.666
  724   1HB   GLU  70          2HB       GLU  70  -9.133  -3.708   4.050
  725   2HB   GLU  70          1HB       GLU  70 -10.671  -4.197   4.758
  726   1HG   GLU  70          2HG       GLU  70 -11.592  -3.111   2.476
  727   2HG   GLU  70          1HG       GLU  70  -9.996  -3.617   1.919
  728    QB   GLU  70           QB       GLU  70  -9.902  -3.952   4.404
  729    QG   GLU  70           QG       GLU  70 -10.794  -3.364   2.198
  730    H    ARG  71           H        ARG  71 -12.256  -0.842   3.102
  731    HA   ARG  71           HA       ARG  71 -14.562  -0.388   3.380
  732   1HB   ARG  71          2HB       ARG  71 -13.991  -3.109   4.283
  733   2HB   ARG  71          1HB       ARG  71 -15.407  -2.431   5.087
  734   1HG   ARG  71          2HG       ARG  71 -15.431  -1.761   2.269
  735   2HG   ARG  71          1HG       ARG  71 -15.296  -3.507   2.488
  736   1HD   ARG  71          2HD       ARG  71 -17.628  -3.187   2.557
  737   2HD   ARG  71          1HD       ARG  71 -17.210  -3.126   4.281
  738    HE   ARG  71           HE       ARG  71 -17.252  -0.599   2.694
  739   1HH1  ARG  71          1HH1      ARG  71 -19.686  -0.042   3.170
  740   2HH1  ARG  71          2HH1      ARG  71 -19.995   0.092   4.870
  741   1HH2  ARG  71          1HH2      ARG  71 -17.080  -1.541   5.797
  742   2HH2  ARG  71          2HH2      ARG  71 -18.520  -0.757   6.357
  743    QB   ARG  71           QB       ARG  71 -14.699  -2.770   4.685
  744    QG   ARG  71           QG       ARG  71 -15.364  -2.634   2.379
  745    QD   ARG  71           QD       ARG  71 -17.419  -3.157   3.419
  746    QH1  ARG  71           QH1      ARG  71 -19.841   0.025   4.020
  747    QH2  ARG  71           QH2      ARG  71 -17.800  -1.149   6.077
  748    H    ASP  72           H        ASP  72 -12.453   0.456   5.470
  749    HA   ASP  72           HA       ASP  72 -14.341   0.923   7.755
  750   1HB   ASP  72          2HB       ASP  72 -12.342  -0.452   8.241
  751   2HB   ASP  72          1HB       ASP  72 -11.306   0.840   7.634
  752    QB   ASP  72           QB       ASP  72 -11.824   0.194   7.937
  753    H    ALA  73           H        ALA  73 -15.056   3.014   7.812
  754    HA   ALA  73           HA       ALA  73 -13.975   5.111   6.163
  755   1HB   ALA  73          3HB       ALA  73 -15.834   5.054   8.560
  756   2HB   ALA  73          1HB       ALA  73 -16.296   5.055   6.858
  757   3HB   ALA  73          2HB       ALA  73 -15.561   6.490   7.574
  758    MB   ALA  73           QB       ALA  73 -15.897   5.533   7.664
  759    H    VAL  74           H        VAL  74 -13.203   7.238   7.152
  760    HA   VAL  74           HA       VAL  74 -11.629   8.452   8.416
  761    HB   VAL  74           HB       VAL  74 -12.250   6.355  10.521
  762   1HG1  VAL  74          3HG1      VAL  74 -11.289   9.226  10.626
  763   2HG1  VAL  74          2HG1      VAL  74 -11.827   8.318  12.040
  764   3HG1  VAL  74          1HG1      VAL  74 -10.404   7.790  11.140
  765   1HG2  VAL  74          3HG2      VAL  74 -13.955   8.353   9.261
  766   2HG2  VAL  74          2HG2      VAL  74 -14.385   7.083  10.406
  767   3HG2  VAL  74          1HG2      VAL  74 -13.796   8.638  10.994
  768    MG1  VAL  74           QG1      VAL  74 -11.173   8.445  11.269
  769    MG2  VAL  74           QG2      VAL  74 -14.046   8.025  10.220
  770    QG   VAL  74           QQG      VAL  74 -12.610   8.235  10.745
  771    H    GLN  75           H        GLN  75  -9.388   8.410   8.570
  772    HA   GLN  75           HA       GLN  75  -7.834   6.087   9.263
  773   1HB   GLN  75          2HB       GLN  75  -8.886   6.298   6.570
  774   2HB   GLN  75          1HB       GLN  75  -7.122   6.313   6.541
  775   1HG   GLN  75          2HG       GLN  75  -7.068   4.106   6.959
  776   2HG   GLN  75          1HG       GLN  75  -7.998   4.344   8.439
  777   1HE2  GLN  75          1HE2      GLN  75  -9.161   2.291   7.903
  778   2HE2  GLN  75          2HE2      GLN  75 -10.398   2.308   6.741
  779    QB   GLN  75           QB       GLN  75  -8.004   6.306   6.555
  780    QG   GLN  75           QG       GLN  75  -7.533   4.225   7.699
  781    QE   GLN  75           QE2      GLN  75  -9.780   2.300   7.322
  782    H    GLY  76           H        GLY  76  -7.738   8.857   9.932
  783   1HA   GLY  76          1HA       GLY  76  -6.388  10.842   9.508
  784   2HA   GLY  76          2HA       GLY  76  -5.360   9.873   8.452
  785    QA   GLY  76           QA       GLY  76  -5.874  10.358   8.980
  786    H    GLY  77           H        GLY  77  -3.370   9.823   9.410
  787   1HA   GLY  77          1HA       GLY  77  -3.106   9.793  12.334
  788   2HA   GLY  77          2HA       GLY  77  -1.778   9.807  11.173
  789    QA   GLY  77           QA       GLY  77  -2.442   9.800  11.754
  790    H    GLN  78           H        GLN  78  -3.275   7.473   9.780
  791    HA   GLN  78           HA       GLN  78  -2.227   5.346  11.613
  792   1HB   GLN  78          2HB       GLN  78  -4.867   5.712  10.250
  793   2HB   GLN  78          1HB       GLN  78  -4.247   4.070  10.424
  794   1HG   GLN  78          2HG       GLN  78  -3.796   4.823  12.911
  795   2HG   GLN  78          1HG       GLN  78  -5.033   6.029  12.554
  796   1HE2  GLN  78          1HE2      GLN  78  -5.956   4.395  14.416
  797   2HE2  GLN  78          2HE2      GLN  78  -6.959   3.170  13.805
  798    QB   GLN  78           QB       GLN  78  -4.557   4.891  10.337
  799    QG   GLN  78           QG       GLN  78  -4.415   5.426  12.732
  800    QE   GLN  78           QE2      GLN  78  -6.457   3.783  14.110
  801    H    GLY  79           H        GLY  79  -1.011   3.770  10.570
  802   1HA   GLY  79          1HA       GLY  79   0.348   2.911   8.851
  803   2HA   GLY  79          2HA       GLY  79  -0.111   4.299   7.866
  804    QA   GLY  79           QA       GLY  79   0.118   3.605   8.358
  805    H    LEU  80           H        LEU  80  -0.679   3.232   5.970
  806    HA   LEU  80           HA       LEU  80  -3.186   1.650   6.058
  807   1HB   LEU  80          2HB       LEU  80  -1.494   2.749   3.786
  808   2HB   LEU  80          1HB       LEU  80  -3.100   2.041   3.611
  809    HG   LEU  80           HG       LEU  80  -2.595   4.377   5.455
  810   1HD1  LEU  80          3HD1      LEU  80  -4.811   2.701   4.860
  811   2HD1  LEU  80          2HD1      LEU  80  -4.796   4.147   5.870
  812   3HD1  LEU  80          1HD1      LEU  80  -5.157   4.278   4.149
  813   1HD2  LEU  80          1HD2      LEU  80  -3.343   4.423   2.516
  814   2HD2  LEU  80          3HD2      LEU  80  -3.432   5.815   3.595
  815   3HD2  LEU  80          2HD2      LEU  80  -1.871   5.081   3.230
  816    MD1  LEU  80           QD1      LEU  80  -4.921   3.709   4.959
  817    MD2  LEU  80           QD2      LEU  80  -2.882   5.107   3.113
  818    QB   LEU  80           QB       LEU  80  -2.297   2.395   3.698
  819    QD   LEU  80           QQD      LEU  80  -3.902   4.408   4.036
  820    H    ILE  81           H        ILE  81   0.130   1.347   4.740
  821    HA   ILE  81           HA       ILE  81  -0.148  -1.625   4.959
  822    HB   ILE  81           HB       ILE  81   0.885   0.005   2.614
  823   1HG1  ILE  81          2HG1      ILE  81  -1.453  -1.920   2.774
  824   2HG1  ILE  81          1HG1      ILE  81  -1.620  -0.170   2.920
  825   1HG2  ILE  81          2HG2      ILE  81   2.177  -2.086   3.017
  826   2HG2  ILE  81          1HG2      ILE  81   0.672  -3.003   2.946
  827   3HG2  ILE  81          3HG2      ILE  81   1.253  -2.149   1.516
  828   1HD1  ILE  81          1HD1      ILE  81  -0.139  -1.309   0.572
  829   2HD1  ILE  81          3HD1      ILE  81  -1.902  -1.313   0.565
  830   3HD1  ILE  81          2HD1      ILE  81  -1.024   0.211   0.698
  831    MG   ILE  81           QG2      ILE  81   1.368  -2.413   2.493
  832    MD   ILE  81           QD1      ILE  81  -1.022  -0.804   0.612
  833    QG   ILE  81           QG1      ILE  81  -1.536  -1.045   2.847
  834    H    LYS  82           H        LYS  82   1.882  -2.702   5.323
  835    HA   LYS  82           HA       LYS  82   3.999  -0.925   6.429
  836   1HB   LYS  82          2HB       LYS  82   2.857  -2.919   7.614
  837   2HB   LYS  82          1HB       LYS  82   3.820  -3.941   6.546
  838   1HG   LYS  82          2HG       LYS  82   5.843  -3.253   7.492
  839   2HG   LYS  82          1HG       LYS  82   5.156  -1.751   8.112
  840   1HD   LYS  82          2HD       LYS  82   4.179  -4.416   9.125
  841   2HD   LYS  82          1HD       LYS  82   5.631  -3.675   9.801
  842   1HE   LYS  82          2HE       LYS  82   4.234  -1.563  10.167
  843   2HE   LYS  82          1HE       LYS  82   2.812  -2.561   9.804
  844   1HZ   LYS  82          2HZ       LYS  82   4.881  -3.234  11.830
  845   2HZ   LYS  82          1HZ       LYS  82   3.365  -2.555  12.191
  846   3HZ   LYS  82          3HZ       LYS  82   3.459  -4.107  11.512
  847    QB   LYS  82           QB       LYS  82   3.339  -3.430   7.080
  848    QD   LYS  82           QD       LYS  82   4.905  -4.045   9.463
  849    QG   LYS  82           QG       LYS  82   5.500  -2.502   7.802
  850    QE   LYS  82           QE       LYS  82   3.523  -2.062   9.986
  851    QZ   LYS  82           QZ       LYS  82   3.902  -3.299  11.844
  852    H    ILE  83           H        ILE  83   6.149  -1.016   5.651
  853    HA   ILE  83           HA       ILE  83   6.760  -2.856   3.394
  854    HB   ILE  83           HB       ILE  83   5.708  -0.752   2.520
  855   1HG1  ILE  83          2HG1      ILE  83   8.617  -0.666   1.772
  856   2HG1  ILE  83          1HG1      ILE  83   7.679  -2.120   1.427
  857   1HG2  ILE  83          1HG2      ILE  83   6.930   0.554   4.494
  858   2HG2  ILE  83          3HG2      ILE  83   8.184   0.753   3.269
  859   3HG2  ILE  83          2HG2      ILE  83   6.553   1.355   2.969
  860   1HD1  ILE  83          1HD1      ILE  83   6.566   0.561   0.661
  861   2HD1  ILE  83          3HD1      ILE  83   7.791  -0.192  -0.361
  862   3HD1  ILE  83          2HD1      ILE  83   6.262  -1.018  -0.062
  863    MG   ILE  83           QG2      ILE  83   7.222   0.887   3.577
  864    MD   ILE  83           QD1      ILE  83   6.873  -0.216   0.079
  865    QG   ILE  83           QG1      ILE  83   8.148  -1.393   1.599
  866    H    GLY  84           H        GLY  84   9.103  -2.924   2.945
  867   1HA   GLY  84          1HA       GLY  84  10.986  -3.448   4.603
  868   2HA   GLY  84          2HA       GLY  84  10.762  -1.788   5.160
  869    QA   GLY  84           QA       GLY  84  10.874  -2.618   4.882

  No H/Q in entry =         869
  Start of MODEL   13
    1    H1   MET   1          1H        MET   1 -24.751  17.122  12.349
    2    H2   MET   1          3H        MET   1 -24.291  18.701  11.941
    3    H3   MET   1          2H        MET   1 -23.924  17.414  10.895
    4    HA   MET   1           HA       MET   1 -21.902  17.842  11.974
    5   1HB   MET   1          2HB       MET   1 -23.839  18.391  14.189
    6   2HB   MET   1          1HB       MET   1 -22.192  17.933  14.625
    7   1HG   MET   1          2HG       MET   1 -22.820  20.136  12.647
    8   2HG   MET   1          1HG       MET   1 -22.576  20.429  14.369
    9   1HE   MET   1          3HE       MET   1 -20.954  21.713  14.625
   10   2HE   MET   1          2HE       MET   1 -19.233  21.491  14.319
   11   3HE   MET   1          1HE       MET   1 -20.270  22.134  13.049
   12    QB   MET   1           QB       MET   1 -23.015  18.162  14.407
   13    QG   MET   1           QG       MET   1 -22.698  20.282  13.508
   14    ME   MET   1           QE       MET   1 -20.152  21.779  13.998
   15    H    LYS   2           H        LYS   2 -20.641  16.034  12.353
   16    HA   LYS   2           HA       LYS   2 -22.026  13.601  13.439
   17   1HB   LYS   2          2HB       LYS   2 -21.205  13.897  10.937
   18   2HB   LYS   2          1HB       LYS   2 -19.630  13.513  11.632
   19   1HG   LYS   2          2HG       LYS   2 -20.309  11.375  12.320
   20   2HG   LYS   2          1HG       LYS   2 -22.021  11.798  12.263
   21   1HD   LYS   2          2HD       LYS   2 -20.262  11.688   9.801
   22   2HD   LYS   2          1HD       LYS   2 -21.230  10.323  10.359
   23   1HE   LYS   2          2HE       LYS   2 -23.039  12.445  10.386
   24   2HE   LYS   2          1HE       LYS   2 -22.091  12.711   8.909
   25   1HZ   LYS   2          1HZ       LYS   2 -22.341  10.223   8.553
   26   2HZ   LYS   2          3HZ       LYS   2 -23.567  10.278   9.724
   27   3HZ   LYS   2          2HZ       LYS   2 -23.725  11.173   8.289
   28    QB   LYS   2           QB       LYS   2 -20.418  13.705  11.285
   29    QD   LYS   2           QD       LYS   2 -20.746  11.006  10.080
   30    QG   LYS   2           QG       LYS   2 -21.165  11.586  12.292
   31    QE   LYS   2           QE       LYS   2 -22.565  12.578   9.648
   32    QZ   LYS   2           QZ       LYS   2 -23.211  10.558   8.855
   33    H    LEU   3           H        LEU   3 -18.788  15.101  13.059
   34    HA   LEU   3           HA       LEU   3 -17.514  13.465  15.061
   35   1HB   LEU   3          2HB       LEU   3 -16.500  14.814  13.147
   36   2HB   LEU   3          1HB       LEU   3 -16.757  16.250  14.139
   37    HG   LEU   3           HG       LEU   3 -15.399  13.960  15.464
   38   1HD1  LEU   3          3HD1      LEU   3 -14.463  14.257  13.048
   39   2HD1  LEU   3          2HD1      LEU   3 -13.793  15.767  13.665
   40   3HD1  LEU   3          1HD1      LEU   3 -13.322  14.230  14.394
   41   1HD2  LEU   3          1HD2      LEU   3 -15.942  16.526  16.153
   42   2HD2  LEU   3          3HD2      LEU   3 -14.580  15.620  16.812
   43   3HD2  LEU   3          2HD2      LEU   3 -14.332  16.731  15.465
   44    MD1  LEU   3           QD1      LEU   3 -13.859  14.751  13.703
   45    MD2  LEU   3           QD2      LEU   3 -14.952  16.292  16.143
   46    QB   LEU   3           QB       LEU   3 -16.629  15.532  13.643
   47    QD   LEU   3           QQD      LEU   3 -14.405  15.522  14.923
   48    H    LYS   4           H        LYS   4 -17.058  13.971  17.251
   49    HA   LYS   4           HA       LYS   4 -18.268  16.451  18.384
   50   1HB   LYS   4          2HB       LYS   4 -19.672  14.165  18.358
   51   2HB   LYS   4          1HB       LYS   4 -18.700  13.852  19.798
   52   1HG   LYS   4          2HG       LYS   4 -20.097  15.162  20.978
   53   2HG   LYS   4          1HG       LYS   4 -19.582  16.536  19.997
   54   1HD   LYS   4          2HD       LYS   4 -21.304  15.989  18.317
   55   2HD   LYS   4          1HD       LYS   4 -21.822  14.614  19.294
   56   1HE   LYS   4          2HE       LYS   4 -21.733  17.010  20.927
   57   2HE   LYS   4          1HE       LYS   4 -22.766  17.261  19.505
   58   1HZ   LYS   4          3HZ       LYS   4 -23.706  14.999  19.987
   59   2HZ   LYS   4          2HZ       LYS   4 -22.910  15.057  21.486
   60   3HZ   LYS   4          1HZ       LYS   4 -24.111  16.198  21.114
   61    QB   LYS   4           QB       LYS   4 -19.186  14.008  19.078
   62    QD   LYS   4           QD       LYS   4 -21.563  15.302  18.806
   63    QG   LYS   4           QG       LYS   4 -19.840  15.849  20.487
   64    QE   LYS   4           QE       LYS   4 -22.250  17.136  20.216
   65    QZ   LYS   4           QZ       LYS   4 -23.576  15.418  20.862
   66    H    VAL   5           H        VAL   5 -17.854  15.578  21.103
   67    HA   VAL   5           HA       VAL   5 -14.888  15.160  21.199
   68    HB   VAL   5           HB       VAL   5 -16.563  17.213  22.684
   69   1HG1  VAL   5          2HG1      VAL   5 -14.334  16.028  23.654
   70   2HG1  VAL   5          1HG1      VAL   5 -13.591  17.297  22.679
   71   3HG1  VAL   5          3HG1      VAL   5 -14.727  17.720  23.960
   72   1HG2  VAL   5          2HG2      VAL   5 -15.092  17.232  20.152
   73   2HG2  VAL   5          1HG2      VAL   5 -16.253  18.401  20.783
   74   3HG2  VAL   5          3HG2      VAL   5 -14.557  18.498  21.258
   75    MG1  VAL   5           QG1      VAL   5 -14.217  17.015  23.431
   76    MG2  VAL   5           QG2      VAL   5 -15.301  18.044  20.731
   77    QG   VAL   5           QQG      VAL   5 -14.759  17.529  22.081
   78    H    THR   6           H        THR   6 -15.424  12.942  21.880
   79    HA   THR   6           HA       THR   6 -15.843  12.736  24.781
   80    HB   THR   6           HB       THR   6 -18.132  12.939  23.906
   81    HG1  THR   6           HG1      THR   6 -18.885  11.183  24.931
   82   1HG2  THR   6          3HG2      THR   6 -17.488  12.081  21.605
   83   2HG2  THR   6          2HG2      THR   6 -17.554  10.453  22.282
   84   3HG2  THR   6          1HG2      THR   6 -19.007  11.451  22.242
   85    MG   THR   6           QG2      THR   6 -18.016  11.328  22.043
   86    H    VAL   7           H        VAL   7 -15.649  11.007  21.662
   87    HA   VAL   7           HA       VAL   7 -14.101   8.850  23.062
   88    HB   VAL   7           HB       VAL   7 -14.979   7.409  21.216
   89   1HG1  VAL   7          2HG1      VAL   7 -16.397   8.528  23.409
   90   2HG1  VAL   7          1HG1      VAL   7 -17.532   8.424  22.063
   91   3HG1  VAL   7          3HG1      VAL   7 -16.686   6.978  22.617
   92   1HG2  VAL   7          3HG2      VAL   7 -15.417   9.829  19.943
   93   2HG2  VAL   7          2HG2      VAL   7 -16.057   8.272  19.419
   94   3HG2  VAL   7          1HG2      VAL   7 -17.041   9.338  20.422
   95    MG1  VAL   7           QG1      VAL   7 -16.872   7.977  22.696
   96    MG2  VAL   7           QG2      VAL   7 -16.172   9.146  19.928
   97    QG   VAL   7           QQG      VAL   7 -16.522   8.561  21.312
   98    H    ASN   8           H        ASN   8 -12.689   7.655  21.264
   99    HA   ASN   8           HA       ASN   8 -11.612   9.429  19.179
  100   1HB   ASN   8          2HB       ASN   8 -10.591  10.286  21.248
  101   2HB   ASN   8          1HB       ASN   8 -10.026   8.665  21.654
  102   1HD2  ASN   8          1HD2      ASN   8  -9.916  10.729  18.682
  103   2HD2  ASN   8          2HD2      ASN   8  -8.264  10.465  18.390
  104    QB   ASN   8           QB       ASN   8 -10.308   9.475  21.451
  105    QD   ASN   8           QD2      ASN   8  -9.090  10.597  18.536
  106    H    GLY   9           H        GLY   9 -10.830   6.554  21.182
  107   1HA   GLY   9          1HA       GLY   9 -10.170   5.123  18.638
  108   2HA   GLY   9          2HA       GLY   9 -10.990   4.338  19.988
  109    QA   GLY   9           QA       GLY   9 -10.580   4.731  19.313
  110    H    ALA  10           H        ALA  10  -8.480   3.490  18.822
  111    HA   ALA  10           HA       ALA  10  -6.645   3.954  21.153
  112   1HB   ALA  10          2HB       ALA  10  -7.579   1.544  19.651
  113   2HB   ALA  10          1HB       ALA  10  -5.926   1.529  20.263
  114   3HB   ALA  10          3HB       ALA  10  -7.277   1.738  21.377
  115    MB   ALA  10           QB       ALA  10  -6.927   1.604  20.430
  116    H    GLY  11           H        GLY  11  -6.508   2.661  17.804
  117   1HA   GLY  11          1HA       GLY  11  -4.536   4.658  17.009
  118   2HA   GLY  11          2HA       GLY  11  -5.103   3.312  16.020
  119    QA   GLY  11           QA       GLY  11  -4.820   3.985  16.515
  120    H    LYS  12           H        LYS  12  -3.276   2.209  15.438
  121    HA   LYS  12           HA       LYS  12  -1.556   1.137  17.620
  122   1HB   LYS  12          2HB       LYS  12  -2.686   0.198  15.168
  123   2HB   LYS  12          1HB       LYS  12  -0.930   0.140  15.006
  124   1HG   LYS  12          2HG       LYS  12  -0.729  -1.164  17.044
  125   2HG   LYS  12          1HG       LYS  12  -2.455  -0.997  17.365
  126   1HD   LYS  12          2HD       LYS  12  -2.784  -2.892  16.193
  127   2HD   LYS  12          1HD       LYS  12  -2.283  -2.014  14.747
  128   1HE   LYS  12          2HE       LYS  12  -0.030  -2.750  14.941
  129   2HE   LYS  12          1HE       LYS  12  -0.262  -3.265  16.624
  130   1HZ   LYS  12          3HZ       LYS  12  -1.902  -4.385  14.436
  131   2HZ   LYS  12          2HZ       LYS  12  -0.389  -5.054  14.821
  132   3HZ   LYS  12          1HZ       LYS  12  -1.628  -5.022  15.984
  133    QB   LYS  12           QB       LYS  12  -1.808   0.169  15.087
  134    QD   LYS  12           QD       LYS  12  -2.533  -2.453  15.470
  135    QG   LYS  12           QG       LYS  12  -1.592  -1.081  17.204
  136    QE   LYS  12           QE       LYS  12  -0.146  -3.007  15.782
  137    QZ   LYS  12           QZ       LYS  12  -1.306  -4.820  15.080
  138    H    ALA  13           H        ALA  13  -0.778   1.962  14.233
  139    HA   ALA  13           HA       ALA  13   1.075   3.129  13.343
  140   1HB   ALA  13          3HB       ALA  13   0.958   4.725  15.903
  141   2HB   ALA  13          2HB       ALA  13   1.299   5.295  14.268
  142   3HB   ALA  13          1HB       ALA  13  -0.342   4.829  14.715
  143    MB   ALA  13           QB       ALA  13   0.638   4.950  14.962
  144    H    GLY  14           H        GLY  14   2.408   1.141  13.802
  145   1HA   GLY  14          1HA       GLY  14   4.105  -0.038  14.989
  146   2HA   GLY  14          2HA       GLY  14   4.047   1.195  16.248
  147    QA   GLY  14           QA       GLY  14   4.076   0.578  15.618
  148    H    GLU  15           H        GLU  15   5.746   0.075  13.521
  149    HA   GLU  15           HA       GLU  15   7.398   2.582  13.487
  150   1HB   GLU  15          2HB       GLU  15   8.105   0.142  14.420
  151   2HB   GLU  15          1HB       GLU  15   8.530  -0.065  12.720
  152   1HG   GLU  15          2HG       GLU  15   9.530   2.443  13.262
  153   2HG   GLU  15          1HG       GLU  15   9.815   1.593  14.781
  154    QB   GLU  15           QB       GLU  15   8.318   0.039  13.570
  155    QG   GLU  15           QG       GLU  15   9.673   2.018  14.021
  156    H    GLY  16           H        GLY  16   6.502  -0.286  11.539
  157   1HA   GLY  16          1HA       GLY  16   6.786  -0.494   9.150
  158   2HA   GLY  16          2HA       GLY  16   7.096   1.239   9.061
  159    QA   GLY  16           QA       GLY  16   6.941   0.373   9.105
  160    H    GLU  17           H        GLU  17   5.263   2.682   9.235
  161    HA   GLU  17           HA       GLU  17   2.809   1.542   8.069
  162   1HB   GLU  17          2HB       GLU  17   1.401   2.369   9.927
  163   2HB   GLU  17          1HB       GLU  17   2.572   1.186  10.507
  164   1HG   GLU  17          2HG       GLU  17   3.253   4.119  10.553
  165   2HG   GLU  17          1HG       GLU  17   2.269   3.418  11.836
  166    QB   GLU  17           QB       GLU  17   1.987   1.777  10.217
  167    QG   GLU  17           QG       GLU  17   2.761   3.768  11.195
  168    H    ILE  18           H        ILE  18   1.501   3.190   7.097
  169    HA   ILE  18           HA       ILE  18   2.817   5.881   6.963
  170    HB   ILE  18           HB       ILE  18   1.078   4.318   5.026
  171   1HG1  ILE  18          2HG1      ILE  18   3.976   5.211   4.873
  172   2HG1  ILE  18          1HG1      ILE  18   3.446   3.574   5.263
  173   1HG2  ILE  18          1HG2      ILE  18   1.331   7.108   5.249
  174   2HG2  ILE  18          3HG2      ILE  18   2.423   6.652   3.941
  175   3HG2  ILE  18          2HG2      ILE  18   0.717   6.215   3.858
  176   1HD1  ILE  18          2HD1      ILE  18   2.230   3.514   3.064
  177   2HD1  ILE  18          1HD1      ILE  18   2.963   5.070   2.672
  178   3HD1  ILE  18          3HD1      ILE  18   3.981   3.648   2.901
  179    MG   ILE  18           QG2      ILE  18   1.491   6.659   4.349
  180    MD   ILE  18           QD1      ILE  18   3.058   4.077   2.879
  181    QG   ILE  18           QG1      ILE  18   3.711   4.392   5.068
  182    HA   PRO  19           HA       PRO  19  -1.095   6.758   9.132
  183   1HB   PRO  19          2HB       PRO  19  -0.242   9.127  10.211
  184   2HB   PRO  19          1HB       PRO  19   0.113   7.548  10.941
  185   1HG   PRO  19          2HG       PRO  19   1.844   9.281   9.244
  186   2HG   PRO  19          1HG       PRO  19   2.262   8.321  10.672
  187   1HD   PRO  19          2HD       PRO  19   2.806   7.515   8.137
  188   2HD   PRO  19          1HD       PRO  19   2.489   6.382   9.469
  189    QB   PRO  19           QB       PRO  19  -0.064   8.338  10.576
  190    QG   PRO  19           QG       PRO  19   2.053   8.801   9.958
  191    QD   PRO  19           QD       PRO  19   2.648   6.949   8.803
  192    H    ALA  20           H        ALA  20  -2.752   7.750   8.035
  193    HA   ALA  20           HA       ALA  20  -2.281   9.393   5.711
  194   1HB   ALA  20          1HB       ALA  20  -4.341   7.904   6.870
  195   2HB   ALA  20          3HB       ALA  20  -4.938   9.564   6.911
  196   3HB   ALA  20          2HB       ALA  20  -4.453   8.838   5.379
  197    MB   ALA  20           QB       ALA  20  -4.577   8.769   6.387
  198    HA   PRO  21           HA       PRO  21  -1.927  13.266   7.856
  199   1HB   PRO  21          2HB       PRO  21  -2.222  14.935   5.710
  200   2HB   PRO  21          1HB       PRO  21  -0.730  14.031   6.033
  201   1HG   PRO  21          2HG       PRO  21  -2.910  13.458   4.095
  202   2HG   PRO  21          1HG       PRO  21  -1.163  13.233   3.929
  203   1HD   PRO  21          2HD       PRO  21  -2.920  11.203   4.466
  204   2HD   PRO  21          1HD       PRO  21  -1.203  11.179   4.923
  205    QB   PRO  21           QB       PRO  21  -1.476  14.483   5.872
  206    QG   PRO  21           QG       PRO  21  -2.037  13.345   4.012
  207    QD   PRO  21           QD       PRO  21  -2.062  11.191   4.694
  208    H    LEU  22           H        LEU  22  -4.712  12.192   6.132
  209    HA   LEU  22           HA       LEU  22  -6.392  14.139   7.638
  210   1HB   LEU  22          2HB       LEU  22  -5.823  14.961   5.309
  211   2HB   LEU  22          1HB       LEU  22  -6.684  13.558   4.677
  212    HG   LEU  22           HG       LEU  22  -8.408  14.710   6.586
  213   1HD1  LEU  22          3HD1      LEU  22  -9.037  13.564   4.487
  214   2HD1  LEU  22          2HD1      LEU  22  -9.806  15.147   4.602
  215   3HD1  LEU  22          1HD1      LEU  22  -8.402  14.922   3.560
  216   1HD2  LEU  22          2HD2      LEU  22  -6.701  16.698   5.251
  217   2HD2  LEU  22          1HD2      LEU  22  -8.427  16.993   5.042
  218   3HD2  LEU  22          3HD2      LEU  22  -7.741  16.878   6.664
  219    MD1  LEU  22           QD1      LEU  22  -9.082  14.544   4.217
  220    MD2  LEU  22           QD2      LEU  22  -7.623  16.856   5.652
  221    QB   LEU  22           QB       LEU  22  -6.253  14.259   4.993
  222    QD   LEU  22           QQD      LEU  22  -8.352  15.700   4.934
  223    H    ALA  23           H        ALA  23  -8.565  13.348   7.972
  224    HA   ALA  23           HA       ALA  23  -8.849  10.525   8.300
  225   1HB   ALA  23          3HB       ALA  23 -11.341  12.021   7.982
  226   2HB   ALA  23          2HB       ALA  23 -10.681  11.249   9.424
  227   3HB   ALA  23          1HB       ALA  23 -10.176  12.882   8.988
  228    MB   ALA  23           QB       ALA  23 -10.733  12.051   8.798
  229    H    GLY  24           H        GLY  24 -10.454   9.136   7.157
  230   1HA   GLY  24          1HA       GLY  24 -10.095   9.135   4.328
  231   2HA   GLY  24          2HA       GLY  24 -11.682   9.816   4.690
  232    QA   GLY  24           QA       GLY  24 -10.888   9.475   4.509
  233    H    THR  25           H        THR  25 -11.479   7.406   3.291
  234    HA   THR  25           HA       THR  25 -11.916   5.221   5.253
  235    HB   THR  25           HB       THR  25 -14.063   5.789   3.235
  236    HG1  THR  25           HG1      THR  25 -13.971   6.975   5.802
  237   1HG2  THR  25          2HG2      THR  25 -13.870   3.740   4.810
  238   2HG2  THR  25          1HG2      THR  25 -14.340   4.861   6.086
  239   3HG2  THR  25          3HG2      THR  25 -15.422   4.573   4.724
  240    MG   THR  25           QG2      THR  25 -14.544   4.391   5.207
  241    H    VAL  26           H        VAL  26 -11.745   3.146   4.272
  242    HA   VAL  26           HA       VAL  26 -10.406   3.124   1.640
  243    HB   VAL  26           HB       VAL  26 -11.032   0.998   3.712
  244   1HG1  VAL  26          2HG1      VAL  26  -9.333   0.929   1.203
  245   2HG1  VAL  26          1HG1      VAL  26  -9.260  -0.295   2.470
  246   3HG1  VAL  26          3HG1      VAL  26 -10.750  -0.062   1.554
  247   1HG2  VAL  26          1HG2      VAL  26  -9.186   3.107   3.748
  248   2HG2  VAL  26          3HG2      VAL  26  -9.167   1.677   4.782
  249   3HG2  VAL  26          2HG2      VAL  26  -8.242   1.692   3.281
  250    MG1  VAL  26           QG1      VAL  26  -9.781   0.191   1.742
  251    MG2  VAL  26           QG2      VAL  26  -8.865   2.158   3.937
  252    QG   VAL  26           QQG      VAL  26  -9.323   1.175   2.840
  253    H    SER  27           H        SER  27 -11.412   2.474  -0.235
  254    HA   SER  27           HA       SER  27 -14.241   1.534  -0.044
  255   1HB   SER  27          2HB       SER  27 -12.693   3.315  -1.718
  256   2HB   SER  27          1HB       SER  27 -13.459   2.078  -2.709
  257    HG   SER  27           HG       SER  27 -15.313   2.980  -2.328
  258    QB   SER  27           QB       SER  27 -13.076   2.696  -2.214
  259    H    LYS  28           H        LYS  28 -11.042   0.629  -1.183
  260    HA   LYS  28           HA       LYS  28 -11.760  -2.175  -1.369
  261   1HB   LYS  28          2HB       LYS  28 -12.234  -0.438  -3.613
  262   2HB   LYS  28          1HB       LYS  28 -10.954  -1.577  -4.035
  263   1HG   LYS  28          2HG       LYS  28 -12.388  -3.452  -3.280
  264   2HG   LYS  28          1HG       LYS  28 -13.673  -2.303  -2.904
  265   1HD   LYS  28          2HD       LYS  28 -14.101  -3.257  -5.100
  266   2HD   LYS  28          1HD       LYS  28 -13.642  -1.565  -5.298
  267   1HE   LYS  28          2HE       LYS  28 -11.860  -2.154  -6.566
  268   2HE   LYS  28          1HE       LYS  28 -11.282  -3.260  -5.304
  269   1HZ   LYS  28          2HZ       LYS  28 -13.494  -3.843  -7.205
  270   2HZ   LYS  28          1HZ       LYS  28 -11.913  -4.450  -7.342
  271   3HZ   LYS  28          3HZ       LYS  28 -12.882  -4.900  -6.024
  272    QB   LYS  28           QB       LYS  28 -11.594  -1.008  -3.824
  273    QD   LYS  28           QD       LYS  28 -13.871  -2.411  -5.199
  274    QG   LYS  28           QG       LYS  28 -13.031  -2.877  -3.092
  275    QE   LYS  28           QE       LYS  28 -11.571  -2.707  -5.935
  276    QZ   LYS  28           QZ       LYS  28 -12.763  -4.398  -6.857
  277    H    ILE  29           H        ILE  29  -9.852  -3.479  -1.759
  278    HA   ILE  29           HA       ILE  29  -7.296  -1.920  -1.575
  279    HB   ILE  29           HB       ILE  29  -7.926  -3.275   0.384
  280   1HG1  ILE  29          2HG1      ILE  29  -5.780  -4.932  -0.860
  281   2HG1  ILE  29          1HG1      ILE  29  -5.494  -3.194  -0.760
  282   1HG2  ILE  29          1HG2      ILE  29  -8.767  -5.100  -1.657
  283   2HG2  ILE  29          3HG2      ILE  29  -7.560  -5.906  -0.656
  284   3HG2  ILE  29          2HG2      ILE  29  -9.008  -5.224   0.086
  285   1HD1  ILE  29          3HD1      ILE  29  -6.498  -3.724   1.735
  286   2HD1  ILE  29          2HD1      ILE  29  -5.604  -5.204   1.393
  287   3HD1  ILE  29          1HD1      ILE  29  -4.779  -3.646   1.349
  288    MG   ILE  29           QG2      ILE  29  -8.445  -5.410  -0.742
  289    MD   ILE  29           QD1      ILE  29  -5.627  -4.191   1.492
  290    QG   ILE  29           QG1      ILE  29  -5.637  -4.063  -0.810
  291    H    LEU  30           H        LEU  30  -5.521  -2.614  -2.868
  292    HA   LEU  30           HA       LEU  30  -6.255  -4.442  -5.131
  293   1HB   LEU  30          2HB       LEU  30  -4.702  -1.898  -4.841
  294   2HB   LEU  30          1HB       LEU  30  -4.212  -3.025  -6.106
  295    HG   LEU  30           HG       LEU  30  -6.960  -2.985  -6.376
  296   1HD1  LEU  30          2HD1      LEU  30  -6.824  -1.009  -4.708
  297   2HD1  LEU  30          1HD1      LEU  30  -6.116  -0.106  -6.048
  298   3HD1  LEU  30          3HD1      LEU  30  -7.747  -0.762  -6.190
  299   1HD2  LEU  30          2HD2      LEU  30  -4.877  -2.665  -8.000
  300   2HD2  LEU  30          1HD2      LEU  30  -6.489  -2.132  -8.480
  301   3HD2  LEU  30          3HD2      LEU  30  -5.322  -0.964  -7.859
  302    MD1  LEU  30           QD1      LEU  30  -6.895  -0.626  -5.649
  303    MD2  LEU  30           QD2      LEU  30  -5.563  -1.920  -8.113
  304    QB   LEU  30           QB       LEU  30  -4.457  -2.462  -5.473
  305    QD   LEU  30           QQD      LEU  30  -6.229  -1.273  -6.881
  306    H    VAL  31           H        VAL  31  -3.722  -3.548  -2.807
  307    HA   VAL  31           HA       VAL  31  -2.181  -5.994  -3.599
  308    HB   VAL  31           HB       VAL  31  -1.390  -3.494  -2.066
  309   1HG1  VAL  31          3HG1      VAL  31  -1.951  -3.442  -4.637
  310   2HG1  VAL  31          2HG1      VAL  31  -0.485  -2.658  -4.049
  311   3HG1  VAL  31          1HG1      VAL  31  -0.393  -4.253  -4.797
  312   1HG2  VAL  31          3HG2      VAL  31  -0.113  -5.601  -1.521
  313   2HG2  VAL  31          2HG2      VAL  31   0.358  -5.686  -3.219
  314   3HG2  VAL  31          1HG2      VAL  31   0.877  -4.324  -2.226
  315    MG1  VAL  31           QG1      VAL  31  -0.943  -3.451  -4.494
  316    MG2  VAL  31           QG2      VAL  31   0.374  -5.204  -2.322
  317    QG   VAL  31           QQG      VAL  31  -0.285  -4.327  -3.408
  318    H    LYS  32           H        LYS  32  -1.323  -7.310  -1.825
  319    HA   LYS  32           HA       LYS  32  -2.921  -7.056   0.706
  320   1HB   LYS  32          2HB       LYS  32  -2.162  -9.333  -1.090
  321   2HB   LYS  32          1HB       LYS  32  -2.361  -9.656   0.634
  322   1HG   LYS  32          2HG       LYS  32  -4.486  -8.016  -0.635
  323   2HG   LYS  32          1HG       LYS  32  -4.423  -9.713  -1.118
  324   1HD   LYS  32          2HD       LYS  32  -4.608 -10.448   1.171
  325   2HD   LYS  32          1HD       LYS  32  -4.421  -8.800   1.769
  326   1HE   LYS  32          2HE       LYS  32  -6.542  -8.182   0.553
  327   2HE   LYS  32          1HE       LYS  32  -6.761  -9.904   0.181
  328   1HZ   LYS  32          3HZ       LYS  32  -6.197  -9.001   2.935
  329   2HZ   LYS  32          2HZ       LYS  32  -7.788  -9.013   2.338
  330   3HZ   LYS  32          1HZ       LYS  32  -6.896 -10.458   2.420
  331    QB   LYS  32           QB       LYS  32  -2.261  -9.495  -0.228
  332    QD   LYS  32           QD       LYS  32  -4.515  -9.624   1.470
  333    QG   LYS  32           QG       LYS  32  -4.454  -8.864  -0.876
  334    QE   LYS  32           QE       LYS  32  -6.652  -9.043   0.367
  335    QZ   LYS  32           QZ       LYS  32  -6.960  -9.491   2.565
  336    H    GLU  33           H        GLU  33  -1.705  -8.476   2.489
  337    HA   GLU  33           HA       GLU  33   0.916  -7.250   2.872
  338   1HB   GLU  33          2HB       GLU  33  -0.963  -7.862   4.562
  339   2HB   GLU  33          1HB       GLU  33  -0.302  -9.495   4.483
  340   1HG   GLU  33          2HG       GLU  33   1.435  -7.087   5.052
  341   2HG   GLU  33          1HG       GLU  33   0.625  -7.985   6.336
  342    QB   GLU  33           QB       GLU  33  -0.633  -8.678   4.523
  343    QG   GLU  33           QG       GLU  33   1.030  -7.536   5.694
  344    H    GLY  34           H        GLY  34   2.878  -8.167   2.360
  345   1HA   GLY  34          1HA       GLY  34   3.064 -11.108   2.051
  346   2HA   GLY  34          2HA       GLY  34   4.428  -9.996   2.145
  347    QA   GLY  34           QA       GLY  34   3.746 -10.552   2.098
  348    H    ASP  35           H        ASP  35   1.987  -8.873   0.036
  349    HA   ASP  35           HA       ASP  35   3.008 -10.293  -2.341
  350   1HB   ASP  35          2HB       ASP  35   0.696  -8.712  -1.506
  351   2HB   ASP  35          1HB       ASP  35   1.267  -8.256  -3.112
  352    QB   ASP  35           QB       ASP  35   0.982  -8.484  -2.309
  353    H    THR  36           H        THR  36   3.913  -9.109  -4.175
  354    HA   THR  36           HA       THR  36   5.677  -6.895  -3.331
  355    HB   THR  36           HB       THR  36   5.764  -7.592  -6.148
  356    HG1  THR  36           HG1      THR  36   5.493  -9.654  -6.060
  357   1HG2  THR  36          3HG2      THR  36   7.521  -7.437  -3.790
  358   2HG2  THR  36          2HG2      THR  36   8.011  -8.636  -4.987
  359   3HG2  THR  36          1HG2      THR  36   7.824  -6.947  -5.457
  360    MG   THR  36           QG2      THR  36   7.785  -7.673  -4.745
  361    H    VAL  37           H        VAL  37   5.900  -5.072  -5.092
  362    HA   VAL  37           HA       VAL  37   3.378  -4.372  -6.455
  363    HB   VAL  37           HB       VAL  37   3.032  -3.758  -4.079
  364   1HG1  VAL  37          1HG1      VAL  37   2.122  -2.348  -5.967
  365   2HG1  VAL  37          3HG1      VAL  37   2.354  -1.469  -4.456
  366   3HG1  VAL  37          2HG1      VAL  37   3.518  -1.288  -5.767
  367   1HG2  VAL  37          3HG2      VAL  37   5.579  -2.189  -4.545
  368   2HG2  VAL  37          2HG2      VAL  37   4.482  -1.850  -3.206
  369   3HG2  VAL  37          1HG2      VAL  37   5.279  -3.419  -3.318
  370    MG1  VAL  37           QG1      VAL  37   2.665  -1.702  -5.397
  371    MG2  VAL  37           QG2      VAL  37   5.113  -2.486  -3.690
  372    QG   VAL  37           QQG      VAL  37   3.889  -2.094  -4.543
  373    H    LYS  38           H        LYS  38   3.658  -2.245  -7.641
  374    HA   LYS  38           HA       LYS  38   6.551  -1.740  -8.269
  375   1HB   LYS  38          2HB       LYS  38   4.123  -2.280  -9.901
  376   2HB   LYS  38          1HB       LYS  38   5.229  -1.062 -10.537
  377   1HG   LYS  38          2HG       LYS  38   7.086  -2.626 -10.451
  378   2HG   LYS  38          1HG       LYS  38   6.079  -3.835  -9.653
  379   1HD   LYS  38          2HD       LYS  38   6.173  -4.429 -11.983
  380   2HD   LYS  38          1HD       LYS  38   4.564  -3.766 -11.685
  381   1HE   LYS  38          2HE       LYS  38   6.297  -1.582 -12.336
  382   2HE   LYS  38          1HE       LYS  38   6.503  -2.842 -13.569
  383   1HZ   LYS  38          2HZ       LYS  38   4.081  -3.027 -13.705
  384   2HZ   LYS  38          1HZ       LYS  38   3.916  -1.754 -12.590
  385   3HZ   LYS  38          3HZ       LYS  38   4.605  -1.464 -14.112
  386    QB   LYS  38           QB       LYS  38   4.676  -1.671 -10.219
  387    QD   LYS  38           QD       LYS  38   5.368  -4.098 -11.834
  388    QG   LYS  38           QG       LYS  38   6.583  -3.230 -10.052
  389    QE   LYS  38           QE       LYS  38   6.400  -2.212 -12.953
  390    QZ   LYS  38           QZ       LYS  38   4.201  -2.082 -13.469
  391    H    ALA  39           H        ALA  39   6.836   0.504  -9.293
  392    HA   ALA  39           HA       ALA  39   5.591   2.510  -7.566
  393   1HB   ALA  39          3HB       ALA  39   8.008   2.279  -8.588
  394   2HB   ALA  39          2HB       ALA  39   7.288   3.082  -9.982
  395   3HB   ALA  39          1HB       ALA  39   7.294   3.882  -8.410
  396    MB   ALA  39           QB       ALA  39   7.530   3.081  -8.993
  397    H    GLY  40           H        GLY  40   3.558   3.251  -8.053
  398   1HA   GLY  40          1HA       GLY  40   2.969   3.896 -10.908
  399   2HA   GLY  40          2HA       GLY  40   2.220   4.692  -9.523
  400    QA   GLY  40           QA       GLY  40   2.594   4.294 -10.216
  401    H    GLN  41           H        GLN  41   2.046   1.859  -8.274
  402    HA   GLN  41           HA       GLN  41  -0.228   0.831  -9.930
  403   1HB   GLN  41          2HB       GLN  41   2.037  -0.391  -8.936
  404   2HB   GLN  41          1HB       GLN  41   0.830  -0.802  -7.716
  405   1HG   GLN  41          2HG       GLN  41  -0.682  -1.416  -9.741
  406   2HG   GLN  41          1HG       GLN  41   0.824  -1.450 -10.658
  407   1HE2  GLN  41          1HE2      GLN  41  -0.320  -2.662  -7.444
  408   2HE2  GLN  41          2HE2      GLN  41   0.409  -4.187  -7.603
  409    QB   GLN  41           QB       GLN  41   1.433  -0.597  -8.326
  410    QG   GLN  41           QG       GLN  41   0.071  -1.433 -10.199
  411    QE   GLN  41           QE2      GLN  41   0.044  -3.425  -7.524
  412    H    THR  42           H        THR  42  -2.213   1.374  -9.115
  413    HA   THR  42           HA       THR  42  -2.741   2.661  -6.671
  414    HB   THR  42           HB       THR  42  -4.497   0.758  -8.259
  415    HG1  THR  42           HG1      THR  42  -4.966   2.512  -9.481
  416   1HG2  THR  42          1HG2      THR  42  -5.126   1.723  -5.857
  417   2HG2  THR  42          3HG2      THR  42  -5.519   3.158  -6.805
  418   3HG2  THR  42          2HG2      THR  42  -6.323   1.627  -7.149
  419    MG   THR  42           QG2      THR  42  -5.656   2.169  -6.604
  420    H    VAL  43           H        VAL  43  -1.661   1.629  -4.912
  421    HA   VAL  43           HA       VAL  43  -1.824  -1.168  -4.292
  422    HB   VAL  43           HB       VAL  43  -1.474   1.238  -2.471
  423   1HG1  VAL  43          1HG1      VAL  43   0.150   0.216  -4.635
  424   2HG1  VAL  43          3HG1      VAL  43   0.420   1.631  -3.618
  425   3HG1  VAL  43          2HG1      VAL  43   1.007   0.051  -3.102
  426   1HG2  VAL  43          3HG2      VAL  43  -1.612  -1.525  -1.915
  427   2HG2  VAL  43          2HG2      VAL  43   0.101  -1.108  -1.848
  428   3HG2  VAL  43          1HG2      VAL  43  -1.057  -0.248  -0.833
  429    MG1  VAL  43           QG1      VAL  43   0.525   0.633  -3.785
  430    MG2  VAL  43           QG2      VAL  43  -0.856  -0.960  -1.532
  431    QG   VAL  43           QQG      VAL  43  -0.165  -0.164  -2.659
  432    H    LEU  44           H        LEU  44  -3.889   1.608  -3.520
  433    HA   LEU  44           HA       LEU  44  -6.042  -0.254  -2.699
  434   1HB   LEU  44          2HB       LEU  44  -4.303   1.233  -0.885
  435   2HB   LEU  44          1HB       LEU  44  -6.005   1.622  -0.631
  436    HG   LEU  44           HG       LEU  44  -5.536  -1.244  -1.029
  437   1HD1  LEU  44          2HD1      LEU  44  -7.622  -0.032  -0.188
  438   2HD1  LEU  44          1HD1      LEU  44  -7.097  -1.412   0.777
  439   3HD1  LEU  44          3HD1      LEU  44  -6.749   0.229   1.321
  440   1HD2  LEU  44          1HD2      LEU  44  -4.285   0.188   1.334
  441   2HD2  LEU  44          3HD2      LEU  44  -4.560  -1.553   1.260
  442   3HD2  LEU  44          2HD2      LEU  44  -3.446  -0.788   0.128
  443    MD1  LEU  44           QD1      LEU  44  -7.156  -0.405   0.637
  444    MD2  LEU  44           QD2      LEU  44  -4.097  -0.717   0.907
  445    QB   LEU  44           QB       LEU  44  -5.154   1.427  -0.758
  446    QD   LEU  44           QQD      LEU  44  -5.626  -0.561   0.772
  447    H    VAL  45           H        VAL  45  -7.967   1.301  -1.859
  448    HA   VAL  45           HA       VAL  45  -8.071   3.713  -3.635
  449    HB   VAL  45           HB       VAL  45 -10.118   1.504  -3.244
  450   1HG1  VAL  45          1HG1      VAL  45  -7.936   1.820  -5.042
  451   2HG1  VAL  45          3HG1      VAL  45  -9.189   0.579  -5.072
  452   3HG1  VAL  45          2HG1      VAL  45  -9.414   2.081  -5.969
  453   1HG2  VAL  45          1HG2      VAL  45 -10.306   4.268  -4.317
  454   2HG2  VAL  45          3HG2      VAL  45 -11.073   3.009  -5.285
  455   3HG2  VAL  45          2HG2      VAL  45 -11.559   3.249  -3.607
  456    MG1  VAL  45           QG1      VAL  45  -8.846   1.493  -5.361
  457    MG2  VAL  45           QG2      VAL  45 -10.979   3.508  -4.403
  458    QG   VAL  45           QQG      VAL  45  -9.913   2.501  -4.882
  459    H    LEU  46           H        LEU  46  -8.646   5.493  -2.447
  460    HA   LEU  46           HA       LEU  46  -9.883   5.079   0.235
  461   1HB   LEU  46          2HB       LEU  46  -7.772   6.599  -0.721
  462   2HB   LEU  46          1HB       LEU  46  -9.074   7.781  -0.577
  463    HG   LEU  46           HG       LEU  46  -9.178   6.122   1.734
  464   1HD1  LEU  46          1HD1      LEU  46  -6.437   6.785   0.782
  465   2HD1  LEU  46          3HD1      LEU  46  -6.770   7.067   2.491
  466   3HD1  LEU  46          2HD1      LEU  46  -6.981   5.456   1.806
  467   1HD2  LEU  46          1HD2      LEU  46  -9.506   8.751   1.097
  468   2HD2  LEU  46          3HD2      LEU  46  -9.374   8.156   2.753
  469   3HD2  LEU  46          2HD2      LEU  46  -7.954   8.812   1.934
  470    MD1  LEU  46           QD1      LEU  46  -6.729   6.436   1.693
  471    MD2  LEU  46           QD2      LEU  46  -8.945   8.573   1.928
  472    QB   LEU  46           QB       LEU  46  -8.423   7.190  -0.649
  473    QD   LEU  46           QQD      LEU  46  -7.837   7.504   1.811
  474    H    GLU  47           H        GLU  47 -11.389   7.083   0.801
  475    HA   GLU  47           HA       GLU  47 -12.998   8.076  -1.457
  476   1HB   GLU  47          2HB       GLU  47 -13.557   5.580  -0.445
  477   2HB   GLU  47          1HB       GLU  47 -14.627   6.604   0.515
  478   1HG   GLU  47          2HG       GLU  47 -15.072   7.688  -1.908
  479   2HG   GLU  47          1HG       GLU  47 -14.660   6.046  -2.409
  480    QB   GLU  47           QB       GLU  47 -14.092   6.092   0.035
  481    QG   GLU  47           QG       GLU  47 -14.866   6.867  -2.158
  482    H    ALA  48           H        ALA  48 -12.667  10.183  -0.617
  483    HA   ALA  48           HA       ALA  48 -13.811  10.692   2.112
  484   1HB   ALA  48          2HB       ALA  48 -12.216  12.709   1.961
  485   2HB   ALA  48          1HB       ALA  48 -11.464  11.123   2.128
  486   3HB   ALA  48          3HB       ALA  48 -11.524  11.908   0.550
  487    MB   ALA  48           QB       ALA  48 -11.735  11.913   1.546
  488    H    MET  49           H        MET  49 -13.235  12.268  -1.062
  489    HA   MET  49           HA       MET  49 -15.554  14.064  -0.566
  490   1HB   MET  49          2HB       MET  49 -13.436  13.932  -2.739
  491   2HB   MET  49          1HB       MET  49 -14.634  15.216  -2.572
  492   1HG   MET  49          2HG       MET  49 -13.142  14.664  -0.098
  493   2HG   MET  49          1HG       MET  49 -12.131  15.243  -1.422
  494   1HE   MET  49          2HE       MET  49 -13.234  16.280   1.495
  495   2HE   MET  49          1HE       MET  49 -14.267  17.704   1.427
  496   3HE   MET  49          3HE       MET  49 -14.952  16.097   1.153
  497    QB   MET  49           QB       MET  49 -14.035  14.574  -2.655
  498    QG   MET  49           QG       MET  49 -12.636  14.954  -0.760
  499    ME   MET  49           QE       MET  49 -14.151  16.694   1.358
  500    H    LYS  50           H        LYS  50 -16.209  11.312  -1.000
  501    HA   LYS  50           HA       LYS  50 -17.587   9.962  -2.367
  502   1HB   LYS  50          2HB       LYS  50 -18.340  12.769  -2.565
  503   2HB   LYS  50          1HB       LYS  50 -18.785  11.879  -4.022
  504   1HG   LYS  50          2HG       LYS  50 -19.948  10.197  -2.664
  505   2HG   LYS  50          1HG       LYS  50 -19.472  11.039  -1.189
  506   1HD   LYS  50          2HD       LYS  50 -20.878  12.650  -3.262
  507   2HD   LYS  50          1HD       LYS  50 -21.844  11.469  -2.376
  508   1HE   LYS  50          2HE       LYS  50 -20.005  13.313  -0.859
  509   2HE   LYS  50          1HE       LYS  50 -21.605  13.881  -1.377
  510   1HZ   LYS  50          3HZ       LYS  50 -21.144  11.317   0.045
  511   2HZ   LYS  50          2HZ       LYS  50 -21.606  12.753   0.826
  512   3HZ   LYS  50          1HZ       LYS  50 -22.638  12.032  -0.316
  513    QB   LYS  50           QB       LYS  50 -18.563  12.324  -3.294
  514    QD   LYS  50           QD       LYS  50 -21.361  12.059  -2.819
  515    QG   LYS  50           QG       LYS  50 -19.710  10.618  -1.926
  516    QE   LYS  50           QE       LYS  50 -20.805  13.597  -1.118
  517    QZ   LYS  50           QZ       LYS  50 -21.796  12.034   0.185
  518    H    MET  51           H        MET  51 -14.859  10.374  -3.296
  519    HA   MET  51           HA       MET  51 -15.308   9.992  -6.228
  520   1HB   MET  51          2HB       MET  51 -14.293  12.287  -5.092
  521   2HB   MET  51          1HB       MET  51 -12.825  11.377  -5.450
  522   1HG   MET  51          2HG       MET  51 -13.486  11.128  -7.777
  523   2HG   MET  51          1HG       MET  51 -15.041  11.896  -7.453
  524   1HE   MET  51          1HE       MET  51 -15.297  14.128  -6.385
  525   2HE   MET  51          3HE       MET  51 -13.923  14.195  -5.273
  526   3HE   MET  51          2HE       MET  51 -14.160  15.472  -6.463
  527    QB   MET  51           QB       MET  51 -13.559  11.832  -5.271
  528    QG   MET  51           QG       MET  51 -14.263  11.512  -7.615
  529    ME   MET  51           QE       MET  51 -14.460  14.598  -6.040
  530    H    GLU  52           H        GLU  52 -14.551   7.949  -6.654
  531    HA   GLU  52           HA       GLU  52 -12.946   6.362  -4.945
  532   1HB   GLU  52          2HB       GLU  52 -13.731   6.391  -7.835
  533   2HB   GLU  52          1HB       GLU  52 -12.492   5.245  -7.324
  534   1HG   GLU  52          2HG       GLU  52 -13.988   3.949  -6.223
  535   2HG   GLU  52          1HG       GLU  52 -14.794   5.346  -5.507
  536    QB   GLU  52           QB       GLU  52 -13.111   5.818  -7.579
  537    QG   GLU  52           QG       GLU  52 -14.391   4.648  -5.865
  538    H    THR  53           H        THR  53 -10.991   7.266  -4.247
  539    HA   THR  53           HA       THR  53  -9.155   8.511  -6.209
  540    HB   THR  53           HB       THR  53  -8.848   8.003  -3.235
  541    HG1  THR  53           HG1      THR  53  -9.557  10.299  -3.241
  542   1HG2  THR  53          3HG2      THR  53  -6.846   8.676  -4.703
  543   2HG2  THR  53          2HG2      THR  53  -7.665  10.227  -4.897
  544   3HG2  THR  53          1HG2      THR  53  -7.177   9.682  -3.292
  545    MG   THR  53           QG2      THR  53  -7.229   9.528  -4.297
  546    H    GLU  54           H        GLU  54  -7.478   7.385  -7.125
  547    HA   GLU  54           HA       GLU  54  -7.034   4.571  -6.350
  548   1HB   GLU  54          2HB       GLU  54  -6.347   6.432  -8.585
  549   2HB   GLU  54          1HB       GLU  54  -5.305   5.028  -8.348
  550   1HG   GLU  54          2HG       GLU  54  -6.968   4.239  -9.825
  551   2HG   GLU  54          1HG       GLU  54  -7.509   3.668  -8.246
  552    QB   GLU  54           QB       GLU  54  -5.826   5.730  -8.467
  553    QG   GLU  54           QG       GLU  54  -7.239   3.953  -9.035
  554    H    ILE  55           H        ILE  55  -5.659   4.241  -4.633
  555    HA   ILE  55           HA       ILE  55  -3.552   6.170  -3.954
  556    HB   ILE  55           HB       ILE  55  -4.358   3.450  -2.876
  557   1HG1  ILE  55          2HG1      ILE  55  -4.853   6.226  -1.760
  558   2HG1  ILE  55          1HG1      ILE  55  -6.035   5.334  -2.719
  559   1HG2  ILE  55          2HG2      ILE  55  -1.971   4.141  -2.410
  560   2HG2  ILE  55          1HG2      ILE  55  -2.611   5.556  -1.575
  561   3HG2  ILE  55          3HG2      ILE  55  -2.965   3.938  -0.968
  562   1HD1  ILE  55          1HD1      ILE  55  -5.190   3.501  -0.784
  563   2HD1  ILE  55          3HD1      ILE  55  -5.337   5.026   0.090
  564   3HD1  ILE  55          2HD1      ILE  55  -6.720   4.379  -0.795
  565    MG   ILE  55           QG2      ILE  55  -2.516   4.545  -1.651
  566    MD   ILE  55           QD1      ILE  55  -5.749   4.302  -0.496
  567    QG   ILE  55           QG1      ILE  55  -5.444   5.780  -2.239
  568    H    ASN  56           H        ASN  56  -2.153   6.032  -5.827
  569    HA   ASN  56           HA       ASN  56  -1.047   3.532  -6.785
  570   1HB   ASN  56          2HB       ASN  56  -0.169   6.425  -7.041
  571   2HB   ASN  56          1HB       ASN  56   0.443   5.096  -8.025
  572   1HD2  ASN  56          1HD2      ASN  56  -1.992   7.477  -7.861
  573   2HD2  ASN  56          2HD2      ASN  56  -3.027   6.843  -9.048
  574    QB   ASN  56           QB       ASN  56   0.137   5.760  -7.533
  575    QD   ASN  56           QD2      ASN  56  -2.509   7.160  -8.455
  576    H    ALA  57           H        ALA  57   0.754   2.455  -6.079
  577    HA   ALA  57           HA       ALA  57   1.931   2.893  -3.542
  578   1HB   ALA  57          1HB       ALA  57   2.166   1.150  -5.806
  579   2HB   ALA  57          2HB       ALA  57   2.691   0.855  -4.148
  580   3HB   ALA  57          3HB       ALA  57   3.790   1.616  -5.299
  581    MB   ALA  57           QB       ALA  57   2.882   1.207  -5.085
  582    HA   PRO  58           HA       PRO  58   4.794   6.164  -4.267
  583   1HB   PRO  58          2HB       PRO  58   6.745   5.545  -2.450
  584   2HB   PRO  58          1HB       PRO  58   5.165   6.207  -1.984
  585   1HG   PRO  58          2HG       PRO  58   6.142   3.399  -1.889
  586   2HG   PRO  58          1HG       PRO  58   5.110   4.275  -0.749
  587   1HD   PRO  58          2HD       PRO  58   4.163   2.486  -2.582
  588   2HD   PRO  58          1HD       PRO  58   3.206   3.837  -1.936
  589    QB   PRO  58           QB       PRO  58   5.955   5.876  -2.217
  590    QG   PRO  58           QG       PRO  58   5.626   3.837  -1.319
  591    QD   PRO  58           QD       PRO  58   3.685   3.162  -2.259
  592    H    THR  59           H        THR  59   6.338   2.948  -3.916
  593    HA   THR  59           HA       THR  59   7.771   3.352  -6.469
  594    HB   THR  59           HB       THR  59   9.325   2.795  -3.936
  595    HG1  THR  59           HG1      THR  59   8.931   5.309  -5.182
  596   1HG2  THR  59          2HG2      THR  59   9.901   3.185  -6.788
  597   2HG2  THR  59          1HG2      THR  59  10.907   4.172  -5.726
  598   3HG2  THR  59          3HG2      THR  59  10.880   2.418  -5.537
  599    MG   THR  59           QG2      THR  59  10.563   3.258  -6.017
  600    H    ASP  60           H        ASP  60   9.111   1.312  -6.953
  601    HA   ASP  60           HA       ASP  60   7.499  -1.041  -6.648
  602   1HB   ASP  60          2HB       ASP  60   9.514  -2.115  -7.677
  603   2HB   ASP  60          1HB       ASP  60   9.032  -0.640  -8.515
  604    QB   ASP  60           QB       ASP  60   9.273  -1.378  -8.096
  605    H    GLY  61           H        GLY  61   7.751  -2.824  -5.243
  606   1HA   GLY  61          1HA       GLY  61   9.067  -2.282  -2.699
  607   2HA   GLY  61          2HA       GLY  61   9.869  -3.549  -3.628
  608    QA   GLY  61           QA       GLY  61   9.468  -2.916  -3.163
  609    H    LYS  62           H        LYS  62   8.520  -3.922  -1.093
  610    HA   LYS  62           HA       LYS  62   6.143  -5.556  -1.915
  611   1HB   LYS  62          2HB       LYS  62   8.290  -6.856  -1.674
  612   2HB   LYS  62          1HB       LYS  62   8.342  -6.357   0.017
  613   1HG   LYS  62          2HG       LYS  62   5.763  -7.310  -0.242
  614   2HG   LYS  62          1HG       LYS  62   6.682  -8.406  -1.273
  615   1HD   LYS  62          2HD       LYS  62   7.776  -7.730   1.432
  616   2HD   LYS  62          1HD       LYS  62   6.451  -8.887   1.322
  617   1HE   LYS  62          2HE       LYS  62   7.729 -10.355  -0.091
  618   2HE   LYS  62          1HE       LYS  62   8.991  -9.127  -0.322
  619   1HZ   LYS  62          1HZ       LYS  62   8.214 -10.032   2.380
  620   2HZ   LYS  62          3HZ       LYS  62   9.370 -10.887   1.481
  621   3HZ   LYS  62          2HZ       LYS  62   9.646  -9.262   1.891
  622    QB   LYS  62           QB       LYS  62   8.316  -6.606  -0.829
  623    QD   LYS  62           QD       LYS  62   7.114  -8.308   1.377
  624    QG   LYS  62           QG       LYS  62   6.223  -7.858  -0.758
  625    QE   LYS  62           QE       LYS  62   8.360  -9.741  -0.206
  626    QZ   LYS  62           QZ       LYS  62   9.077 -10.060   1.918
  627    H    VAL  63           H        VAL  63   4.537  -5.770  -0.251
  628    HA   VAL  63           HA       VAL  63   4.355  -3.544   1.592
  629    HB   VAL  63           HB       VAL  63   2.777  -6.064   1.026
  630   1HG1  VAL  63          2HG1      VAL  63   2.364  -3.101   0.574
  631   2HG1  VAL  63          1HG1      VAL  63   2.586  -4.350  -0.652
  632   3HG1  VAL  63          3HG1      VAL  63   1.105  -4.306   0.306
  633   1HG2  VAL  63          2HG2      VAL  63   2.368  -4.013   3.199
  634   2HG2  VAL  63          1HG2      VAL  63   0.990  -4.842   2.477
  635   3HG2  VAL  63          3HG2      VAL  63   2.243  -5.768   3.304
  636    MG1  VAL  63           QG1      VAL  63   2.018  -3.919   0.076
  637    MG2  VAL  63           QG2      VAL  63   1.867  -4.874   2.993
  638    QG   VAL  63           QQG      VAL  63   1.942  -4.397   1.535
  639    H    GLU  64           H        GLU  64   4.977  -3.465   3.711
  640    HA   GLU  64           HA       GLU  64   6.151  -5.928   4.922
  641   1HB   GLU  64          2HB       GLU  64   6.670  -3.035   4.922
  642   2HB   GLU  64          1HB       GLU  64   6.738  -3.750   6.534
  643   1HG   GLU  64          2HG       GLU  64   8.061  -5.420   4.537
  644   2HG   GLU  64          1HG       GLU  64   8.775  -3.810   4.636
  645    QB   GLU  64           QB       GLU  64   6.704  -3.393   5.728
  646    QG   GLU  64           QG       GLU  64   8.418  -4.615   4.587
  647    H    LYS  65           H        LYS  65   3.328  -4.006   5.024
  648    HA   LYS  65           HA       LYS  65   2.146  -5.502   7.174
  649   1HB   LYS  65          2HB       LYS  65   3.868  -3.285   7.861
  650   2HB   LYS  65          1HB       LYS  65   2.216  -2.927   8.364
  651   1HG   LYS  65          2HG       LYS  65   2.134  -4.695   9.851
  652   2HG   LYS  65          1HG       LYS  65   3.291  -5.657   8.931
  653   1HD   LYS  65          2HD       LYS  65   4.859  -3.549   9.630
  654   2HD   LYS  65          1HD       LYS  65   3.775  -3.613  11.020
  655   1HE   LYS  65          2HE       LYS  65   5.358  -5.156  11.728
  656   2HE   LYS  65          1HE       LYS  65   4.323  -6.250  10.789
  657   1HZ   LYS  65          1HZ       LYS  65   5.706  -5.483   8.806
  658   2HZ   LYS  65          3HZ       LYS  65   6.826  -4.917   9.948
  659   3HZ   LYS  65          2HZ       LYS  65   6.438  -6.571   9.888
  660    QB   LYS  65           QB       LYS  65   3.042  -3.106   8.112
  661    QD   LYS  65           QD       LYS  65   4.317  -3.581  10.325
  662    QG   LYS  65           QG       LYS  65   2.713  -5.176   9.391
  663    QE   LYS  65           QE       LYS  65   4.841  -5.703  11.259
  664    QZ   LYS  65           QZ       LYS  65   6.323  -5.657   9.548
  665    H    VAL  66           H        VAL  66  -0.089  -5.147   7.131
  666    HA   VAL  66           HA       VAL  66  -1.037  -2.809   5.502
  667    HB   VAL  66           HB       VAL  66  -2.098  -5.648   5.679
  668   1HG1  VAL  66          2HG1      VAL  66  -3.694  -3.603   5.252
  669   2HG1  VAL  66          1HG1      VAL  66  -2.943  -3.591   3.657
  670   3HG1  VAL  66          3HG1      VAL  66  -3.810  -5.023   4.214
  671   1HG2  VAL  66          1HG2      VAL  66  -0.610  -4.151   3.500
  672   2HG2  VAL  66          3HG2      VAL  66  -0.014  -5.535   4.418
  673   3HG2  VAL  66          2HG2      VAL  66  -1.355  -5.736   3.290
  674    MG1  VAL  66           QG1      VAL  66  -3.482  -4.072   4.375
  675    MG2  VAL  66           QG2      VAL  66  -0.660  -5.140   3.736
  676    QG   VAL  66           QQG      VAL  66  -2.071  -4.606   4.055
  677    H    LEU  67           H        LEU  67  -1.598  -1.506   7.319
  678    HA   LEU  67           HA       LEU  67  -3.146  -2.552   9.557
  679   1HB   LEU  67          2HB       LEU  67  -2.567   0.261   8.568
  680   2HB   LEU  67          1HB       LEU  67  -3.207  -0.144  10.161
  681    HG   LEU  67           HG       LEU  67  -0.881  -1.748   9.690
  682   1HD1  LEU  67          1HD1      LEU  67  -0.691   1.134   8.889
  683   2HD1  LEU  67          3HD1      LEU  67   0.663   0.406   9.752
  684   3HD1  LEU  67          2HD1      LEU  67   0.133  -0.271   8.211
  685   1HD2  LEU  67          1HD2      LEU  67  -2.013  -0.780  11.834
  686   2HD2  LEU  67          3HD2      LEU  67  -0.256  -0.922  11.799
  687   3HD2  LEU  67          2HD2      LEU  67  -1.019   0.643  11.517
  688    MD1  LEU  67           QD1      LEU  67   0.035   0.423   8.951
  689    MD2  LEU  67           QD2      LEU  67  -1.096  -0.353  11.717
  690    QB   LEU  67           QB       LEU  67  -2.887   0.058   9.364
  691    QD   LEU  67           QQD      LEU  67  -0.531   0.035  10.334
  692    H    VAL  68           H        VAL  68  -3.900  -1.389   6.380
  693    HA   VAL  68           HA       VAL  68  -6.558  -0.382   6.880
  694    HB   VAL  68           HB       VAL  68  -5.328  -1.608   4.390
  695   1HG1  VAL  68          1HG1      VAL  68  -7.746   0.082   4.954
  696   2HG1  VAL  68          3HG1      VAL  68  -6.914   0.250   3.408
  697   3HG1  VAL  68          2HG1      VAL  68  -7.587  -1.311   3.882
  698   1HG2  VAL  68          2HG2      VAL  68  -4.600   0.730   5.881
  699   2HG2  VAL  68          1HG2      VAL  68  -3.930   0.154   4.355
  700   3HG2  VAL  68          3HG2      VAL  68  -5.318   1.241   4.354
  701    MG1  VAL  68           QG1      VAL  68  -7.416  -0.326   4.081
  702    MG2  VAL  68           QG2      VAL  68  -4.616   0.708   4.863
  703    QG   VAL  68           QQG      VAL  68  -6.016   0.191   4.472
  704    H    LYS  69           H        LYS  69  -8.541  -1.482   6.791
  705    HA   LYS  69           HA       LYS  69  -8.389  -4.472   6.566
  706   1HB   LYS  69          2HB       LYS  69  -9.802  -2.586   8.439
  707   2HB   LYS  69          1HB       LYS  69 -10.451  -4.204   8.170
  708   1HG   LYS  69          2HG       LYS  69  -7.602  -4.366   8.575
  709   2HG   LYS  69          1HG       LYS  69  -8.339  -3.473   9.906
  710   1HD   LYS  69          2HD       LYS  69  -8.314  -5.896  10.379
  711   2HD   LYS  69          1HD       LYS  69  -9.967  -5.299  10.233
  712   1HE   LYS  69          2HE       LYS  69 -10.273  -6.964   8.711
  713   2HE   LYS  69          1HE       LYS  69  -9.275  -5.992   7.613
  714   1HZ   LYS  69          1HZ       LYS  69  -8.155  -7.839   9.650
  715   2HZ   LYS  69          3HZ       LYS  69  -8.401  -8.277   8.030
  716   3HZ   LYS  69          2HZ       LYS  69  -7.312  -7.032   8.416
  717    QB   LYS  69           QB       LYS  69 -10.127  -3.395   8.305
  718    QD   LYS  69           QD       LYS  69  -9.141  -5.597  10.306
  719    QG   LYS  69           QG       LYS  69  -7.970  -3.920   9.240
  720    QE   LYS  69           QE       LYS  69  -9.774  -6.478   8.162
  721    QZ   LYS  69           QZ       LYS  69  -7.956  -7.716   8.699
  722    H    GLU  70           H        GLU  70  -9.215  -2.042   4.699
  723    HA   GLU  70           HA       GLU  70 -10.769  -1.763   2.946
  724   1HB   GLU  70          2HB       GLU  70 -10.397  -4.517   3.422
  725   2HB   GLU  70          1HB       GLU  70 -12.139  -4.300   3.253
  726   1HG   GLU  70          2HG       GLU  70 -11.646  -2.940   1.158
  727   2HG   GLU  70          1HG       GLU  70  -9.983  -3.512   1.282
  728    QB   GLU  70           QB       GLU  70 -11.268  -4.409   3.338
  729    QG   GLU  70           QG       GLU  70 -10.815  -3.226   1.220
  730    H    ARG  71           H        ARG  71 -12.749  -0.747   2.899
  731    HA   ARG  71           HA       ARG  71 -14.811   0.088   3.698
  732   1HB   ARG  71          2HB       ARG  71 -14.954  -2.589   3.382
  733   2HB   ARG  71          1HB       ARG  71 -15.292  -2.490   5.111
  734   1HG   ARG  71          2HG       ARG  71 -17.323  -1.520   4.785
  735   2HG   ARG  71          1HG       ARG  71 -16.729  -0.502   3.472
  736   1HD   ARG  71          2HD       ARG  71 -16.754  -3.337   2.736
  737   2HD   ARG  71          1HD       ARG  71 -18.368  -2.722   3.149
  738    HE   ARG  71           HE       ARG  71 -16.574  -1.495   1.092
  739   1HH1  ARG  71          1HH1      ARG  71 -19.226  -0.674   2.918
  740   2HH1  ARG  71          2HH1      ARG  71 -20.295  -0.386   1.586
  741   1HH2  ARG  71          1HH2      ARG  71 -18.123  -1.690  -0.783
  742   2HH2  ARG  71          2HH2      ARG  71 -19.670  -0.962  -0.510
  743    QB   ARG  71           QB       ARG  71 -15.123  -2.540   4.246
  744    QG   ARG  71           QG       ARG  71 -17.026  -1.011   4.129
  745    QD   ARG  71           QD       ARG  71 -17.561  -3.030   2.942
  746    QH1  ARG  71           QH1      ARG  71 -19.760  -0.530   2.252
  747    QH2  ARG  71           QH2      ARG  71 -18.897  -1.326  -0.647
  748    H    ASP  72           H        ASP  72 -12.403   0.383   5.425
  749    HA   ASP  72           HA       ASP  72 -13.802   0.571   8.075
  750   1HB   ASP  72          2HB       ASP  72 -11.922  -1.213   7.622
  751   2HB   ASP  72          1HB       ASP  72 -10.834   0.169   7.772
  752    QB   ASP  72           QB       ASP  72 -11.378  -0.522   7.697
  753    H    ALA  73           H        ALA  73 -14.066   2.725   8.514
  754    HA   ALA  73           HA       ALA  73 -12.680   4.845   7.175
  755   1HB   ALA  73          2HB       ALA  73 -14.773   4.444   9.079
  756   2HB   ALA  73          1HB       ALA  73 -13.674   5.657   9.736
  757   3HB   ALA  73          3HB       ALA  73 -14.414   5.903   8.154
  758    MB   ALA  73           QB       ALA  73 -14.287   5.335   8.990
  759    H    VAL  74           H        VAL  74 -10.929   6.130   7.871
  760    HA   VAL  74           HA       VAL  74  -9.519   5.275  10.370
  761    HB   VAL  74           HB       VAL  74  -7.398   5.419   9.012
  762   1HG1  VAL  74          3HG1      VAL  74  -8.933   3.308   9.398
  763   2HG1  VAL  74          2HG1      VAL  74  -9.219   3.450   7.663
  764   3HG1  VAL  74          1HG1      VAL  74  -7.580   3.218   8.271
  765   1HG2  VAL  74          2HG2      VAL  74  -9.404   5.700   6.755
  766   2HG2  VAL  74          1HG2      VAL  74  -8.150   6.854   7.207
  767   3HG2  VAL  74          3HG2      VAL  74  -7.706   5.294   6.516
  768    MG1  VAL  74           QG1      VAL  74  -8.577   3.325   8.444
  769    MG2  VAL  74           QG2      VAL  74  -8.420   5.949   6.826
  770    QG   VAL  74           QQG      VAL  74  -8.499   4.637   7.635
  771    H    GLN  75           H        GLN  75  -9.201   7.069  11.615
  772    HA   GLN  75           HA       GLN  75  -9.621   9.755  10.585
  773   1HB   GLN  75          2HB       GLN  75  -9.243   8.339  13.112
  774   2HB   GLN  75          1HB       GLN  75  -8.417   9.897  13.101
  775   1HG   GLN  75          2HG       GLN  75 -10.539  10.540  13.800
  776   2HG   GLN  75          1HG       GLN  75 -10.690  10.747  12.054
  777   1HE2  GLN  75          1HE2      GLN  75 -12.390   9.540  14.598
  778   2HE2  GLN  75          2HE2      GLN  75 -13.235   8.287  13.825
  779    QB   GLN  75           QB       GLN  75  -8.830   9.118  13.106
  780    QG   GLN  75           QG       GLN  75 -10.614  10.644  12.927
  781    QE   GLN  75           QE2      GLN  75 -12.812   8.913  14.211
  782    H    GLY  76           H        GLY  76  -7.961  11.476  10.710
  783   1HA   GLY  76          1HA       GLY  76  -5.836  12.344  10.222
  784   2HA   GLY  76          2HA       GLY  76  -5.535  10.819   9.388
  785    QA   GLY  76           QA       GLY  76  -5.686  11.582   9.805
  786    H    GLY  77           H        GLY  77  -3.610  10.062  10.155
  787   1HA   GLY  77          1HA       GLY  77  -3.122  10.227  13.098
  788   2HA   GLY  77          2HA       GLY  77  -1.846  10.137  11.886
  789    QA   GLY  77           QA       GLY  77  -2.484  10.182  12.492
  790    H    GLN  78           H        GLN  78  -4.281   8.062  10.908
  791    HA   GLN  78           HA       GLN  78  -3.348   5.771  12.561
  792   1HB   GLN  78          2HB       GLN  78  -5.760   6.203  12.237
  793   2HB   GLN  78          1HB       GLN  78  -5.548   6.082  10.490
  794   1HG   GLN  78          2HG       GLN  78  -5.926   3.869  10.686
  795   2HG   GLN  78          1HG       GLN  78  -4.375   3.750  11.520
  796   1HE2  GLN  78          1HE2      GLN  78  -6.751   2.121  12.133
  797   2HE2  GLN  78          2HE2      GLN  78  -7.191   2.485  13.732
  798    QB   GLN  78           QB       GLN  78  -5.654   6.143  11.364
  799    QG   GLN  78           QG       GLN  78  -5.151   3.809  11.103
  800    QE   GLN  78           QE2      GLN  78  -6.971   2.303  12.932
  801    H    GLY  79           H        GLY  79  -1.749   4.472  11.744
  802   1HA   GLY  79          1HA       GLY  79  -0.342   3.407  10.197
  803   2HA   GLY  79          2HA       GLY  79  -0.591   4.816   9.164
  804    QA   GLY  79           QA       GLY  79  -0.466   4.111   9.681
  805    H    LEU  80           H        LEU  80  -1.035   3.853   7.193
  806    HA   LEU  80           HA       LEU  80  -3.474   2.123   7.086
  807   1HB   LEU  80          2HB       LEU  80  -2.084   3.968   5.125
  808   2HB   LEU  80          1HB       LEU  80  -3.440   2.934   4.674
  809    HG   LEU  80           HG       LEU  80  -3.616   4.824   7.020
  810   1HD1  LEU  80          3HD1      LEU  80  -3.878   5.379   4.086
  811   2HD1  LEU  80          2HD1      LEU  80  -4.970   6.195   5.205
  812   3HD1  LEU  80          1HD1      LEU  80  -3.227   6.406   5.362
  813   1HD2  LEU  80          3HD2      LEU  80  -5.250   2.865   6.528
  814   2HD2  LEU  80          2HD2      LEU  80  -5.938   4.456   6.851
  815   3HD2  LEU  80          1HD2      LEU  80  -5.815   3.868   5.193
  816    MD1  LEU  80           QD1      LEU  80  -4.025   5.993   4.884
  817    MD2  LEU  80           QD2      LEU  80  -5.668   3.730   6.191
  818    QB   LEU  80           QB       LEU  80  -2.762   3.451   4.899
  819    QD   LEU  80           QQD      LEU  80  -4.846   4.862   5.537
  820    H    ILE  81           H        ILE  81  -0.393   2.530   5.280
  821    HA   ILE  81           HA       ILE  81  -0.082  -0.437   5.276
  822    HB   ILE  81           HB       ILE  81  -1.324   0.274   3.249
  823   1HG1  ILE  81          2HG1      ILE  81   1.509  -0.403   2.440
  824   2HG1  ILE  81          1HG1      ILE  81   0.480  -1.574   3.267
  825   1HG2  ILE  81          3HG2      ILE  81   0.670   2.377   3.319
  826   2HG2  ILE  81          2HG2      ILE  81   0.672   1.570   1.751
  827   3HG2  ILE  81          1HG2      ILE  81  -0.815   2.285   2.373
  828   1HD1  ILE  81          3HD1      ILE  81  -1.149  -0.519   1.254
  829   2HD1  ILE  81          2HD1      ILE  81   0.425  -0.724   0.484
  830   3HD1  ILE  81          1HD1      ILE  81  -0.370  -2.102   1.246
  831    MG   ILE  81           QG2      ILE  81   0.176   2.077   2.481
  832    MD   ILE  81           QD1      ILE  81  -0.365  -1.115   0.995
  833    QG   ILE  81           QG1      ILE  81   0.994  -0.988   2.854
  834    H    LYS  82           H        LYS  82   2.165  -1.003   4.362
  835    HA   LYS  82           HA       LYS  82   4.160   1.183   4.751
  836   1HB   LYS  82          2HB       LYS  82   3.736   0.034   6.906
  837   2HB   LYS  82          1HB       LYS  82   4.118  -1.512   6.150
  838   1HG   LYS  82          2HG       LYS  82   6.039  -0.589   7.414
  839   2HG   LYS  82          1HG       LYS  82   6.405  -0.766   5.712
  840   1HD   LYS  82          2HD       LYS  82   5.939   1.630   5.345
  841   2HD   LYS  82          1HD       LYS  82   5.534   1.812   7.046
  842   1HE   LYS  82          2HE       LYS  82   7.718   2.193   7.489
  843   2HE   LYS  82          1HE       LYS  82   8.091   0.552   6.925
  844   1HZ   LYS  82          1HZ       LYS  82   7.882   1.495   4.610
  845   2HZ   LYS  82          3HZ       LYS  82   7.927   3.036   5.318
  846   3HZ   LYS  82          2HZ       LYS  82   9.252   1.987   5.486
  847    QB   LYS  82           QB       LYS  82   3.927  -0.739   6.528
  848    QD   LYS  82           QD       LYS  82   5.736   1.721   6.196
  849    QG   LYS  82           QG       LYS  82   6.222  -0.677   6.563
  850    QE   LYS  82           QE       LYS  82   7.905   1.372   7.207
  851    QZ   LYS  82           QZ       LYS  82   8.353   2.173   5.138
  852    H    ILE  83           H        ILE  83   6.435   0.269   4.138
  853    HA   ILE  83           HA       ILE  83   6.363  -2.006   2.244
  854    HB   ILE  83           HB       ILE  83   7.305  -0.467   0.444
  855   1HG1  ILE  83          2HG1      ILE  83   6.021   1.832   1.842
  856   2HG1  ILE  83          1HG1      ILE  83   7.615   1.348   2.417
  857   1HG2  ILE  83          2HG2      ILE  83   4.820  -1.230   0.821
  858   2HG2  ILE  83          1HG2      ILE  83   4.562   0.463   1.240
  859   3HG2  ILE  83          3HG2      ILE  83   5.170   0.034  -0.358
  860   1HD1  ILE  83          2HD1      ILE  83   8.313   1.368  -0.070
  861   2HD1  ILE  83          1HD1      ILE  83   6.823   2.272  -0.344
  862   3HD1  ILE  83          3HD1      ILE  83   8.070   2.929   0.715
  863    MG   ILE  83           QG2      ILE  83   4.851  -0.244   0.568
  864    MD   ILE  83           QD1      ILE  83   7.735   2.190   0.100
  865    QG   ILE  83           QG1      ILE  83   6.818   1.590   2.129
  866    H    GLY  84           H        GLY  84   8.312  -3.066   2.345
  867   1HA   GLY  84          1HA       GLY  84  10.874  -1.888   2.440
  868   2HA   GLY  84          2HA       GLY  84  10.524  -3.530   2.979
  869    QA   GLY  84           QA       GLY  84  10.699  -2.709   2.709

  No H/Q in entry =         869
  Start of MODEL   14
    1    H1   MET   1          2H        MET   1  -9.851  11.738  27.924
    2    H2   MET   1          1H        MET   1 -11.475  11.801  27.428
    3    H3   MET   1          3H        MET   1 -10.585  13.235  27.597
    4    HA   MET   1           HA       MET   1 -12.080  12.948  29.485
    5   1HB   MET   1          2HB       MET   1 -11.162  10.266  29.038
    6   2HB   MET   1          1HB       MET   1 -10.788  10.712  30.703
    7   1HG   MET   1          2HG       MET   1 -13.020  11.043  31.262
    8   2HG   MET   1          1HG       MET   1 -13.493  11.384  29.597
    9   1HE   MET   1          1HE       MET   1 -13.825  10.158  27.951
   10   2HE   MET   1          3HE       MET   1 -13.734   8.406  27.726
   11   3HE   MET   1          2HE       MET   1 -15.169   9.133  28.447
   12    QB   MET   1           QB       MET   1 -10.975  10.489  29.870
   13    QG   MET   1           QG       MET   1 -13.257  11.213  30.429
   14    ME   MET   1           QE       MET   1 -14.243   9.232  28.041
   15    H    LYS   2           H        LYS   2 -10.903  12.437  31.946
   16    HA   LYS   2           HA       LYS   2  -9.053  14.587  32.263
   17   1HB   LYS   2          2HB       LYS   2  -9.777  12.163  33.932
   18   2HB   LYS   2          1HB       LYS   2  -8.751  13.468  34.531
   19   1HG   LYS   2          2HG       LYS   2 -11.181  14.484  33.277
   20   2HG   LYS   2          1HG       LYS   2 -11.536  13.401  34.624
   21   1HD   LYS   2          2HD       LYS   2 -10.125  14.701  36.111
   22   2HD   LYS   2          1HD       LYS   2  -9.589  15.719  34.774
   23   1HE   LYS   2          2HE       LYS   2 -11.772  16.690  34.516
   24   2HE   LYS   2          1HE       LYS   2 -12.500  15.488  35.600
   25   1HZ   LYS   2          2HZ       LYS   2 -10.803  16.299  37.289
   26   2HZ   LYS   2          1HZ       LYS   2 -10.591  17.646  36.276
   27   3HZ   LYS   2          3HZ       LYS   2 -12.111  17.334  36.962
   28    QB   LYS   2           QB       LYS   2  -9.264  12.816  34.231
   29    QD   LYS   2           QD       LYS   2  -9.857  15.210  35.443
   30    QG   LYS   2           QG       LYS   2 -11.358  13.942  33.950
   31    QE   LYS   2           QE       LYS   2 -12.136  16.089  35.058
   32    QZ   LYS   2           QZ       LYS   2 -11.168  17.093  36.842
   33    H    LEU   3           H        LEU   3  -8.476  11.046  32.328
   34    HA   LEU   3           HA       LEU   3  -5.551  11.489  32.228
   35   1HB   LEU   3          2HB       LEU   3  -7.465   9.410  32.976
   36   2HB   LEU   3          1HB       LEU   3  -6.124   8.765  32.028
   37    HG   LEU   3           HG       LEU   3  -5.595   8.745  34.441
   38   1HD1  LEU   3          2HD1      LEU   3  -3.999   9.648  32.384
   39   2HD1  LEU   3          1HD1      LEU   3  -3.831  10.937  33.577
   40   3HD1  LEU   3          3HD1      LEU   3  -3.429   9.275  34.010
   41   1HD2  LEU   3          3HD2      LEU   3  -7.027  11.042  34.588
   42   2HD2  LEU   3          2HD2      LEU   3  -5.849  10.564  35.809
   43   3HD2  LEU   3          1HD2      LEU   3  -5.393  11.705  34.545
   44    MD1  LEU   3           QD1      LEU   3  -3.753   9.953  33.324
   45    MD2  LEU   3           QD2      LEU   3  -6.090  11.104  34.980
   46    QB   LEU   3           QB       LEU   3  -6.795   9.087  32.502
   47    QD   LEU   3           QQD      LEU   3  -4.922  10.528  34.152
   48    H    LYS   4           H        LYS   4  -8.192  10.603  30.105
   49    HA   LYS   4           HA       LYS   4  -8.246  10.203  27.777
   50   1HB   LYS   4          2HB       LYS   4  -6.766  12.308  28.054
   51   2HB   LYS   4          1HB       LYS   4  -5.402  11.225  27.778
   52   1HG   LYS   4          2HG       LYS   4  -6.160  10.650  25.601
   53   2HG   LYS   4          1HG       LYS   4  -7.762  11.326  25.896
   54   1HD   LYS   4          2HD       LYS   4  -6.322  13.542  26.326
   55   2HD   LYS   4          1HD       LYS   4  -5.210  12.719  25.230
   56   1HE   LYS   4          2HE       LYS   4  -6.708  12.786  23.442
   57   2HE   LYS   4          1HE       LYS   4  -8.127  12.870  24.506
   58   1HZ   LYS   4          3HZ       LYS   4  -6.076  15.000  24.490
   59   2HZ   LYS   4          2HZ       LYS   4  -7.379  15.028  23.401
   60   3HZ   LYS   4          1HZ       LYS   4  -7.667  15.072  25.074
   61    QB   LYS   4           QB       LYS   4  -6.084  11.767  27.916
   62    QD   LYS   4           QD       LYS   4  -5.766  13.130  25.778
   63    QG   LYS   4           QG       LYS   4  -6.961  10.988  25.749
   64    QE   LYS   4           QE       LYS   4  -7.418  12.828  23.974
   65    QZ   LYS   4           QZ       LYS   4  -7.040  15.033  24.322
   66    H    VAL   5           H        VAL   5  -7.461   8.640  26.205
   67    HA   VAL   5           HA       VAL   5  -6.418   6.220  27.286
   68    HB   VAL   5           HB       VAL   5  -7.794   6.424  25.251
   69   1HG1  VAL   5          1HG1      VAL   5  -6.043   8.497  24.637
   70   2HG1  VAL   5          3HG1      VAL   5  -5.608   7.234  23.484
   71   3HG1  VAL   5          2HG1      VAL   5  -7.267   7.829  23.557
   72   1HG2  VAL   5          3HG2      VAL   5  -5.264   4.974  25.408
   73   2HG2  VAL   5          2HG2      VAL   5  -6.839   4.417  24.845
   74   3HG2  VAL   5          1HG2      VAL   5  -5.758   5.265  23.741
   75    MG1  VAL   5           QG1      VAL   5  -6.306   7.853  23.893
   76    MG2  VAL   5           QG2      VAL   5  -5.954   4.885  24.665
   77    QG   VAL   5           QQG      VAL   5  -6.130   6.369  24.279
   78    H    THR   6           H        THR   6  -4.335   5.754  27.856
   79    HA   THR   6           HA       THR   6  -2.136   7.555  27.107
   80    HB   THR   6           HB       THR   6  -0.931   5.679  28.516
   81    HG1  THR   6           HG1      THR   6  -2.266   4.356  29.576
   82   1HG2  THR   6          2HG2      THR   6  -1.458   7.957  29.318
   83   2HG2  THR   6          1HG2      THR   6  -3.096   7.432  29.710
   84   3HG2  THR   6          3HG2      THR   6  -1.721   6.754  30.582
   85    MG   THR   6           QG2      THR   6  -2.092   7.381  29.870
   86    H    VAL   7           H        VAL   7  -0.407   7.001  25.733
   87    HA   VAL   7           HA       VAL   7  -0.855   5.277  23.531
   88    HB   VAL   7           HB       VAL   7   0.766   7.128  23.602
   89   1HG1  VAL   7          2HG1      VAL   7   1.518   5.888  26.034
   90   2HG1  VAL   7          1HG1      VAL   7   2.920   5.785  24.968
   91   3HG1  VAL   7          3HG1      VAL   7   2.197   7.353  25.326
   92   1HG2  VAL   7          3HG2      VAL   7   1.975   4.388  23.133
   93   2HG2  VAL   7          2HG2      VAL   7   1.203   5.428  21.936
   94   3HG2  VAL   7          1HG2      VAL   7   2.749   5.895  22.644
   95    MG1  VAL   7           QG1      VAL   7   2.212   6.342  25.443
   96    MG2  VAL   7           QG2      VAL   7   1.976   5.237  22.571
   97    QG   VAL   7           QQG      VAL   7   2.094   5.790  24.007
   98    H    ASN   8           H        ASN   8  -0.482   3.090  23.224
   99    HA   ASN   8           HA       ASN   8   1.304   1.560  24.972
  100   1HB   ASN   8          2HB       ASN   8  -0.572   0.156  25.862
  101   2HB   ASN   8          1HB       ASN   8  -0.660   1.833  26.404
  102   1HD2  ASN   8          1HD2      ASN   8  -1.961  -0.364  23.868
  103   2HD2  ASN   8          2HD2      ASN   8  -3.428   0.471  23.686
  104    QB   ASN   8           QB       ASN   8  -0.616   0.994  26.133
  105    QD   ASN   8           QD2      ASN   8  -2.694   0.053  23.777
  106    H    GLY   9           H        GLY   9   1.013   1.994  22.098
  107   1HA   GLY   9          1HA       GLY   9  -0.247  -0.368  20.944
  108   2HA   GLY   9          2HA       GLY   9   1.512  -0.495  21.013
  109    QA   GLY   9           QA       GLY   9   0.633  -0.431  20.979
  110    H    ALA  10           H        ALA  10   0.722  -0.544  18.525
  111    HA   ALA  10           HA       ALA  10   1.551   2.056  17.422
  112   1HB   ALA  10          1HB       ALA  10   0.653  -0.227  15.725
  113   2HB   ALA  10          3HB       ALA  10   2.089   0.784  15.571
  114   3HB   ALA  10          2HB       ALA  10   2.046  -0.509  16.769
  115    MB   ALA  10           QB       ALA  10   1.596   0.016  16.022
  116    H    GLY  11           H        GLY  11   0.249   3.307  15.974
  117   1HA   GLY  11          1HA       GLY  11  -2.471   3.636  16.595
  118   2HA   GLY  11          2HA       GLY  11  -2.420   2.558  15.198
  119    QA   GLY  11           QA       GLY  11  -2.446   3.097  15.897
  120    H    LYS  12           H        LYS  12  -1.206   5.712  16.350
  121    HA   LYS  12           HA       LYS  12  -2.026   7.182  14.070
  122   1HB   LYS  12          2HB       LYS  12  -1.365   8.077  16.297
  123   2HB   LYS  12          1HB       LYS  12   0.312   7.657  15.949
  124   1HG   LYS  12          2HG       LYS  12   0.086   9.097  13.845
  125   2HG   LYS  12          1HG       LYS  12  -1.420   9.696  14.542
  126   1HD   LYS  12          2HD       LYS  12   0.566   9.789  16.585
  127   2HD   LYS  12          1HD       LYS  12   1.259  10.519  15.137
  128   1HE   LYS  12          2HE       LYS  12   0.089  12.398  15.628
  129   2HE   LYS  12          1HE       LYS  12  -1.398  11.490  15.288
  130   1HZ   LYS  12          1HZ       LYS  12   0.059  11.454  17.879
  131   2HZ   LYS  12          3HZ       LYS  12  -1.343  12.359  17.576
  132   3HZ   LYS  12          2HZ       LYS  12  -1.404  10.662  17.535
  133    QB   LYS  12           QB       LYS  12  -0.526   7.867  16.123
  134    QD   LYS  12           QD       LYS  12   0.912  10.154  15.861
  135    QG   LYS  12           QG       LYS  12  -0.667   9.397  14.194
  136    QE   LYS  12           QE       LYS  12  -0.654  11.944  15.458
  137    QZ   LYS  12           QZ       LYS  12  -0.896  11.491  17.663
  138    H    ALA  13           H        ALA  13   1.329   6.154  14.858
  139    HA   ALA  13           HA       ALA  13   1.867   5.313  12.125
  140   1HB   ALA  13          3HB       ALA  13   3.607   7.277  11.927
  141   2HB   ALA  13          2HB       ALA  13   1.911   7.589  11.558
  142   3HB   ALA  13          1HB       ALA  13   2.574   8.063  13.121
  143    MB   ALA  13           QB       ALA  13   2.697   7.643  12.202
  144    H    GLY  14           H        GLY  14   3.711   4.030  12.122
  145   1HA   GLY  14          1HA       GLY  14   5.166   2.606  13.446
  146   2HA   GLY  14          2HA       GLY  14   5.207   3.859  14.689
  147    QA   GLY  14           QA       GLY  14   5.186   3.233  14.068
  148    H    GLU  15           H        GLU  15   6.971   2.471  12.216
  149    HA   GLU  15           HA       GLU  15   8.673   4.928  11.943
  150   1HB   GLU  15          2HB       GLU  15   9.389   1.985  12.153
  151   2HB   GLU  15          1HB       GLU  15  10.559   3.275  11.872
  152   1HG   GLU  15          2HG       GLU  15   9.388   4.317  14.027
  153   2HG   GLU  15          1HG       GLU  15   9.014   2.624  14.347
  154    QB   GLU  15           QB       GLU  15   9.974   2.630  12.013
  155    QG   GLU  15           QG       GLU  15   9.201   3.470  14.187
  156    H    GLY  16           H        GLY  16   7.429   2.004  10.364
  157   1HA   GLY  16          1HA       GLY  16   8.210   1.426   8.045
  158   2HA   GLY  16          2HA       GLY  16   8.299   3.160   7.743
  159    QA   GLY  16           QA       GLY  16   8.254   2.293   7.894
  160    H    GLU  17           H        GLU  17   5.673   3.230   9.498
  161    HA   GLU  17           HA       GLU  17   3.767   2.106   7.508
  162   1HB   GLU  17          2HB       GLU  17   3.457   3.351  10.261
  163   2HB   GLU  17          1HB       GLU  17   2.130   2.668   9.319
  164   1HG   GLU  17          2HG       GLU  17   2.841   0.498   9.627
  165   2HG   GLU  17          1HG       GLU  17   4.540   0.959   9.741
  166    QB   GLU  17           QB       GLU  17   2.794   3.009   9.790
  167    QG   GLU  17           QG       GLU  17   3.691   0.728   9.684
  168    H    ILE  18           H        ILE  18   2.945   3.451   5.963
  169    HA   ILE  18           HA       ILE  18   3.452   6.336   6.054
  170    HB   ILE  18           HB       ILE  18   1.907   4.568   4.131
  171   1HG1  ILE  18          2HG1      ILE  18   4.609   5.625   3.486
  172   2HG1  ILE  18          1HG1      ILE  18   4.551   4.357   4.711
  173   1HG2  ILE  18          2HG2      ILE  18   1.870   7.306   4.273
  174   2HG2  ILE  18          1HG2      ILE  18   3.226   7.028   3.180
  175   3HG2  ILE  18          3HG2      ILE  18   1.633   6.383   2.789
  176   1HD1  ILE  18          3HD1      ILE  18   3.056   4.067   2.108
  177   2HD1  ILE  18          2HD1      ILE  18   4.760   3.631   2.231
  178   3HD1  ILE  18          1HD1      ILE  18   3.564   2.806   3.232
  179    MG   ILE  18           QG2      ILE  18   2.243   6.906   3.414
  180    MD   ILE  18           QD1      ILE  18   3.794   3.502   2.524
  181    QG   ILE  18           QG1      ILE  18   4.580   4.991   4.098
  182    HA   PRO  19           HA       PRO  19  -0.539   6.917   8.069
  183   1HB   PRO  19          2HB       PRO  19  -0.269   9.607   8.485
  184   2HB   PRO  19          1HB       PRO  19   0.494   8.388   9.525
  185   1HG   PRO  19          2HG       PRO  19   1.681  10.040   7.359
  186   2HG   PRO  19          1HG       PRO  19   2.383   9.519   8.898
  187   1HD   PRO  19          2HD       PRO  19   2.945   8.355   6.481
  188   2HD   PRO  19          1HD       PRO  19   3.091   7.526   8.046
  189    QB   PRO  19           QB       PRO  19   0.113   8.998   9.005
  190    QG   PRO  19           QG       PRO  19   2.032   9.780   8.129
  191    QD   PRO  19           QD       PRO  19   3.018   7.941   7.264
  192    H    ALA  20           H        ALA  20  -2.482   7.356   7.047
  193    HA   ALA  20           HA       ALA  20  -2.461   8.443   4.333
  194   1HB   ALA  20          2HB       ALA  20  -5.010   8.023   5.783
  195   2HB   ALA  20          1HB       ALA  20  -4.482   7.373   4.230
  196   3HB   ALA  20          3HB       ALA  20  -3.941   6.622   5.731
  197    MB   ALA  20           QB       ALA  20  -4.478   7.340   5.248
  198    HA   PRO  21           HA       PRO  21  -3.195  12.590   5.866
  199   1HB   PRO  21          2HB       PRO  21  -3.400  13.810   3.428
  200   2HB   PRO  21          1HB       PRO  21  -1.845  13.351   4.148
  201   1HG   PRO  21          2HG       PRO  21  -3.419  12.001   2.021
  202   2HG   PRO  21          1HG       PRO  21  -1.666  12.175   2.192
  203   1HD   PRO  21          2HD       PRO  21  -3.051   9.888   2.799
  204   2HD   PRO  21          1HD       PRO  21  -1.485  10.326   3.514
  205    QB   PRO  21           QB       PRO  21  -2.623  13.581   3.788
  206    QG   PRO  21           QG       PRO  21  -2.543  12.088   2.106
  207    QD   PRO  21           QD       PRO  21  -2.268  10.107   3.157
  208    H    LEU  22           H        LEU  22  -5.109  13.719   6.264
  209    HA   LEU  22           HA       LEU  22  -7.415  14.224   6.225
  210   1HB   LEU  22          2HB       LEU  22  -6.464  14.357   3.663
  211   2HB   LEU  22          1HB       LEU  22  -7.752  13.165   3.482
  212    HG   LEU  22           HG       LEU  22  -8.480  15.501   5.128
  213   1HD1  LEU  22          3HD1      LEU  22  -7.819  15.765   2.183
  214   2HD1  LEU  22          2HD1      LEU  22  -8.838  16.908   3.058
  215   3HD1  LEU  22          1HD1      LEU  22  -7.147  16.704   3.515
  216   1HD2  LEU  22          1HD2      LEU  22 -10.053  13.719   4.400
  217   2HD2  LEU  22          3HD2      LEU  22 -10.538  15.307   3.805
  218   3HD2  LEU  22          2HD2      LEU  22  -9.750  14.161   2.720
  219    MD1  LEU  22           QD1      LEU  22  -7.935  16.459   2.919
  220    MD2  LEU  22           QD2      LEU  22 -10.114  14.396   3.642
  221    QB   LEU  22           QB       LEU  22  -7.108  13.761   3.572
  222    QD   LEU  22           QQD      LEU  22  -9.024  15.427   3.280
  223    H    ALA  23           H        ALA  23  -9.003  13.009   7.168
  224    HA   ALA  23           HA       ALA  23  -8.935  10.187   7.395
  225   1HB   ALA  23          2HB       ALA  23 -11.102  12.279   7.680
  226   2HB   ALA  23          1HB       ALA  23 -11.378  10.586   8.088
  227   3HB   ALA  23          3HB       ALA  23 -10.158  11.515   8.959
  228    MB   ALA  23           QB       ALA  23 -10.879  11.460   8.242
  229    H    GLY  24           H        GLY  24 -10.786   8.727   6.584
  230   1HA   GLY  24          1HA       GLY  24 -10.779   8.662   3.720
  231   2HA   GLY  24          2HA       GLY  24 -12.329   9.290   4.285
  232    QA   GLY  24           QA       GLY  24 -11.554   8.976   4.003
  233    H    THR  25           H        THR  25 -12.628   7.006   2.993
  234    HA   THR  25           HA       THR  25 -12.597   4.817   5.039
  235    HB   THR  25           HB       THR  25 -14.887   5.605   3.209
  236    HG1  THR  25           HG1      THR  25 -14.619   5.885   6.017
  237   1HG2  THR  25          3HG2      THR  25 -14.294   3.244   4.781
  238   2HG2  THR  25          2HG2      THR  25 -15.766   4.027   5.359
  239   3HG2  THR  25          1HG2      THR  25 -15.634   3.534   3.671
  240    MG   THR  25           QG2      THR  25 -15.231   3.601   4.604
  241    H    VAL  26           H        VAL  26 -12.346   2.720   4.157
  242    HA   VAL  26           HA       VAL  26 -11.224   2.619   1.433
  243    HB   VAL  26           HB       VAL  26 -11.686   0.414   3.470
  244   1HG1  VAL  26          2HG1      VAL  26 -10.706   0.403   0.826
  245   2HG1  VAL  26          1HG1      VAL  26  -9.286   0.253   1.861
  246   3HG1  VAL  26          3HG1      VAL  26 -10.606  -0.908   2.001
  247   1HG2  VAL  26          3HG2      VAL  26  -9.363   2.339   3.152
  248   2HG2  VAL  26          2HG2      VAL  26 -10.425   2.189   4.552
  249   3HG2  VAL  26          1HG2      VAL  26  -9.314   0.881   4.144
  250    MG1  VAL  26           QG1      VAL  26 -10.199  -0.084   1.563
  251    MG2  VAL  26           QG2      VAL  26  -9.701   1.803   3.950
  252    QG   VAL  26           QQG      VAL  26  -9.950   0.860   2.756
  253    H    SER  27           H        SER  27 -12.307   1.808  -0.340
  254    HA   SER  27           HA       SER  27 -15.064   0.722   0.113
  255   1HB   SER  27          2HB       SER  27 -15.098   1.413  -2.448
  256   2HB   SER  27          1HB       SER  27 -15.268   2.638  -1.195
  257    HG   SER  27           HG       SER  27 -13.598   3.470  -2.186
  258    QB   SER  27           QB       SER  27 -15.183   2.026  -1.821
  259    H    LYS  28           H        LYS  28 -11.905   0.001  -1.159
  260    HA   LYS  28           HA       LYS  28 -12.572  -2.793  -1.561
  261   1HB   LYS  28          2HB       LYS  28 -13.173  -0.952  -3.635
  262   2HB   LYS  28          1HB       LYS  28 -11.759  -1.861  -4.168
  263   1HG   LYS  28          2HG       LYS  28 -13.268  -3.871  -3.126
  264   2HG   LYS  28          1HG       LYS  28 -14.533  -2.786  -3.705
  265   1HD   LYS  28          2HD       LYS  28 -14.130  -3.372  -5.841
  266   2HD   LYS  28          1HD       LYS  28 -12.423  -2.965  -5.668
  267   1HE   LYS  28          2HE       LYS  28 -12.172  -5.232  -4.462
  268   2HE   LYS  28          1HE       LYS  28 -13.771  -5.618  -5.128
  269   1HZ   LYS  28          3HZ       LYS  28 -12.912  -4.912  -7.326
  270   2HZ   LYS  28          2HZ       LYS  28 -11.362  -4.773  -6.646
  271   3HZ   LYS  28          1HZ       LYS  28 -12.130  -6.287  -6.716
  272    QB   LYS  28           QB       LYS  28 -12.466  -1.406  -3.901
  273    QD   LYS  28           QD       LYS  28 -13.277  -3.168  -5.754
  274    QG   LYS  28           QG       LYS  28 -13.901  -3.328  -3.416
  275    QE   LYS  28           QE       LYS  28 -12.972  -5.425  -4.795
  276    QZ   LYS  28           QZ       LYS  28 -12.135  -5.324  -6.896
  277    H    ILE  29           H        ILE  29 -10.670  -3.782  -1.027
  278    HA   ILE  29           HA       ILE  29  -8.122  -2.322  -1.154
  279    HB   ILE  29           HB       ILE  29  -8.816  -3.781   0.732
  280   1HG1  ILE  29          2HG1      ILE  29  -6.597  -5.415  -0.199
  281   2HG1  ILE  29          1HG1      ILE  29  -6.324  -3.709  -0.552
  282   1HG2  ILE  29          3HG2      ILE  29  -9.620  -5.497  -1.337
  283   2HG2  ILE  29          2HG2      ILE  29  -8.253  -6.313  -0.576
  284   3HG2  ILE  29          1HG2      ILE  29  -9.652  -5.846   0.392
  285   1HD1  ILE  29          3HD1      ILE  29  -7.166  -3.360   1.917
  286   2HD1  ILE  29          2HD1      ILE  29  -6.708  -5.053   2.105
  287   3HD1  ILE  29          1HD1      ILE  29  -5.501  -3.860   1.625
  288    MG   ILE  29           QG2      ILE  29  -9.175  -5.885  -0.507
  289    MD   ILE  29           QD1      ILE  29  -6.459  -4.091   1.882
  290    QG   ILE  29           QG1      ILE  29  -6.460  -4.562  -0.375
  291    H    LEU  30           H        LEU  30  -6.389  -2.837  -2.551
  292    HA   LEU  30           HA       LEU  30  -7.044  -4.740  -4.780
  293   1HB   LEU  30          2HB       LEU  30  -6.076  -1.964  -4.624
  294   2HB   LEU  30          1HB       LEU  30  -5.152  -2.975  -5.735
  295    HG   LEU  30           HG       LEU  30  -7.052  -1.909  -6.892
  296   1HD1  LEU  30          3HD1      LEU  30  -8.448  -1.899  -4.719
  297   2HD1  LEU  30          2HD1      LEU  30  -9.302  -2.234  -6.224
  298   3HD1  LEU  30          1HD1      LEU  30  -8.876  -3.556  -5.139
  299   1HD2  LEU  30          3HD2      LEU  30  -6.247  -4.422  -7.206
  300   2HD2  LEU  30          2HD2      LEU  30  -7.872  -4.777  -6.619
  301   3HD2  LEU  30          1HD2      LEU  30  -7.652  -3.810  -8.078
  302    MD1  LEU  30           QD1      LEU  30  -8.875  -2.563  -5.360
  303    MD2  LEU  30           QD2      LEU  30  -7.257  -4.336  -7.301
  304    QB   LEU  30           QB       LEU  30  -5.614  -2.469  -5.180
  305    QD   LEU  30           QQD      LEU  30  -8.066  -3.450  -6.331
  306    H    VAL  31           H        VAL  31  -4.664  -3.725  -2.408
  307    HA   VAL  31           HA       VAL  31  -2.693  -5.683  -3.524
  308    HB   VAL  31           HB       VAL  31  -1.985  -3.333  -3.245
  309   1HG1  VAL  31          3HG1      VAL  31  -3.331  -3.721  -0.670
  310   2HG1  VAL  31          2HG1      VAL  31  -1.742  -2.973  -0.509
  311   3HG1  VAL  31          1HG1      VAL  31  -2.969  -2.226  -1.533
  312   1HG2  VAL  31          1HG2      VAL  31  -0.529  -5.463  -2.627
  313   2HG2  VAL  31          3HG2      VAL  31   0.083  -3.838  -2.321
  314   3HG2  VAL  31          2HG2      VAL  31  -0.619  -4.778  -1.004
  315    MG1  VAL  31           QG1      VAL  31  -2.680  -2.973  -0.904
  316    MG2  VAL  31           QG2      VAL  31  -0.355  -4.693  -1.984
  317    QG   VAL  31           QQG      VAL  31  -1.518  -3.833  -1.444
  318    H    LYS  32           H        LYS  32  -1.485  -6.962  -1.834
  319    HA   LYS  32           HA       LYS  32  -3.104  -7.464   0.634
  320   1HB   LYS  32          2HB       LYS  32  -2.797  -9.900   0.173
  321   2HB   LYS  32          1HB       LYS  32  -3.727  -9.091  -1.088
  322   1HG   LYS  32          2HG       LYS  32  -1.003  -8.838  -1.820
  323   2HG   LYS  32          1HG       LYS  32  -1.231 -10.514  -1.323
  324   1HD   LYS  32          2HD       LYS  32  -3.447  -9.524  -2.957
  325   2HD   LYS  32          1HD       LYS  32  -1.901  -9.459  -3.804
  326   1HE   LYS  32          2HE       LYS  32  -1.497 -11.846  -3.227
  327   2HE   LYS  32          1HE       LYS  32  -3.090 -11.905  -2.444
  328   1HZ   LYS  32          3HZ       LYS  32  -2.796 -10.884  -5.199
  329   2HZ   LYS  32          2HZ       LYS  32  -2.934 -12.553  -4.913
  330   3HZ   LYS  32          1HZ       LYS  32  -4.180 -11.500  -4.436
  331    QB   LYS  32           QB       LYS  32  -3.262  -9.496  -0.457
  332    QD   LYS  32           QD       LYS  32  -2.674  -9.492  -3.380
  333    QG   LYS  32           QG       LYS  32  -1.117  -9.676  -1.572
  334    QE   LYS  32           QE       LYS  32  -2.293 -11.876  -2.836
  335    QZ   LYS  32           QZ       LYS  32  -3.303 -11.645  -4.849
  336    H    GLU  33           H        GLU  33  -1.791  -8.847   2.216
  337    HA   GLU  33           HA       GLU  33   0.832  -7.670   2.600
  338   1HB   GLU  33          2HB       GLU  33   0.819  -9.170   4.579
  339   2HB   GLU  33          1HB       GLU  33  -0.708  -8.303   4.419
  340   1HG   GLU  33          2HG       GLU  33  -1.109 -10.585   2.890
  341   2HG   GLU  33          1HG       GLU  33  -0.185 -11.177   4.271
  342    QB   GLU  33           QB       GLU  33   0.055  -8.736   4.499
  343    QG   GLU  33           QG       GLU  33  -0.647 -10.881   3.581
  344    H    GLY  34           H        GLY  34   2.857  -8.879   2.683
  345   1HA   GLY  34          1HA       GLY  34   3.099 -11.593   1.778
  346   2HA   GLY  34          2HA       GLY  34   4.424 -10.433   1.883
  347    QA   GLY  34           QA       GLY  34   3.762 -11.013   1.831
  348    H    ASP  35           H        ASP  35   2.790  -8.565   0.104
  349    HA   ASP  35           HA       ASP  35   3.234 -10.011  -2.489
  350   1HB   ASP  35          2HB       ASP  35   0.962  -8.783  -1.393
  351   2HB   ASP  35          1HB       ASP  35   1.557  -7.631  -2.589
  352    QB   ASP  35           QB       ASP  35   1.259  -8.207  -1.991
  353    H    THR  36           H        THR  36   3.876  -8.484  -4.295
  354    HA   THR  36           HA       THR  36   5.753  -6.398  -3.246
  355    HB   THR  36           HB       THR  36   5.781  -7.653  -5.992
  356    HG1  THR  36           HG1      THR  36   6.671  -8.720  -3.533
  357   1HG2  THR  36          1HG2      THR  36   7.276  -5.739  -5.499
  358   2HG2  THR  36          3HG2      THR  36   7.964  -6.641  -4.149
  359   3HG2  THR  36          2HG2      THR  36   8.186  -7.219  -5.801
  360    MG   THR  36           QG2      THR  36   7.809  -6.533  -5.150
  361    H    VAL  37           H        VAL  37   5.264  -4.294  -3.730
  362    HA   VAL  37           HA       VAL  37   3.175  -3.775  -5.812
  363    HB   VAL  37           HB       VAL  37   2.665  -3.116  -3.496
  364   1HG1  VAL  37          3HG1      VAL  37   1.904  -1.686  -5.409
  365   2HG1  VAL  37          2HG1      VAL  37   2.122  -0.778  -3.912
  366   3HG1  VAL  37          1HG1      VAL  37   3.341  -0.688  -5.183
  367   1HG2  VAL  37          2HG2      VAL  37   5.334  -1.745  -3.752
  368   2HG2  VAL  37          1HG2      VAL  37   4.129  -1.154  -2.610
  369   3HG2  VAL  37          3HG2      VAL  37   4.753  -2.796  -2.462
  370    MG1  VAL  37           QG1      VAL  37   2.456  -1.051  -4.834
  371    MG2  VAL  37           QG2      VAL  37   4.739  -1.898  -2.941
  372    QG   VAL  37           QQG      VAL  37   3.597  -1.475  -3.888
  373    H    LYS  38           H        LYS  38   3.505  -1.854  -7.172
  374    HA   LYS  38           HA       LYS  38   6.410  -1.272  -7.637
  375   1HB   LYS  38          2HB       LYS  38   4.249  -2.138  -9.280
  376   2HB   LYS  38          1HB       LYS  38   4.659  -0.500  -9.790
  377   1HG   LYS  38          2HG       LYS  38   6.837  -1.085 -10.386
  378   2HG   LYS  38          1HG       LYS  38   6.862  -2.483  -9.311
  379   1HD   LYS  38          2HD       LYS  38   4.794  -2.611 -11.408
  380   2HD   LYS  38          1HD       LYS  38   6.449  -2.622 -12.019
  381   1HE   LYS  38          2HE       LYS  38   5.590  -4.430  -9.747
  382   2HE   LYS  38          1HE       LYS  38   5.454  -4.923 -11.447
  383   1HZ   LYS  38          3HZ       LYS  38   7.931  -3.883 -10.175
  384   2HZ   LYS  38          2HZ       LYS  38   7.617  -5.526 -10.473
  385   3HZ   LYS  38          1HZ       LYS  38   7.777  -4.439 -11.769
  386    QB   LYS  38           QB       LYS  38   4.454  -1.319  -9.535
  387    QD   LYS  38           QD       LYS  38   5.622  -2.616 -11.713
  388    QG   LYS  38           QG       LYS  38   6.849  -1.784  -9.848
  389    QE   LYS  38           QE       LYS  38   5.522  -4.676 -10.597
  390    QZ   LYS  38           QZ       LYS  38   7.775  -4.616 -10.805
  391    H    ALA  39           H        ALA  39   6.524   1.026  -8.863
  392    HA   ALA  39           HA       ALA  39   5.342   2.976  -6.977
  393   1HB   ALA  39          2HB       ALA  39   7.654   3.260  -7.424
  394   2HB   ALA  39          1HB       ALA  39   7.433   3.002  -9.155
  395   3HB   ALA  39          3HB       ALA  39   6.875   4.499  -8.408
  396    MB   ALA  39           QB       ALA  39   7.321   3.587  -8.329
  397    H    GLY  40           H        GLY  40   3.481   4.054  -7.480
  398   1HA   GLY  40          1HA       GLY  40   2.948   4.826 -10.278
  399   2HA   GLY  40          2HA       GLY  40   2.034   5.359  -8.867
  400    QA   GLY  40           QA       GLY  40   2.491   5.092  -9.573
  401    H    GLN  41           H        GLN  41   1.840   2.495  -7.926
  402    HA   GLN  41           HA       GLN  41  -0.120   1.484  -9.962
  403   1HB   GLN  41          2HB       GLN  41   1.896   0.102  -9.463
  404   2HB   GLN  41          1HB       GLN  41   1.401   0.036  -7.771
  405   1HG   GLN  41          2HG       GLN  41  -0.883  -0.816  -8.822
  406   2HG   GLN  41          1HG       GLN  41   0.169  -1.283 -10.158
  407   1HE2  GLN  41          1HE2      GLN  41   1.462  -3.147  -9.880
  408   2HE2  GLN  41          2HE2      GLN  41   1.556  -4.025  -8.431
  409    QB   GLN  41           QB       GLN  41   1.649   0.069  -8.617
  410    QG   GLN  41           QG       GLN  41  -0.357  -1.049  -9.490
  411    QE   GLN  41           QE2      GLN  41   1.509  -3.586  -9.156
  412    H    THR  42           H        THR  42  -2.230   1.707  -9.335
  413    HA   THR  42           HA       THR  42  -3.131   2.678  -6.830
  414    HB   THR  42           HB       THR  42  -4.596   0.848  -8.756
  415    HG1  THR  42           HG1      THR  42  -3.927   2.386 -10.071
  416   1HG2  THR  42          2HG2      THR  42  -5.508   3.074  -6.915
  417   2HG2  THR  42          1HG2      THR  42  -6.546   2.222  -8.057
  418   3HG2  THR  42          3HG2      THR  42  -5.824   1.352  -6.703
  419    MG   THR  42           QG2      THR  42  -5.959   2.216  -7.225
  420    H    VAL  43           H        VAL  43  -2.675   1.615  -4.915
  421    HA   VAL  43           HA       VAL  43  -2.756  -1.353  -4.840
  422    HB   VAL  43           HB       VAL  43  -1.741  -0.972  -2.601
  423   1HG1  VAL  43          1HG1      VAL  43  -0.394  -0.972  -4.758
  424   2HG1  VAL  43          3HG1      VAL  43  -0.426   0.789  -4.680
  425   3HG1  VAL  43          2HG1      VAL  43   0.362  -0.134  -3.402
  426   1HG2  VAL  43          3HG2      VAL  43  -2.995   1.532  -2.850
  427   2HG2  VAL  43          2HG2      VAL  43  -1.930   1.010  -1.544
  428   3HG2  VAL  43          1HG2      VAL  43  -1.267   1.872  -2.933
  429    MG1  VAL  43           QG1      VAL  43  -0.153  -0.105  -4.280
  430    MG2  VAL  43           QG2      VAL  43  -2.064   1.471  -2.442
  431    QG   VAL  43           QQG      VAL  43  -1.108   0.683  -3.361
  432    H    LEU  44           H        LEU  44  -4.666   1.422  -3.893
  433    HA   LEU  44           HA       LEU  44  -6.677  -0.450  -2.731
  434   1HB   LEU  44          2HB       LEU  44  -5.046   1.593  -1.329
  435   2HB   LEU  44          1HB       LEU  44  -6.760   1.559  -0.909
  436    HG   LEU  44           HG       LEU  44  -5.742  -1.136  -1.065
  437   1HD1  LEU  44          2HD1      LEU  44  -7.194   0.653   0.808
  438   2HD1  LEU  44          1HD1      LEU  44  -7.585  -0.985   0.287
  439   3HD1  LEU  44          3HD1      LEU  44  -6.370  -0.724   1.539
  440   1HD2  LEU  44          1HD2      LEU  44  -4.208   0.841   0.637
  441   2HD2  LEU  44          3HD2      LEU  44  -4.262  -0.882   1.011
  442   3HD2  LEU  44          2HD2      LEU  44  -3.562  -0.333  -0.511
  443    MD1  LEU  44           QD1      LEU  44  -7.050  -0.352   0.878
  444    MD2  LEU  44           QD2      LEU  44  -4.011  -0.125   0.379
  445    QB   LEU  44           QB       LEU  44  -5.903   1.576  -1.119
  446    QD   LEU  44           QQD      LEU  44  -5.530  -0.239   0.628
  447    H    VAL  45           H        VAL  45  -8.728   0.859  -2.152
  448    HA   VAL  45           HA       VAL  45  -9.149   3.071  -4.132
  449    HB   VAL  45           HB       VAL  45 -11.038   0.839  -3.312
  450   1HG1  VAL  45          2HG1      VAL  45 -11.343   3.345  -4.812
  451   2HG1  VAL  45          1HG1      VAL  45 -11.908   1.928  -5.699
  452   3HG1  VAL  45          3HG1      VAL  45 -12.578   2.299  -4.110
  453   1HG2  VAL  45          1HG2      VAL  45  -9.083   1.166  -5.552
  454   2HG2  VAL  45          3HG2      VAL  45  -9.543  -0.291  -4.671
  455   3HG2  VAL  45          2HG2      VAL  45 -10.618   0.374  -5.900
  456    MG1  VAL  45           QG1      VAL  45 -11.943   2.524  -4.874
  457    MG2  VAL  45           QG2      VAL  45  -9.748   0.416  -5.375
  458    QG   VAL  45           QQG      VAL  45 -10.846   1.470  -5.124
  459    H    LEU  46           H        LEU  46  -9.463   4.908  -2.880
  460    HA   LEU  46           HA       LEU  46 -10.941   4.587  -0.290
  461   1HB   LEU  46          2HB       LEU  46  -8.500   5.804  -1.043
  462   2HB   LEU  46          1HB       LEU  46  -9.607   7.122  -0.656
  463    HG   LEU  46           HG       LEU  46 -10.197   5.721   1.450
  464   1HD1  LEU  46          2HD1      LEU  46  -7.633   7.222   0.952
  465   2HD1  LEU  46          1HD1      LEU  46  -9.068   7.749   1.830
  466   3HD1  LEU  46          3HD1      LEU  46  -7.983   6.558   2.547
  467   1HD2  LEU  46          3HD2      LEU  46  -8.017   4.179   0.226
  468   2HD2  LEU  46          2HD2      LEU  46  -7.729   4.570   1.922
  469   3HD2  LEU  46          1HD2      LEU  46  -9.185   3.691   1.453
  470    MD1  LEU  46           QD1      LEU  46  -8.228   7.176   1.776
  471    MD2  LEU  46           QD2      LEU  46  -8.311   4.147   1.200
  472    QB   LEU  46           QB       LEU  46  -9.054   6.463  -0.849
  473    QD   LEU  46           QQD      LEU  46  -8.269   5.661   1.488
  474    H    GLU  47           H        GLU  47 -12.320   6.484   0.309
  475    HA   GLU  47           HA       GLU  47 -13.391   8.038  -2.000
  476   1HB   GLU  47          2HB       GLU  47 -14.725   5.911  -0.371
  477   2HB   GLU  47          1HB       GLU  47 -15.698   7.301  -0.850
  478   1HG   GLU  47          2HG       GLU  47 -13.996   5.998  -2.935
  479   2HG   GLU  47          1HG       GLU  47 -15.471   5.170  -2.433
  480    QB   GLU  47           QB       GLU  47 -15.211   6.606  -0.611
  481    QG   GLU  47           QG       GLU  47 -14.734   5.584  -2.684
  482    H    ALA  48           H        ALA  48 -12.234   9.749  -0.705
  483    HA   ALA  48           HA       ALA  48 -13.338  10.395   1.952
  484   1HB   ALA  48          1HB       ALA  48 -11.464  11.744   2.101
  485   2HB   ALA  48          2HB       ALA  48 -11.544  12.214   0.402
  486   3HB   ALA  48          3HB       ALA  48 -10.907  10.632   0.851
  487    MB   ALA  48           QB       ALA  48 -11.305  11.530   1.118
  488    H    MET  49           H        MET  49 -13.364  13.185   1.836
  489    HA   MET  49           HA       MET  49 -15.917  13.662   0.451
  490   1HB   MET  49          2HB       MET  49 -15.785  15.796   1.698
  491   2HB   MET  49          1HB       MET  49 -15.450  14.429   2.759
  492   1HG   MET  49          2HG       MET  49 -13.490  15.393   3.297
  493   2HG   MET  49          1HG       MET  49 -12.964  15.145   1.632
  494   1HE   MET  49          1HE       MET  49 -11.884  17.235   3.493
  495   2HE   MET  49          3HE       MET  49 -12.496  18.891   3.373
  496   3HE   MET  49          2HE       MET  49 -13.363  17.694   4.333
  497    QB   MET  49           QB       MET  49 -15.618  15.113   2.229
  498    QG   MET  49           QG       MET  49 -13.227  15.269   2.464
  499    ME   MET  49           QE       MET  49 -12.581  17.940   3.733
  500    H    LYS  50           H        LYS  50 -14.091  13.177  -1.513
  501    HA   LYS  50           HA       LYS  50 -14.057  15.675  -3.004
  502   1HB   LYS  50          2HB       LYS  50 -12.119  15.743  -1.302
  503   2HB   LYS  50          1HB       LYS  50 -11.372  14.482  -2.285
  504   1HG   LYS  50          2HG       LYS  50 -11.951  16.166  -4.261
  505   2HG   LYS  50          1HG       LYS  50 -11.891  17.352  -2.956
  506   1HD   LYS  50          2HD       LYS  50  -9.639  16.585  -2.340
  507   2HD   LYS  50          1HD       LYS  50  -9.693  15.368  -3.616
  508   1HE   LYS  50          2HE       LYS  50  -9.890  17.146  -5.322
  509   2HE   LYS  50          1HE       LYS  50  -9.842  18.377  -4.042
  510   1HZ   LYS  50          1HZ       LYS  50  -7.764  16.285  -4.227
  511   2HZ   LYS  50          3HZ       LYS  50  -7.636  17.713  -5.133
  512   3HZ   LYS  50          2HZ       LYS  50  -7.691  17.787  -3.437
  513    QB   LYS  50           QB       LYS  50 -11.745  15.113  -1.794
  514    QD   LYS  50           QD       LYS  50  -9.666  15.977  -2.978
  515    QG   LYS  50           QG       LYS  50 -11.921  16.759  -3.608
  516    QE   LYS  50           QE       LYS  50  -9.866  17.762  -4.682
  517    QZ   LYS  50           QZ       LYS  50  -7.697  17.262  -4.265
  518    H    MET  51           H        MET  51 -12.218  12.591  -2.812
  519    HA   MET  51           HA       MET  51 -13.452  11.319  -5.036
  520   1HB   MET  51          2HB       MET  51 -11.775  13.530  -5.720
  521   2HB   MET  51          1HB       MET  51 -10.957  12.059  -6.248
  522   1HG   MET  51          2HG       MET  51 -13.593  11.602  -6.971
  523   2HG   MET  51          1HG       MET  51 -13.382  13.321  -7.303
  524   1HE   MET  51          1HE       MET  51 -13.985  12.551  -9.770
  525   2HE   MET  51          3HE       MET  51 -12.925  13.956  -9.584
  526   3HE   MET  51          2HE       MET  51 -12.595  12.758 -10.833
  527    QB   MET  51           QB       MET  51 -11.366  12.795  -5.984
  528    QG   MET  51           QG       MET  51 -13.488  12.461  -7.137
  529    ME   MET  51           QE       MET  51 -13.168  13.088 -10.062
  530    H    GLU  52           H        GLU  52  -9.954  11.815  -4.549
  531    HA   GLU  52           HA       GLU  52  -8.260  10.266  -4.006
  532   1HB   GLU  52          2HB       GLU  52 -10.629   9.433  -2.314
  533   2HB   GLU  52          1HB       GLU  52  -9.047   8.670  -2.148
  534   1HG   GLU  52          2HG       GLU  52  -9.159  11.656  -2.130
  535   2HG   GLU  52          1HG       GLU  52  -9.714  10.802  -0.689
  536    QB   GLU  52           QB       GLU  52  -9.838   9.052  -2.231
  537    QG   GLU  52           QG       GLU  52  -9.436  11.229  -1.410
  538    H    THR  53           H        THR  53 -10.675   7.760  -3.501
  539    HA   THR  53           HA       THR  53 -11.001   5.717  -4.624
  540    HB   THR  53           HB       THR  53 -10.683   7.706  -6.888
  541    HG1  THR  53           HG1      THR  53 -12.921   6.659  -5.498
  542   1HG2  THR  53          3HG2      THR  53 -11.353   4.808  -6.838
  543   2HG2  THR  53          2HG2      THR  53 -12.340   5.833  -7.881
  544   3HG2  THR  53          1HG2      THR  53 -10.592   5.765  -8.109
  545    MG   THR  53           QG2      THR  53 -11.428   5.469  -7.609
  546    H    GLU  54           H        GLU  54  -8.980   6.881  -7.274
  547    HA   GLU  54           HA       GLU  54  -7.341   4.559  -7.322
  548   1HB   GLU  54          2HB       GLU  54  -7.855   6.626  -8.959
  549   2HB   GLU  54          1HB       GLU  54  -6.306   7.173  -8.317
  550   1HG   GLU  54          2HG       GLU  54  -5.404   4.851  -8.876
  551   2HG   GLU  54          1HG       GLU  54  -6.892   4.597  -9.788
  552    QB   GLU  54           QB       GLU  54  -7.080   6.900  -8.638
  553    QG   GLU  54           QG       GLU  54  -6.148   4.724  -9.332
  554    H    ILE  55           H        ILE  55  -6.224   4.063  -5.406
  555    HA   ILE  55           HA       ILE  55  -4.507   6.196  -4.204
  556    HB   ILE  55           HB       ILE  55  -5.485   3.489  -3.235
  557   1HG1  ILE  55          2HG1      ILE  55  -7.194   5.254  -3.234
  558   2HG1  ILE  55          1HG1      ILE  55  -6.711   4.882  -1.579
  559   1HG2  ILE  55          1HG2      ILE  55  -3.700   5.539  -1.890
  560   2HG2  ILE  55          3HG2      ILE  55  -4.461   4.186  -1.053
  561   3HG2  ILE  55          2HG2      ILE  55  -3.268   3.883  -2.317
  562   1HD1  ILE  55          3HD1      ILE  55  -4.911   6.856  -2.387
  563   2HD1  ILE  55          2HD1      ILE  55  -6.455   7.381  -3.057
  564   3HD1  ILE  55          1HD1      ILE  55  -6.300   7.086  -1.325
  565    MG   ILE  55           QG2      ILE  55  -3.810   4.536  -1.753
  566    MD   ILE  55           QD1      ILE  55  -5.888   7.108  -2.256
  567    QG   ILE  55           QG1      ILE  55  -6.953   5.068  -2.406
  568    H    ASN  56           H        ASN  56  -2.828   6.068  -5.817
  569    HA   ASN  56           HA       ASN  56  -1.522   3.585  -6.553
  570   1HB   ASN  56          2HB       ASN  56  -0.596   6.467  -6.725
  571   2HB   ASN  56          1HB       ASN  56   0.016   5.117  -7.680
  572   1HD2  ASN  56          1HD2      ASN  56  -1.886   3.887  -8.910
  573   2HD2  ASN  56          2HD2      ASN  56  -3.034   4.891  -9.653
  574    QB   ASN  56           QB       ASN  56  -0.290   5.792  -7.202
  575    QD   ASN  56           QD2      ASN  56  -2.460   4.389  -9.281
  576    H    ALA  57           H        ALA  57   0.184   2.584  -5.562
  577    HA   ALA  57           HA       ALA  57   0.947   3.088  -2.888
  578   1HB   ALA  57          1HB       ALA  57   1.445   1.234  -4.893
  579   2HB   ALA  57          2HB       ALA  57   2.136   1.189  -3.272
  580   3HB   ALA  57          3HB       ALA  57   3.037   1.932  -4.593
  581    MB   ALA  57           QB       ALA  57   2.206   1.452  -4.253
  582    HA   PRO  58           HA       PRO  58   3.905   6.341  -3.100
  583   1HB   PRO  58          2HB       PRO  58   5.866   5.515  -1.381
  584   2HB   PRO  58          1HB       PRO  58   4.273   6.067  -0.831
  585   1HG   PRO  58          2HG       PRO  58   5.322   3.302  -1.116
  586   2HG   PRO  58          1HG       PRO  58   4.249   3.982   0.116
  587   1HD   PRO  58          2HD       PRO  58   3.393   2.439  -1.980
  588   2HD   PRO  58          1HD       PRO  58   2.377   3.629  -1.139
  589    QB   PRO  58           QB       PRO  58   5.069   5.791  -1.106
  590    QG   PRO  58           QG       PRO  58   4.785   3.642  -0.500
  591    QD   PRO  58           QD       PRO  58   2.885   3.034  -1.559
  592    H    THR  59           H        THR  59   5.667   3.209  -3.050
  593    HA   THR  59           HA       THR  59   6.945   3.826  -5.626
  594    HB   THR  59           HB       THR  59   8.970   3.309  -3.553
  595    HG1  THR  59           HG1      THR  59   8.746   5.138  -2.448
  596   1HG2  THR  59          2HG2      THR  59   8.577   5.348  -5.753
  597   2HG2  THR  59          1HG2      THR  59  10.011   5.288  -4.727
  598   3HG2  THR  59          3HG2      THR  59   9.624   3.929  -5.782
  599    MG   THR  59           QG2      THR  59   9.404   4.855  -5.420
  600    H    ASP  60           H        ASP  60   8.535   1.987  -6.179
  601    HA   ASP  60           HA       ASP  60   7.295  -0.553  -5.939
  602   1HB   ASP  60          2HB       ASP  60  10.157   0.287  -6.497
  603   2HB   ASP  60          1HB       ASP  60   9.542  -1.342  -6.775
  604    QB   ASP  60           QB       ASP  60   9.849  -0.528  -6.636
  605    H    GLY  61           H        GLY  61   7.512  -2.213  -4.433
  606   1HA   GLY  61          1HA       GLY  61   8.610  -1.586  -1.831
  607   2HA   GLY  61          2HA       GLY  61   9.650  -2.714  -2.702
  608    QA   GLY  61           QA       GLY  61   9.130  -2.150  -2.267
  609    H    LYS  62           H        LYS  62   8.876  -4.012  -0.685
  610    HA   LYS  62           HA       LYS  62   6.453  -5.577  -1.495
  611   1HB   LYS  62          2HB       LYS  62   8.751  -6.636  -1.461
  612   2HB   LYS  62          1HB       LYS  62   8.784  -6.363   0.282
  613   1HG   LYS  62          2HG       LYS  62   6.503  -7.607   0.299
  614   2HG   LYS  62          1HG       LYS  62   6.972  -8.176  -1.303
  615   1HD   LYS  62          2HD       LYS  62   7.752  -9.846   0.208
  616   2HD   LYS  62          1HD       LYS  62   9.182  -8.909  -0.230
  617   1HE   LYS  62          2HE       LYS  62   9.460  -8.826   2.058
  618   2HE   LYS  62          1HE       LYS  62   8.307  -7.483   1.926
  619   1HZ   LYS  62          1HZ       LYS  62   6.523  -9.248   2.016
  620   2HZ   LYS  62          3HZ       LYS  62   7.730 -10.325   2.529
  621   3HZ   LYS  62          2HZ       LYS  62   7.357  -8.960   3.469
  622    QB   LYS  62           QB       LYS  62   8.767  -6.500  -0.589
  623    QD   LYS  62           QD       LYS  62   8.467  -9.378  -0.011
  624    QG   LYS  62           QG       LYS  62   6.738  -7.892  -0.502
  625    QE   LYS  62           QE       LYS  62   8.884  -8.155   1.992
  626    QZ   LYS  62           QZ       LYS  62   7.203  -9.511   2.671
  627    H    VAL  63           H        VAL  63   4.925  -6.136   0.158
  628    HA   VAL  63           HA       VAL  63   4.690  -4.190   2.321
  629    HB   VAL  63           HB       VAL  63   3.130  -6.587   1.331
  630   1HG1  VAL  63          1HG1      VAL  63   2.714  -3.593   1.385
  631   2HG1  VAL  63          3HG1      VAL  63   2.917  -4.622  -0.033
  632   3HG1  VAL  63          2HG1      VAL  63   1.446  -4.732   0.934
  633   1HG2  VAL  63          1HG2      VAL  63   2.784  -5.012   3.863
  634   2HG2  VAL  63          3HG2      VAL  63   1.345  -5.529   2.983
  635   3HG2  VAL  63          2HG2      VAL  63   2.499  -6.727   3.570
  636    MG1  VAL  63           QG1      VAL  63   2.359  -4.316   0.762
  637    MG2  VAL  63           QG2      VAL  63   2.209  -5.756   3.472
  638    QG   VAL  63           QQG      VAL  63   2.284  -5.036   2.117
  639    H    GLU  64           H        GLU  64   5.577  -4.430   4.312
  640    HA   GLU  64           HA       GLU  64   6.549  -7.121   5.155
  641   1HB   GLU  64          2HB       GLU  64   7.098  -4.281   6.074
  642   2HB   GLU  64          1HB       GLU  64   7.831  -5.710   6.805
  643   1HG   GLU  64          2HG       GLU  64   8.323  -6.161   4.153
  644   2HG   GLU  64          1HG       GLU  64   8.426  -4.402   4.226
  645    QB   GLU  64           QB       GLU  64   7.465  -4.996   6.440
  646    QG   GLU  64           QG       GLU  64   8.375  -5.281   4.189
  647    H    LYS  65           H        LYS  65   3.896  -5.048   5.611
  648    HA   LYS  65           HA       LYS  65   2.732  -6.657   7.693
  649   1HB   LYS  65          2HB       LYS  65   4.716  -5.054   8.644
  650   2HB   LYS  65          1HB       LYS  65   3.339  -3.961   8.787
  651   1HG   LYS  65          2HG       LYS  65   2.099  -5.675  10.052
  652   2HG   LYS  65          1HG       LYS  65   3.471  -6.775   9.910
  653   1HD   LYS  65          2HD       LYS  65   4.878  -5.002  11.053
  654   2HD   LYS  65          1HD       LYS  65   3.380  -4.130  11.380
  655   1HE   LYS  65          2HE       LYS  65   3.260  -6.982  12.115
  656   2HE   LYS  65          1HE       LYS  65   4.441  -6.042  13.048
  657   1HZ   LYS  65          3HZ       LYS  65   1.741  -4.982  12.494
  658   2HZ   LYS  65          2HZ       LYS  65   2.016  -6.001  13.825
  659   3HZ   LYS  65          1HZ       LYS  65   2.833  -4.517  13.705
  660    QB   LYS  65           QB       LYS  65   4.028  -4.508   8.716
  661    QD   LYS  65           QD       LYS  65   4.129  -4.566  11.217
  662    QG   LYS  65           QG       LYS  65   2.785  -6.225   9.981
  663    QE   LYS  65           QE       LYS  65   3.851  -6.512  12.582
  664    QZ   LYS  65           QZ       LYS  65   2.197  -5.166  13.341
  665    H    VAL  66           H        VAL  66   0.544  -5.988   8.088
  666    HA   VAL  66           HA       VAL  66  -0.376  -3.704   6.371
  667    HB   VAL  66           HB       VAL  66  -1.055  -5.904   5.558
  668   1HG1  VAL  66          3HG1      VAL  66  -2.698  -3.879   5.715
  669   2HG1  VAL  66          2HG1      VAL  66  -3.349  -5.470   5.320
  670   3HG1  VAL  66          1HG1      VAL  66  -3.496  -4.839   6.961
  671   1HG2  VAL  66          3HG2      VAL  66  -1.875  -6.267   8.434
  672   2HG2  VAL  66          2HG2      VAL  66  -2.651  -7.206   7.158
  673   3HG2  VAL  66          1HG2      VAL  66  -0.911  -7.337   7.415
  674    MG1  VAL  66           QG1      VAL  66  -3.181  -4.729   5.999
  675    MG2  VAL  66           QG2      VAL  66  -1.812  -6.937   7.669
  676    QG   VAL  66           QQG      VAL  66  -2.497  -5.833   6.834
  677    H    LEU  67           H        LEU  67  -1.905  -2.276   7.282
  678    HA   LEU  67           HA       LEU  67  -2.430  -2.630  10.217
  679   1HB   LEU  67          2HB       LEU  67  -1.410  -0.432   8.524
  680   2HB   LEU  67          1HB       LEU  67  -2.619   0.058   9.710
  681    HG   LEU  67           HG       LEU  67  -0.602  -1.796  10.773
  682   1HD1  LEU  67          3HD1      LEU  67   0.297   0.327   9.099
  683   2HD1  LEU  67          2HD1      LEU  67   0.633   0.792  10.766
  684   3HD1  LEU  67          1HD1      LEU  67   1.269  -0.724  10.129
  685   1HD2  LEU  67          2HD2      LEU  67  -1.622   0.936  11.611
  686   2HD2  LEU  67          1HD2      LEU  67  -2.265  -0.614  12.155
  687   3HD2  LEU  67          3HD2      LEU  67  -0.629  -0.132  12.605
  688    MD1  LEU  67           QD1      LEU  67   0.733   0.132   9.998
  689    MD2  LEU  67           QD2      LEU  67  -1.505   0.063  12.124
  690    QB   LEU  67           QB       LEU  67  -2.015  -0.187   9.117
  691    QD   LEU  67           QQD      LEU  67  -0.386   0.097  11.061
  692    H    VAL  68           H        VAL  68  -3.700  -0.498   7.636
  693    HA   VAL  68           HA       VAL  68  -6.414  -0.671   8.678
  694    HB   VAL  68           HB       VAL  68  -6.874   0.714   6.649
  695   1HG1  VAL  68          1HG1      VAL  68  -4.475   1.360   8.371
  696   2HG1  VAL  68          3HG1      VAL  68  -5.132   2.517   7.213
  697   3HG1  VAL  68          2HG1      VAL  68  -6.131   1.940   8.548
  698   1HG2  VAL  68          1HG2      VAL  68  -4.609  -0.646   5.666
  699   2HG2  VAL  68          3HG2      VAL  68  -5.516   0.628   4.853
  700   3HG2  VAL  68          2HG2      VAL  68  -4.113   1.037   5.840
  701    MG1  VAL  68           QG1      VAL  68  -5.246   1.939   8.044
  702    MG2  VAL  68           QG2      VAL  68  -4.746   0.340   5.453
  703    QG   VAL  68           QQG      VAL  68  -4.996   1.139   6.748
  704    H    LYS  69           H        LYS  69  -8.244  -1.550   7.430
  705    HA   LYS  69           HA       LYS  69  -7.461  -3.735   5.530
  706   1HB   LYS  69          2HB       LYS  69  -8.360  -4.010   8.133
  707   2HB   LYS  69          1HB       LYS  69  -9.843  -4.186   7.193
  708   1HG   LYS  69          2HG       LYS  69  -9.002  -6.382   7.271
  709   2HG   LYS  69          1HG       LYS  69  -8.445  -5.795   5.704
  710   1HD   LYS  69          2HD       LYS  69  -6.242  -5.447   6.484
  711   2HD   LYS  69          1HD       LYS  69  -6.740  -5.503   8.175
  712   1HE   LYS  69          2HE       LYS  69  -5.799  -7.639   7.884
  713   2HE   LYS  69          1HE       LYS  69  -7.512  -7.961   7.546
  714   1HZ   LYS  69          3HZ       LYS  69  -7.039  -7.434   5.187
  715   2HZ   LYS  69          2HZ       LYS  69  -5.385  -7.354   5.562
  716   3HZ   LYS  69          1HZ       LYS  69  -6.228  -8.818   5.736
  717    QB   LYS  69           QB       LYS  69  -9.101  -4.098   7.663
  718    QD   LYS  69           QD       LYS  69  -6.491  -5.475   7.330
  719    QG   LYS  69           QG       LYS  69  -8.723  -6.089   6.488
  720    QE   LYS  69           QE       LYS  69  -6.656  -7.800   7.715
  721    QZ   LYS  69           QZ       LYS  69  -6.217  -7.869   5.495
  722    H    GLU  70           H        GLU  70 -10.001  -4.597   4.864
  723    HA   GLU  70           HA       GLU  70 -10.984  -2.349   3.232
  724   1HB   GLU  70          2HB       GLU  70 -10.646  -5.014   2.831
  725   2HB   GLU  70          1HB       GLU  70 -12.351  -4.987   3.282
  726   1HG   GLU  70          2HG       GLU  70 -11.663  -2.843   1.419
  727   2HG   GLU  70          1HG       GLU  70 -11.333  -4.443   0.753
  728    QB   GLU  70           QB       GLU  70 -11.499  -5.000   3.057
  729    QG   GLU  70           QG       GLU  70 -11.498  -3.643   1.086
  730    H    ARG  71           H        ARG  71 -13.240  -1.671   3.277
  731    HA   ARG  71           HA       ARG  71 -15.214  -1.010   4.402
  732   1HB   ARG  71          2HB       ARG  71 -15.359  -3.576   4.118
  733   2HB   ARG  71          1HB       ARG  71 -14.927  -3.663   5.826
  734   1HG   ARG  71          2HG       ARG  71 -16.870  -2.337   6.439
  735   2HG   ARG  71          1HG       ARG  71 -17.269  -2.074   4.741
  736   1HD   ARG  71          2HD       ARG  71 -17.080  -4.844   4.916
  737   2HD   ARG  71          1HD       ARG  71 -17.872  -4.384   6.436
  738    HE   ARG  71           HE       ARG  71 -19.012  -2.858   4.304
  739   1HH1  ARG  71          1HH1      ARG  71 -19.420  -5.004   2.630
  740   2HH1  ARG  71          2HH1      ARG  71 -20.712  -5.937   3.307
  741   1HH2  ARG  71          1HH2      ARG  71 -20.435  -4.517   6.459
  742   2HH2  ARG  71          2HH2      ARG  71 -21.287  -5.661   5.476
  743    QB   ARG  71           QB       ARG  71 -15.143  -3.620   4.972
  744    QG   ARG  71           QG       ARG  71 -17.070  -2.205   5.590
  745    QD   ARG  71           QD       ARG  71 -17.476  -4.614   5.676
  746    QH1  ARG  71           QH1      ARG  71 -20.066  -5.470   2.968
  747    QH2  ARG  71           QH2      ARG  71 -20.861  -5.089   5.967
  748    H    ASP  72           H        ASP  72 -12.471  -0.570   5.671
  749    HA   ASP  72           HA       ASP  72 -13.377  -0.318   8.522
  750   1HB   ASP  72          2HB       ASP  72 -11.178  -1.616   7.365
  751   2HB   ASP  72          1HB       ASP  72 -10.511  -0.128   8.038
  752    QB   ASP  72           QB       ASP  72 -10.844  -0.872   7.701
  753    H    ALA  73           H        ALA  73 -14.084   1.814   8.647
  754    HA   ALA  73           HA       ALA  73 -13.188   4.023   7.130
  755   1HB   ALA  73          1HB       ALA  73 -14.937   3.447   9.267
  756   2HB   ALA  73          3HB       ALA  73 -13.881   4.731   9.856
  757   3HB   ALA  73          2HB       ALA  73 -14.818   4.967   8.381
  758    MB   ALA  73           QB       ALA  73 -14.545   4.382   9.168
  759    H    VAL  74           H        VAL  74 -11.412   5.379   7.314
  760    HA   VAL  74           HA       VAL  74  -9.590   4.966   9.661
  761    HB   VAL  74           HB       VAL  74  -8.843   3.786   7.598
  762   1HG1  VAL  74          3HG1      VAL  74  -9.947   5.463   6.046
  763   2HG1  VAL  74          2HG1      VAL  74  -8.603   6.553   6.389
  764   3HG1  VAL  74          1HG1      VAL  74  -8.304   5.006   5.595
  765   1HG2  VAL  74          1HG2      VAL  74  -7.318   6.080   8.770
  766   2HG2  VAL  74          3HG2      VAL  74  -6.986   4.350   8.864
  767   3HG2  VAL  74          2HG2      VAL  74  -6.628   5.237   7.383
  768    MG1  VAL  74           QG1      VAL  74  -8.952   5.674   6.010
  769    MG2  VAL  74           QG2      VAL  74  -6.977   5.223   8.339
  770    QG   VAL  74           QQG      VAL  74  -7.964   5.448   7.175
  771    H    GLN  75           H        GLN  75  -8.983   6.877  10.624
  772    HA   GLN  75           HA       GLN  75  -9.963   9.415   9.487
  773   1HB   GLN  75          2HB       GLN  75  -9.095   8.291  12.058
  774   2HB   GLN  75          1HB       GLN  75  -8.543   9.947  11.805
  775   1HG   GLN  75          2HG       GLN  75 -10.637  10.795  11.983
  776   2HG   GLN  75          1HG       GLN  75 -11.333   9.509  10.998
  777   1HE2  GLN  75          1HE2      GLN  75 -12.691   8.131  12.137
  778   2HE2  GLN  75          2HE2      GLN  75 -12.602   7.826  13.805
  779    QB   GLN  75           QB       GLN  75  -8.819   9.119  11.932
  780    QG   GLN  75           QG       GLN  75 -10.985  10.152  11.491
  781    QE   GLN  75           QE2      GLN  75 -12.646   7.978  12.971
  782    H    GLY  76           H        GLY  76  -8.217  11.313   9.985
  783   1HA   GLY  76          1HA       GLY  76  -6.373  12.307   8.856
  784   2HA   GLY  76          2HA       GLY  76  -5.959  10.724   8.196
  785    QA   GLY  76           QA       GLY  76  -6.166  11.516   8.526
  786    H    GLY  77           H        GLY  77  -3.973  10.136   8.922
  787   1HA   GLY  77          1HA       GLY  77  -3.181  10.933  11.685
  788   2HA   GLY  77          2HA       GLY  77  -2.052  10.516  10.394
  789    QA   GLY  77           QA       GLY  77  -2.617  10.725  11.040
  790    H    GLN  78           H        GLN  78  -2.731   8.140   9.475
  791    HA   GLN  78           HA       GLN  78  -2.430   6.353  11.816
  792   1HB   GLN  78          2HB       GLN  78  -4.934   6.916  10.874
  793   2HB   GLN  78          1HB       GLN  78  -4.522   5.499   9.908
  794   1HG   GLN  78          2HG       GLN  78  -3.941   5.423  12.840
  795   2HG   GLN  78          1HG       GLN  78  -5.615   5.235  12.318
  796   1HE2  GLN  78          1HE2      GLN  78  -6.146   3.349  10.979
  797   2HE2  GLN  78          2HE2      GLN  78  -5.088   2.025  10.873
  798    QB   GLN  78           QB       GLN  78  -4.728   6.207  10.391
  799    QG   GLN  78           QG       GLN  78  -4.778   5.329  12.579
  800    QE   GLN  78           QE2      GLN  78  -5.617   2.687  10.926
  801    H    GLY  79           H        GLY  79  -0.949   4.807  11.266
  802   1HA   GLY  79          1HA       GLY  79   0.322   3.328   9.962
  803   2HA   GLY  79          2HA       GLY  79   0.353   4.644   8.788
  804    QA   GLY  79           QA       GLY  79   0.338   3.986   9.375
  805    H    LEU  80           H        LEU  80  -0.179   3.759   6.848
  806    HA   LEU  80           HA       LEU  80  -2.787   2.372   6.583
  807   1HB   LEU  80          2HB       LEU  80  -0.791   3.762   4.827
  808   2HB   LEU  80          1HB       LEU  80  -1.899   2.609   4.081
  809    HG   LEU  80           HG       LEU  80  -2.925   4.752   5.936
  810   1HD1  LEU  80          3HD1      LEU  80  -4.066   3.018   3.735
  811   2HD1  LEU  80          2HD1      LEU  80  -4.533   3.061   5.435
  812   3HD1  LEU  80          1HD1      LEU  80  -4.929   4.415   4.378
  813   1HD2  LEU  80          2HD2      LEU  80  -1.757   5.089   3.277
  814   2HD2  LEU  80          1HD2      LEU  80  -3.439   5.616   3.339
  815   3HD2  LEU  80          3HD2      LEU  80  -2.255   6.314   4.443
  816    MD1  LEU  80           QD1      LEU  80  -4.509   3.498   4.516
  817    MD2  LEU  80           QD2      LEU  80  -2.483   5.673   3.686
  818    QB   LEU  80           QB       LEU  80  -1.345   3.185   4.454
  819    QD   LEU  80           QQD      LEU  80  -3.496   4.585   4.101
  820    H    ILE  81           H        ILE  81   0.368   1.839   4.990
  821    HA   ILE  81           HA       ILE  81   0.164  -1.069   5.682
  822    HB   ILE  81           HB       ILE  81   0.722   0.234   2.998
  823   1HG1  ILE  81          2HG1      ILE  81  -1.665   0.113   3.674
  824   2HG1  ILE  81          1HG1      ILE  81  -1.322  -0.947   2.307
  825   1HG2  ILE  81          3HG2      ILE  81   1.338  -2.443   4.074
  826   2HG2  ILE  81          2HG2      ILE  81   0.475  -2.458   2.535
  827   3HG2  ILE  81          1HG2      ILE  81   2.015  -1.610   2.675
  828   1HD1  ILE  81          2HD1      ILE  81  -1.024  -2.838   3.949
  829   2HD1  ILE  81          1HD1      ILE  81  -1.597  -1.752   5.215
  830   3HD1  ILE  81          3HD1      ILE  81  -2.665  -2.195   3.884
  831    MG   ILE  81           QG2      ILE  81   1.276  -2.171   3.095
  832    MD   ILE  81           QD1      ILE  81  -1.762  -2.262   4.350
  833    QG   ILE  81           QG1      ILE  81  -1.494  -0.417   2.990
  834    H    LYS  82           H        LYS  82   2.194  -2.053   6.053
  835    HA   LYS  82           HA       LYS  82   4.454  -0.201   6.480
  836   1HB   LYS  82          2HB       LYS  82   3.712  -1.912   8.137
  837   2HB   LYS  82          1HB       LYS  82   4.133  -3.177   6.981
  838   1HG   LYS  82          2HG       LYS  82   6.399  -2.862   7.247
  839   2HG   LYS  82          1HG       LYS  82   6.225  -1.143   7.602
  840   1HD   LYS  82          2HD       LYS  82   4.896  -2.659   9.652
  841   2HD   LYS  82          1HD       LYS  82   6.540  -3.269   9.458
  842   1HE   LYS  82          2HE       LYS  82   7.513  -1.199  10.000
  843   2HE   LYS  82          1HE       LYS  82   6.037  -0.297   9.603
  844   1HZ   LYS  82          1HZ       LYS  82   4.967  -1.697  11.426
  845   2HZ   LYS  82          3HZ       LYS  82   6.548  -2.051  11.929
  846   3HZ   LYS  82          2HZ       LYS  82   6.002  -0.442  11.919
  847    QB   LYS  82           QB       LYS  82   3.923  -2.545   7.559
  848    QD   LYS  82           QD       LYS  82   5.718  -2.964   9.555
  849    QG   LYS  82           QG       LYS  82   6.312  -2.003   7.425
  850    QE   LYS  82           QE       LYS  82   6.775  -0.748   9.801
  851    QZ   LYS  82           QZ       LYS  82   5.839  -1.396  11.758
  852    H    ILE  83           H        ILE  83   6.310  -0.178   5.232
  853    HA   ILE  83           HA       ILE  83   6.601  -2.265   3.099
  854    HB   ILE  83           HB       ILE  83   5.582  -0.229   2.174
  855   1HG1  ILE  83          2HG1      ILE  83   8.296   0.257   1.185
  856   2HG1  ILE  83          1HG1      ILE  83   7.900  -1.462   1.257
  857   1HG2  ILE  83          3HG2      ILE  83   7.324   1.029   4.060
  858   2HG2  ILE  83          2HG2      ILE  83   7.747   1.618   2.453
  859   3HG2  ILE  83          1HG2      ILE  83   6.095   1.782   3.045
  860   1HD1  ILE  83          1HD1      ILE  83   5.614  -0.595   0.180
  861   2HD1  ILE  83          3HD1      ILE  83   6.663   0.704  -0.387
  862   3HD1  ILE  83          2HD1      ILE  83   7.018  -0.969  -0.818
  863    MG   ILE  83           QG2      ILE  83   7.055   1.476   3.186
  864    MD   ILE  83           QD1      ILE  83   6.432  -0.287  -0.342
  865    QG   ILE  83           QG1      ILE  83   8.098  -0.602   1.221
  866    H    GLY  84           H        GLY  84   8.779  -2.808   2.640
  867   1HA   GLY  84          1HA       GLY  84  10.908  -3.274   3.741
  868   2HA   GLY  84          2HA       GLY  84  10.764  -1.731   4.584
  869    QA   GLY  84           QA       GLY  84  10.836  -2.502   4.163

  No H/Q in entry =         869
  Start of MODEL   15
    1    H1   MET   1          2H        MET   1   9.755   8.410  32.282
    2    H2   MET   1          1H        MET   1   9.036   9.918  32.589
    3    H3   MET   1          3H        MET   1  10.228   9.320  33.635
    4    HA   MET   1           HA       MET   1   8.816   7.657  34.498
    5   1HB   MET   1          2HB       MET   1   7.960  10.466  34.206
    6   2HB   MET   1          1HB       MET   1   6.674   9.370  34.709
    7   1HG   MET   1          2HG       MET   1   7.528   9.706  36.794
    8   2HG   MET   1          1HG       MET   1   8.723   8.510  36.292
    9   1HE   MET   1          2HE       MET   1  10.008   9.093  37.938
   10   2HE   MET   1          1HE       MET   1  11.488   9.482  37.064
   11   3HE   MET   1          3HE       MET   1  10.857  10.598  38.283
   12    QB   MET   1           QB       MET   1   7.317   9.918  34.457
   13    QG   MET   1           QG       MET   1   8.125   9.108  36.543
   14    ME   MET   1           QE       MET   1  10.784   9.724  37.762
   15    H    LYS   2           H        LYS   2   8.709   6.652  32.002
   16    HA   LYS   2           HA       LYS   2   7.306   5.578  30.429
   17   1HB   LYS   2          2HB       LYS   2   5.615   5.906  32.915
   18   2HB   LYS   2          1HB       LYS   2   5.033   5.017  31.507
   19   1HG   LYS   2          2HG       LYS   2   6.012   3.312  32.765
   20   2HG   LYS   2          1HG       LYS   2   7.336   3.768  31.691
   21   1HD   LYS   2          2HD       LYS   2   8.534   4.792  33.372
   22   2HD   LYS   2          1HD       LYS   2   7.085   5.251  34.268
   23   1HE   LYS   2          2HE       LYS   2   8.371   3.459  35.440
   24   2HE   LYS   2          1HE       LYS   2   6.760   2.891  34.955
   25   1HZ   LYS   2          1HZ       LYS   2   9.078   2.632  33.143
   26   2HZ   LYS   2          3HZ       LYS   2   8.768   1.454  34.321
   27   3HZ   LYS   2          2HZ       LYS   2   7.610   1.776  33.120
   28    QB   LYS   2           QB       LYS   2   5.324   5.461  32.211
   29    QD   LYS   2           QD       LYS   2   7.810   5.022  33.820
   30    QG   LYS   2           QG       LYS   2   6.674   3.540  32.228
   31    QE   LYS   2           QE       LYS   2   7.565   3.175  35.198
   32    QZ   LYS   2           QZ       LYS   2   8.485   1.954  33.528
   33    H    LEU   3           H        LEU   3   4.633   5.874  29.803
   34    HA   LEU   3           HA       LEU   3   3.811   8.668  29.679
   35   1HB   LEU   3          2HB       LEU   3   4.185   8.839  27.203
   36   2HB   LEU   3          1HB       LEU   3   5.688   8.704  28.116
   37    HG   LEU   3           HG       LEU   3   4.426   6.159  27.230
   38   1HD1  LEU   3          1HD1      LEU   3   4.508   8.076  25.340
   39   2HD1  LEU   3          3HD1      LEU   3   6.176   7.514  25.239
   40   3HD1  LEU   3          2HD1      LEU   3   4.848   6.383  24.982
   41   1HD2  LEU   3          2HD2      LEU   3   7.103   7.275  27.873
   42   2HD2  LEU   3          1HD2      LEU   3   6.432   5.682  28.227
   43   3HD2  LEU   3          3HD2      LEU   3   7.063   6.034  26.619
   44    MD1  LEU   3           QD1      LEU   3   5.177   7.324  25.187
   45    MD2  LEU   3           QD2      LEU   3   6.866   6.330  27.573
   46    QB   LEU   3           QB       LEU   3   4.937   8.772  27.660
   47    QD   LEU   3           QQD      LEU   3   6.022   6.827  26.380
   48    H    LYS   4           H        LYS   4   2.352   6.490  30.528
   49    HA   LYS   4           HA       LYS   4   0.296   6.253  28.376
   50   1HB   LYS   4          2HB       LYS   4   2.127   4.247  29.171
   51   2HB   LYS   4          1HB       LYS   4   0.570   3.789  29.862
   52   1HG   LYS   4          2HG       LYS   4  -0.497   3.797  27.732
   53   2HG   LYS   4          1HG       LYS   4   0.854   4.643  26.977
   54   1HD   LYS   4          2HD       LYS   4   1.476   2.548  26.326
   55   2HD   LYS   4          1HD       LYS   4   2.131   2.448  27.961
   56   1HE   LYS   4          2HE       LYS   4   0.799   0.502  27.823
   57   2HE   LYS   4          1HE       LYS   4  -0.306   1.660  28.590
   58   1HZ   LYS   4          1HZ       LYS   4  -0.089   1.221  25.659
   59   2HZ   LYS   4          3HZ       LYS   4  -1.301   0.555  26.640
   60   3HZ   LYS   4          2HZ       LYS   4  -1.196   2.239  26.452
   61    QB   LYS   4           QB       LYS   4   1.349   4.018  29.516
   62    QD   LYS   4           QD       LYS   4   1.803   2.498  27.144
   63    QG   LYS   4           QG       LYS   4   0.179   4.220  27.355
   64    QE   LYS   4           QE       LYS   4   0.247   1.081  28.206
   65    QZ   LYS   4           QZ       LYS   4  -0.862   1.339  26.250
   66    H    VAL   5           H        VAL   5  -1.150   7.578  29.567
   67    HA   VAL   5           HA       VAL   5  -1.863   6.656  32.326
   68    HB   VAL   5           HB       VAL   5  -2.461   9.258  30.878
   69   1HG1  VAL   5          3HG1      VAL   5  -3.283   8.101  33.415
   70   2HG1  VAL   5          2HG1      VAL   5  -2.410   9.614  33.660
   71   3HG1  VAL   5          1HG1      VAL   5  -3.842   9.579  32.632
   72   1HG2  VAL   5          1HG2      VAL   5  -0.016   8.839  31.209
   73   2HG2  VAL   5          3HG2      VAL   5  -0.608  10.208  32.149
   74   3HG2  VAL   5          2HG2      VAL   5  -0.314   8.658  32.937
   75    MG1  VAL   5           QG1      VAL   5  -3.178   9.098  33.236
   76    MG2  VAL   5           QG2      VAL   5  -0.313   9.235  32.098
   77    QG   VAL   5           QQG      VAL   5  -1.746   9.166  32.667
   78    H    THR   6           H        THR   6  -4.069   6.221  32.796
   79    HA   THR   6           HA       THR   6  -6.184   5.292  32.271
   80    HB   THR   6           HB       THR   6  -7.578   6.941  31.124
   81    HG1  THR   6           HG1      THR   6  -6.741   8.425  29.822
   82   1HG2  THR   6          1HG2      THR   6  -6.305   7.384  33.423
   83   2HG2  THR   6          3HG2      THR   6  -5.572   8.683  32.482
   84   3HG2  THR   6          2HG2      THR   6  -7.323   8.619  32.682
   85    MG   THR   6           QG2      THR   6  -6.400   8.229  32.862
   86    H    VAL   7           H        VAL   7  -7.593   5.577  29.738
   87    HA   VAL   7           HA       VAL   7  -5.895   3.827  27.987
   88    HB   VAL   7           HB       VAL   7  -8.067   2.697  27.450
   89   1HG1  VAL   7          1HG1      VAL   7  -9.198   4.987  28.456
   90   2HG1  VAL   7          3HG1      VAL   7 -10.065   3.469  28.214
   91   3HG1  VAL   7          2HG1      VAL   7  -9.407   3.866  29.802
   92   1HG2  VAL   7          1HG2      VAL   7  -6.493   2.001  29.348
   93   2HG2  VAL   7          3HG2      VAL   7  -7.625   2.798  30.442
   94   3HG2  VAL   7          2HG2      VAL   7  -8.156   1.426  29.468
   95    MG1  VAL   7           QG1      VAL   7  -9.557   4.107  28.824
   96    MG2  VAL   7           QG2      VAL   7  -7.424   2.075  29.752
   97    QG   VAL   7           QQG      VAL   7  -8.490   3.091  29.288
   98    H    ASN   8           H        ASN   8  -5.630   6.404  27.361
   99    HA   ASN   8           HA       ASN   8  -7.492   6.815  25.046
  100   1HB   ASN   8          2HB       ASN   8  -7.458   9.216  25.610
  101   2HB   ASN   8          1HB       ASN   8  -8.029   8.272  26.986
  102   1HD2  ASN   8          1HD2      ASN   8  -6.379  10.934  26.676
  103   2HD2  ASN   8          2HD2      ASN   8  -5.101  10.712  27.771
  104    QB   ASN   8           QB       ASN   8  -7.743   8.744  26.298
  105    QD   ASN   8           QD2      ASN   8  -5.740  10.823  27.224
  106    H    GLY   9           H        GLY   9  -6.343   6.958  23.158
  107   1HA   GLY   9          1HA       GLY   9  -3.413   7.316  23.291
  108   2HA   GLY   9          2HA       GLY   9  -4.306   8.531  22.376
  109    QA   GLY   9           QA       GLY   9  -3.860   7.924  22.834
  110    H    ALA  10           H        ALA  10  -4.655   8.071  20.252
  111    HA   ALA  10           HA       ALA  10  -4.655   5.201  19.396
  112   1HB   ALA  10          3HB       ALA  10  -6.684   6.134  18.739
  113   2HB   ALA  10          1HB       ALA  10  -5.705   6.471  17.309
  114   3HB   ALA  10          2HB       ALA  10  -5.984   7.737  18.505
  115    MB   ALA  10           QB       ALA  10  -6.124   6.781  18.184
  116    H    GLY  11           H        GLY  11  -2.146   6.494  19.865
  117   1HA   GLY  11          1HA       GLY  11  -0.138   7.095  18.784
  118   2HA   GLY  11          2HA       GLY  11  -1.095   7.573  17.380
  119    QA   GLY  11           QA       GLY  11  -0.617   7.334  18.082
  120    H    LYS  12           H        LYS  12  -1.510   6.009  15.758
  121    HA   LYS  12           HA       LYS  12   0.036   3.451  16.046
  122   1HB   LYS  12          2HB       LYS  12  -2.545   4.003  14.545
  123   2HB   LYS  12          1HB       LYS  12  -1.757   2.434  14.701
  124   1HG   LYS  12          2HG       LYS  12  -2.024   3.474  17.327
  125   2HG   LYS  12          1HG       LYS  12  -3.577   3.717  16.526
  126   1HD   LYS  12          2HD       LYS  12  -4.044   1.536  16.801
  127   2HD   LYS  12          1HD       LYS  12  -2.652   1.125  15.799
  128   1HE   LYS  12          2HE       LYS  12  -1.331   0.626  17.611
  129   2HE   LYS  12          1HE       LYS  12  -2.050   1.905  18.609
  130   1HZ   LYS  12          3HZ       LYS  12  -3.478  -0.563  17.780
  131   2HZ   LYS  12          2HZ       LYS  12  -2.730  -0.363  19.293
  132   3HZ   LYS  12          1HZ       LYS  12  -4.039   0.625  18.852
  133    QB   LYS  12           QB       LYS  12  -2.151   3.218  14.623
  134    QD   LYS  12           QD       LYS  12  -3.348   1.330  16.300
  135    QG   LYS  12           QG       LYS  12  -2.801   3.596  16.927
  136    QE   LYS  12           QE       LYS  12  -1.690   1.266  18.110
  137    QZ   LYS  12           QZ       LYS  12  -3.416  -0.100  18.642
  138    H    ALA  13           H        ALA  13   1.787   4.903  15.045
  139    HA   ALA  13           HA       ALA  13   1.797   4.516  12.131
  140   1HB   ALA  13          2HB       ALA  13   1.196   7.083  13.476
  141   2HB   ALA  13          1HB       ALA  13   2.407   7.183  12.198
  142   3HB   ALA  13          3HB       ALA  13   0.799   6.554  11.842
  143    MB   ALA  13           QB       ALA  13   1.467   6.940  12.505
  144    H    GLY  14           H        GLY  14   3.953   4.808  11.256
  145   1HA   GLY  14          1HA       GLY  14   6.094   4.142  12.998
  146   2HA   GLY  14          2HA       GLY  14   6.154   5.884  12.723
  147    QA   GLY  14           QA       GLY  14   6.124   5.013  12.860
  148    H    GLU  15           H        GLU  15   8.296   4.547  11.804
  149    HA   GLU  15           HA       GLU  15   8.342   5.101   8.993
  150   1HB   GLU  15          2HB       GLU  15  10.086   4.037  11.113
  151   2HB   GLU  15          1HB       GLU  15  10.466   3.414   9.507
  152   1HG   GLU  15          2HG       GLU  15   9.918   6.265   9.413
  153   2HG   GLU  15          1HG       GLU  15  11.218   5.907  10.551
  154    QB   GLU  15           QB       GLU  15  10.276   3.726  10.310
  155    QG   GLU  15           QG       GLU  15  10.568   6.086   9.982
  156    H    GLY  16           H        GLY  16   7.910   3.771   7.245
  157   1HA   GLY  16          1HA       GLY  16   7.595   0.851   7.746
  158   2HA   GLY  16          2HA       GLY  16   7.878   1.582   6.167
  159    QA   GLY  16           QA       GLY  16   7.737   1.217   6.957
  160    H    GLU  17           H        GLU  17   5.584   3.177   8.209
  161    HA   GLU  17           HA       GLU  17   3.322   1.827   6.782
  162   1HB   GLU  17          2HB       GLU  17   3.824   2.926   9.480
  163   2HB   GLU  17          1HB       GLU  17   2.232   3.295   8.820
  164   1HG   GLU  17          2HG       GLU  17   1.659   1.236   9.584
  165   2HG   GLU  17          1HG       GLU  17   2.508   0.645   8.155
  166    QB   GLU  17           QB       GLU  17   3.028   3.110   9.150
  167    QG   GLU  17           QG       GLU  17   2.083   0.941   8.869
  168    H    ILE  18           H        ILE  18   2.256   3.030   5.263
  169    HA   ILE  18           HA       ILE  18   2.954   5.850   4.842
  170    HB   ILE  18           HB       ILE  18   0.948   3.997   3.515
  171   1HG1  ILE  18          2HG1      ILE  18   3.245   4.490   1.911
  172   2HG1  ILE  18          1HG1      ILE  18   3.823   4.033   3.513
  173   1HG2  ILE  18          3HG2      ILE  18   0.661   6.493   3.156
  174   2HG2  ILE  18          2HG2      ILE  18   2.260   6.495   2.414
  175   3HG2  ILE  18          1HG2      ILE  18   0.951   5.560   1.689
  176   1HD1  ILE  18          2HD1      ILE  18   1.600   2.459   2.255
  177   2HD1  ILE  18          1HD1      ILE  18   3.261   2.162   1.744
  178   3HD1  ILE  18          3HD1      ILE  18   2.804   1.938   3.433
  179    MG   ILE  18           QG2      ILE  18   1.291   6.183   2.419
  180    MD   ILE  18           QD1      ILE  18   2.555   2.186   2.477
  181    QG   ILE  18           QG1      ILE  18   3.534   4.261   2.712
  182    HA   PRO  19           HA       PRO  19  -0.495   6.896   7.568
  183   1HB   PRO  19          2HB       PRO  19   0.027   9.585   7.663
  184   2HB   PRO  19          1HB       PRO  19   0.895   8.395   8.653
  185   1HG   PRO  19          2HG       PRO  19   1.734   9.719   6.121
  186   2HG   PRO  19          1HG       PRO  19   2.687   9.337   7.565
  187   1HD   PRO  19          2HD       PRO  19   2.772   7.849   5.290
  188   2HD   PRO  19          1HD       PRO  19   3.057   7.170   6.909
  189    QB   PRO  19           QB       PRO  19   0.461   8.990   8.158
  190    QG   PRO  19           QG       PRO  19   2.210   9.528   6.843
  191    QD   PRO  19           QD       PRO  19   2.914   7.510   6.100
  192    H    ALA  20           H        ALA  20  -2.563   7.679   7.054
  193    HA   ALA  20           HA       ALA  20  -3.055   8.375   4.237
  194   1HB   ALA  20          2HB       ALA  20  -5.266   8.470   6.181
  195   2HB   ALA  20          1HB       ALA  20  -5.105   7.502   4.715
  196   3HB   ALA  20          3HB       ALA  20  -4.354   6.961   6.217
  197    MB   ALA  20           QB       ALA  20  -4.908   7.644   5.704
  198    HA   PRO  21           HA       PRO  21  -3.102  12.726   5.177
  199   1HB   PRO  21          2HB       PRO  21  -4.144  13.615   2.811
  200   2HB   PRO  21          1HB       PRO  21  -2.460  13.083   2.983
  201   1HG   PRO  21          2HG       PRO  21  -4.792  11.645   1.833
  202   2HG   PRO  21          1HG       PRO  21  -3.096  11.635   1.328
  203   1HD   PRO  21          2HD       PRO  21  -4.287   9.632   2.778
  204   2HD   PRO  21          1HD       PRO  21  -2.542   9.971   2.783
  205    QB   PRO  21           QB       PRO  21  -3.302  13.349   2.897
  206    QG   PRO  21           QG       PRO  21  -3.944  11.640   1.580
  207    QD   PRO  21           QD       PRO  21  -3.415   9.802   2.781
  208    H    LEU  22           H        LEU  22  -4.655  13.938   6.234
  209    HA   LEU  22           HA       LEU  22  -6.782  14.560   7.061
  210   1HB   LEU  22          2HB       LEU  22  -7.066  14.079   4.109
  211   2HB   LEU  22          1HB       LEU  22  -8.506  14.459   5.054
  212    HG   LEU  22           HG       LEU  22  -6.482  16.266   5.887
  213   1HD1  LEU  22          2HD1      LEU  22  -5.490  15.533   3.611
  214   2HD1  LEU  22          1HD1      LEU  22  -6.844  16.408   2.895
  215   3HD1  LEU  22          3HD1      LEU  22  -5.674  17.263   3.901
  216   1HD2  LEU  22          1HD2      LEU  22  -8.999  16.491   4.224
  217   2HD2  LEU  22          3HD2      LEU  22  -8.792  16.867   5.935
  218   3HD2  LEU  22          2HD2      LEU  22  -8.061  17.905   4.709
  219    MD1  LEU  22           QD1      LEU  22  -6.003  16.401   3.469
  220    MD2  LEU  22           QD2      LEU  22  -8.618  17.088   4.956
  221    QB   LEU  22           QB       LEU  22  -7.786  14.269   4.582
  222    QD   LEU  22           QQD      LEU  22  -7.310  16.744   4.212
  223    H    ALA  23           H        ALA  23  -9.320  13.600   6.605
  224    HA   ALA  23           HA       ALA  23  -9.101  10.790   7.580
  225   1HB   ALA  23          2HB       ALA  23 -11.524  12.600   7.549
  226   2HB   ALA  23          1HB       ALA  23 -11.196  11.241   8.625
  227   3HB   ALA  23          3HB       ALA  23 -10.279  12.738   8.790
  228    MB   ALA  23           QB       ALA  23 -11.000  12.193   8.322
  229    H    GLY  24           H        GLY  24 -10.001   9.098   6.409
  230   1HA   GLY  24          1HA       GLY  24 -10.362   9.024   3.714
  231   2HA   GLY  24          2HA       GLY  24 -11.929   9.629   4.255
  232    QA   GLY  24           QA       GLY  24 -11.145   9.326   3.985
  233    H    THR  25           H        THR  25 -12.550   7.457   3.201
  234    HA   THR  25           HA       THR  25 -12.298   5.256   5.228
  235    HB   THR  25           HB       THR  25 -14.672   5.662   3.419
  236    HG1  THR  25           HG1      THR  25 -15.512   6.850   5.315
  237   1HG2  THR  25          3HG2      THR  25 -14.292   3.606   4.893
  238   2HG2  THR  25          2HG2      THR  25 -14.533   4.678   6.273
  239   3HG2  THR  25          1HG2      THR  25 -15.832   4.440   5.104
  240    MG   THR  25           QG2      THR  25 -14.886   4.242   5.423
  241    H    VAL  26           H        VAL  26 -11.586   3.323   4.399
  242    HA   VAL  26           HA       VAL  26 -10.667   3.099   1.683
  243    HB   VAL  26           HB       VAL  26 -11.186   1.065   3.876
  244   1HG1  VAL  26          1HG1      VAL  26  -9.857   0.873   1.181
  245   2HG1  VAL  26          3HG1      VAL  26  -9.324  -0.156   2.508
  246   3HG1  VAL  26          2HG1      VAL  26 -10.990  -0.246   1.937
  247   1HG2  VAL  26          2HG2      VAL  26  -9.427   3.149   3.893
  248   2HG2  VAL  26          1HG2      VAL  26  -9.140   1.619   4.723
  249   3HG2  VAL  26          3HG2      VAL  26  -8.446   1.899   3.126
  250    MG1  VAL  26           QG1      VAL  26 -10.057   0.157   1.875
  251    MG2  VAL  26           QG2      VAL  26  -9.004   2.222   3.914
  252    QG   VAL  26           QQG      VAL  26  -9.531   1.190   2.895
  253    H    SER  27           H        SER  27 -11.639   2.107  -0.098
  254    HA   SER  27           HA       SER  27 -14.493   1.252   0.253
  255   1HB   SER  27          2HB       SER  27 -12.934   2.740  -1.827
  256   2HB   SER  27          1HB       SER  27 -14.324   1.794  -2.350
  257    HG   SER  27           HG       SER  27 -15.624   3.126  -1.327
  258    QB   SER  27           QB       SER  27 -13.629   2.267  -2.089
  259    H    LYS  28           H        LYS  28 -11.330   0.337  -0.925
  260    HA   LYS  28           HA       LYS  28 -12.025  -2.459  -1.090
  261   1HB   LYS  28          2HB       LYS  28 -12.659  -0.765  -3.320
  262   2HB   LYS  28          1HB       LYS  28 -11.374  -1.872  -3.806
  263   1HG   LYS  28          2HG       LYS  28 -12.923  -3.630  -2.515
  264   2HG   LYS  28          1HG       LYS  28 -14.174  -2.471  -2.962
  265   1HD   LYS  28          2HD       LYS  28 -12.975  -2.599  -5.328
  266   2HD   LYS  28          1HD       LYS  28 -12.449  -4.169  -4.722
  267   1HE   LYS  28          2HE       LYS  28 -14.584  -5.046  -4.750
  268   2HE   LYS  28          1HE       LYS  28 -15.338  -3.484  -4.371
  269   1HZ   LYS  28          3HZ       LYS  28 -13.968  -4.082  -6.938
  270   2HZ   LYS  28          2HZ       LYS  28 -15.649  -4.197  -6.719
  271   3HZ   LYS  28          1HZ       LYS  28 -14.868  -2.696  -6.559
  272    QB   LYS  28           QB       LYS  28 -12.017  -1.319  -3.563
  273    QD   LYS  28           QD       LYS  28 -12.712  -3.384  -5.025
  274    QG   LYS  28           QG       LYS  28 -13.548  -3.051  -2.739
  275    QE   LYS  28           QE       LYS  28 -14.961  -4.265  -4.560
  276    QZ   LYS  28           QZ       LYS  28 -14.828  -3.658  -6.738
  277    H    ILE  29           H        ILE  29 -10.122  -3.673  -1.140
  278    HA   ILE  29           HA       ILE  29  -7.577  -2.131  -1.306
  279    HB   ILE  29           HB       ILE  29  -8.140  -3.468   0.712
  280   1HG1  ILE  29          2HG1      ILE  29  -5.853  -4.602  -0.931
  281   2HG1  ILE  29          1HG1      ILE  29  -5.776  -3.156   0.075
  282   1HG2  ILE  29          3HG2      ILE  29  -9.075  -5.314  -1.181
  283   2HG2  ILE  29          2HG2      ILE  29  -7.647  -6.074  -0.479
  284   3HG2  ILE  29          1HG2      ILE  29  -8.973  -5.559   0.563
  285   1HD1  ILE  29          1HD1      ILE  29  -6.589  -4.718   1.990
  286   2HD1  ILE  29          3HD1      ILE  29  -6.068  -6.028   0.931
  287   3HD1  ILE  29          2HD1      ILE  29  -4.904  -4.826   1.484
  288    MG   ILE  29           QG2      ILE  29  -8.565  -5.649  -0.366
  289    MD   ILE  29           QD1      ILE  29  -5.854  -5.191   1.468
  290    QG   ILE  29           QG1      ILE  29  -5.814  -3.879  -0.428
  291    H    LEU  30           H        LEU  30  -6.134  -2.499  -2.961
  292    HA   LEU  30           HA       LEU  30  -6.930  -4.293  -5.158
  293   1HB   LEU  30          2HB       LEU  30  -5.238  -1.969  -4.669
  294   2HB   LEU  30          1HB       LEU  30  -4.407  -3.174  -5.651
  295    HG   LEU  30           HG       LEU  30  -5.663  -1.629  -7.089
  296   1HD1  LEU  30          2HD1      LEU  30  -7.415  -1.290  -5.167
  297   2HD1  LEU  30          1HD1      LEU  30  -7.950  -1.196  -6.845
  298   3HD1  LEU  30          3HD1      LEU  30  -8.228  -2.666  -5.911
  299   1HD2  LEU  30          3HD2      LEU  30  -5.960  -4.476  -7.014
  300   2HD2  LEU  30          2HD2      LEU  30  -7.479  -3.776  -7.571
  301   3HD2  LEU  30          1HD2      LEU  30  -5.976  -3.415  -8.421
  302    MD1  LEU  30           QD1      LEU  30  -7.864  -1.717  -5.974
  303    MD2  LEU  30           QD2      LEU  30  -6.472  -3.889  -7.669
  304    QB   LEU  30           QB       LEU  30  -4.822  -2.572  -5.160
  305    QD   LEU  30           QQD      LEU  30  -7.168  -2.803  -6.821
  306    H    VAL  31           H        VAL  31  -3.951  -3.872  -3.198
  307    HA   VAL  31           HA       VAL  31  -2.930  -6.493  -4.017
  308    HB   VAL  31           HB       VAL  31  -1.041  -5.829  -2.591
  309   1HG1  VAL  31          3HG1      VAL  31  -2.530  -4.871  -0.775
  310   2HG1  VAL  31          2HG1      VAL  31  -1.118  -3.891  -1.170
  311   3HG1  VAL  31          1HG1      VAL  31  -2.707  -3.433  -1.781
  312   1HG2  VAL  31          3HG2      VAL  31  -2.270  -3.734  -4.377
  313   2HG2  VAL  31          2HG2      VAL  31  -0.725  -3.443  -3.576
  314   3HG2  VAL  31          1HG2      VAL  31  -0.897  -4.792  -4.700
  315    MG1  VAL  31           QG1      VAL  31  -2.119  -4.065  -1.242
  316    MG2  VAL  31           QG2      VAL  31  -1.297  -3.990  -4.217
  317    QG   VAL  31           QQG      VAL  31  -1.708  -4.027  -2.730
  318    H    LYS  32           H        LYS  32  -1.964  -7.776  -1.939
  319    HA   LYS  32           HA       LYS  32  -4.018  -7.948   0.213
  320   1HB   LYS  32          2HB       LYS  32  -4.455  -9.433  -1.884
  321   2HB   LYS  32          1HB       LYS  32  -3.098 -10.395  -1.294
  322   1HG   LYS  32          2HG       LYS  32  -4.247 -11.136   0.559
  323   2HG   LYS  32          1HG       LYS  32  -5.216  -9.667   0.676
  324   1HD   LYS  32          2HD       LYS  32  -6.735 -10.377  -0.949
  325   2HD   LYS  32          1HD       LYS  32  -5.585 -11.500  -1.675
  326   1HE   LYS  32          2HE       LYS  32  -7.120 -12.891  -0.485
  327   2HE   LYS  32          1HE       LYS  32  -5.709 -12.777   0.586
  328   1HZ   LYS  32          2HZ       LYS  32  -6.813 -10.752   1.551
  329   2HZ   LYS  32          1HZ       LYS  32  -8.222 -11.206   0.717
  330   3HZ   LYS  32          3HZ       LYS  32  -7.575 -12.229   1.905
  331    QB   LYS  32           QB       LYS  32  -3.776  -9.914  -1.589
  332    QD   LYS  32           QD       LYS  32  -6.160 -10.939  -1.312
  333    QG   LYS  32           QG       LYS  32  -4.732 -10.401   0.618
  334    QE   LYS  32           QE       LYS  32  -6.415 -12.834   0.050
  335    QZ   LYS  32           QZ       LYS  32  -7.536 -11.396   1.391
  336    H    GLU  33           H        GLU  33  -1.508  -6.938   0.650
  337    HA   GLU  33           HA       GLU  33   0.400  -7.235   2.015
  338   1HB   GLU  33          2HB       GLU  33  -1.640  -8.496   3.200
  339   2HB   GLU  33          1HB       GLU  33  -0.653  -9.913   2.841
  340   1HG   GLU  33          2HG       GLU  33   1.221  -8.162   3.828
  341   2HG   GLU  33          1HG       GLU  33  -0.197  -7.761   4.798
  342    QB   GLU  33           QB       GLU  33  -1.146  -9.205   3.021
  343    QG   GLU  33           QG       GLU  33   0.512  -7.961   4.313
  344    H    GLY  34           H        GLY  34   2.408  -8.495   2.091
  345   1HA   GLY  34          1HA       GLY  34   2.819 -10.980   0.794
  346   2HA   GLY  34          2HA       GLY  34   4.081  -9.773   1.051
  347    QA   GLY  34           QA       GLY  34   3.450 -10.376   0.923
  348    H    ASP  35           H        ASP  35   2.480  -7.754  -0.495
  349    HA   ASP  35           HA       ASP  35   2.699  -8.901  -3.250
  350   1HB   ASP  35          2HB       ASP  35   1.210  -7.031  -3.835
  351   2HB   ASP  35          1HB       ASP  35   0.541  -7.930  -2.473
  352    QB   ASP  35           QB       ASP  35   0.875  -7.480  -3.154
  353    H    THR  36           H        THR  36   3.982  -7.793  -4.813
  354    HA   THR  36           HA       THR  36   5.930  -5.837  -3.657
  355    HB   THR  36           HB       THR  36   6.067  -7.675  -6.071
  356    HG1  THR  36           HG1      THR  36   6.754  -9.076  -4.690
  357   1HG2  THR  36          3HG2      THR  36   7.659  -5.400  -5.260
  358   2HG2  THR  36          2HG2      THR  36   8.632  -6.870  -5.239
  359   3HG2  THR  36          1HG2      THR  36   7.795  -6.389  -6.715
  360    MG   THR  36           QG2      THR  36   8.028  -6.220  -5.738
  361    H    VAL  37           H        VAL  37   5.675  -3.749  -4.323
  362    HA   VAL  37           HA       VAL  37   4.149  -3.229  -6.848
  363    HB   VAL  37           HB       VAL  37   3.754  -1.013  -5.765
  364   1HG1  VAL  37          3HG1      VAL  37   2.696  -3.516  -5.056
  365   2HG1  VAL  37          2HG1      VAL  37   2.979  -2.691  -3.524
  366   3HG1  VAL  37          1HG1      VAL  37   1.963  -1.941  -4.754
  367   1HG2  VAL  37          3HG2      VAL  37   6.020  -1.511  -4.367
  368   2HG2  VAL  37          2HG2      VAL  37   4.789  -0.372  -3.824
  369   3HG2  VAL  37          1HG2      VAL  37   4.818  -2.013  -3.177
  370    MG1  VAL  37           QG1      VAL  37   2.546  -2.716  -4.445
  371    MG2  VAL  37           QG2      VAL  37   5.209  -1.299  -3.789
  372    QG   VAL  37           QQG      VAL  37   3.877  -2.007  -4.117
  373    H    LYS  38           H        LYS  38   4.923  -0.814  -7.624
  374    HA   LYS  38           HA       LYS  38   7.906  -0.692  -7.595
  375   1HB   LYS  38          2HB       LYS  38   6.882  -2.072  -9.519
  376   2HB   LYS  38          1HB       LYS  38   6.277  -0.535 -10.138
  377   1HG   LYS  38          2HG       LYS  38   8.636   0.345 -10.043
  378   2HG   LYS  38          1HG       LYS  38   9.170  -1.288  -9.640
  379   1HD   LYS  38          2HD       LYS  38   9.282  -1.670 -11.862
  380   2HD   LYS  38          1HD       LYS  38   7.518  -1.650 -11.856
  381   1HE   LYS  38          2HE       LYS  38   7.440   0.362 -12.917
  382   2HE   LYS  38          1HE       LYS  38   8.712   1.043 -11.881
  383   1HZ   LYS  38          3HZ       LYS  38  10.305  -0.407 -13.110
  384   2HZ   LYS  38          2HZ       LYS  38   9.060  -0.769 -14.207
  385   3HZ   LYS  38          1HZ       LYS  38   9.623   0.828 -14.052
  386    QB   LYS  38           QB       LYS  38   6.580  -1.304  -9.828
  387    QD   LYS  38           QD       LYS  38   8.400  -1.660 -11.859
  388    QG   LYS  38           QG       LYS  38   8.903  -0.471  -9.842
  389    QE   LYS  38           QE       LYS  38   8.076   0.702 -12.399
  390    QZ   LYS  38           QZ       LYS  38   9.663  -0.116 -13.790
  391    H    ALA  39           H        ALA  39   6.292   1.091  -6.206
  392    HA   ALA  39           HA       ALA  39   5.835   3.399  -5.987
  393   1HB   ALA  39          3HB       ALA  39   8.316   3.084  -6.907
  394   2HB   ALA  39          2HB       ALA  39   7.640   3.878  -8.329
  395   3HB   ALA  39          1HB       ALA  39   7.602   4.689  -6.765
  396    MB   ALA  39           QB       ALA  39   7.853   3.884  -7.333
  397    H    GLY  40           H        GLY  40   3.640   3.364  -6.749
  398   1HA   GLY  40          1HA       GLY  40   3.318   4.105  -9.632
  399   2HA   GLY  40          2HA       GLY  40   2.419   4.923  -8.355
  400    QA   GLY  40           QA       GLY  40   2.869   4.514  -8.994
  401    H    GLN  41           H        GLN  41   2.851   1.577  -7.764
  402    HA   GLN  41           HA       GLN  41   0.549   0.618  -9.276
  403   1HB   GLN  41          2HB       GLN  41   2.635  -0.648  -8.513
  404   2HB   GLN  41          1HB       GLN  41   1.933  -0.642  -6.895
  405   1HG   GLN  41          2HG       GLN  41   0.272  -2.129  -7.456
  406   2HG   GLN  41          1HG       GLN  41   0.172  -1.547  -9.120
  407   1HE2  GLN  41          1HE2      GLN  41   0.990  -4.263  -7.472
  408   2HE2  GLN  41          2HE2      GLN  41   2.206  -4.878  -8.483
  409    QB   GLN  41           QB       GLN  41   2.284  -0.645  -7.704
  410    QG   GLN  41           QG       GLN  41   0.222  -1.838  -8.288
  411    QE   GLN  41           QE2      GLN  41   1.598  -4.570  -7.978
  412    H    THR  42           H        THR  42  -1.537   1.038  -8.672
  413    HA   THR  42           HA       THR  42  -2.331   2.237  -6.201
  414    HB   THR  42           HB       THR  42  -4.144   0.497  -7.848
  415    HG1  THR  42           HG1      THR  42  -3.171   3.022  -8.679
  416   1HG2  THR  42          3HG2      THR  42  -4.310   2.846  -6.099
  417   2HG2  THR  42          2HG2      THR  42  -5.202   3.037  -7.609
  418   3HG2  THR  42          1HG2      THR  42  -5.560   1.681  -6.538
  419    MG   THR  42           QG2      THR  42  -5.024   2.521  -6.749
  420    H    VAL  43           H        VAL  43  -1.776   1.122  -4.321
  421    HA   VAL  43           HA       VAL  43  -2.187  -1.790  -4.129
  422    HB   VAL  43           HB       VAL  43  -1.216  -1.403  -1.869
  423   1HG1  VAL  43          2HG1      VAL  43  -2.380   0.967  -1.838
  424   2HG1  VAL  43          1HG1      VAL  43  -0.853   0.724  -0.991
  425   3HG1  VAL  43          3HG1      VAL  43  -0.868   1.493  -2.578
  426   1HG2  VAL  43          2HG2      VAL  43  -0.008  -0.733  -4.419
  427   2HG2  VAL  43          1HG2      VAL  43   0.750   0.175  -3.110
  428   3HG2  VAL  43          3HG2      VAL  43   0.696  -1.586  -3.046
  429    MG1  VAL  43           QG1      VAL  43  -1.367   1.061  -1.802
  430    MG2  VAL  43           QG2      VAL  43   0.479  -0.714  -3.525
  431    QG   VAL  43           QQG      VAL  43  -0.444   0.173  -2.664
  432    H    LEU  44           H        LEU  44  -3.903   1.138  -3.329
  433    HA   LEU  44           HA       LEU  44  -6.141  -0.496  -2.260
  434   1HB   LEU  44          2HB       LEU  44  -4.362   1.339  -0.738
  435   2HB   LEU  44          1HB       LEU  44  -6.086   1.458  -0.386
  436    HG   LEU  44           HG       LEU  44  -5.695  -1.270  -0.467
  437   1HD1  LEU  44          1HD1      LEU  44  -3.127  -0.163  -0.267
  438   2HD1  LEU  44          3HD1      LEU  44  -3.538  -0.641   1.379
  439   3HD1  LEU  44          2HD1      LEU  44  -3.579  -1.832   0.079
  440   1HD2  LEU  44          2HD2      LEU  44  -6.109   0.822   1.549
  441   2HD2  LEU  44          1HD2      LEU  44  -6.902  -0.744   1.377
  442   3HD2  LEU  44          3HD2      LEU  44  -5.348  -0.628   2.203
  443    MD1  LEU  44           QD1      LEU  44  -3.415  -0.879   0.397
  444    MD2  LEU  44           QD2      LEU  44  -6.120  -0.183   1.710
  445    QB   LEU  44           QB       LEU  44  -5.224   1.398  -0.562
  446    QD   LEU  44           QQD      LEU  44  -4.767  -0.531   1.054
  447    H    VAL  45           H        VAL  45  -8.029   1.140  -1.708
  448    HA   VAL  45           HA       VAL  45  -8.010   3.410  -3.663
  449    HB   VAL  45           HB       VAL  45 -10.147   1.297  -3.228
  450   1HG1  VAL  45          3HG1      VAL  45 -10.864   3.710  -3.801
  451   2HG1  VAL  45          2HG1      VAL  45 -10.093   3.432  -5.363
  452   3HG1  VAL  45          1HG1      VAL  45 -11.450   2.425  -4.857
  453   1HG2  VAL  45          2HG2      VAL  45  -7.839   1.485  -4.989
  454   2HG2  VAL  45          1HG2      VAL  45  -8.931   0.126  -4.726
  455   3HG2  VAL  45          3HG2      VAL  45  -9.339   1.369  -5.908
  456    MG1  VAL  45           QG1      VAL  45 -10.802   3.189  -4.674
  457    MG2  VAL  45           QG2      VAL  45  -8.703   0.994  -5.208
  458    QG   VAL  45           QQG      VAL  45  -9.753   2.091  -4.941
  459    H    LEU  46           H        LEU  46  -8.419   5.238  -2.478
  460    HA   LEU  46           HA       LEU  46  -9.993   5.015   0.043
  461   1HB   LEU  46          2HB       LEU  46  -7.648   6.157  -0.384
  462   2HB   LEU  46          1HB       LEU  46  -8.635   7.497  -0.968
  463    HG   LEU  46           HG       LEU  46  -9.956   6.962   1.317
  464   1HD1  LEU  46          3HD1      LEU  46  -7.600   5.392   1.509
  465   2HD1  LEU  46          2HD1      LEU  46  -7.394   6.750   2.614
  466   3HD1  LEU  46          1HD1      LEU  46  -8.797   5.692   2.769
  467   1HD2  LEU  46          2HD2      LEU  46  -8.272   8.959   0.347
  468   2HD2  LEU  46          1HD2      LEU  46  -9.255   9.054   1.809
  469   3HD2  LEU  46          3HD2      LEU  46  -7.571   8.541   1.911
  470    MD1  LEU  46           QD1      LEU  46  -7.930   5.944   2.297
  471    MD2  LEU  46           QD2      LEU  46  -8.366   8.852   1.356
  472    QB   LEU  46           QB       LEU  46  -8.141   6.827  -0.676
  473    QD   LEU  46           QQD      LEU  46  -8.148   7.398   1.827
  474    H    GLU  47           H        GLU  47 -11.737   6.578   0.427
  475    HA   GLU  47           HA       GLU  47 -12.763   8.104  -1.891
  476   1HB   GLU  47          2HB       GLU  47 -13.455   5.514  -1.744
  477   2HB   GLU  47          1HB       GLU  47 -14.661   6.168  -0.635
  478   1HG   GLU  47          2HG       GLU  47 -15.191   7.890  -2.452
  479   2HG   GLU  47          1HG       GLU  47 -14.227   6.888  -3.539
  480    QB   GLU  47           QB       GLU  47 -14.058   5.841  -1.190
  481    QG   GLU  47           QG       GLU  47 -14.709   7.389  -2.996
  482    H    ALA  48           H        ALA  48 -13.212  10.038  -0.903
  483    HA   ALA  48           HA       ALA  48 -14.754   9.975   1.666
  484   1HB   ALA  48          1HB       ALA  48 -12.432  11.786   0.922
  485   2HB   ALA  48          3HB       ALA  48 -13.319  11.820   2.447
  486   3HB   ALA  48          2HB       ALA  48 -12.334  10.418   2.030
  487    MB   ALA  48           QB       ALA  48 -12.695  11.341   1.800
  488    H    MET  49           H        MET  49 -16.663  11.027   1.313
  489    HA   MET  49           HA       MET  49 -18.228  12.564   0.444
  490   1HB   MET  49          2HB       MET  49 -15.635  13.921   0.805
  491   2HB   MET  49          1HB       MET  49 -16.722  14.741  -0.314
  492   1HG   MET  49          2HG       MET  49 -18.252  13.857   1.941
  493   2HG   MET  49          1HG       MET  49 -16.830  14.712   2.539
  494   1HE   MET  49          3HE       MET  49 -19.885  14.471   0.758
  495   2HE   MET  49          2HE       MET  49 -20.503  15.668   1.893
  496   3HE   MET  49          1HE       MET  49 -20.391  16.063   0.180
  497    QB   MET  49           QB       MET  49 -16.178  14.331   0.245
  498    QG   MET  49           QG       MET  49 -17.541  14.284   2.240
  499    ME   MET  49           QE       MET  49 -20.260  15.401   0.944
  500    H    LYS  50           H        LYS  50 -17.629  10.637  -1.404
  501    HA   LYS  50           HA       LYS  50 -17.592  10.190  -3.725
  502   1HB   LYS  50          2HB       LYS  50 -18.709  13.002  -3.532
  503   2HB   LYS  50          1HB       LYS  50 -18.754  12.038  -5.010
  504   1HG   LYS  50          2HG       LYS  50 -19.724  10.613  -2.624
  505   2HG   LYS  50          1HG       LYS  50 -20.703  12.009  -3.074
  506   1HD   LYS  50          2HD       LYS  50 -19.857  10.270  -5.318
  507   2HD   LYS  50          1HD       LYS  50 -21.007   9.550  -4.191
  508   1HE   LYS  50          2HE       LYS  50 -22.631  10.678  -5.312
  509   2HE   LYS  50          1HE       LYS  50 -21.958  12.165  -4.613
  510   1HZ   LYS  50          1HZ       LYS  50 -20.234  11.984  -6.457
  511   2HZ   LYS  50          3HZ       LYS  50 -21.296  10.891  -7.199
  512   3HZ   LYS  50          2HZ       LYS  50 -21.792  12.490  -6.906
  513    QB   LYS  50           QB       LYS  50 -18.731  12.520  -4.271
  514    QD   LYS  50           QD       LYS  50 -20.432   9.910  -4.754
  515    QG   LYS  50           QG       LYS  50 -20.213  11.311  -2.849
  516    QE   LYS  50           QE       LYS  50 -22.295  11.421  -4.962
  517    QZ   LYS  50           QZ       LYS  50 -21.107  11.789  -6.854
  518    H    MET  51           H        MET  51 -15.036  10.729  -2.967
  519    HA   MET  51           HA       MET  51 -14.039  12.773  -4.925
  520   1HB   MET  51          2HB       MET  51 -13.315  11.909  -2.191
  521   2HB   MET  51          1HB       MET  51 -11.943  12.180  -3.265
  522   1HG   MET  51          2HG       MET  51 -13.583  14.342  -3.811
  523   2HG   MET  51          1HG       MET  51 -13.785  14.125  -2.072
  524   1HE   MET  51          2HE       MET  51 -12.877  15.548  -0.862
  525   2HE   MET  51          1HE       MET  51 -11.234  16.179  -0.791
  526   3HE   MET  51          3HE       MET  51 -12.379  16.816  -1.980
  527    QB   MET  51           QB       MET  51 -12.629  12.044  -2.728
  528    QG   MET  51           QG       MET  51 -13.684  14.233  -2.941
  529    ME   MET  51           QE       MET  51 -12.163  16.181  -1.211
  530    H    GLU  52           H        GLU  52 -13.659   9.439  -3.763
  531    HA   GLU  52           HA       GLU  52 -12.574   7.582  -4.745
  532   1HB   GLU  52          2HB       GLU  52 -14.205   8.333  -6.516
  533   2HB   GLU  52          1HB       GLU  52 -12.905   9.283  -7.237
  534   1HG   GLU  52          2HG       GLU  52 -13.037   7.144  -8.388
  535   2HG   GLU  52          1HG       GLU  52 -11.552   7.185  -7.438
  536    QB   GLU  52           QB       GLU  52 -13.555   8.808  -6.876
  537    QG   GLU  52           QG       GLU  52 -12.294   7.164  -7.913
  538    H    THR  53           H        THR  53 -10.462   7.693  -3.911
  539    HA   THR  53           HA       THR  53  -8.461   9.130  -5.624
  540    HB   THR  53           HB       THR  53  -8.643   8.896  -2.603
  541    HG1  THR  53           HG1      THR  53  -8.803  11.064  -4.421
  542   1HG2  THR  53          2HG2      THR  53  -6.303   8.725  -3.440
  543   2HG2  THR  53          1HG2      THR  53  -6.525  10.253  -4.294
  544   3HG2  THR  53          3HG2      THR  53  -6.587  10.211  -2.532
  545    MG   THR  53           QG2      THR  53  -6.472   9.730  -3.422
  546    H    GLU  54           H        GLU  54  -7.451   7.411  -6.646
  547    HA   GLU  54           HA       GLU  54  -7.152   4.771  -5.591
  548   1HB   GLU  54          2HB       GLU  54  -6.089   6.447  -7.805
  549   2HB   GLU  54          1HB       GLU  54  -5.138   5.019  -7.393
  550   1HG   GLU  54          2HG       GLU  54  -7.096   3.587  -7.673
  551   2HG   GLU  54          1HG       GLU  54  -8.115   4.995  -7.976
  552    QB   GLU  54           QB       GLU  54  -5.613   5.733  -7.599
  553    QG   GLU  54           QG       GLU  54  -7.605   4.291  -7.824
  554    H    ILE  55           H        ILE  55  -5.312   3.780  -4.584
  555    HA   ILE  55           HA       ILE  55  -3.428   5.726  -3.300
  556    HB   ILE  55           HB       ILE  55  -4.468   2.998  -2.475
  557   1HG1  ILE  55          2HG1      ILE  55  -4.865   5.780  -1.322
  558   2HG1  ILE  55          1HG1      ILE  55  -6.068   4.869  -2.236
  559   1HG2  ILE  55          1HG2      ILE  55  -2.365   4.808  -1.285
  560   2HG2  ILE  55          3HG2      ILE  55  -3.272   3.678  -0.279
  561   3HG2  ILE  55          2HG2      ILE  55  -2.271   3.076  -1.599
  562   1HD1  ILE  55          2HD1      ILE  55  -4.928   3.350   0.000
  563   2HD1  ILE  55          1HD1      ILE  55  -5.776   4.809   0.513
  564   3HD1  ILE  55          3HD1      ILE  55  -6.616   3.593  -0.449
  565    MG   ILE  55           QG2      ILE  55  -2.636   3.854  -1.054
  566    MD   ILE  55           QD1      ILE  55  -5.773   3.917   0.021
  567    QG   ILE  55           QG1      ILE  55  -5.466   5.324  -1.779
  568    H    ASN  56           H        ASN  56  -1.959   5.626  -5.147
  569    HA   ASN  56           HA       ASN  56  -0.744   3.062  -5.913
  570   1HB   ASN  56          2HB       ASN  56  -0.129   5.954  -6.593
  571   2HB   ASN  56          1HB       ASN  56   0.554   4.550  -7.413
  572   1HD2  ASN  56          1HD2      ASN  56  -0.596   5.648  -9.354
  573   2HD2  ASN  56          2HD2      ASN  56  -2.224   5.248  -9.612
  574    QB   ASN  56           QB       ASN  56   0.213   5.252  -7.003
  575    QD   ASN  56           QD2      ASN  56  -1.410   5.448  -9.483
  576    H    ALA  57           H        ALA  57   0.996   2.199  -4.909
  577    HA   ALA  57           HA       ALA  57   2.204   3.096  -2.559
  578   1HB   ALA  57          2HB       ALA  57   2.980   1.347  -4.860
  579   2HB   ALA  57          1HB       ALA  57   4.219   1.725  -3.662
  580   3HB   ALA  57          3HB       ALA  57   2.728   0.920  -3.168
  581    MB   ALA  57           QB       ALA  57   3.309   1.331  -3.897
  582    HA   PRO  58           HA       PRO  58   4.596   6.585  -3.823
  583   1HB   PRO  58          2HB       PRO  58   6.388   6.669  -1.757
  584   2HB   PRO  58          1HB       PRO  58   4.695   7.176  -1.591
  585   1HG   PRO  58          2HG       PRO  58   5.999   4.633  -0.766
  586   2HG   PRO  58          1HG       PRO  58   4.737   5.572   0.047
  587   1HD   PRO  58          2HD       PRO  58   4.249   3.305  -1.401
  588   2HD   PRO  58          1HD       PRO  58   3.057   4.602  -1.161
  589    QB   PRO  58           QB       PRO  58   5.542   6.922  -1.674
  590    QG   PRO  58           QG       PRO  58   5.368   5.102  -0.360
  591    QD   PRO  58           QD       PRO  58   3.653   3.954  -1.281
  592    H    THR  59           H        THR  59   6.469   3.764  -2.642
  593    HA   THR  59           HA       THR  59   8.287   4.122  -4.990
  594    HB   THR  59           HB       THR  59   9.247   5.149  -2.940
  595    HG1  THR  59           HG1      THR  59  10.422   2.740  -3.853
  596   1HG2  THR  59          3HG2      THR  59   7.992   3.153  -1.592
  597   2HG2  THR  59          2HG2      THR  59   9.634   2.514  -1.646
  598   3HG2  THR  59          1HG2      THR  59   9.325   4.093  -0.922
  599    MG   THR  59           QG2      THR  59   8.984   3.253  -1.387
  600    H    ASP  60           H        ASP  60   9.410   2.120  -5.578
  601    HA   ASP  60           HA       ASP  60   7.812  -0.215  -5.583
  602   1HB   ASP  60          2HB       ASP  60   9.891  -1.268  -6.422
  603   2HB   ASP  60          1HB       ASP  60   9.656   0.324  -7.144
  604    QB   ASP  60           QB       ASP  60   9.773  -0.472  -6.783
  605    H    GLY  61           H        GLY  61   8.251  -2.300  -4.490
  606   1HA   GLY  61          1HA       GLY  61   8.986  -1.881  -1.655
  607   2HA   GLY  61          2HA       GLY  61   9.928  -3.078  -2.545
  608    QA   GLY  61           QA       GLY  61   9.457  -2.480  -2.100
  609    H    LYS  62           H        LYS  62   8.892  -4.475  -0.770
  610    HA   LYS  62           HA       LYS  62   6.300  -5.559  -1.805
  611   1HB   LYS  62          2HB       LYS  62   8.404  -6.950  -1.856
  612   2HB   LYS  62          1HB       LYS  62   8.433  -6.871  -0.094
  613   1HG   LYS  62          2HG       LYS  62   6.265  -7.975   0.037
  614   2HG   LYS  62          1HG       LYS  62   6.116  -7.956  -1.720
  615   1HD   LYS  62          2HD       LYS  62   6.906 -10.123  -1.323
  616   2HD   LYS  62          1HD       LYS  62   8.397  -9.244  -1.666
  617   1HE   LYS  62          2HE       LYS  62   9.124  -9.357   0.523
  618   2HE   LYS  62          1HE       LYS  62   7.476  -9.307   1.178
  619   1HZ   LYS  62          1HZ       LYS  62   8.628 -11.587  -0.342
  620   2HZ   LYS  62          3HZ       LYS  62   8.476 -11.536   1.346
  621   3HZ   LYS  62          2HZ       LYS  62   7.086 -11.526   0.369
  622    QB   LYS  62           QB       LYS  62   8.418  -6.910  -0.975
  623    QD   LYS  62           QD       LYS  62   7.651  -9.684  -1.495
  624    QG   LYS  62           QG       LYS  62   6.191  -7.966  -0.842
  625    QE   LYS  62           QE       LYS  62   8.300  -9.332   0.851
  626    QZ   LYS  62           QZ       LYS  62   8.063 -11.550   0.458
  627    H    VAL  63           H        VAL  63   4.553  -5.739  -0.380
  628    HA   VAL  63           HA       VAL  63   4.528  -4.155   2.016
  629    HB   VAL  63           HB       VAL  63   2.729  -6.224   0.742
  630   1HG1  VAL  63          1HG1      VAL  63   2.664  -3.239   1.206
  631   2HG1  VAL  63          3HG1      VAL  63   2.711  -4.091  -0.337
  632   3HG1  VAL  63          2HG1      VAL  63   1.253  -4.141   0.655
  633   1HG2  VAL  63          2HG2      VAL  63   2.366  -4.838   3.412
  634   2HG2  VAL  63          1HG2      VAL  63   1.001  -5.438   2.474
  635   3HG2  VAL  63          3HG2      VAL  63   2.229  -6.560   3.060
  636    MG1  VAL  63           QG1      VAL  63   2.209  -3.824   0.508
  637    MG2  VAL  63           QG2      VAL  63   1.865  -5.612   2.982
  638    QG   VAL  63           QQG      VAL  63   2.037  -4.718   1.745
  639    H    GLU  64           H        GLU  64   4.979  -4.708   4.114
  640    HA   GLU  64           HA       GLU  64   5.970  -7.472   4.631
  641   1HB   GLU  64          2HB       GLU  64   6.230  -4.828   6.102
  642   2HB   GLU  64          1HB       GLU  64   6.979  -6.337   6.625
  643   1HG   GLU  64          2HG       GLU  64   7.449  -5.432   3.814
  644   2HG   GLU  64          1HG       GLU  64   8.311  -4.604   5.110
  645    QB   GLU  64           QB       GLU  64   6.604  -5.583   6.364
  646    QG   GLU  64           QG       GLU  64   7.880  -5.018   4.462
  647    H    LYS  65           H        LYS  65   3.318  -5.335   5.309
  648    HA   LYS  65           HA       LYS  65   1.792  -7.346   6.675
  649   1HB   LYS  65          2HB       LYS  65   3.784  -5.989   8.217
  650   2HB   LYS  65          1HB       LYS  65   2.203  -5.451   8.786
  651   1HG   LYS  65          2HG       LYS  65   1.487  -7.776   9.081
  652   2HG   LYS  65          1HG       LYS  65   3.032  -8.349   8.450
  653   1HD   LYS  65          2HD       LYS  65   4.032  -8.081  10.452
  654   2HD   LYS  65          1HD       LYS  65   3.428  -6.430  10.596
  655   1HE   LYS  65          2HE       LYS  65   1.261  -8.337  10.947
  656   2HE   LYS  65          1HE       LYS  65   2.571  -8.637  12.107
  657   1HZ   LYS  65          2HZ       LYS  65   2.626  -6.180  12.469
  658   2HZ   LYS  65          1HZ       LYS  65   1.187  -6.066  11.574
  659   3HZ   LYS  65          3HZ       LYS  65   1.213  -6.938  13.028
  660    QB   LYS  65           QB       LYS  65   2.994  -5.720   8.502
  661    QD   LYS  65           QD       LYS  65   3.730  -7.256  10.524
  662    QG   LYS  65           QG       LYS  65   2.259  -8.062   8.766
  663    QE   LYS  65           QE       LYS  65   1.916  -8.487  11.527
  664    QZ   LYS  65           QZ       LYS  65   1.676  -6.395  12.357
  665    H    VAL  66           H        VAL  66  -0.318  -6.527   7.299
  666    HA   VAL  66           HA       VAL  66  -0.871  -3.717   6.405
  667    HB   VAL  66           HB       VAL  66  -3.040  -4.685   5.543
  668   1HG1  VAL  66          1HG1      VAL  66  -0.330  -5.190   4.511
  669   2HG1  VAL  66          3HG1      VAL  66  -1.564  -6.250   3.828
  670   3HG1  VAL  66          2HG1      VAL  66  -1.735  -4.499   3.697
  671   1HG2  VAL  66          1HG2      VAL  66  -1.647  -7.313   6.148
  672   2HG2  VAL  66          3HG2      VAL  66  -3.078  -6.698   6.973
  673   3HG2  VAL  66          2HG2      VAL  66  -3.163  -7.135   5.268
  674    MG1  VAL  66           QG1      VAL  66  -1.210  -5.313   4.012
  675    MG2  VAL  66           QG2      VAL  66  -2.629  -7.049   6.130
  676    QG   VAL  66           QQG      VAL  66  -1.919  -6.181   5.071
  677    H    LEU  67           H        LEU  67  -1.853  -2.527   8.012
  678    HA   LEU  67           HA       LEU  67  -3.003  -4.018  10.331
  679   1HB   LEU  67          2HB       LEU  67  -2.475  -2.033  11.591
  680   2HB   LEU  67          1HB       LEU  67  -1.084  -2.367  10.563
  681    HG   LEU  67           HG       LEU  67  -2.623  -0.767   8.934
  682   1HD1  LEU  67          2HD1      LEU  67  -0.175  -0.626   9.395
  683   2HD1  LEU  67          1HD1      LEU  67  -0.960   0.954   9.405
  684   3HD1  LEU  67          3HD1      LEU  67  -0.539   0.168  10.927
  685   1HD2  LEU  67          1HD2      LEU  67  -4.150  -0.372  10.893
  686   2HD2  LEU  67          3HD2      LEU  67  -2.791   0.365  11.740
  687   3HD2  LEU  67          2HD2      LEU  67  -3.413   1.100  10.263
  688    MD1  LEU  67           QD1      LEU  67  -0.558   0.166   9.909
  689    MD2  LEU  67           QD2      LEU  67  -3.451   0.364  10.966
  690    QB   LEU  67           QB       LEU  67  -1.779  -2.200  11.077
  691    QD   LEU  67           QQD      LEU  67  -2.005   0.265  10.437
  692    H    VAL  68           H        VAL  68  -3.800  -1.750   7.774
  693    HA   VAL  68           HA       VAL  68  -6.490  -1.246   8.953
  694    HB   VAL  68           HB       VAL  68  -4.961  -0.123   6.583
  695   1HG1  VAL  68          3HG1      VAL  68  -7.456  -0.132   6.274
  696   2HG1  VAL  68          2HG1      VAL  68  -7.595   0.819   7.753
  697   3HG1  VAL  68          1HG1      VAL  68  -6.761   1.487   6.350
  698   1HG2  VAL  68          1HG2      VAL  68  -5.287   0.605   9.440
  699   2HG2  VAL  68          3HG2      VAL  68  -3.950   0.937   8.339
  700   3HG2  VAL  68          2HG2      VAL  68  -5.400   1.939   8.292
  701    MG1  VAL  68           QG1      VAL  68  -7.271   0.724   6.792
  702    MG2  VAL  68           QG2      VAL  68  -4.879   1.160   8.690
  703    QG   VAL  68           QQG      VAL  68  -6.075   0.942   7.741
  704    H    LYS  69           H        LYS  69  -8.398  -1.824   7.775
  705    HA   LYS  69           HA       LYS  69  -7.960  -3.742   5.507
  706   1HB   LYS  69          2HB       LYS  69  -9.083  -4.090   8.121
  707   2HB   LYS  69          1HB       LYS  69 -10.372  -4.295   6.935
  708   1HG   LYS  69          2HG       LYS  69  -8.255  -5.657   5.783
  709   2HG   LYS  69          1HG       LYS  69  -8.072  -6.021   7.500
  710   1HD   LYS  69          2HD       LYS  69 -10.574  -6.559   7.504
  711   2HD   LYS  69          1HD       LYS  69 -10.481  -6.521   5.743
  712   1HE   LYS  69          2HE       LYS  69  -8.301  -8.110   6.786
  713   2HE   LYS  69          1HE       LYS  69  -9.850  -8.710   7.416
  714   1HZ   LYS  69          1HZ       LYS  69  -9.374  -8.013   4.569
  715   2HZ   LYS  69          3HZ       LYS  69  -9.280  -9.592   5.178
  716   3HZ   LYS  69          2HZ       LYS  69 -10.756  -8.753   5.225
  717    QB   LYS  69           QB       LYS  69  -9.728  -4.193   7.528
  718    QD   LYS  69           QD       LYS  69 -10.528  -6.540   6.624
  719    QG   LYS  69           QG       LYS  69  -8.164  -5.839   6.642
  720    QE   LYS  69           QE       LYS  69  -9.075  -8.410   7.101
  721    QZ   LYS  69           QZ       LYS  69  -9.803  -8.786   4.991
  722    H    GLU  70           H        GLU  70 -10.625  -4.127   4.830
  723    HA   GLU  70           HA       GLU  70 -11.259  -1.616   3.467
  724   1HB   GLU  70          2HB       GLU  70 -12.659  -4.305   3.650
  725   2HB   GLU  70          1HB       GLU  70 -13.057  -3.033   2.494
  726   1HG   GLU  70          2HG       GLU  70 -11.534  -3.991   1.125
  727   2HG   GLU  70          1HG       GLU  70 -10.309  -3.326   2.206
  728    QB   GLU  70           QB       GLU  70 -12.858  -3.669   3.072
  729    QG   GLU  70           QG       GLU  70 -10.922  -3.659   1.665
  730    H    ARG  71           H        ARG  71 -13.211  -0.395   3.784
  731    HA   ARG  71           HA       ARG  71 -14.861   0.642   5.126
  732   1HB   ARG  71          2HB       ARG  71 -15.401  -2.062   4.726
  733   2HB   ARG  71          1HB       ARG  71 -15.621  -1.849   6.463
  734   1HG   ARG  71          2HG       ARG  71 -16.781   0.298   4.798
  735   2HG   ARG  71          1HG       ARG  71 -17.541  -1.281   4.603
  736   1HD   ARG  71          2HD       ARG  71 -16.999  -0.637   7.416
  737   2HD   ARG  71          1HD       ARG  71 -18.115   0.505   6.641
  738    HE   ARG  71           HE       ARG  71 -18.711  -2.259   7.223
  739   1HH1  ARG  71          1HH1      ARG  71 -19.765  -3.393   5.341
  740   2HH1  ARG  71          2HH1      ARG  71 -20.934  -2.439   4.492
  741   1HH2  ARG  71          1HH2      ARG  71 -19.938   0.552   5.936
  742   2HH2  ARG  71          2HH2      ARG  71 -21.034  -0.208   4.829
  743    QB   ARG  71           QB       ARG  71 -15.511  -1.955   5.594
  744    QG   ARG  71           QG       ARG  71 -17.161  -0.492   4.700
  745    QD   ARG  71           QD       ARG  71 -17.557  -0.066   7.029
  746    QH1  ARG  71           QH1      ARG  71 -20.350  -2.916   4.917
  747    QH2  ARG  71           QH2      ARG  71 -20.486   0.172   5.382
  748    H    ASP  72           H        ASP  72 -12.193   0.547   6.259
  749    HA   ASP  72           HA       ASP  72 -12.665  -0.022   9.148
  750   1HB   ASP  72          2HB       ASP  72 -10.448  -0.074   7.258
  751   2HB   ASP  72          1HB       ASP  72 -10.030   0.828   8.715
  752    QB   ASP  72           QB       ASP  72 -10.239   0.377   7.986
  753    H    ALA  73           H        ALA  73 -12.394   2.598   6.887
  754    HA   ALA  73           HA       ALA  73 -12.469   4.936   7.169
  755   1HB   ALA  73          2HB       ALA  73 -13.688   3.838   9.709
  756   2HB   ALA  73          3HB       ALA  73 -14.516   4.499   8.300
  757   3HB   ALA  73          1HB       ALA  73 -13.624   5.569   9.382
  758    MB   ALA  73           QB       ALA  73 -13.943   4.636   9.130
  759    H    VAL  74           H        VAL  74 -10.462   5.877   7.307
  760    HA   VAL  74           HA       VAL  74  -9.027   5.709   9.939
  761    HB   VAL  74           HB       VAL  74  -6.964   5.776   8.604
  762   1HG1  VAL  74          2HG1      VAL  74  -7.824   7.207   6.777
  763   2HG1  VAL  74          1HG1      VAL  74  -7.086   5.737   6.139
  764   3HG1  VAL  74          3HG1      VAL  74  -8.842   5.878   6.222
  765   1HG2  VAL  74          2HG2      VAL  74  -8.457   3.625   8.934
  766   2HG2  VAL  74          1HG2      VAL  74  -8.677   3.758   7.190
  767   3HG2  VAL  74          3HG2      VAL  74  -7.058   3.570   7.863
  768    MG1  VAL  74           QG1      VAL  74  -7.917   6.274   6.379
  769    MG2  VAL  74           QG2      VAL  74  -8.064   3.651   7.996
  770    QG   VAL  74           QQG      VAL  74  -7.991   4.962   7.188
  771    H    GLN  75           H        GLN  75  -8.162   7.664  10.734
  772    HA   GLN  75           HA       GLN  75  -9.203  10.138   9.455
  773   1HB   GLN  75          2HB       GLN  75  -8.845   9.122  12.092
  774   2HB   GLN  75          1HB       GLN  75  -7.806  10.539  11.936
  775   1HG   GLN  75          2HG       GLN  75  -9.991  11.536  10.758
  776   2HG   GLN  75          1HG       GLN  75 -10.780  10.344  11.791
  777   1HE2  GLN  75          1HE2      GLN  75 -10.923  13.275  12.129
  778   2HE2  GLN  75          2HE2      GLN  75 -10.247  13.619  13.648
  779    QB   GLN  75           QB       GLN  75  -8.326   9.830  12.014
  780    QG   GLN  75           QG       GLN  75 -10.386  10.940  11.274
  781    QE   GLN  75           QE2      GLN  75 -10.585  13.447  12.889
  782    H    GLY  76           H        GLY  76  -7.625  12.078   9.630
  783   1HA   GLY  76          1HA       GLY  76  -5.624  13.066   8.903
  784   2HA   GLY  76          2HA       GLY  76  -5.277  11.539   8.091
  785    QA   GLY  76           QA       GLY  76  -5.450  12.302   8.497
  786    H    GLY  77           H        GLY  77  -3.421  10.615   8.807
  787   1HA   GLY  77          1HA       GLY  77  -2.472  11.287  11.548
  788   2HA   GLY  77          2HA       GLY  77  -1.459  10.662  10.246
  789    QA   GLY  77           QA       GLY  77  -1.966  10.975  10.897
  790    H    GLN  78           H        GLN  78  -3.004   8.497   9.399
  791    HA   GLN  78           HA       GLN  78  -2.871   6.718  11.807
  792   1HB   GLN  78          2HB       GLN  78  -5.146   7.559  10.314
  793   2HB   GLN  78          1HB       GLN  78  -4.873   5.859   9.927
  794   1HG   GLN  78          2HG       GLN  78  -5.932   5.396  11.869
  795   2HG   GLN  78          1HG       GLN  78  -4.464   5.957  12.670
  796   1HE2  GLN  78          1HE2      GLN  78  -5.402   7.077  14.448
  797   2HE2  GLN  78          2HE2      GLN  78  -6.446   8.403  14.269
  798    QB   GLN  78           QB       GLN  78  -5.010   6.709  10.120
  799    QG   GLN  78           QG       GLN  78  -5.198   5.676  12.269
  800    QE   GLN  78           QE2      GLN  78  -5.924   7.740  14.359
  801    H    GLY  79           H        GLY  79  -1.485   5.037  11.400
  802   1HA   GLY  79          1HA       GLY  79  -0.280   3.403  10.219
  803   2HA   GLY  79          2HA       GLY  79  -0.136   4.626   8.957
  804    QA   GLY  79           QA       GLY  79  -0.208   4.014   9.588
  805    H    LEU  80           H        LEU  80  -0.585   3.384   7.137
  806    HA   LEU  80           HA       LEU  80  -3.341   2.219   7.005
  807   1HB   LEU  80          2HB       LEU  80  -1.421   3.476   5.055
  808   2HB   LEU  80          1HB       LEU  80  -2.721   2.439   4.467
  809    HG   LEU  80           HG       LEU  80  -3.402   4.577   6.447
  810   1HD1  LEU  80          2HD1      LEU  80  -4.718   3.008   4.261
  811   2HD1  LEU  80          1HD1      LEU  80  -5.282   3.332   5.900
  812   3HD1  LEU  80          3HD1      LEU  80  -5.375   4.592   4.670
  813   1HD2  LEU  80          2HD2      LEU  80  -2.504   4.991   3.621
  814   2HD2  LEU  80          1HD2      LEU  80  -3.855   5.956   4.219
  815   3HD2  LEU  80          3HD2      LEU  80  -2.289   6.034   5.027
  816    MD1  LEU  80           QD1      LEU  80  -5.125   3.644   4.943
  817    MD2  LEU  80           QD2      LEU  80  -2.883   5.660   4.289
  818    QB   LEU  80           QB       LEU  80  -2.071   2.957   4.761
  819    QD   LEU  80           QQD      LEU  80  -4.004   4.652   4.616
  820    H    ILE  81           H        ILE  81  -0.148   1.605   5.484
  821    HA   ILE  81           HA       ILE  81  -0.470  -1.297   6.102
  822    HB   ILE  81           HB       ILE  81  -1.449  -0.810   3.875
  823   1HG1  ILE  81          2HG1      ILE  81   1.201  -2.146   3.363
  824   2HG1  ILE  81          1HG1      ILE  81   0.030  -2.896   4.449
  825   1HG2  ILE  81          3HG2      ILE  81   0.660   1.023   3.718
  826   2HG2  ILE  81          2HG2      ILE  81   1.074  -0.224   2.542
  827   3HG2  ILE  81          1HG2      ILE  81  -0.471   0.619   2.427
  828   1HD1  ILE  81          3HD1      ILE  81  -0.527  -2.061   1.587
  829   2HD1  ILE  81          2HD1      ILE  81  -0.239  -3.714   2.128
  830   3HD1  ILE  81          1HD1      ILE  81  -1.672  -2.845   2.675
  831    MG   ILE  81           QG2      ILE  81   0.421   0.472   2.895
  832    MD   ILE  81           QD1      ILE  81  -0.813  -2.873   2.130
  833    QG   ILE  81           QG1      ILE  81   0.615  -2.521   3.906
  834    H    LYS  82           H        LYS  82   1.564  -2.424   6.148
  835    HA   LYS  82           HA       LYS  82   3.919  -0.644   6.496
  836   1HB   LYS  82          2HB       LYS  82   3.093  -2.420   8.151
  837   2HB   LYS  82          1HB       LYS  82   3.665  -3.621   6.993
  838   1HG   LYS  82          2HG       LYS  82   5.893  -3.088   7.328
  839   2HG   LYS  82          1HG       LYS  82   5.533  -1.424   7.788
  840   1HD   LYS  82          2HD       LYS  82   5.804  -2.098   9.928
  841   2HD   LYS  82          1HD       LYS  82   4.258  -2.927   9.749
  842   1HE   LYS  82          2HE       LYS  82   5.268  -4.952   9.853
  843   2HE   LYS  82          1HE       LYS  82   6.425  -4.494   8.588
  844   1HZ   LYS  82          3HZ       LYS  82   7.494  -3.064  10.370
  845   2HZ   LYS  82          2HZ       LYS  82   6.581  -3.952  11.494
  846   3HZ   LYS  82          1HZ       LYS  82   7.720  -4.740  10.510
  847    QB   LYS  82           QB       LYS  82   3.379  -3.020   7.572
  848    QD   LYS  82           QD       LYS  82   5.031  -2.512   9.839
  849    QG   LYS  82           QG       LYS  82   5.713  -2.256   7.558
  850    QE   LYS  82           QE       LYS  82   5.846  -4.723   9.221
  851    QZ   LYS  82           QZ       LYS  82   7.265  -3.919  10.791
  852    H    ILE  83           H        ILE  83   5.789  -0.858   5.208
  853    HA   ILE  83           HA       ILE  83   5.710  -2.897   3.017
  854    HB   ILE  83           HB       ILE  83   4.843  -0.677   2.278
  855   1HG1  ILE  83          2HG1      ILE  83   7.577  -1.081   1.068
  856   2HG1  ILE  83          1HG1      ILE  83   6.296  -2.273   0.836
  857   1HG2  ILE  83          1HG2      ILE  83   6.886   0.298   3.922
  858   2HG2  ILE  83          3HG2      ILE  83   7.429   0.660   2.283
  859   3HG2  ILE  83          2HG2      ILE  83   5.865   1.252   2.845
  860   1HD1  ILE  83          3HD1      ILE  83   4.837  -0.244   0.128
  861   2HD1  ILE  83          2HD1      ILE  83   6.371   0.605  -0.057
  862   3HD1  ILE  83          1HD1      ILE  83   6.041  -0.839  -1.016
  863    MG   ILE  83           QG2      ILE  83   6.726   0.737   3.016
  864    MD   ILE  83           QD1      ILE  83   5.750  -0.160  -0.315
  865    QG   ILE  83           QG1      ILE  83   6.937  -1.677   0.952
  866    H    GLY  84           H        GLY  84   7.820  -3.521   2.263
  867   1HA   GLY  84          1HA       GLY  84  10.075  -4.081   2.623
  868   2HA   GLY  84          2HA       GLY  84   9.900  -3.440   4.258
  869    QA   GLY  84           QA       GLY  84   9.987  -3.761   3.440

  No H/Q in entry =         869
  Start of MODEL   16
    1    H1   MET   1          2H        MET   1  -9.497  14.378  37.626
    2    H2   MET   1          1H        MET   1 -10.702  14.278  38.820
    3    H3   MET   1          3H        MET   1  -9.445  13.140  38.789
    4    HA   MET   1           HA       MET   1 -11.243  11.994  37.850
    5   1HB   MET   1          2HB       MET   1 -12.670  13.175  36.166
    6   2HB   MET   1          1HB       MET   1 -12.654  13.992  37.730
    7   1HG   MET   1          2HG       MET   1 -11.481  15.791  36.932
    8   2HG   MET   1          1HG       MET   1 -10.550  14.813  35.799
    9   1HE   MET   1          1HE       MET   1 -13.515  16.668  36.760
   10   2HE   MET   1          3HE       MET   1 -14.524  16.907  35.326
   11   3HE   MET   1          2HE       MET   1 -14.617  15.399  36.233
   12    QB   MET   1           QB       MET   1 -12.662  13.584  36.948
   13    QG   MET   1           QG       MET   1 -11.016  15.302  36.365
   14    ME   MET   1           QE       MET   1 -14.218  16.325  36.106
   15    H    LYS   2           H        LYS   2 -11.455  11.150  35.496
   16    HA   LYS   2           HA       LYS   2  -8.752  11.250  34.236
   17   1HB   LYS   2          2HB       LYS   2 -10.451   9.207  34.989
   18   2HB   LYS   2          1HB       LYS   2 -10.765   9.336  33.258
   19   1HG   LYS   2          2HG       LYS   2  -8.952   7.847  33.339
   20   2HG   LYS   2          1HG       LYS   2  -8.166   9.396  33.034
   21   1HD   LYS   2          2HD       LYS   2  -7.208   9.467  35.107
   22   2HD   LYS   2          1HD       LYS   2  -8.606   8.728  35.889
   23   1HE   LYS   2          2HE       LYS   2  -7.556   6.722  35.884
   24   2HE   LYS   2          1HE       LYS   2  -7.398   6.798  34.118
   25   1HZ   LYS   2          1HZ       LYS   2  -5.638   8.277  35.998
   26   2HZ   LYS   2          3HZ       LYS   2  -5.234   6.773  35.328
   27   3HZ   LYS   2          2HZ       LYS   2  -5.445   8.122  34.317
   28    QB   LYS   2           QB       LYS   2 -10.608   9.272  34.123
   29    QD   LYS   2           QD       LYS   2  -7.907   9.097  35.498
   30    QG   LYS   2           QG       LYS   2  -8.559   8.621  33.187
   31    QE   LYS   2           QE       LYS   2  -7.477   6.760  35.001
   32    QZ   LYS   2           QZ       LYS   2  -5.439   7.724  35.214
   33    H    LEU   3           H        LEU   3  -8.562  12.553  32.457
   34    HA   LEU   3           HA       LEU   3 -10.640  13.950  31.163
   35   1HB   LEU   3          2HB       LEU   3  -7.846  13.084  30.497
   36   2HB   LEU   3          1HB       LEU   3  -8.812  13.858  29.240
   37    HG   LEU   3           HG       LEU   3  -9.207  15.386  31.586
   38   1HD1  LEU   3          3HD1      LEU   3  -8.692  15.776  28.906
   39   2HD1  LEU   3          2HD1      LEU   3  -8.793  17.061  30.109
   40   3HD1  LEU   3          1HD1      LEU   3  -7.223  16.393  29.662
   41   1HD2  LEU   3          2HD2      LEU   3  -6.294  14.705  31.082
   42   2HD2  LEU   3          1HD2      LEU   3  -6.849  16.037  32.096
   43   3HD2  LEU   3          3HD2      LEU   3  -7.208  14.372  32.552
   44    MD1  LEU   3           QD1      LEU   3  -8.236  16.410  29.559
   45    MD2  LEU   3           QD2      LEU   3  -6.784  15.038  31.910
   46    QB   LEU   3           QB       LEU   3  -8.329  13.471  29.869
   47    QD   LEU   3           QQD      LEU   3  -7.510  15.724  30.735
   48    H    LYS   4           H        LYS   4 -11.362  13.604  28.841
   49    HA   LYS   4           HA       LYS   4 -11.453  10.740  28.014
   50   1HB   LYS   4          2HB       LYS   4 -13.939  10.975  27.787
   51   2HB   LYS   4          1HB       LYS   4 -13.389  11.121  29.457
   52   1HG   LYS   4          2HG       LYS   4 -13.409  13.676  28.005
   53   2HG   LYS   4          1HG       LYS   4 -15.006  12.944  28.167
   54   1HD   LYS   4          2HD       LYS   4 -13.436  12.767  30.630
   55   2HD   LYS   4          1HD       LYS   4 -13.712  14.432  30.119
   56   1HE   LYS   4          2HE       LYS   4 -16.137  14.005  29.970
   57   2HE   LYS   4          1HE       LYS   4 -15.872  12.321  30.465
   58   1HZ   LYS   4          1HZ       LYS   4 -14.796  13.124  32.480
   59   2HZ   LYS   4          3HZ       LYS   4 -15.091  14.730  32.021
   60   3HZ   LYS   4          2HZ       LYS   4 -16.391  13.699  32.383
   61    QB   LYS   4           QB       LYS   4 -13.664  11.048  28.622
   62    QD   LYS   4           QD       LYS   4 -13.574  13.600  30.374
   63    QG   LYS   4           QG       LYS   4 -14.207  13.310  28.086
   64    QE   LYS   4           QE       LYS   4 -16.005  13.163  30.217
   65    QZ   LYS   4           QZ       LYS   4 -15.426  13.851  32.295
   66    H    VAL   5           H        VAL   5 -10.306  13.410  27.005
   67    HA   VAL   5           HA       VAL   5 -11.785  13.610  24.411
   68    HB   VAL   5           HB       VAL   5  -9.708  15.411  25.702
   69   1HG1  VAL   5          2HG1      VAL   5 -12.574  15.063  26.136
   70   2HG1  VAL   5          1HG1      VAL   5 -11.411  16.012  27.061
   71   3HG1  VAL   5          3HG1      VAL   5 -12.178  16.707  25.634
   72   1HG2  VAL   5          1HG2      VAL   5 -11.362  15.550  23.194
   73   2HG2  VAL   5          3HG2      VAL   5 -10.900  17.037  24.020
   74   3HG2  VAL   5          2HG2      VAL   5  -9.657  15.940  23.423
   75    MG1  VAL   5           QG1      VAL   5 -12.054  15.928  26.277
   76    MG2  VAL   5           QG2      VAL   5 -10.639  16.176  23.546
   77    QG   VAL   5           QQG      VAL   5 -11.347  16.052  24.911
   78    H    THR   6           H        THR   6 -10.869  12.467  22.757
   79    HA   THR   6           HA       THR   6  -8.238  11.289  22.898
   80    HB   THR   6           HB       THR   6  -8.803  10.795  20.460
   81    HG1  THR   6           HG1      THR   6 -10.305  11.959  19.610
   82   1HG2  THR   6          1HG2      THR   6  -9.468   9.310  22.335
   83   2HG2  THR   6          3HG2      THR   6 -10.968  10.224  22.503
   84   3HG2  THR   6          2HG2      THR   6 -10.657   9.302  21.033
   85    MG   THR   6           QG2      THR   6 -10.364   9.612  21.957
   86    H    VAL   7           H        VAL   7  -6.507  12.727  22.966
   87    HA   VAL   7           HA       VAL   7  -5.909  14.271  20.555
   88    HB   VAL   7           HB       VAL   7  -7.543  15.689  21.788
   89   1HG1  VAL   7          3HG1      VAL   7  -6.126  14.755  24.031
   90   2HG1  VAL   7          2HG1      VAL   7  -5.757  16.476  23.933
   91   3HG1  VAL   7          1HG1      VAL   7  -7.434  15.938  24.026
   92   1HG2  VAL   7          3HG2      VAL   7  -4.719  16.483  21.294
   93   2HG2  VAL   7          2HG2      VAL   7  -6.207  17.122  20.595
   94   3HG2  VAL   7          1HG2      VAL   7  -5.707  17.619  22.211
   95    MG1  VAL   7           QG1      VAL   7  -6.439  15.723  23.997
   96    MG2  VAL   7           QG2      VAL   7  -5.545  17.074  21.367
   97    QG   VAL   7           QQG      VAL   7  -5.992  16.399  22.682
   98    H    ASN   8           H        ASN   8  -4.340  12.296  21.453
   99    HA   ASN   8           HA       ASN   8  -2.021  13.729  22.677
  100   1HB   ASN   8          2HB       ASN   8  -3.705  11.736  23.876
  101   2HB   ASN   8          1HB       ASN   8  -2.102  11.043  23.642
  102   1HD2  ASN   8          1HD2      ASN   8  -2.953  11.536  26.268
  103   2HD2  ASN   8          2HD2      ASN   8  -2.090  12.848  26.914
  104    QB   ASN   8           QB       ASN   8  -2.904  11.389  23.759
  105    QD   ASN   8           QD2      ASN   8  -2.521  12.192  26.591
  106    H    GLY   9           H        GLY   9  -0.178  11.741  22.703
  107   1HA   GLY   9          1HA       GLY   9   1.268  10.511  21.324
  108   2HA   GLY   9          2HA       GLY   9   0.592  11.442  19.987
  109    QA   GLY   9           QA       GLY   9   0.930  10.976  20.656
  110    H    ALA  10           H        ALA  10  -0.955   9.092  22.195
  111    HA   ALA  10           HA       ALA  10  -2.140   7.107  21.707
  112   1HB   ALA  10          1HB       ALA  10  -3.724   7.441  20.041
  113   2HB   ALA  10          2HB       ALA  10  -2.549   8.134  18.923
  114   3HB   ALA  10          3HB       ALA  10  -3.170   9.100  20.262
  115    MB   ALA  10           QB       ALA  10  -3.148   8.225  19.742
  116    H    GLY  11           H        GLY  11  -2.307   5.412  19.667
  117   1HA   GLY  11          1HA       GLY  11  -1.098   3.767  18.509
  118   2HA   GLY  11          2HA       GLY  11   0.329   4.319  19.387
  119    QA   GLY  11           QA       GLY  11  -0.385   4.043  18.948
  120    H    LYS  12           H        LYS  12  -1.830   5.586  16.813
  121    HA   LYS  12           HA       LYS  12  -1.290   6.628  14.764
  122   1HB   LYS  12          2HB       LYS  12   0.389   7.648  16.891
  123   2HB   LYS  12          1HB       LYS  12   1.257   7.698  15.355
  124   1HG   LYS  12          2HG       LYS  12  -1.057   8.652  14.468
  125   2HG   LYS  12          1HG       LYS  12  -1.257   9.111  16.159
  126   1HD   LYS  12          2HD       LYS  12   1.412   9.716  15.086
  127   2HD   LYS  12          1HD       LYS  12   0.111  10.590  14.279
  128   1HE   LYS  12          2HE       LYS  12  -0.704  11.445  16.423
  129   2HE   LYS  12          1HE       LYS  12   0.521  10.497  17.290
  130   1HZ   LYS  12          2HZ       LYS  12   1.117  12.510  15.186
  131   2HZ   LYS  12          1HZ       LYS  12   1.245  12.799  16.856
  132   3HZ   LYS  12          3HZ       LYS  12   2.252  11.653  16.116
  133    QB   LYS  12           QB       LYS  12   0.823   7.673  16.123
  134    QD   LYS  12           QD       LYS  12   0.762  10.153  14.682
  135    QG   LYS  12           QG       LYS  12  -1.157   8.881  15.313
  136    QE   LYS  12           QE       LYS  12  -0.092  10.971  16.856
  137    QZ   LYS  12           QZ       LYS  12   1.538  12.321  16.053
  138    H    ALA  13           H        ALA  13  -0.944   4.214  14.113
  139    HA   ALA  13           HA       ALA  13   0.341   2.594  12.961
  140   1HB   ALA  13          2HB       ALA  13   2.172   4.864  12.237
  141   2HB   ALA  13          1HB       ALA  13   1.533   3.581  11.207
  142   3HB   ALA  13          3HB       ALA  13   0.489   4.911  11.710
  143    MB   ALA  13           QB       ALA  13   1.398   4.452  11.718
  144    H    GLY  14           H        GLY  14   3.072   2.405  12.466
  145   1HA   GLY  14          1HA       GLY  14   4.416   1.079  14.235
  146   2HA   GLY  14          2HA       GLY  14   4.325   2.569  15.174
  147    QA   GLY  14           QA       GLY  14   4.371   1.824  14.705
  148    H    GLU  15           H        GLU  15   6.083   0.876  12.797
  149    HA   GLU  15           HA       GLU  15   7.586   3.361  12.047
  150   1HB   GLU  15          2HB       GLU  15   8.443   1.592  13.877
  151   2HB   GLU  15          1HB       GLU  15   8.999   0.757  12.426
  152   1HG   GLU  15          2HG       GLU  15  10.203   2.773  11.703
  153   2HG   GLU  15          1HG       GLU  15   9.625   3.641  13.127
  154    QB   GLU  15           QB       GLU  15   8.721   1.175  13.152
  155    QG   GLU  15           QG       GLU  15   9.914   3.207  12.415
  156    H    GLY  16           H        GLY  16   8.772   3.135   9.989
  157   1HA   GLY  16          1HA       GLY  16   8.655   0.855   8.302
  158   2HA   GLY  16          2HA       GLY  16   8.885   2.507   7.729
  159    QA   GLY  16           QA       GLY  16   8.770   1.681   8.016
  160    H    GLU  17           H        GLU  17   6.411   3.581   8.664
  161    HA   GLU  17           HA       GLU  17   4.524   2.195   6.797
  162   1HB   GLU  17          2HB       GLU  17   2.758   2.517   8.471
  163   2HB   GLU  17          1HB       GLU  17   4.098   1.623   9.191
  164   1HG   GLU  17          2HG       GLU  17   3.736   3.224  10.831
  165   2HG   GLU  17          1HG       GLU  17   4.940   4.050   9.844
  166    QB   GLU  17           QB       GLU  17   3.428   2.070   8.831
  167    QG   GLU  17           QG       GLU  17   4.338   3.637  10.337
  168    H    ILE  18           H        ILE  18   2.801   3.674   6.009
  169    HA   ILE  18           HA       ILE  18   3.684   6.542   6.044
  170    HB   ILE  18           HB       ILE  18   2.358   4.838   3.912
  171   1HG1  ILE  18          2HG1      ILE  18   4.581   5.697   2.751
  172   2HG1  ILE  18          1HG1      ILE  18   5.131   5.864   4.419
  173   1HG2  ILE  18          2HG2      ILE  18   2.948   7.793   4.075
  174   2HG2  ILE  18          1HG2      ILE  18   2.848   6.967   2.520
  175   3HG2  ILE  18          3HG2      ILE  18   1.450   6.996   3.593
  176   1HD1  ILE  18          3HD1      ILE  18   3.763   3.317   3.693
  177   2HD1  ILE  18          2HD1      ILE  18   5.390   3.564   3.057
  178   3HD1  ILE  18          1HD1      ILE  18   5.109   3.595   4.799
  179    MG   ILE  18           QG2      ILE  18   2.415   7.252   3.396
  180    MD   ILE  18           QD1      ILE  18   4.754   3.492   3.850
  181    QG   ILE  18           QG1      ILE  18   4.856   5.780   3.585
  182    HA   PRO  19           HA       PRO  19  -0.438   6.628   7.959
  183   1HB   PRO  19          2HB       PRO  19  -0.115   9.072   9.149
  184   2HB   PRO  19          1HB       PRO  19   0.499   7.564   9.855
  185   1HG   PRO  19          2HG       PRO  19   1.952   9.667   8.331
  186   2HG   PRO  19          1HG       PRO  19   2.474   8.728   9.739
  187   1HD   PRO  19          2HD       PRO  19   3.270   8.185   7.188
  188   2HD   PRO  19          1HD       PRO  19   3.158   6.955   8.466
  189    QB   PRO  19           QB       PRO  19   0.192   8.318   9.502
  190    QG   PRO  19           QG       PRO  19   2.213   9.197   9.035
  191    QD   PRO  19           QD       PRO  19   3.214   7.570   7.827
  192    H    ALA  20           H        ALA  20  -2.312   7.984   7.496
  193    HA   ALA  20           HA       ALA  20  -2.118   9.367   4.903
  194   1HB   ALA  20          2HB       ALA  20  -4.285   8.472   6.798
  195   2HB   ALA  20          3HB       ALA  20  -3.984   7.948   5.140
  196   3HB   ALA  20          1HB       ALA  20  -4.670   9.544   5.451
  197    MB   ALA  20           QB       ALA  20  -4.313   8.655   5.796
  198    HA   PRO  21           HA       PRO  21  -1.823  13.352   6.842
  199   1HB   PRO  21          2HB       PRO  21  -2.391  14.900   4.661
  200   2HB   PRO  21          1HB       PRO  21  -0.828  14.090   4.890
  201   1HG   PRO  21          2HG       PRO  21  -3.126  13.317   3.171
  202   2HG   PRO  21          1HG       PRO  21  -1.388  13.171   2.868
  203   1HD   PRO  21          2HD       PRO  21  -2.993  11.087   3.643
  204   2HD   PRO  21          1HD       PRO  21  -1.242  11.162   3.940
  205    QB   PRO  21           QB       PRO  21  -1.609  14.495   4.775
  206    QG   PRO  21           QG       PRO  21  -2.257  13.244   3.020
  207    QD   PRO  21           QD       PRO  21  -2.117  11.124   3.791
  208    H    LEU  22           H        LEU  22  -4.648  12.320   5.012
  209    HA   LEU  22           HA       LEU  22  -6.334  14.114   6.725
  210   1HB   LEU  22          2HB       LEU  22  -5.840  14.436   4.045
  211   2HB   LEU  22          1HB       LEU  22  -7.310  13.462   4.014
  212    HG   LEU  22           HG       LEU  22  -7.969  15.251   5.945
  213   1HD1  LEU  22          1HD1      LEU  22  -5.615  16.311   4.812
  214   2HD1  LEU  22          3HD1      LEU  22  -6.937  17.259   4.132
  215   3HD1  LEU  22          2HD1      LEU  22  -6.745  17.142   5.882
  216   1HD2  LEU  22          3HD2      LEU  22  -9.290  14.664   3.938
  217   2HD2  LEU  22          2HD2      LEU  22  -9.255  16.409   4.190
  218   3HD2  LEU  22          1HD2      LEU  22  -8.235  15.676   2.952
  219    MD1  LEU  22           QD1      LEU  22  -6.433  16.904   4.942
  220    MD2  LEU  22           QD2      LEU  22  -8.927  15.583   3.693
  221    QB   LEU  22           QB       LEU  22  -6.575  13.949   4.030
  222    QD   LEU  22           QQD      LEU  22  -7.680  16.243   4.318
  223    H    ALA  23           H        ALA  23  -8.631  13.287   6.856
  224    HA   ALA  23           HA       ALA  23  -8.743  10.541   7.628
  225   1HB   ALA  23          1HB       ALA  23 -10.463  12.882   7.409
  226   2HB   ALA  23          2HB       ALA  23 -10.519  11.568   8.585
  227   3HB   ALA  23          3HB       ALA  23 -11.342  11.399   7.035
  228    MB   ALA  23           QB       ALA  23 -10.775  11.950   7.677
  229    H    GLY  24           H        GLY  24  -9.918   8.781   6.581
  230   1HA   GLY  24          1HA       GLY  24  -9.394   7.779   4.240
  231   2HA   GLY  24          2HA       GLY  24 -10.349   9.141   3.649
  232    QA   GLY  24           QA       GLY  24  -9.872   8.460   3.945
  233    H    THR  25           H        THR  25 -11.384   6.822   2.903
  234    HA   THR  25           HA       THR  25 -13.552   6.236   4.891
  235    HB   THR  25           HB       THR  25 -13.903   6.112   1.904
  236    HG1  THR  25           HG1      THR  25 -14.289   8.453   3.436
  237   1HG2  THR  25          2HG2      THR  25 -15.538   5.844   4.228
  238   2HG2  THR  25          1HG2      THR  25 -16.062   7.286   3.356
  239   3HG2  THR  25          3HG2      THR  25 -16.022   5.724   2.537
  240    MG   THR  25           QG2      THR  25 -15.874   6.285   3.374
  241    H    VAL  26           H        VAL  26 -14.405   4.319   2.516
  242    HA   VAL  26           HA       VAL  26 -13.887   1.837   3.468
  243    HB   VAL  26           HB       VAL  26 -13.871   1.126   1.027
  244   1HG1  VAL  26          1HG1      VAL  26 -13.696   4.126   0.691
  245   2HG1  VAL  26          3HG1      VAL  26 -12.677   2.885  -0.041
  246   3HG1  VAL  26          2HG1      VAL  26 -14.352   3.073  -0.560
  247   1HG2  VAL  26          1HG2      VAL  26 -15.874   2.117   2.595
  248   2HG2  VAL  26          3HG2      VAL  26 -15.987   3.178   1.190
  249   3HG2  VAL  26          2HG2      VAL  26 -16.124   1.432   0.988
  250    MG1  VAL  26           QG1      VAL  26 -13.575   3.361   0.030
  251    MG2  VAL  26           QG2      VAL  26 -15.995   2.242   1.591
  252    QG   VAL  26           QQG      VAL  26 -14.785   2.802   0.810
  253    H    SER  27           H        SER  27 -11.543   3.578   1.365
  254    HA   SER  27           HA       SER  27  -9.236   3.166   1.032
  255   1HB   SER  27          2HB       SER  27  -9.687   3.441   3.638
  256   2HB   SER  27          1HB       SER  27  -9.239   1.738   3.669
  257    HG   SER  27           HG       SER  27  -7.335   2.412   2.450
  258    QB   SER  27           QB       SER  27  -9.463   2.589   3.653
  259    H    LYS  28           H        LYS  28 -11.004   1.217  -0.088
  260    HA   LYS  28           HA       LYS  28 -10.555  -1.483   0.536
  261   1HB   LYS  28          2HB       LYS  28 -11.427   0.156  -1.705
  262   2HB   LYS  28          1HB       LYS  28 -10.572  -1.281  -2.265
  263   1HG   LYS  28          2HG       LYS  28 -12.374  -2.544  -1.804
  264   2HG   LYS  28          1HG       LYS  28 -12.298  -2.047  -0.114
  265   1HD   LYS  28          2HD       LYS  28 -14.360  -1.171  -0.608
  266   2HD   LYS  28          1HD       LYS  28 -13.379   0.185  -1.161
  267   1HE   LYS  28          2HE       LYS  28 -13.429  -1.586  -3.344
  268   2HE   LYS  28          1HE       LYS  28 -15.092  -1.568  -2.722
  269   1HZ   LYS  28          2HZ       LYS  28 -13.511   0.916  -3.020
  270   2HZ   LYS  28          1HZ       LYS  28 -14.440   0.300  -4.301
  271   3HZ   LYS  28          3HZ       LYS  28 -15.193   0.751  -2.850
  272    QB   LYS  28           QB       LYS  28 -10.999  -0.563  -1.985
  273    QD   LYS  28           QD       LYS  28 -13.869  -0.493  -0.885
  274    QG   LYS  28           QG       LYS  28 -12.336  -2.295  -0.959
  275    QE   LYS  28           QE       LYS  28 -14.260  -1.577  -3.033
  276    QZ   LYS  28           QZ       LYS  28 -14.381   0.656  -3.390
  277    H    ILE  29           H        ILE  29  -8.379  -1.876   1.189
  278    HA   ILE  29           HA       ILE  29  -6.063  -1.088  -0.331
  279    HB   ILE  29           HB       ILE  29  -6.032  -1.651   2.054
  280   1HG1  ILE  29          2HG1      ILE  29  -4.509  -3.789   0.537
  281   2HG1  ILE  29          1HG1      ILE  29  -4.009  -2.098   0.585
  282   1HG2  ILE  29          3HG2      ILE  29  -7.530  -3.933   1.105
  283   2HG2  ILE  29          2HG2      ILE  29  -6.133  -4.475   2.036
  284   3HG2  ILE  29          1HG2      ILE  29  -7.303  -3.371   2.760
  285   1HD1  ILE  29          2HD1      ILE  29  -4.501  -2.719   3.255
  286   2HD1  ILE  29          1HD1      ILE  29  -3.718  -4.167   2.623
  287   3HD1  ILE  29          3HD1      ILE  29  -2.914  -2.603   2.494
  288    MG   ILE  29           QG2      ILE  29  -6.989  -3.926   1.967
  289    MD   ILE  29           QD1      ILE  29  -3.711  -3.163   2.791
  290    QG   ILE  29           QG1      ILE  29  -4.259  -2.944   0.561
  291    H    LEU  30           H        LEU  30  -6.611  -1.765  -2.543
  292    HA   LEU  30           HA       LEU  30  -7.344  -4.350  -3.393
  293   1HB   LEU  30          2HB       LEU  30  -6.019  -1.943  -4.468
  294   2HB   LEU  30          1HB       LEU  30  -5.621  -3.426  -5.335
  295    HG   LEU  30           HG       LEU  30  -7.630  -2.310  -6.281
  296   1HD1  LEU  30          1HD1      LEU  30  -8.253  -1.690  -3.709
  297   2HD1  LEU  30          3HD1      LEU  30  -9.433  -1.695  -5.019
  298   3HD1  LEU  30          2HD1      LEU  30  -9.293  -3.093  -3.953
  299   1HD2  LEU  30          3HD2      LEU  30  -7.538  -5.045  -5.202
  300   2HD2  LEU  30          2HD2      LEU  30  -9.172  -4.470  -5.535
  301   3HD2  LEU  30          1HD2      LEU  30  -7.964  -4.488  -6.820
  302    MD1  LEU  30           QD1      LEU  30  -8.993  -2.159  -4.227
  303    MD2  LEU  30           QD2      LEU  30  -8.225  -4.668  -5.852
  304    QB   LEU  30           QB       LEU  30  -5.820  -2.685  -4.902
  305    QD   LEU  30           QQD      LEU  30  -8.609  -3.413  -5.040
  306    H    VAL  31           H        VAL  31  -4.092  -3.047  -2.711
  307    HA   VAL  31           HA       VAL  31  -2.585  -5.334  -3.516
  308    HB   VAL  31           HB       VAL  31  -1.689  -3.073  -3.055
  309   1HG1  VAL  31          3HG1      VAL  31  -0.172  -5.020  -2.922
  310   2HG1  VAL  31          2HG1      VAL  31   0.300  -3.766  -1.775
  311   3HG1  VAL  31          1HG1      VAL  31  -0.557  -5.200  -1.210
  312   1HG2  VAL  31          3HG2      VAL  31  -2.442  -3.771  -0.203
  313   2HG2  VAL  31          2HG2      VAL  31  -1.390  -2.425  -0.637
  314   3HG2  VAL  31          1HG2      VAL  31  -3.070  -2.438  -1.170
  315    MG1  VAL  31           QG1      VAL  31  -0.143  -4.662  -1.969
  316    MG2  VAL  31           QG2      VAL  31  -2.301  -2.878  -0.670
  317    QG   VAL  31           QQG      VAL  31  -1.222  -3.770  -1.320
  318    H    LYS  32           H        LYS  32  -1.464  -6.855  -1.972
  319    HA   LYS  32           HA       LYS  32  -3.219  -7.534   0.367
  320   1HB   LYS  32          2HB       LYS  32  -2.830  -8.933  -1.988
  321   2HB   LYS  32          1HB       LYS  32  -1.688  -9.707  -0.888
  322   1HG   LYS  32          2HG       LYS  32  -3.376 -10.356   0.611
  323   2HG   LYS  32          1HG       LYS  32  -4.516  -9.162  -0.010
  324   1HD   LYS  32          2HD       LYS  32  -3.502 -11.329  -1.827
  325   2HD   LYS  32          1HD       LYS  32  -4.800 -11.683  -0.687
  326   1HE   LYS  32          2HE       LYS  32  -6.129  -9.804  -1.615
  327   2HE   LYS  32          1HE       LYS  32  -4.832  -9.479  -2.783
  328   1HZ   LYS  32          1HZ       LYS  32  -5.019 -11.941  -3.340
  329   2HZ   LYS  32          3HZ       LYS  32  -6.512 -11.903  -2.536
  330   3HZ   LYS  32          2HZ       LYS  32  -6.261 -10.929  -3.905
  331    QB   LYS  32           QB       LYS  32  -2.259  -9.320  -1.438
  332    QD   LYS  32           QD       LYS  32  -4.151 -11.506  -1.257
  333    QG   LYS  32           QG       LYS  32  -3.946  -9.759   0.301
  334    QE   LYS  32           QE       LYS  32  -5.480  -9.642  -2.199
  335    QZ   LYS  32           QZ       LYS  32  -5.931 -11.591  -3.260
  336    H    GLU  33           H        GLU  33  -1.978  -8.928   2.003
  337    HA   GLU  33           HA       GLU  33   0.589  -7.628   2.611
  338   1HB   GLU  33          2HB       GLU  33  -1.500  -8.503   4.081
  339   2HB   GLU  33          1HB       GLU  33  -0.469  -9.930   4.182
  340   1HG   GLU  33          2HG       GLU  33   0.926  -7.354   4.589
  341   2HG   GLU  33          1HG       GLU  33  -0.243  -7.776   5.841
  342    QB   GLU  33           QB       GLU  33  -0.985  -9.216   4.131
  343    QG   GLU  33           QG       GLU  33   0.341  -7.565   5.215
  344    H    GLY  34           H        GLY  34   2.590  -8.551   2.283
  345   1HA   GLY  34          1HA       GLY  34   2.844 -11.463   1.916
  346   2HA   GLY  34          2HA       GLY  34   4.176 -10.309   2.004
  347    QA   GLY  34           QA       GLY  34   3.510 -10.886   1.960
  348    H    ASP  35           H        ASP  35   2.542  -8.638  -0.047
  349    HA   ASP  35           HA       ASP  35   3.236 -10.278  -2.463
  350   1HB   ASP  35          2HB       ASP  35   0.894  -8.839  -1.611
  351   2HB   ASP  35          1HB       ASP  35   1.521  -8.086  -3.077
  352    QB   ASP  35           QB       ASP  35   1.207  -8.463  -2.344
  353    H    THR  36           H        THR  36   3.602  -8.591  -4.405
  354    HA   THR  36           HA       THR  36   5.467  -6.470  -3.386
  355    HB   THR  36           HB       THR  36   5.634  -8.270  -5.826
  356    HG1  THR  36           HG1      THR  36   7.377  -8.119  -3.611
  357   1HG2  THR  36          2HG2      THR  36   7.519  -6.130  -4.798
  358   2HG2  THR  36          1HG2      THR  36   7.883  -7.250  -6.110
  359   3HG2  THR  36          3HG2      THR  36   6.588  -6.067  -6.295
  360    MG   THR  36           QG2      THR  36   7.330  -6.483  -5.734
  361    H    VAL  37           H        VAL  37   5.263  -4.442  -4.329
  362    HA   VAL  37           HA       VAL  37   3.320  -4.158  -6.598
  363    HB   VAL  37           HB       VAL  37   2.586  -2.061  -5.409
  364   1HG1  VAL  37          1HG1      VAL  37   1.488  -4.362  -5.155
  365   2HG1  VAL  37          3HG1      VAL  37   2.340  -4.485  -3.616
  366   3HG1  VAL  37          2HG1      VAL  37   1.160  -3.199  -3.870
  367   1HG2  VAL  37          2HG2      VAL  37   4.820  -2.013  -4.086
  368   2HG2  VAL  37          1HG2      VAL  37   3.346  -1.548  -3.236
  369   3HG2  VAL  37          3HG2      VAL  37   4.031  -3.156  -3.000
  370    MG1  VAL  37           QG1      VAL  37   1.663  -4.015  -4.214
  371    MG2  VAL  37           QG2      VAL  37   4.066  -2.239  -3.441
  372    QG   VAL  37           QQG      VAL  37   2.864  -3.127  -3.827
  373    H    LYS  38           H        LYS  38   3.610  -1.804  -7.543
  374    HA   LYS  38           HA       LYS  38   6.541  -1.155  -7.598
  375   1HB   LYS  38          2HB       LYS  38   4.575  -1.858  -9.673
  376   2HB   LYS  38          1HB       LYS  38   5.518  -0.416 -10.053
  377   1HG   LYS  38          2HG       LYS  38   7.371  -2.244  -8.996
  378   2HG   LYS  38          1HG       LYS  38   6.346  -3.195 -10.071
  379   1HD   LYS  38          2HD       LYS  38   7.156  -0.557 -11.133
  380   2HD   LYS  38          1HD       LYS  38   8.472  -1.713 -10.924
  381   1HE   LYS  38          2HE       LYS  38   7.467  -3.296 -12.385
  382   2HE   LYS  38          1HE       LYS  38   5.892  -2.480 -12.313
  383   1HZ   LYS  38          1HZ       LYS  38   8.309  -1.062 -13.251
  384   2HZ   LYS  38          3HZ       LYS  38   7.385  -1.998 -14.321
  385   3HZ   LYS  38          2HZ       LYS  38   6.677  -0.675 -13.525
  386    QB   LYS  38           QB       LYS  38   5.047  -1.137  -9.863
  387    QD   LYS  38           QD       LYS  38   7.814  -1.135 -11.029
  388    QG   LYS  38           QG       LYS  38   6.859  -2.719  -9.533
  389    QE   LYS  38           QE       LYS  38   6.680  -2.888 -12.349
  390    QZ   LYS  38           QZ       LYS  38   7.457  -1.245 -13.699
  391    H    ALA  39           H        ALA  39   6.986   1.132  -8.188
  392    HA   ALA  39           HA       ALA  39   5.393   3.014  -6.732
  393   1HB   ALA  39          3HB       ALA  39   7.893   2.961  -7.615
  394   2HB   ALA  39          2HB       ALA  39   7.196   3.800  -9.002
  395   3HB   ALA  39          1HB       ALA  39   7.067   4.503  -7.389
  396    MB   ALA  39           QB       ALA  39   7.385   3.755  -8.002
  397    H    GLY  40           H        GLY  40   3.532   4.042  -7.354
  398   1HA   GLY  40          1HA       GLY  40   3.047   4.585 -10.219
  399   2HA   GLY  40          2HA       GLY  40   2.110   5.233  -8.872
  400    QA   GLY  40           QA       GLY  40   2.578   4.909  -9.545
  401    H    GLN  41           H        GLN  41   2.092   2.316  -7.792
  402    HA   GLN  41           HA       GLN  41   0.064   1.209  -9.698
  403   1HB   GLN  41          2HB       GLN  41   2.161  -0.084  -9.103
  404   2HB   GLN  41          1HB       GLN  41   1.563  -0.161  -7.445
  405   1HG   GLN  41          2HG       GLN  41  -0.511  -1.259  -8.272
  406   2HG   GLN  41          1HG       GLN  41   0.158  -1.248  -9.904
  407   1HE2  GLN  41          1HE2      GLN  41  -0.216  -3.254  -7.281
  408   2HE2  GLN  41          2HE2      GLN  41   1.116  -4.279  -7.517
  409    QB   GLN  41           QB       GLN  41   1.862  -0.122  -8.274
  410    QG   GLN  41           QG       GLN  41  -0.177  -1.254  -9.088
  411    QE   GLN  41           QE2      GLN  41   0.450  -3.766  -7.399
  412    H    THR  42           H        THR  42  -1.968   1.801  -9.030
  413    HA   THR  42           HA       THR  42  -2.790   2.734  -6.519
  414    HB   THR  42           HB       THR  42  -4.344   1.023  -8.489
  415    HG1  THR  42           HG1      THR  42  -3.722   3.783  -8.412
  416   1HG2  THR  42          1HG2      THR  42  -5.395   1.537  -6.237
  417   2HG2  THR  42          3HG2      THR  42  -5.329   3.241  -6.686
  418   3HG2  THR  42          2HG2      THR  42  -6.298   2.116  -7.637
  419    MG   THR  42           QG2      THR  42  -5.674   2.298  -6.853
  420    H    VAL  43           H        VAL  43  -2.585   1.703  -4.577
  421    HA   VAL  43           HA       VAL  43  -2.997  -1.265  -4.486
  422    HB   VAL  43           HB       VAL  43  -1.540  -1.085  -2.444
  423   1HG1  VAL  43          2HG1      VAL  43  -0.810  -0.702  -5.209
  424   2HG1  VAL  43          1HG1      VAL  43   0.339   0.139  -4.169
  425   3HG1  VAL  43          3HG1      VAL  43   0.053  -1.588  -3.953
  426   1HG2  VAL  43          3HG2      VAL  43  -2.219   1.586  -2.549
  427   2HG2  VAL  43          2HG2      VAL  43  -0.895   0.919  -1.593
  428   3HG2  VAL  43          1HG2      VAL  43  -0.577   1.592  -3.192
  429    MG1  VAL  43           QG1      VAL  43  -0.139  -0.717  -4.444
  430    MG2  VAL  43           QG2      VAL  43  -1.230   1.366  -2.445
  431    QG   VAL  43           QQG      VAL  43  -0.685   0.324  -3.444
  432    H    LEU  44           H        LEU  44  -4.015   1.844  -3.262
  433    HA   LEU  44           HA       LEU  44  -6.007   0.441  -1.510
  434   1HB   LEU  44          2HB       LEU  44  -4.181   2.784  -0.994
  435   2HB   LEU  44          1HB       LEU  44  -5.665   2.581  -0.063
  436    HG   LEU  44           HG       LEU  44  -4.311   0.055  -0.198
  437   1HD1  LEU  44          3HD1      LEU  44  -2.417   1.951  -0.491
  438   2HD1  LEU  44          2HD1      LEU  44  -2.577   1.982   1.265
  439   3HD1  LEU  44          1HD1      LEU  44  -2.147   0.481   0.446
  440   1HD2  LEU  44          1HD2      LEU  44  -5.933   1.055   1.531
  441   2HD2  LEU  44          3HD2      LEU  44  -4.565   0.139   2.166
  442   3HD2  LEU  44          2HD2      LEU  44  -4.532   1.902   2.185
  443    MD1  LEU  44           QD1      LEU  44  -2.380   1.471   0.407
  444    MD2  LEU  44           QD2      LEU  44  -5.010   1.032   1.961
  445    QB   LEU  44           QB       LEU  44  -4.923   2.682  -0.528
  446    QD   LEU  44           QQD      LEU  44  -3.695   1.252   1.184
  447    H    VAL  45           H        VAL  45  -8.056   1.580  -1.304
  448    HA   VAL  45           HA       VAL  45  -8.479   3.725  -3.364
  449    HB   VAL  45           HB       VAL  45 -10.190   1.330  -2.630
  450   1HG1  VAL  45          1HG1      VAL  45 -11.437   3.487  -3.186
  451   2HG1  VAL  45          3HG1      VAL  45 -10.713   3.384  -4.791
  452   3HG1  VAL  45          2HG1      VAL  45 -11.795   2.111  -4.228
  453   1HG2  VAL  45          2HG2      VAL  45  -8.560   2.086  -5.066
  454   2HG2  VAL  45          1HG2      VAL  45  -8.367   0.664  -4.040
  455   3HG2  VAL  45          3HG2      VAL  45  -9.779   0.812  -5.086
  456    MG1  VAL  45           QG1      VAL  45 -11.315   2.994  -4.068
  457    MG2  VAL  45           QG2      VAL  45  -8.902   1.188  -4.731
  458    QG   VAL  45           QQG      VAL  45 -10.109   2.091  -4.399
  459    H    LEU  46           H        LEU  46  -8.870   5.550  -2.142
  460    HA   LEU  46           HA       LEU  46 -10.468   5.317   0.362
  461   1HB   LEU  46          2HB       LEU  46  -8.670   7.380  -0.915
  462   2HB   LEU  46          1HB       LEU  46  -9.698   7.796   0.457
  463    HG   LEU  46           HG       LEU  46  -7.879   5.392   0.539
  464   1HD1  LEU  46          3HD1      LEU  46  -9.507   7.013   2.454
  465   2HD1  LEU  46          2HD1      LEU  46  -9.308   5.263   2.358
  466   3HD1  LEU  46          1HD1      LEU  46  -8.028   6.261   3.048
  467   1HD2  LEU  46          2HD2      LEU  46  -7.069   8.131   0.382
  468   2HD2  LEU  46          1HD2      LEU  46  -6.791   7.571   2.030
  469   3HD2  LEU  46          3HD2      LEU  46  -6.063   6.712   0.672
  470    MD1  LEU  46           QD1      LEU  46  -8.948   6.179   2.620
  471    MD2  LEU  46           QD2      LEU  46  -6.641   7.471   1.028
  472    QB   LEU  46           QB       LEU  46  -9.184   7.588  -0.229
  473    QD   LEU  46           QQD      LEU  46  -7.794   6.825   1.824
  474    H    GLU  47           H        GLU  47 -12.441   6.475   0.605
  475    HA   GLU  47           HA       GLU  47 -13.540   7.707  -1.903
  476   1HB   GLU  47          2HB       GLU  47 -14.270   5.311  -0.978
  477   2HB   GLU  47          1HB       GLU  47 -15.287   6.296   0.076
  478   1HG   GLU  47          2HG       GLU  47 -15.934   7.536  -2.137
  479   2HG   GLU  47          1HG       GLU  47 -15.335   6.076  -2.923
  480    QB   GLU  47           QB       GLU  47 -14.778   5.803  -0.451
  481    QG   GLU  47           QG       GLU  47 -15.634   6.806  -2.530
  482    H    ALA  48           H        ALA  48 -12.441   9.524  -0.297
  483    HA   ALA  48           HA       ALA  48 -14.061  10.394   1.939
  484   1HB   ALA  48          1HB       ALA  48 -11.803  11.089   1.891
  485   2HB   ALA  48          3HB       ALA  48 -11.895  11.562   0.194
  486   3HB   ALA  48          2HB       ALA  48 -12.681  12.547   1.428
  487    MB   ALA  48           QB       ALA  48 -12.126  11.733   1.171
  488    H    MET  49           H        MET  49 -16.172  11.005   1.574
  489    HA   MET  49           HA       MET  49 -18.012  12.156   0.639
  490   1HB   MET  49          2HB       MET  49 -15.679  13.824   0.656
  491   2HB   MET  49          1HB       MET  49 -16.602  14.179  -0.804
  492   1HG   MET  49          2HG       MET  49 -17.819  15.521   0.577
  493   2HG   MET  49          1HG       MET  49 -18.605  14.013   1.042
  494   1HE   MET  49          3HE       MET  49 -19.364  15.357   2.748
  495   2HE   MET  49          2HE       MET  49 -18.984  14.179   4.000
  496   3HE   MET  49          1HE       MET  49 -18.531  15.866   4.222
  497    QB   MET  49           QB       MET  49 -16.140  14.001  -0.074
  498    QG   MET  49           QG       MET  49 -18.212  14.767   0.809
  499    ME   MET  49           QE       MET  49 -18.960  15.134   3.656
  500    H    LYS  50           H        LYS  50 -17.070   9.940  -0.870
  501    HA   LYS  50           HA       LYS  50 -17.193   9.018  -3.044
  502   1HB   LYS  50          2HB       LYS  50 -19.006  11.429  -3.038
  503   2HB   LYS  50          1HB       LYS  50 -18.846  10.433  -4.486
  504   1HG   LYS  50          2HG       LYS  50 -19.183   8.724  -2.195
  505   2HG   LYS  50          1HG       LYS  50 -20.472   9.928  -2.218
  506   1HD   LYS  50          2HD       LYS  50 -19.682   8.174  -4.562
  507   2HD   LYS  50          1HD       LYS  50 -21.085   7.915  -3.525
  508   1HE   LYS  50          2HE       LYS  50 -21.687  10.394  -4.168
  509   2HE   LYS  50          1HE       LYS  50 -20.611  10.091  -5.548
  510   1HZ   LYS  50          2HZ       LYS  50 -21.863   7.915  -5.783
  511   2HZ   LYS  50          1HZ       LYS  50 -23.033   8.585  -4.749
  512   3HZ   LYS  50          3HZ       LYS  50 -22.701   9.321  -6.241
  513    QB   LYS  50           QB       LYS  50 -18.926  10.931  -3.762
  514    QD   LYS  50           QD       LYS  50 -20.383   8.044  -4.044
  515    QG   LYS  50           QG       LYS  50 -19.828   9.326  -2.206
  516    QE   LYS  50           QE       LYS  50 -21.149  10.243  -4.858
  517    QZ   LYS  50           QZ       LYS  50 -22.532   8.607  -5.591
  518    H    MET  51           H        MET  51 -14.836  10.461  -2.638
  519    HA   MET  51           HA       MET  51 -14.502  12.297  -4.945
  520   1HB   MET  51          2HB       MET  51 -13.162  11.646  -2.387
  521   2HB   MET  51          1HB       MET  51 -12.076  12.086  -3.707
  522   1HG   MET  51          2HG       MET  51 -13.295  14.168  -4.069
  523   2HG   MET  51          1HG       MET  51 -14.478  13.720  -2.839
  524   1HE   MET  51          3HE       MET  51 -13.089  16.151  -3.277
  525   2HE   MET  51          2HE       MET  51 -13.316  16.542  -1.574
  526   3HE   MET  51          1HE       MET  51 -11.703  16.611  -2.279
  527    QB   MET  51           QB       MET  51 -12.619  11.866  -3.047
  528    QG   MET  51           QG       MET  51 -13.887  13.944  -3.454
  529    ME   MET  51           QE       MET  51 -12.703  16.435  -2.376
  530    H    GLU  52           H        GLU  52 -13.902   8.986  -4.078
  531    HA   GLU  52           HA       GLU  52 -12.788   7.245  -5.233
  532   1HB   GLU  52          2HB       GLU  52 -14.451   8.481  -6.897
  533   2HB   GLU  52          1HB       GLU  52 -12.949   8.963  -7.688
  534   1HG   GLU  52          2HG       GLU  52 -12.297   6.474  -7.577
  535   2HG   GLU  52          1HG       GLU  52 -13.995   6.172  -7.212
  536    QB   GLU  52           QB       GLU  52 -13.700   8.722  -7.293
  537    QG   GLU  52           QG       GLU  52 -13.146   6.323  -7.395
  538    H    THR  53           H        THR  53 -10.707   7.644  -4.193
  539    HA   THR  53           HA       THR  53  -8.762   9.143  -5.918
  540    HB   THR  53           HB       THR  53  -8.890   8.701  -2.918
  541    HG1  THR  53           HG1      THR  53  -9.532  10.743  -2.849
  542   1HG2  THR  53          2HG2      THR  53  -6.841  10.156  -4.612
  543   2HG2  THR  53          1HG2      THR  53  -6.917  10.216  -2.851
  544   3HG2  THR  53          3HG2      THR  53  -6.565   8.692  -3.667
  545    MG   THR  53           QG2      THR  53  -6.774   9.688  -3.710
  546    H    GLU  54           H        GLU  54  -7.498   7.664  -6.985
  547    HA   GLU  54           HA       GLU  54  -7.105   4.943  -5.992
  548   1HB   GLU  54          2HB       GLU  54  -6.381   6.623  -8.350
  549   2HB   GLU  54          1HB       GLU  54  -5.372   5.209  -8.040
  550   1HG   GLU  54          2HG       GLU  54  -7.182   4.540  -9.511
  551   2HG   GLU  54          1HG       GLU  54  -7.464   3.821  -7.925
  552    QB   GLU  54           QB       GLU  54  -5.876   5.916  -8.195
  553    QG   GLU  54           QG       GLU  54  -7.323   4.181  -8.718
  554    H    ILE  55           H        ILE  55  -5.632   4.505  -4.399
  555    HA   ILE  55           HA       ILE  55  -3.464   6.420  -3.810
  556    HB   ILE  55           HB       ILE  55  -4.476   3.851  -2.560
  557   1HG1  ILE  55          2HG1      ILE  55  -5.980   5.795  -2.383
  558   2HG1  ILE  55          1HG1      ILE  55  -5.290   5.404  -0.808
  559   1HG2  ILE  55          2HG2      ILE  55  -2.071   5.510  -2.002
  560   2HG2  ILE  55          1HG2      ILE  55  -3.020   5.014  -0.601
  561   3HG2  ILE  55          3HG2      ILE  55  -2.352   3.798  -1.689
  562   1HD1  ILE  55          2HD1      ILE  55  -3.413   7.134  -1.812
  563   2HD1  ILE  55          1HD1      ILE  55  -4.903   7.798  -2.484
  564   3HD1  ILE  55          3HD1      ILE  55  -4.731   7.606  -0.740
  565    MG   ILE  55           QG2      ILE  55  -2.481   4.774  -1.431
  566    MD   ILE  55           QD1      ILE  55  -4.349   7.513  -1.679
  567    QG   ILE  55           QG1      ILE  55  -5.635   5.599  -1.595
  568    H    ASN  56           H        ASN  56  -2.073   6.101  -5.660
  569    HA   ASN  56           HA       ASN  56  -1.066   3.490  -6.433
  570   1HB   ASN  56          2HB       ASN  56   0.442   4.871  -7.819
  571   2HB   ASN  56          1HB       ASN  56  -1.214   5.471  -7.917
  572   1HD2  ASN  56          1HD2      ASN  56   2.032   6.276  -6.925
  573   2HD2  ASN  56          2HD2      ASN  56   1.685   7.832  -6.343
  574    QB   ASN  56           QB       ASN  56  -0.386   5.171  -7.868
  575    QD   ASN  56           QD2      ASN  56   1.858   7.054  -6.634
  576    H    ALA  57           H        ALA  57   0.635   2.391  -5.545
  577    HA   ALA  57           HA       ALA  57   1.788   2.884  -3.058
  578   1HB   ALA  57          3HB       ALA  57   2.605   1.438  -5.551
  579   2HB   ALA  57          2HB       ALA  57   3.771   1.547  -4.233
  580   3HB   ALA  57          1HB       ALA  57   2.204   0.784  -3.963
  581    MB   ALA  57           QB       ALA  57   2.860   1.256  -4.582
  582    HA   PRO  58           HA       PRO  58   4.486   6.323  -3.676
  583   1HB   PRO  58          2HB       PRO  58   6.239   5.916  -1.614
  584   2HB   PRO  58          1HB       PRO  58   4.585   6.515  -1.375
  585   1HG   PRO  58          2HG       PRO  58   5.683   3.780  -0.983
  586   2HG   PRO  58          1HG       PRO  58   4.470   4.658  -0.039
  587   1HD   PRO  58          2HD       PRO  58   3.867   2.708  -1.861
  588   2HD   PRO  58          1HD       PRO  58   2.757   4.020  -1.409
  589    QB   PRO  58           QB       PRO  58   5.412   6.216  -1.494
  590    QG   PRO  58           QG       PRO  58   5.077   4.219  -0.511
  591    QD   PRO  58           QD       PRO  58   3.312   3.364  -1.635
  592    H    THR  59           H        THR  59   6.027   3.150  -3.118
  593    HA   THR  59           HA       THR  59   7.820   3.629  -5.416
  594    HB   THR  59           HB       THR  59   8.788   3.273  -2.561
  595    HG1  THR  59           HG1      THR  59   9.017   5.345  -2.619
  596   1HG2  THR  59          2HG2      THR  59  10.054   2.801  -5.173
  597   2HG2  THR  59          1HG2      THR  59  10.979   3.863  -4.111
  598   3HG2  THR  59          3HG2      THR  59  10.537   2.243  -3.571
  599    MG   THR  59           QG2      THR  59  10.523   2.969  -4.285
  600    H    ASP  60           H        ASP  60   8.817   1.647  -6.140
  601    HA   ASP  60           HA       ASP  60   7.318  -0.730  -5.868
  602   1HB   ASP  60          2HB       ASP  60   8.858  -0.260  -7.702
  603   2HB   ASP  60          1HB       ASP  60  10.225  -0.241  -6.588
  604    QB   ASP  60           QB       ASP  60   9.541  -0.250  -7.145
  605    H    GLY  61           H        GLY  61   7.468  -2.494  -4.467
  606   1HA   GLY  61          1HA       GLY  61   8.749  -2.085  -1.901
  607   2HA   GLY  61          2HA       GLY  61   9.617  -3.279  -2.866
  608    QA   GLY  61           QA       GLY  61   9.183  -2.682  -2.384
  609    H    LYS  62           H        LYS  62   8.729  -4.448  -0.740
  610    HA   LYS  62           HA       LYS  62   6.197  -5.830  -1.555
  611   1HB   LYS  62          2HB       LYS  62   8.280  -7.162  -1.516
  612   2HB   LYS  62          1HB       LYS  62   8.537  -6.708   0.168
  613   1HG   LYS  62          2HG       LYS  62   5.893  -7.696   0.023
  614   2HG   LYS  62          1HG       LYS  62   6.886  -8.823  -0.901
  615   1HD   LYS  62          2HD       LYS  62   8.322  -8.114   1.471
  616   2HD   LYS  62          1HD       LYS  62   6.686  -8.576   1.936
  617   1HE   LYS  62          2HE       LYS  62   8.088 -10.296  -0.078
  618   2HE   LYS  62          1HE       LYS  62   8.577 -10.431   1.623
  619   1HZ   LYS  62          3HZ       LYS  62   6.181 -10.579   2.189
  620   2HZ   LYS  62          2HZ       LYS  62   5.825 -10.668   0.531
  621   3HZ   LYS  62          1HZ       LYS  62   6.737 -11.894   1.273
  622    QB   LYS  62           QB       LYS  62   8.409  -6.935  -0.674
  623    QD   LYS  62           QD       LYS  62   7.504  -8.345   1.704
  624    QG   LYS  62           QG       LYS  62   6.390  -8.259  -0.439
  625    QE   LYS  62           QE       LYS  62   8.333 -10.363   0.773
  626    QZ   LYS  62           QZ       LYS  62   6.248 -11.047   1.331
  627    H    VAL  63           H        VAL  63   4.524  -5.999  -0.028
  628    HA   VAL  63           HA       VAL  63   4.486  -4.099   2.161
  629    HB   VAL  63           HB       VAL  63   2.692  -6.336   1.183
  630   1HG1  VAL  63          1HG1      VAL  63   3.076  -4.048  -0.013
  631   2HG1  VAL  63          3HG1      VAL  63   1.422  -4.617   0.217
  632   3HG1  VAL  63          2HG1      VAL  63   2.091  -3.393   1.296
  633   1HG2  VAL  63          1HG2      VAL  63   2.378  -4.517   3.575
  634   2HG2  VAL  63          3HG2      VAL  63   0.972  -5.168   2.732
  635   3HG2  VAL  63          2HG2      VAL  63   2.132  -6.262   3.486
  636    MG1  VAL  63           QG1      VAL  63   2.196  -4.019   0.500
  637    MG2  VAL  63           QG2      VAL  63   1.827  -5.316   3.264
  638    QG   VAL  63           QQG      VAL  63   2.012  -4.668   1.882
  639    H    GLU  64           H        GLU  64   5.143  -4.435   4.241
  640    HA   GLU  64           HA       GLU  64   6.031  -7.162   5.028
  641   1HB   GLU  64          2HB       GLU  64   6.379  -4.412   6.267
  642   2HB   GLU  64          1HB       GLU  64   7.159  -5.887   6.840
  643   1HG   GLU  64          2HG       GLU  64   7.494  -5.333   3.954
  644   2HG   GLU  64          1HG       GLU  64   8.290  -4.187   5.035
  645    QB   GLU  64           QB       GLU  64   6.769  -5.149   6.554
  646    QG   GLU  64           QG       GLU  64   7.892  -4.760   4.495
  647    H    LYS  65           H        LYS  65   3.278  -5.192   5.357
  648    HA   LYS  65           HA       LYS  65   2.025  -6.982   7.249
  649   1HB   LYS  65          2HB       LYS  65   3.656  -5.751   8.696
  650   2HB   LYS  65          1HB       LYS  65   2.859  -4.241   8.255
  651   1HG   LYS  65          2HG       LYS  65   0.712  -5.181   9.151
  652   2HG   LYS  65          1HG       LYS  65   1.614  -6.585   9.721
  653   1HD   LYS  65          2HD       LYS  65   2.607  -5.426  11.426
  654   2HD   LYS  65          1HD       LYS  65   2.719  -3.938  10.484
  655   1HE   LYS  65          2HE       LYS  65   0.090  -3.924  10.716
  656   2HE   LYS  65          1HE       LYS  65   0.414  -4.969  12.114
  657   1HZ   LYS  65          3HZ       LYS  65   2.173  -3.291  12.730
  658   2HZ   LYS  65          2HZ       LYS  65   1.473  -2.251  11.583
  659   3HZ   LYS  65          1HZ       LYS  65   0.568  -2.777  12.923
  660    QB   LYS  65           QB       LYS  65   3.257  -4.996   8.476
  661    QD   LYS  65           QD       LYS  65   2.663  -4.682  10.955
  662    QG   LYS  65           QG       LYS  65   1.163  -5.883   9.436
  663    QE   LYS  65           QE       LYS  65   0.252  -4.446  11.415
  664    QZ   LYS  65           QZ       LYS  65   1.405  -2.773  12.412
  665    H    VAL  66           H        VAL  66  -0.225  -6.533   7.397
  666    HA   VAL  66           HA       VAL  66  -1.184  -4.364   5.576
  667    HB   VAL  66           HB       VAL  66  -1.794  -6.682   5.039
  668   1HG1  VAL  66          3HG1      VAL  66  -2.137  -6.812   7.906
  669   2HG1  VAL  66          2HG1      VAL  66  -3.612  -7.341   7.097
  670   3HG1  VAL  66          1HG1      VAL  66  -2.078  -8.132   6.737
  671   1HG2  VAL  66          1HG2      VAL  66  -3.689  -4.570   5.639
  672   2HG2  VAL  66          3HG2      VAL  66  -3.690  -5.715   4.297
  673   3HG2  VAL  66          2HG2      VAL  66  -4.439  -6.155   5.832
  674    MG1  VAL  66           QG1      VAL  66  -2.609  -7.428   7.247
  675    MG2  VAL  66           QG2      VAL  66  -3.939  -5.480   5.256
  676    QG   VAL  66           QQG      VAL  66  -3.274  -6.454   6.251
  677    H    LEU  67           H        LEU  67  -2.700  -2.845   6.342
  678    HA   LEU  67           HA       LEU  67  -3.427  -3.011   9.248
  679   1HB   LEU  67          2HB       LEU  67  -1.725  -1.174   7.834
  680   2HB   LEU  67          1HB       LEU  67  -3.139  -0.301   8.425
  681    HG   LEU  67           HG       LEU  67  -1.852  -2.219  10.308
  682   1HD1  LEU  67          2HD1      LEU  67  -0.607   0.352   9.336
  683   2HD1  LEU  67          1HD1      LEU  67  -0.312  -0.239  10.971
  684   3HD1  LEU  67          3HD1      LEU  67   0.160  -1.217   9.581
  685   1HD2  LEU  67          3HD2      LEU  67  -3.708  -0.023  10.346
  686   2HD2  LEU  67          2HD2      LEU  67  -3.268  -1.112  11.662
  687   3HD2  LEU  67          1HD2      LEU  67  -2.341   0.363  11.391
  688    MD1  LEU  67           QD1      LEU  67  -0.253  -0.368   9.963
  689    MD2  LEU  67           QD2      LEU  67  -3.106  -0.257  11.133
  690    QB   LEU  67           QB       LEU  67  -2.432  -0.737   8.130
  691    QD   LEU  67           QQD      LEU  67  -1.679  -0.313  10.548
  692    H    VAL  68           H        VAL  68  -4.124  -1.192   6.233
  693    HA   VAL  68           HA       VAL  68  -6.679  -0.218   6.901
  694    HB   VAL  68           HB       VAL  68  -5.534  -1.213   4.271
  695   1HG1  VAL  68          3HG1      VAL  68  -5.085   1.123   5.956
  696   2HG1  VAL  68          2HG1      VAL  68  -4.175   0.568   4.551
  697   3HG1  VAL  68          1HG1      VAL  68  -5.607   1.575   4.333
  698   1HG2  VAL  68          3HG2      VAL  68  -8.108   0.078   4.986
  699   2HG2  VAL  68          2HG2      VAL  68  -7.263   0.769   3.600
  700   3HG2  VAL  68          1HG2      VAL  68  -7.706  -0.938   3.602
  701    MG1  VAL  68           QG1      VAL  68  -4.956   1.089   4.947
  702    MG2  VAL  68           QG2      VAL  68  -7.692  -0.030   4.063
  703    QG   VAL  68           QQG      VAL  68  -6.324   0.529   4.505
  704    H    LYS  69           H        LYS  69  -8.597  -1.256   7.291
  705    HA   LYS  69           HA       LYS  69  -8.787  -4.164   7.043
  706   1HB   LYS  69          2HB       LYS  69 -10.181  -1.908   8.289
  707   2HB   LYS  69          1HB       LYS  69 -11.285  -3.142   7.685
  708   1HG   LYS  69          2HG       LYS  69 -10.762  -4.503   9.396
  709   2HG   LYS  69          1HG       LYS  69  -9.050  -4.418   8.976
  710   1HD   LYS  69          2HD       LYS  69  -9.006  -2.158  10.158
  711   2HD   LYS  69          1HD       LYS  69 -10.607  -2.557  10.781
  712   1HE   LYS  69          2HE       LYS  69  -9.801  -4.319  12.101
  713   2HE   LYS  69          1HE       LYS  69  -8.344  -4.522  11.107
  714   1HZ   LYS  69          3HZ       LYS  69  -8.970  -2.117  12.736
  715   2HZ   LYS  69          2HZ       LYS  69  -7.879  -3.337  13.193
  716   3HZ   LYS  69          1HZ       LYS  69  -7.560  -2.374  11.829
  717    QB   LYS  69           QB       LYS  69 -10.733  -2.525   7.987
  718    QD   LYS  69           QD       LYS  69  -9.806  -2.357  10.469
  719    QG   LYS  69           QG       LYS  69  -9.906  -4.460   9.186
  720    QE   LYS  69           QE       LYS  69  -9.073  -4.421  11.604
  721    QZ   LYS  69           QZ       LYS  69  -8.136  -2.609  12.586
  722    H    GLU  70           H        GLU  70  -9.104  -1.774   4.749
  723    HA   GLU  70           HA       GLU  70 -10.095  -1.745   2.607
  724   1HB   GLU  70          2HB       GLU  70  -9.229  -4.163   2.853
  725   2HB   GLU  70          1HB       GLU  70 -10.899  -4.599   3.213
  726   1HG   GLU  70          2HG       GLU  70 -11.522  -3.388   1.043
  727   2HG   GLU  70          1HG       GLU  70  -9.798  -3.402   0.667
  728    QB   GLU  70           QB       GLU  70 -10.064  -4.381   3.033
  729    QG   GLU  70           QG       GLU  70 -10.660  -3.395   0.855
  730    H    ARG  71           H        ARG  71 -12.067  -0.892   2.012
  731    HA   ARG  71           HA       ARG  71 -14.364  -0.343   2.135
  732   1HB   ARG  71          2HB       ARG  71 -14.066  -3.077   2.040
  733   2HB   ARG  71          1HB       ARG  71 -15.065  -2.871   3.480
  734   1HG   ARG  71          2HG       ARG  71 -16.864  -2.170   2.281
  735   2HG   ARG  71          1HG       ARG  71 -15.874  -1.201   1.188
  736   1HD   ARG  71          2HD       ARG  71 -16.205  -2.817  -0.372
  737   2HD   ARG  71          1HD       ARG  71 -15.192  -3.880   0.625
  738    HE   ARG  71           HE       ARG  71 -18.164  -3.662   0.910
  739   1HH1  ARG  71          1HH1      ARG  71 -15.486  -4.861   2.498
  740   2HH1  ARG  71          2HH1      ARG  71 -16.029  -6.505   2.563
  741   1HH2  ARG  71          1HH2      ARG  71 -18.737  -5.970   0.464
  742   2HH2  ARG  71          2HH2      ARG  71 -17.870  -7.133   1.410
  743    QB   ARG  71           QB       ARG  71 -14.565  -2.974   2.760
  744    QG   ARG  71           QG       ARG  71 -16.369  -1.686   1.734
  745    QD   ARG  71           QD       ARG  71 -15.699  -3.349   0.126
  746    QH1  ARG  71           QH1      ARG  71 -15.758  -5.683   2.530
  747    QH2  ARG  71           QH2      ARG  71 -18.303  -6.551   0.937
  748    H    ASP  72           H        ASP  72 -12.510   0.083   4.510
  749    HA   ASP  72           HA       ASP  72 -14.647   0.296   6.605
  750   1HB   ASP  72          2HB       ASP  72 -12.496  -1.351   6.690
  751   2HB   ASP  72          1HB       ASP  72 -11.785   0.106   7.386
  752    QB   ASP  72           QB       ASP  72 -12.140  -0.622   7.038
  753    H    ALA  73           H        ALA  73 -15.065   2.432   7.004
  754    HA   ALA  73           HA       ALA  73 -13.646   4.641   5.982
  755   1HB   ALA  73          1HB       ALA  73 -14.962   4.956   8.620
  756   2HB   ALA  73          2HB       ALA  73 -15.945   4.178   7.381
  757   3HB   ALA  73          3HB       ALA  73 -15.285   5.790   7.099
  758    MB   ALA  73           QB       ALA  73 -15.397   4.975   7.700
  759    H    VAL  74           H        VAL  74 -11.922   5.902   6.805
  760    HA   VAL  74           HA       VAL  74 -10.725   5.035   9.412
  761    HB   VAL  74           HB       VAL  74  -8.509   5.119   8.265
  762   1HG1  VAL  74          1HG1      VAL  74 -10.524   3.153   8.047
  763   2HG1  VAL  74          3HG1      VAL  74  -9.776   3.255   6.454
  764   3HG1  VAL  74          2HG1      VAL  74  -8.785   2.919   7.873
  765   1HG2  VAL  74          3HG2      VAL  74  -9.311   6.721   6.477
  766   2HG2  VAL  74          2HG2      VAL  74  -8.382   5.351   5.866
  767   3HG2  VAL  74          1HG2      VAL  74 -10.141   5.359   5.722
  768    MG1  VAL  74           QG1      VAL  74  -9.695   3.109   7.458
  769    MG2  VAL  74           QG2      VAL  74  -9.278   5.810   6.022
  770    QG   VAL  74           QQG      VAL  74  -9.487   4.459   6.740
  771    H    GLN  75           H        GLN  75  -8.984   6.700  10.087
  772    HA   GLN  75           HA       GLN  75  -9.961   9.451   9.401
  773   1HB   GLN  75          2HB       GLN  75  -9.501   7.991  11.846
  774   2HB   GLN  75          1HB       GLN  75  -8.459   9.414  11.810
  775   1HG   GLN  75          2HG       GLN  75 -11.396   9.580  11.120
  776   2HG   GLN  75          1HG       GLN  75 -10.822   9.734  12.780
  777   1HE2  GLN  75          1HE2      GLN  75 -12.037  11.986  11.809
  778   2HE2  GLN  75          2HE2      GLN  75 -10.896  13.179  11.413
  779    QB   GLN  75           QB       GLN  75  -8.980   8.703  11.828
  780    QG   GLN  75           QG       GLN  75 -11.109   9.657  11.950
  781    QE   GLN  75           QE2      GLN  75 -11.467  12.583  11.611
  782    H    GLY  76           H        GLY  76  -8.033  11.087  10.053
  783   1HA   GLY  76          1HA       GLY  76  -6.094  11.902   8.880
  784   2HA   GLY  76          2HA       GLY  76  -5.730  10.248   8.387
  785    QA   GLY  76           QA       GLY  76  -5.912  11.075   8.634
  786    H    GLY  77           H        GLY  77  -3.638  10.077   9.202
  787   1HA   GLY  77          1HA       GLY  77  -3.230  10.714  12.085
  788   2HA   GLY  77          2HA       GLY  77  -1.939  10.533  10.897
  789    QA   GLY  77           QA       GLY  77  -2.584  10.624  11.491
  790    H    GLN  78           H        GLN  78  -3.500   8.080   9.856
  791    HA   GLN  78           HA       GLN  78  -2.571   6.192  11.997
  792   1HB   GLN  78          2HB       GLN  78  -4.999   6.166  10.187
  793   2HB   GLN  78          1HB       GLN  78  -4.482   4.754  11.106
  794   1HG   GLN  78          2HG       GLN  78  -4.494   7.005  12.870
  795   2HG   GLN  78          1HG       GLN  78  -6.037   6.967  12.016
  796   1HE2  GLN  78          1HE2      GLN  78  -3.903   5.054  14.137
  797   2HE2  GLN  78          2HE2      GLN  78  -5.101   3.956  14.629
  798    QB   GLN  78           QB       GLN  78  -4.741   5.460  10.646
  799    QG   GLN  78           QG       GLN  78  -5.266   6.986  12.443
  800    QE   GLN  78           QE2      GLN  78  -4.502   4.505  14.383
  801    H    GLY  79           H        GLY  79  -1.394   4.397  11.256
  802   1HA   GLY  79          1HA       GLY  79  -0.050   3.159   9.785
  803   2HA   GLY  79          2HA       GLY  79  -0.023   4.596   8.761
  804    QA   GLY  79           QA       GLY  79  -0.037   3.877   9.273
  805    H    LEU  80           H        LEU  80  -0.355   3.523   6.789
  806    HA   LEU  80           HA       LEU  80  -3.097   2.388   6.416
  807   1HB   LEU  80          2HB       LEU  80  -1.034   3.528   4.500
  808   2HB   LEU  80          1HB       LEU  80  -2.642   2.972   4.034
  809    HG   LEU  80           HG       LEU  80  -2.235   5.077   6.162
  810   1HD1  LEU  80          1HD1      LEU  80  -4.420   3.822   5.947
  811   2HD1  LEU  80          3HD1      LEU  80  -4.559   5.567   5.733
  812   3HD1  LEU  80          2HD1      LEU  80  -4.577   4.502   4.327
  813   1HD2  LEU  80          1HD2      LEU  80  -1.636   5.329   3.397
  814   2HD2  LEU  80          3HD2      LEU  80  -3.169   6.160   3.666
  815   3HD2  LEU  80          2HD2      LEU  80  -1.742   6.618   4.597
  816    MD1  LEU  80           QD1      LEU  80  -4.519   4.630   5.336
  817    MD2  LEU  80           QD2      LEU  80  -2.182   6.035   3.886
  818    QB   LEU  80           QB       LEU  80  -1.838   3.250   4.267
  819    QD   LEU  80           QQD      LEU  80  -3.351   5.333   4.611
  820    H    ILE  81           H        ILE  81   0.332   1.799   5.607
  821    HA   ILE  81           HA       ILE  81  -0.028  -1.092   5.767
  822    HB   ILE  81           HB       ILE  81  -1.090  -0.565   3.603
  823   1HG1  ILE  81          2HG1      ILE  81   0.763  -1.809   2.144
  824   2HG1  ILE  81          1HG1      ILE  81   1.506  -2.056   3.725
  825   1HG2  ILE  81          1HG2      ILE  81   0.453   1.535   3.373
  826   2HG2  ILE  81          3HG2      ILE  81   1.574   0.415   2.600
  827   3HG2  ILE  81          2HG2      ILE  81  -0.030   0.671   1.915
  828   1HD1  ILE  81          3HD1      ILE  81  -1.170  -2.646   4.178
  829   2HD1  ILE  81          2HD1      ILE  81  -0.869  -3.318   2.574
  830   3HD1  ILE  81          1HD1      ILE  81   0.119  -3.827   3.945
  831    MG   ILE  81           QG2      ILE  81   0.665   0.874   2.629
  832    MD   ILE  81           QD1      ILE  81  -0.640  -3.264   3.566
  833    QG   ILE  81           QG1      ILE  81   1.134  -1.933   2.934
  834    H    LYS  82           H        LYS  82   1.997  -2.102   5.963
  835    HA   LYS  82           HA       LYS  82   4.341  -0.294   6.121
  836   1HB   LYS  82          2HB       LYS  82   3.634  -1.942   7.911
  837   2HB   LYS  82          1HB       LYS  82   4.061  -3.239   6.794
  838   1HG   LYS  82          2HG       LYS  82   6.369  -2.281   6.641
  839   2HG   LYS  82          1HG       LYS  82   5.921  -1.102   7.875
  840   1HD   LYS  82          2HD       LYS  82   5.134  -3.630   8.872
  841   2HD   LYS  82          1HD       LYS  82   6.759  -3.839   8.220
  842   1HE   LYS  82          2HE       LYS  82   6.385  -1.351   9.778
  843   2HE   LYS  82          1HE       LYS  82   6.261  -2.851  10.721
  844   1HZ   LYS  82          2HZ       LYS  82   8.311  -3.622   9.656
  845   2HZ   LYS  82          1HZ       LYS  82   8.453  -2.137   8.843
  846   3HZ   LYS  82          3HZ       LYS  82   8.569  -2.191  10.535
  847    QB   LYS  82           QB       LYS  82   3.848  -2.590   7.352
  848    QD   LYS  82           QD       LYS  82   5.947  -3.735   8.546
  849    QG   LYS  82           QG       LYS  82   6.145  -1.692   7.258
  850    QE   LYS  82           QE       LYS  82   6.323  -2.101  10.250
  851    QZ   LYS  82           QZ       LYS  82   8.444  -2.650   9.678
  852    H    ILE  83           H        ILE  83   6.242  -0.648   4.879
  853    HA   ILE  83           HA       ILE  83   6.039  -2.683   2.688
  854    HB   ILE  83           HB       ILE  83   6.971  -0.892   1.194
  855   1HG1  ILE  83          2HG1      ILE  83   6.395   0.885   3.586
  856   2HG1  ILE  83          1HG1      ILE  83   8.006   0.453   3.013
  857   1HG2  ILE  83          3HG2      ILE  83   4.367  -0.291   2.629
  858   2HG2  ILE  83          2HG2      ILE  83   4.855   0.449   1.104
  859   3HG2  ILE  83          1HG2      ILE  83   4.570  -1.289   1.189
  860   1HD1  ILE  83          3HD1      ILE  83   6.015   1.695   1.130
  861   2HD1  ILE  83          2HD1      ILE  83   6.957   2.711   2.222
  862   3HD1  ILE  83          1HD1      ILE  83   7.776   1.694   1.036
  863    MG   ILE  83           QG2      ILE  83   4.597  -0.377   1.641
  864    MD   ILE  83           QD1      ILE  83   6.916   2.033   1.462
  865    QG   ILE  83           QG1      ILE  83   7.200   0.669   3.300
  866    H    GLY  84           H        GLY  84   8.168  -3.296   1.817
  867   1HA   GLY  84          1HA       GLY  84  10.294  -4.196   2.404
  868   2HA   GLY  84          2HA       GLY  84  10.244  -3.270   3.905
  869    QA   GLY  84           QA       GLY  84  10.269  -3.733   3.154

  No H/Q in entry =         869
  Start of MODEL   17
    1    H1   MET   1          1H        MET   1  -7.620   5.459  35.996
    2    H2   MET   1          3H        MET   1  -8.814   4.438  35.359
    3    H3   MET   1          2H        MET   1  -7.250   3.840  35.642
    4    HA   MET   1           HA       MET   1  -6.328   5.033  33.857
    5   1HB   MET   1          2HB       MET   1  -8.823   3.498  33.594
    6   2HB   MET   1          1HB       MET   1  -8.471   4.503  32.188
    7   1HG   MET   1          2HG       MET   1  -6.171   3.538  32.120
    8   2HG   MET   1          1HG       MET   1  -6.611   2.470  33.453
    9   1HE   MET   1          3HE       MET   1  -7.742   4.023  30.415
   10   2HE   MET   1          2HE       MET   1  -7.690   2.747  29.201
   11   3HE   MET   1          1HE       MET   1  -9.205   3.107  30.024
   12    QB   MET   1           QB       MET   1  -8.647   4.000  32.891
   13    QG   MET   1           QG       MET   1  -6.391   3.004  32.786
   14    ME   MET   1           QE       MET   1  -8.213   3.292  29.880
   15    H    LYS   2           H        LYS   2  -6.846   7.295  35.073
   16    HA   LYS   2           HA       LYS   2  -9.045   8.900  34.210
   17   1HB   LYS   2          2HB       LYS   2  -6.481   9.156  35.593
   18   2HB   LYS   2          1HB       LYS   2  -6.876  10.595  34.654
   19   1HG   LYS   2          2HG       LYS   2  -9.248  10.335  35.727
   20   2HG   LYS   2          1HG       LYS   2  -8.406   9.345  36.920
   21   1HD   LYS   2          2HD       LYS   2  -7.101  11.920  36.258
   22   2HD   LYS   2          1HD       LYS   2  -8.638  12.047  37.116
   23   1HE   LYS   2          2HE       LYS   2  -7.818  10.993  39.019
   24   2HE   LYS   2          1HE       LYS   2  -6.607  10.068  38.108
   25   1HZ   LYS   2          3HZ       LYS   2  -6.548  13.025  38.296
   26   2HZ   LYS   2          2HZ       LYS   2  -5.731  12.030  39.405
   27   3HZ   LYS   2          1HZ       LYS   2  -5.317  11.991  37.758
   28    QB   LYS   2           QB       LYS   2  -6.679   9.875  35.124
   29    QD   LYS   2           QD       LYS   2  -7.869  11.984  36.687
   30    QG   LYS   2           QG       LYS   2  -8.827   9.840  36.324
   31    QE   LYS   2           QE       LYS   2  -7.212  10.530  38.563
   32    QZ   LYS   2           QZ       LYS   2  -5.865  12.349  38.486
   33    H    LEU   3           H        LEU   3  -8.152  11.148  33.005
   34    HA   LEU   3           HA       LEU   3  -6.735  10.317  30.506
   35   1HB   LEU   3          2HB       LEU   3  -9.135  10.074  30.132
   36   2HB   LEU   3          1HB       LEU   3  -9.429  11.692  30.772
   37    HG   LEU   3           HG       LEU   3  -7.465  11.546  28.561
   38   1HD1  LEU   3          2HD1      LEU   3  -9.523  13.355  29.683
   39   2HD1  LEU   3          1HD1      LEU   3  -7.954  13.738  28.972
   40   3HD1  LEU   3          3HD1      LEU   3  -9.342  13.420  27.929
   41   1HD2  LEU   3          2HD2      LEU   3  -9.276   9.876  27.941
   42   2HD2  LEU   3          1HD2      LEU   3 -10.421  11.216  27.988
   43   3HD2  LEU   3          3HD2      LEU   3  -9.098  11.229  26.823
   44    MD1  LEU   3           QD1      LEU   3  -8.940  13.504  28.861
   45    MD2  LEU   3           QD2      LEU   3  -9.598  10.773  27.584
   46    QB   LEU   3           QB       LEU   3  -9.282  10.883  30.452
   47    QD   LEU   3           QQD      LEU   3  -9.269  12.139  28.223
   48    H    LYS   4           H        LYS   4  -4.939  11.661  30.848
   49    HA   LYS   4           HA       LYS   4  -5.514  14.583  31.234
   50   1HB   LYS   4          2HB       LYS   4  -3.263  12.776  32.154
   51   2HB   LYS   4          1HB       LYS   4  -3.164  14.536  32.242
   52   1HG   LYS   4          2HG       LYS   4  -5.567  14.203  33.396
   53   2HG   LYS   4          1HG       LYS   4  -4.845  12.651  33.822
   54   1HD   LYS   4          2HD       LYS   4  -3.235  13.609  35.164
   55   2HD   LYS   4          1HD       LYS   4  -3.179  15.096  34.217
   56   1HE   LYS   4          2HE       LYS   4  -5.729  15.237  35.163
   57   2HE   LYS   4          1HE       LYS   4  -4.931  14.393  36.505
   58   1HZ   LYS   4          2HZ       LYS   4  -3.086  16.094  36.187
   59   2HZ   LYS   4          1HZ       LYS   4  -4.212  16.991  35.288
   60   3HZ   LYS   4          3HZ       LYS   4  -4.517  16.642  36.919
   61    QB   LYS   4           QB       LYS   4  -3.213  13.656  32.198
   62    QD   LYS   4           QD       LYS   4  -3.207  14.352  34.691
   63    QG   LYS   4           QG       LYS   4  -5.206  13.427  33.609
   64    QE   LYS   4           QE       LYS   4  -5.330  14.815  35.834
   65    QZ   LYS   4           QZ       LYS   4  -3.938  16.576  36.131
   66    H    VAL   5           H        VAL   5  -2.738  12.605  30.111
   67    HA   VAL   5           HA       VAL   5  -2.745  14.181  27.566
   68    HB   VAL   5           HB       VAL   5  -0.303  14.477  27.859
   69   1HG1  VAL   5          1HG1      VAL   5  -0.852  12.982  30.435
   70   2HG1  VAL   5          3HG1      VAL   5   0.274  12.540  29.152
   71   3HG1  VAL   5          2HG1      VAL   5   0.608  13.937  30.176
   72   1HG2  VAL   5          3HG2      VAL   5  -2.329  15.821  29.186
   73   2HG2  VAL   5          2HG2      VAL   5  -1.187  15.459  30.479
   74   3HG2  VAL   5          1HG2      VAL   5  -0.657  16.364  29.060
   75    MG1  VAL   5           QG1      VAL   5   0.010  13.153  29.921
   76    MG2  VAL   5           QG2      VAL   5  -1.391  15.881  29.575
   77    QG   VAL   5           QQG      VAL   5  -0.690  14.517  29.748
   78    H    THR   6           H        THR   6  -2.438  12.862  25.806
   79    HA   THR   6           HA       THR   6  -2.060  10.883  24.569
   80    HB   THR   6           HB       THR   6   0.064  10.473  26.693
   81    HG1  THR   6           HG1      THR   6   0.748  12.345  26.065
   82   1HG2  THR   6          2HG2      THR   6  -0.492   9.428  23.977
   83   2HG2  THR   6          1HG2      THR   6   1.185   9.866  24.300
   84   3HG2  THR   6          3HG2      THR   6   0.372   8.677  25.318
   85    MG   THR   6           QG2      THR   6   0.355   9.324  24.532
   86    H    VAL   7           H        VAL   7  -4.149   9.989  25.386
   87    HA   VAL   7           HA       VAL   7  -4.422   8.422  27.746
   88    HB   VAL   7           HB       VAL   7  -5.752   8.258  25.022
   89   1HG1  VAL   7          1HG1      VAL   7  -6.134   6.757  27.534
   90   2HG1  VAL   7          3HG1      VAL   7  -7.611   7.457  26.870
   91   3HG1  VAL   7          2HG1      VAL   7  -6.641   6.354  25.894
   92   1HG2  VAL   7          1HG2      VAL   7  -5.829  10.457  26.286
   93   2HG2  VAL   7          3HG2      VAL   7  -7.405   9.739  25.955
   94   3HG2  VAL   7          2HG2      VAL   7  -6.699   9.607  27.564
   95    MG1  VAL   7           QG1      VAL   7  -6.795   6.856  26.766
   96    MG2  VAL   7           QG2      VAL   7  -6.644   9.934  26.602
   97    QG   VAL   7           QQG      VAL   7  -6.720   8.395  26.684
   98    H    ASN   8           H        ASN   8  -4.202   6.150  28.076
   99    HA   ASN   8           HA       ASN   8  -2.015   4.787  26.985
  100   1HB   ASN   8          2HB       ASN   8  -4.501   4.132  28.462
  101   2HB   ASN   8          1HB       ASN   8  -3.706   2.768  27.677
  102   1HD2  ASN   8          1HD2      ASN   8  -3.127   1.980  29.895
  103   2HD2  ASN   8          2HD2      ASN   8  -1.818   2.681  30.716
  104    QB   ASN   8           QB       ASN   8  -4.103   3.450  28.070
  105    QD   ASN   8           QD2      ASN   8  -2.473   2.330  30.305
  106    H    GLY   9           H        GLY   9  -1.907   4.872  24.695
  107   1HA   GLY   9          1HA       GLY   9  -4.106   4.208  22.962
  108   2HA   GLY   9          2HA       GLY   9  -3.074   2.796  23.203
  109    QA   GLY   9           QA       GLY   9  -3.590   3.502  23.082
  110    H    ALA  10           H        ALA  10  -0.581   4.140  23.401
  111    HA   ALA  10           HA       ALA  10  -0.172   5.928  21.145
  112   1HB   ALA  10          1HB       ALA  10   1.367   6.159  22.888
  113   2HB   ALA  10          2HB       ALA  10   2.285   5.160  21.760
  114   3HB   ALA  10          3HB       ALA  10   1.484   4.418  23.145
  115    MB   ALA  10           QB       ALA  10   1.712   5.246  22.598
  116    H    GLY  11           H        GLY  11  -0.648   5.020  19.134
  117   1HA   GLY  11          1HA       GLY  11  -0.849   3.008  17.704
  118   2HA   GLY  11          2HA       GLY  11   0.567   2.356  18.528
  119    QA   GLY  11           QA       GLY  11  -0.141   2.682  18.116
  120    H    LYS  12           H        LYS  12  -0.402   5.196  16.572
  121    HA   LYS  12           HA       LYS  12   0.766   6.303  14.839
  122   1HB   LYS  12          2HB       LYS  12   3.082   5.443  16.606
  123   2HB   LYS  12          1HB       LYS  12   3.121   6.749  15.419
  124   1HG   LYS  12          2HG       LYS  12   2.005   8.187  16.781
  125   2HG   LYS  12          1HG       LYS  12   0.904   6.934  17.355
  126   1HD   LYS  12          2HD       LYS  12   2.097   7.248  19.297
  127   2HD   LYS  12          1HD       LYS  12   3.156   6.063  18.531
  128   1HE   LYS  12          2HE       LYS  12   3.578   8.975  17.918
  129   2HE   LYS  12          1HE       LYS  12   4.188   8.316  19.448
  130   1HZ   LYS  12          3HZ       LYS  12   5.244   6.521  18.205
  131   2HZ   LYS  12          2HZ       LYS  12   4.695   7.190  16.743
  132   3HZ   LYS  12          1HZ       LYS  12   5.826   8.031  17.693
  133    QB   LYS  12           QB       LYS  12   3.102   6.096  16.013
  134    QD   LYS  12           QD       LYS  12   2.626   6.656  18.914
  135    QG   LYS  12           QG       LYS  12   1.455   7.561  17.068
  136    QE   LYS  12           QE       LYS  12   3.883   8.645  18.683
  137    QZ   LYS  12           QZ       LYS  12   5.255   7.247  17.547
  138    H    ALA  13           H        ALA  13   3.317   5.718  13.743
  139    HA   ALA  13           HA       ALA  13   2.670   3.361  12.132
  140   1HB   ALA  13          3HB       ALA  13   4.282   5.730  12.010
  141   2HB   ALA  13          1HB       ALA  13   3.890   4.614  10.703
  142   3HB   ALA  13          2HB       ALA  13   5.320   4.339  11.699
  143    MB   ALA  13           QB       ALA  13   4.497   4.895  11.471
  144    H    GLY  14           H        GLY  14   5.247   2.302  11.706
  145   1HA   GLY  14          1HA       GLY  14   5.637   0.162  13.223
  146   2HA   GLY  14          2HA       GLY  14   6.185   1.385  14.370
  147    QA   GLY  14           QA       GLY  14   5.911   0.773  13.797
  148    H    GLU  15           H        GLU  15   7.739   3.064  13.105
  149    HA   GLU  15           HA       GLU  15   9.845   3.359  12.074
  150   1HB   GLU  15          2HB       GLU  15  10.274   1.676  13.898
  151   2HB   GLU  15          1HB       GLU  15  10.037   0.398  12.706
  152   1HG   GLU  15          2HG       GLU  15  11.837   1.692  11.324
  153   2HG   GLU  15          1HG       GLU  15  12.246   2.433  12.871
  154    QB   GLU  15           QB       GLU  15  10.156   1.037  13.302
  155    QG   GLU  15           QG       GLU  15  12.042   2.063  12.097
  156    H    GLY  16           H        GLY  16   8.634   3.605   9.963
  157   1HA   GLY  16          1HA       GLY  16   9.058   1.252   8.166
  158   2HA   GLY  16          2HA       GLY  16   9.522   2.880   7.671
  159    QA   GLY  16           QA       GLY  16   9.290   2.066   7.918
  160    H    GLU  17           H        GLU  17   6.618   1.412   9.177
  161    HA   GLU  17           HA       GLU  17   4.839   1.674   7.015
  162   1HB   GLU  17          2HB       GLU  17   4.485   1.904  10.014
  163   2HB   GLU  17          1HB       GLU  17   3.129   1.777   8.901
  164   1HG   GLU  17          2HG       GLU  17   3.806  -0.388   8.165
  165   2HG   GLU  17          1HG       GLU  17   5.390  -0.227   8.925
  166    QB   GLU  17           QB       GLU  17   3.807   1.841   9.458
  167    QG   GLU  17           QG       GLU  17   4.598  -0.308   8.545
  168    H    ILE  18           H        ILE  18   3.546   3.377   6.248
  169    HA   ILE  18           HA       ILE  18   4.170   6.091   7.357
  170    HB   ILE  18           HB       ILE  18   3.246   5.221   4.599
  171   1HG1  ILE  18          2HG1      ILE  18   5.776   6.189   4.293
  172   2HG1  ILE  18          1HG1      ILE  18   5.906   5.440   5.885
  173   1HG2  ILE  18          3HG2      ILE  18   4.020   7.865   5.825
  174   2HG2  ILE  18          2HG2      ILE  18   4.201   7.587   4.093
  175   3HG2  ILE  18          1HG2      ILE  18   2.608   7.476   4.842
  176   1HD1  ILE  18          3HD1      ILE  18   4.815   4.059   3.415
  177   2HD1  ILE  18          2HD1      ILE  18   6.451   3.852   4.041
  178   3HD1  ILE  18          1HD1      ILE  18   5.067   3.324   4.998
  179    MG   ILE  18           QG2      ILE  18   3.610   7.642   4.920
  180    MD   ILE  18           QD1      ILE  18   5.444   3.745   4.151
  181    QG   ILE  18           QG1      ILE  18   5.841   5.814   5.089
  182    HA   PRO  19           HA       PRO  19  -0.160   6.092   8.434
  183   1HB   PRO  19          2HB       PRO  19  -0.337   8.704   9.222
  184   2HB   PRO  19          1HB       PRO  19   0.402   7.442  10.226
  185   1HG   PRO  19          2HG       PRO  19   1.699   9.504   8.522
  186   2HG   PRO  19          1HG       PRO  19   2.190   8.873  10.101
  187   1HD   PRO  19          2HD       PRO  19   3.332   8.110   7.738
  188   2HD   PRO  19          1HD       PRO  19   3.284   7.086   9.190
  189    QB   PRO  19           QB       PRO  19   0.033   8.073   9.724
  190    QG   PRO  19           QG       PRO  19   1.944   9.189   9.312
  191    QD   PRO  19           QD       PRO  19   3.308   7.598   8.464
  192    H    ALA  20           H        ALA  20  -2.067   6.712   7.354
  193    HA   ALA  20           HA       ALA  20  -1.696   8.465   4.948
  194   1HB   ALA  20          3HB       ALA  20  -2.819   5.843   5.431
  195   2HB   ALA  20          2HB       ALA  20  -4.052   6.909   4.760
  196   3HB   ALA  20          1HB       ALA  20  -2.540   6.653   3.890
  197    MB   ALA  20           QB       ALA  20  -3.137   6.469   4.693
  198    HA   PRO  21           HA       PRO  21  -4.636  10.560   7.889
  199   1HB   PRO  21          2HB       PRO  21  -3.507  13.046   7.691
  200   2HB   PRO  21          1HB       PRO  21  -2.968  11.832   8.867
  201   1HG   PRO  21          2HG       PRO  21  -1.769  12.595   6.250
  202   2HG   PRO  21          1HG       PRO  21  -0.976  12.193   7.782
  203   1HD   PRO  21          2HD       PRO  21  -1.175  10.450   5.701
  204   2HD   PRO  21          1HD       PRO  21  -1.090   9.937   7.400
  205    QB   PRO  21           QB       PRO  21  -3.238  12.439   8.279
  206    QG   PRO  21           QG       PRO  21  -1.372  12.394   7.016
  207    QD   PRO  21           QD       PRO  21  -1.133  10.194   6.551
  208    H    LEU  22           H        LEU  22  -5.605   9.898   5.521
  209    HA   LEU  22           HA       LEU  22  -6.141  12.440   4.022
  210   1HB   LEU  22          2HB       LEU  22  -5.568   9.651   3.321
  211   2HB   LEU  22          1HB       LEU  22  -6.978  10.290   2.476
  212    HG   LEU  22           HG       LEU  22  -4.909  10.724   1.199
  213   1HD1  LEU  22          1HD1      LEU  22  -6.938  12.471   1.683
  214   2HD1  LEU  22          3HD1      LEU  22  -5.557  13.439   2.199
  215   3HD1  LEU  22          2HD1      LEU  22  -5.620  12.799   0.556
  216   1HD2  LEU  22          3HD2      LEU  22  -3.742  11.070   3.650
  217   2HD2  LEU  22          2HD2      LEU  22  -3.026  11.605   2.130
  218   3HD2  LEU  22          1HD2      LEU  22  -3.935  12.741   3.125
  219    MD1  LEU  22           QD1      LEU  22  -6.038  12.903   1.480
  220    MD2  LEU  22           QD2      LEU  22  -3.568  11.805   2.968
  221    QB   LEU  22           QB       LEU  22  -6.273   9.970   2.899
  222    QD   LEU  22           QQD      LEU  22  -4.803  12.354   2.224
  223    H    ALA  23           H        ALA  23  -7.559  10.081   6.082
  224    HA   ALA  23           HA       ALA  23  -9.794   9.720   6.754
  225   1HB   ALA  23          3HB       ALA  23  -9.284  12.354   6.738
  226   2HB   ALA  23          2HB       ALA  23 -10.536  12.327   5.496
  227   3HB   ALA  23          1HB       ALA  23 -10.889  11.727   7.116
  228    MB   ALA  23           QB       ALA  23 -10.236  12.136   6.450
  229    H    GLY  24           H        GLY  24 -12.205  10.120   5.699
  230   1HA   GLY  24          1HA       GLY  24 -12.014   9.274   2.834
  231   2HA   GLY  24          2HA       GLY  24 -13.397  10.138   3.507
  232    QA   GLY  24           QA       GLY  24 -12.705   9.706   3.170
  233    H    THR  25           H        THR  25 -13.701   7.669   2.164
  234    HA   THR  25           HA       THR  25 -14.274   5.766   4.411
  235    HB   THR  25           HB       THR  25 -16.392   5.291   3.008
  236    HG1  THR  25           HG1      THR  25 -15.859   7.887   2.043
  237   1HG2  THR  25          1HG2      THR  25 -15.887   7.011   5.095
  238   2HG2  THR  25          3HG2      THR  25 -16.668   8.071   3.922
  239   3HG2  THR  25          2HG2      THR  25 -17.493   6.615   4.480
  240    MG   THR  25           QG2      THR  25 -16.683   7.232   4.499
  241    H    VAL  26           H        VAL  26 -12.652   4.241   3.892
  242    HA   VAL  26           HA       VAL  26 -11.760   3.502   1.309
  243    HB   VAL  26           HB       VAL  26 -11.047   1.411   2.449
  244   1HG1  VAL  26          3HG1      VAL  26 -12.834   2.444   4.667
  245   2HG1  VAL  26          2HG1      VAL  26 -13.078   0.975   3.720
  246   3HG1  VAL  26          1HG1      VAL  26 -11.711   1.094   4.828
  247   1HG2  VAL  26          3HG2      VAL  26 -10.773   3.964   4.058
  248   2HG2  VAL  26          2HG2      VAL  26  -9.844   2.500   4.378
  249   3HG2  VAL  26          1HG2      VAL  26  -9.659   3.343   2.840
  250    MG1  VAL  26           QG1      VAL  26 -12.541   1.505   4.405
  251    MG2  VAL  26           QG2      VAL  26 -10.092   3.269   3.759
  252    QG   VAL  26           QQG      VAL  26 -11.317   2.387   4.082
  253    H    SER  27           H        SER  27 -12.631   2.174  -0.284
  254    HA   SER  27           HA       SER  27 -15.337   1.019   0.266
  255   1HB   SER  27          2HB       SER  27 -14.481   2.737  -1.664
  256   2HB   SER  27          1HB       SER  27 -14.242   1.198  -2.489
  257    HG   SER  27           HG       SER  27 -16.402   0.708  -2.105
  258    QB   SER  27           QB       SER  27 -14.361   1.967  -2.076
  259    H    LYS  28           H        LYS  28 -12.046   0.225  -0.578
  260    HA   LYS  28           HA       LYS  28 -12.406  -2.588  -0.103
  261   1HB   LYS  28          2HB       LYS  28 -13.136  -1.548  -2.696
  262   2HB   LYS  28          1HB       LYS  28 -11.759  -2.637  -2.868
  263   1HG   LYS  28          2HG       LYS  28 -12.928  -4.467  -2.012
  264   2HG   LYS  28          1HG       LYS  28 -14.085  -3.452  -1.150
  265   1HD   LYS  28          2HD       LYS  28 -15.186  -4.444  -3.087
  266   2HD   LYS  28          1HD       LYS  28 -15.009  -2.707  -3.348
  267   1HE   LYS  28          2HE       LYS  28 -12.631  -3.738  -4.362
  268   2HE   LYS  28          1HE       LYS  28 -13.849  -4.925  -4.868
  269   1HZ   LYS  28          1HZ       LYS  28 -15.261  -2.946  -5.485
  270   2HZ   LYS  28          3HZ       LYS  28 -13.867  -1.996  -5.315
  271   3HZ   LYS  28          2HZ       LYS  28 -13.915  -3.229  -6.482
  272    QB   LYS  28           QB       LYS  28 -12.447  -2.092  -2.782
  273    QD   LYS  28           QD       LYS  28 -15.097  -3.576  -3.218
  274    QG   LYS  28           QG       LYS  28 -13.506  -3.960  -1.581
  275    QE   LYS  28           QE       LYS  28 -13.240  -4.332  -4.615
  276    QZ   LYS  28           QZ       LYS  28 -14.348  -2.723  -5.761
  277    H    ILE  29           H        ILE  29 -10.359  -3.806  -0.698
  278    HA   ILE  29           HA       ILE  29  -8.018  -1.930  -0.750
  279    HB   ILE  29           HB       ILE  29  -8.336  -3.188   1.339
  280   1HG1  ILE  29          2HG1      ILE  29  -6.135  -4.804   0.692
  281   2HG1  ILE  29          1HG1      ILE  29  -6.024  -3.432  -0.411
  282   1HG2  ILE  29          3HG2      ILE  29  -9.036  -5.282  -0.522
  283   2HG2  ILE  29          2HG2      ILE  29  -7.748  -5.838   0.546
  284   3HG2  ILE  29          1HG2      ILE  29  -9.260  -5.238   1.227
  285   1HD1  ILE  29          2HD1      ILE  29  -6.466  -1.966   1.670
  286   2HD1  ILE  29          1HD1      ILE  29  -6.077  -3.410   2.607
  287   3HD1  ILE  29          3HD1      ILE  29  -4.872  -2.707   1.526
  288    MG   ILE  29           QG2      ILE  29  -8.681  -5.453   0.417
  289    MD   ILE  29           QD1      ILE  29  -5.805  -2.694   1.934
  290    QG   ILE  29           QG1      ILE  29  -6.079  -4.118   0.140
  291    H    LEU  30           H        LEU  30  -6.308  -2.424  -2.181
  292    HA   LEU  30           HA       LEU  30  -6.880  -4.612  -4.154
  293   1HB   LEU  30          2HB       LEU  30  -6.077  -1.766  -4.336
  294   2HB   LEU  30          1HB       LEU  30  -5.224  -2.852  -5.432
  295    HG   LEU  30           HG       LEU  30  -7.275  -1.965  -6.482
  296   1HD1  LEU  30          1HD1      LEU  30  -8.400  -1.925  -4.083
  297   2HD1  LEU  30          3HD1      LEU  30  -9.386  -2.142  -5.530
  298   3HD1  LEU  30          2HD1      LEU  30  -8.939  -3.539  -4.549
  299   1HD2  LEU  30          1HD2      LEU  30  -6.562  -4.718  -6.166
  300   2HD2  LEU  30          3HD2      LEU  30  -8.322  -4.612  -6.230
  301   3HD2  LEU  30          2HD2      LEU  30  -7.349  -3.948  -7.543
  302    MD1  LEU  30           QD1      LEU  30  -8.908  -2.535  -4.721
  303    MD2  LEU  30           QD2      LEU  30  -7.411  -4.426  -6.646
  304    QB   LEU  30           QB       LEU  30  -5.651  -2.309  -4.884
  305    QD   LEU  30           QQD      LEU  30  -8.160  -3.481  -5.684
  306    H    VAL  31           H        VAL  31  -4.632  -3.380  -1.838
  307    HA   VAL  31           HA       VAL  31  -2.422  -5.031  -2.984
  308    HB   VAL  31           HB       VAL  31  -2.078  -2.603  -2.483
  309   1HG1  VAL  31          2HG1      VAL  31  -2.608  -3.522   0.360
  310   2HG1  VAL  31          1HG1      VAL  31  -1.930  -1.953  -0.071
  311   3HG1  VAL  31          3HG1      VAL  31  -3.570  -2.370  -0.567
  312   1HG2  VAL  31          1HG2      VAL  31  -0.231  -4.324  -2.358
  313   2HG2  VAL  31          3HG2      VAL  31   0.043  -2.889  -1.370
  314   3HG2  VAL  31          2HG2      VAL  31  -0.497  -4.389  -0.616
  315    MG1  VAL  31           QG1      VAL  31  -2.703  -2.615  -0.093
  316    MG2  VAL  31           QG2      VAL  31  -0.228  -3.867  -1.448
  317    QG   VAL  31           QQG      VAL  31  -1.466  -3.241  -0.771
  318    H    LYS  32           H        LYS  32  -1.622  -6.785  -1.826
  319    HA   LYS  32           HA       LYS  32  -2.998  -7.424   0.765
  320   1HB   LYS  32          2HB       LYS  32  -3.047  -8.779  -1.610
  321   2HB   LYS  32          1HB       LYS  32  -1.685  -9.563  -0.808
  322   1HG   LYS  32          2HG       LYS  32  -3.582  -9.358   1.210
  323   2HG   LYS  32          1HG       LYS  32  -4.544  -9.748  -0.216
  324   1HD   LYS  32          2HD       LYS  32  -2.433 -11.454  -0.530
  325   2HD   LYS  32          1HD       LYS  32  -2.568 -11.399   1.229
  326   1HE   LYS  32          2HE       LYS  32  -5.173 -11.627  -0.125
  327   2HE   LYS  32          1HE       LYS  32  -4.102 -13.017  -0.394
  328   1HZ   LYS  32          2HZ       LYS  32  -4.550 -11.785   2.270
  329   2HZ   LYS  32          1HZ       LYS  32  -5.425 -13.128   1.708
  330   3HZ   LYS  32          3HZ       LYS  32  -3.747 -13.244   1.929
  331    QB   LYS  32           QB       LYS  32  -2.366  -9.171  -1.209
  332    QD   LYS  32           QD       LYS  32  -2.500 -11.427   0.349
  333    QG   LYS  32           QG       LYS  32  -4.063  -9.553   0.497
  334    QE   LYS  32           QE       LYS  32  -4.638 -12.322  -0.260
  335    QZ   LYS  32           QZ       LYS  32  -4.574 -12.719   1.969
  336    H    GLU  33           H        GLU  33  -1.495  -9.137   2.001
  337    HA   GLU  33           HA       GLU  33   1.073  -7.766   2.451
  338   1HB   GLU  33          2HB       GLU  33   1.162  -9.302   4.379
  339   2HB   GLU  33          1HB       GLU  33  -0.420  -8.529   4.282
  340   1HG   GLU  33          2HG       GLU  33  -1.381 -10.560   4.199
  341   2HG   GLU  33          1HG       GLU  33  -0.541 -10.877   2.682
  342    QB   GLU  33           QB       GLU  33   0.371  -8.915   4.330
  343    QG   GLU  33           QG       GLU  33  -0.961 -10.719   3.441
  344    H    GLY  34           H        GLY  34   3.107  -8.672   2.019
  345   1HA   GLY  34          1HA       GLY  34   3.369 -11.437   1.103
  346   2HA   GLY  34          2HA       GLY  34   4.676 -10.261   1.233
  347    QA   GLY  34           QA       GLY  34   4.022 -10.849   1.168
  348    H    ASP  35           H        ASP  35   2.887  -8.333  -0.364
  349    HA   ASP  35           HA       ASP  35   3.316  -9.587  -3.058
  350   1HB   ASP  35          2HB       ASP  35   1.006  -8.620  -1.845
  351   2HB   ASP  35          1HB       ASP  35   1.505  -7.289  -2.890
  352    QB   ASP  35           QB       ASP  35   1.255  -7.954  -2.368
  353    H    THR  36           H        THR  36   4.037  -8.072  -4.751
  354    HA   THR  36           HA       THR  36   5.725  -5.877  -3.631
  355    HB   THR  36           HB       THR  36   5.747  -7.363  -6.279
  356    HG1  THR  36           HG1      THR  36   7.101  -8.664  -5.332
  357   1HG2  THR  36          3HG2      THR  36   6.647  -4.944  -6.185
  358   2HG2  THR  36          2HG2      THR  36   7.932  -5.605  -5.174
  359   3HG2  THR  36          1HG2      THR  36   7.721  -6.187  -6.824
  360    MG   THR  36           QG2      THR  36   7.434  -5.579  -6.061
  361    H    VAL  37           H        VAL  37   5.289  -3.762  -4.175
  362    HA   VAL  37           HA       VAL  37   3.181  -3.268  -6.256
  363    HB   VAL  37           HB       VAL  37   2.580  -1.324  -4.804
  364   1HG1  VAL  37          2HG1      VAL  37   1.738  -3.807  -4.529
  365   2HG1  VAL  37          1HG1      VAL  37   2.649  -3.739  -3.019
  366   3HG1  VAL  37          3HG1      VAL  37   1.330  -2.603  -3.306
  367   1HG2  VAL  37          1HG2      VAL  37   4.906  -1.124  -3.830
  368   2HG2  VAL  37          3HG2      VAL  37   3.609  -1.053  -2.638
  369   3HG2  VAL  37          2HG2      VAL  37   4.543  -2.537  -2.838
  370    MG1  VAL  37           QG1      VAL  37   1.906  -3.383  -3.618
  371    MG2  VAL  37           QG2      VAL  37   4.352  -1.571  -3.102
  372    QG   VAL  37           QQG      VAL  37   3.129  -2.477  -3.360
  373    H    LYS  38           H        LYS  38   3.366  -0.857  -7.023
  374    HA   LYS  38           HA       LYS  38   6.226   0.003  -7.192
  375   1HB   LYS  38          2HB       LYS  38   5.340  -1.469  -9.127
  376   2HB   LYS  38          1HB       LYS  38   4.358  -0.070  -9.565
  377   1HG   LYS  38          2HG       LYS  38   6.168   1.167 -10.238
  378   2HG   LYS  38          1HG       LYS  38   7.239   0.444  -9.036
  379   1HD   LYS  38          2HD       LYS  38   8.092  -0.645 -10.855
  380   2HD   LYS  38          1HD       LYS  38   6.729  -1.728 -10.576
  381   1HE   LYS  38          2HE       LYS  38   5.907   0.591 -12.135
  382   2HE   LYS  38          1HE       LYS  38   7.222  -0.297 -12.932
  383   1HZ   LYS  38          1HZ       LYS  38   6.011  -2.363 -12.498
  384   2HZ   LYS  38          3HZ       LYS  38   4.728  -1.479 -11.828
  385   3HZ   LYS  38          2HZ       LYS  38   5.107  -1.307 -13.476
  386    QB   LYS  38           QB       LYS  38   4.849  -0.769  -9.346
  387    QD   LYS  38           QD       LYS  38   7.411  -1.187 -10.716
  388    QG   LYS  38           QG       LYS  38   6.704   0.806  -9.637
  389    QE   LYS  38           QE       LYS  38   6.565   0.147 -12.533
  390    QZ   LYS  38           QZ       LYS  38   5.282  -1.717 -12.601
  391    H    ALA  39           H        ALA  39   6.466   2.276  -7.409
  392    HA   ALA  39           HA       ALA  39   4.445   3.972  -6.355
  393   1HB   ALA  39          1HB       ALA  39   7.110   4.115  -6.996
  394   2HB   ALA  39          3HB       ALA  39   6.402   5.170  -8.219
  395   3HB   ALA  39          2HB       ALA  39   6.135   5.501  -6.507
  396    MB   ALA  39           QB       ALA  39   6.549   4.929  -7.241
  397    H    GLY  40           H        GLY  40   2.451   4.017  -7.421
  398   1HA   GLY  40          1HA       GLY  40   2.509   4.681 -10.338
  399   2HA   GLY  40          2HA       GLY  40   1.418   5.501  -9.221
  400    QA   GLY  40           QA       GLY  40   1.963   5.091  -9.779
  401    H    GLN  41           H        GLN  41   1.751   2.261  -8.314
  402    HA   GLN  41           HA       GLN  41  -0.393   1.271 -10.111
  403   1HB   GLN  41          2HB       GLN  41   1.874   0.226  -8.774
  404   2HB   GLN  41          1HB       GLN  41   0.470  -0.542  -8.031
  405   1HG   GLN  41          2HG       GLN  41  -0.355  -1.232 -10.229
  406   2HG   GLN  41          1HG       GLN  41   0.985  -0.398 -11.016
  407   1HE2  GLN  41          1HE2      GLN  41   0.742  -2.682  -8.219
  408   2HE2  GLN  41          2HE2      GLN  41   1.969  -3.715  -8.776
  409    QB   GLN  41           QB       GLN  41   1.172  -0.158  -8.403
  410    QG   GLN  41           QG       GLN  41   0.315  -0.815 -10.622
  411    QE   GLN  41           QE2      GLN  41   1.356  -3.198  -8.497
  412    H    THR  42           H        THR  42  -2.503   1.481  -9.459
  413    HA   THR  42           HA       THR  42  -3.432   2.538  -7.029
  414    HB   THR  42           HB       THR  42  -4.946   0.384  -8.481
  415    HG1  THR  42           HG1      THR  42  -4.949   1.479 -10.286
  416   1HG2  THR  42          3HG2      THR  42  -5.858   1.870  -6.594
  417   2HG2  THR  42          2HG2      THR  42  -5.788   3.191  -7.759
  418   3HG2  THR  42          1HG2      THR  42  -6.812   1.791  -8.074
  419    MG   THR  42           QG2      THR  42  -6.153   2.284  -7.476
  420    H    VAL  43           H        VAL  43  -3.524   1.713  -4.968
  421    HA   VAL  43           HA       VAL  43  -3.230  -1.254  -4.636
  422    HB   VAL  43           HB       VAL  43  -1.937  -0.630  -2.569
  423   1HG1  VAL  43          3HG1      VAL  43  -1.113  -0.736  -5.192
  424   2HG1  VAL  43          2HG1      VAL  43  -0.482   0.827  -4.674
  425   3HG1  VAL  43          1HG1      VAL  43  -0.030  -0.639  -3.804
  426   1HG2  VAL  43          3HG2      VAL  43  -3.098   1.756  -2.692
  427   2HG2  VAL  43          2HG2      VAL  43  -1.480   1.575  -2.014
  428   3HG2  VAL  43          1HG2      VAL  43  -1.683   2.142  -3.672
  429    MG1  VAL  43           QG1      VAL  43  -0.542  -0.182  -4.557
  430    MG2  VAL  43           QG2      VAL  43  -2.087   1.824  -2.793
  431    QG   VAL  43           QQG      VAL  43  -1.314   0.821  -3.675
  432    H    LEU  44           H        LEU  44  -4.884   1.684  -3.598
  433    HA   LEU  44           HA       LEU  44  -6.695  -0.050  -1.960
  434   1HB   LEU  44          2HB       LEU  44  -4.982   2.247  -1.154
  435   2HB   LEU  44          1HB       LEU  44  -6.597   2.180  -0.445
  436    HG   LEU  44           HG       LEU  44  -5.582  -0.458  -0.343
  437   1HD1  LEU  44          1HD1      LEU  44  -3.346   0.697  -0.694
  438   2HD1  LEU  44          3HD1      LEU  44  -3.612   1.509   0.849
  439   3HD1  LEU  44          2HD1      LEU  44  -3.474  -0.249   0.789
  440   1HD2  LEU  44          1HD2      LEU  44  -6.167   1.741   1.621
  441   2HD2  LEU  44          3HD2      LEU  44  -7.031   0.227   1.361
  442   3HD2  LEU  44          2HD2      LEU  44  -5.473   0.222   2.187
  443    MD1  LEU  44           QD1      LEU  44  -3.478   0.652   0.314
  444    MD2  LEU  44           QD2      LEU  44  -6.224   0.730   1.723
  445    QB   LEU  44           QB       LEU  44  -5.789   2.213  -0.799
  446    QD   LEU  44           QQD      LEU  44  -4.851   0.691   1.019
  447    H    VAL  45           H        VAL  45  -8.764   1.139  -1.416
  448    HA   VAL  45           HA       VAL  45  -9.498   3.098  -3.572
  449    HB   VAL  45           HB       VAL  45 -11.045   0.799  -2.330
  450   1HG1  VAL  45          1HG1      VAL  45  -9.218   0.857  -4.445
  451   2HG1  VAL  45          3HG1      VAL  45 -10.400  -0.412  -4.124
  452   3HG1  VAL  45          2HG1      VAL  45 -10.795   0.900  -5.233
  453   1HG2  VAL  45          2HG2      VAL  45 -11.867   3.002  -4.229
  454   2HG2  VAL  45          1HG2      VAL  45 -12.733   1.468  -4.152
  455   3HG2  VAL  45          3HG2      VAL  45 -12.653   2.507  -2.730
  456    MG1  VAL  45           QG1      VAL  45 -10.137   0.448  -4.600
  457    MG2  VAL  45           QG2      VAL  45 -12.418   2.326  -3.704
  458    QG   VAL  45           QQG      VAL  45 -11.278   1.387  -4.152
  459    H    LEU  46           H        LEU  46 -10.037   5.044  -2.668
  460    HA   LEU  46           HA       LEU  46 -11.655   5.089  -0.179
  461   1HB   LEU  46          2HB       LEU  46  -9.244   5.017   0.456
  462   2HB   LEU  46          1HB       LEU  46  -8.974   6.479  -0.494
  463    HG   LEU  46           HG       LEU  46 -11.180   6.605   1.490
  464   1HD1  LEU  46          1HD1      LEU  46  -9.209   5.349   2.578
  465   2HD1  LEU  46          3HD1      LEU  46  -8.315   6.861   2.416
  466   3HD1  LEU  46          2HD1      LEU  46  -9.779   6.803   3.399
  467   1HD2  LEU  46          2HD2      LEU  46  -9.793   8.380  -0.118
  468   2HD2  LEU  46          1HD2      LEU  46 -10.801   8.829   1.259
  469   3HD2  LEU  46          3HD2      LEU  46  -9.060   8.636   1.465
  470    MD1  LEU  46           QD1      LEU  46  -9.101   6.338   2.798
  471    MD2  LEU  46           QD2      LEU  46  -9.884   8.615   0.869
  472    QB   LEU  46           QB       LEU  46  -9.109   5.748  -0.019
  473    QD   LEU  46           QQD      LEU  46  -9.493   7.476   1.833
  474    H    GLU  47           H        GLU  47 -13.000   6.896  -0.121
  475    HA   GLU  47           HA       GLU  47 -12.649   8.911  -2.318
  476   1HB   GLU  47          2HB       GLU  47 -15.145   9.013  -2.249
  477   2HB   GLU  47          1HB       GLU  47 -14.556   7.394  -2.627
  478   1HG   GLU  47          2HG       GLU  47 -15.106   6.555  -0.523
  479   2HG   GLU  47          1HG       GLU  47 -15.055   8.146   0.236
  480    QB   GLU  47           QB       GLU  47 -14.850   8.204  -2.438
  481    QG   GLU  47           QG       GLU  47 -15.080   7.350  -0.143
  482    H    ALA  48           H        ALA  48 -13.249  11.117  -1.756
  483    HA   ALA  48           HA       ALA  48 -14.064  11.813   0.957
  484   1HB   ALA  48          1HB       ALA  48 -11.685  13.075   1.097
  485   2HB   ALA  48          3HB       ALA  48 -11.917  11.437   1.709
  486   3HB   ALA  48          2HB       ALA  48 -11.207  11.691   0.114
  487    MB   ALA  48           QB       ALA  48 -11.603  12.068   0.973
  488    H    MET  49           H        MET  49 -15.537  12.850  -0.770
  489    HA   MET  49           HA       MET  49 -16.238  14.768  -1.967
  490   1HB   MET  49          2HB       MET  49 -14.929  15.416   0.450
  491   2HB   MET  49          1HB       MET  49 -14.340  16.579  -0.739
  492   1HG   MET  49          2HG       MET  49 -16.263  17.692  -0.211
  493   2HG   MET  49          1HG       MET  49 -16.986  16.562  -1.354
  494   1HE   MET  49          2HE       MET  49 -18.475  15.298  -1.161
  495   2HE   MET  49          1HE       MET  49 -18.347  13.942  -0.045
  496   3HE   MET  49          3HE       MET  49 -19.610  15.160   0.180
  497    QB   MET  49           QB       MET  49 -14.634  15.998  -0.145
  498    QG   MET  49           QG       MET  49 -16.625  17.127  -0.782
  499    ME   MET  49           QE       MET  49 -18.811  14.800  -0.342
  500    H    LYS  50           H        LYS  50 -13.817  13.203  -2.969
  501    HA   LYS  50           HA       LYS  50 -13.024  15.132  -5.040
  502   1HB   LYS  50          2HB       LYS  50 -11.603  15.202  -2.741
  503   2HB   LYS  50          1HB       LYS  50 -10.736  13.912  -3.575
  504   1HG   LYS  50          2HG       LYS  50 -10.584  15.445  -5.585
  505   2HG   LYS  50          1HG       LYS  50 -11.213  16.736  -4.559
  506   1HD   LYS  50          2HD       LYS  50  -9.238  16.993  -3.478
  507   2HD   LYS  50          1HD       LYS  50  -8.989  15.252  -3.340
  508   1HE   LYS  50          2HE       LYS  50  -8.216  15.152  -5.676
  509   2HE   LYS  50          1HE       LYS  50  -8.499  16.896  -5.850
  510   1HZ   LYS  50          2HZ       LYS  50  -7.025  17.232  -3.910
  511   2HZ   LYS  50          1HZ       LYS  50  -6.651  15.574  -3.936
  512   3HZ   LYS  50          3HZ       LYS  50  -6.217  16.562  -5.246
  513    QB   LYS  50           QB       LYS  50 -11.170  14.557  -3.158
  514    QD   LYS  50           QD       LYS  50  -9.113  16.122  -3.409
  515    QG   LYS  50           QG       LYS  50 -10.898  16.091  -5.072
  516    QE   LYS  50           QE       LYS  50  -8.358  16.024  -5.763
  517    QZ   LYS  50           QZ       LYS  50  -6.631  16.456  -4.364
  518    H    MET  51           H        MET  51 -14.295  12.417  -4.770
  519    HA   MET  51           HA       MET  51 -14.231  10.346  -5.893
  520   1HB   MET  51          2HB       MET  51 -12.585  12.270  -7.483
  521   2HB   MET  51          1HB       MET  51 -12.515  10.568  -7.940
  522   1HG   MET  51          2HG       MET  51 -15.175  10.805  -7.666
  523   2HG   MET  51          1HG       MET  51 -14.799  12.477  -8.080
  524   1HE   MET  51          2HE       MET  51 -15.819  12.825  -9.858
  525   2HE   MET  51          1HE       MET  51 -15.355  12.391 -11.502
  526   3HE   MET  51          3HE       MET  51 -16.525  11.401 -10.619
  527    QB   MET  51           QB       MET  51 -12.550  11.419  -7.712
  528    QG   MET  51           QG       MET  51 -14.987  11.641  -7.873
  529    ME   MET  51           QE       MET  51 -15.900  12.206 -10.660
  530    H    GLU  52           H        GLU  52 -10.844  11.065  -6.629
  531    HA   GLU  52           HA       GLU  52  -8.848  10.026  -5.924
  532   1HB   GLU  52          2HB       GLU  52 -10.530  10.443  -3.645
  533   2HB   GLU  52          1HB       GLU  52  -9.718   8.889  -3.446
  534   1HG   GLU  52          2HG       GLU  52  -7.590  10.216  -4.228
  535   2HG   GLU  52          1HG       GLU  52  -8.516  11.628  -3.722
  536    QB   GLU  52           QB       GLU  52 -10.124   9.666  -3.545
  537    QG   GLU  52           QG       GLU  52  -8.053  10.922  -3.975
  538    H    THR  53           H        THR  53 -11.123   7.833  -4.286
  539    HA   THR  53           HA       THR  53 -11.307   5.489  -4.422
  540    HB   THR  53           HB       THR  53 -11.806   4.823  -6.830
  541    HG1  THR  53           HG1      THR  53 -11.776   6.462  -8.335
  542   1HG2  THR  53          1HG2      THR  53 -13.327   6.102  -5.040
  543   2HG2  THR  53          3HG2      THR  53 -13.276   7.356  -6.278
  544   3HG2  THR  53          2HG2      THR  53 -13.903   5.756  -6.671
  545    MG   THR  53           QG2      THR  53 -13.502   6.405  -5.996
  546    H    GLU  54           H        GLU  54  -9.637   5.470  -7.518
  547    HA   GLU  54           HA       GLU  54  -7.854   3.407  -6.873
  548   1HB   GLU  54          2HB       GLU  54  -8.026   5.615  -8.870
  549   2HB   GLU  54          1HB       GLU  54  -6.491   4.751  -8.762
  550   1HG   GLU  54          2HG       GLU  54  -7.386   3.103 -10.004
  551   2HG   GLU  54          1HG       GLU  54  -8.508   2.773  -8.682
  552    QB   GLU  54           QB       GLU  54  -7.258   5.183  -8.816
  553    QG   GLU  54           QG       GLU  54  -7.947   2.938  -9.343
  554    H    ILE  55           H        ILE  55  -6.592   3.547  -5.003
  555    HA   ILE  55           HA       ILE  55  -5.093   6.051  -4.435
  556    HB   ILE  55           HB       ILE  55  -5.501   3.425  -2.960
  557   1HG1  ILE  55          2HG1      ILE  55  -7.472   4.862  -2.964
  558   2HG1  ILE  55          1HG1      ILE  55  -6.736   4.906  -1.367
  559   1HG2  ILE  55          1HG2      ILE  55  -3.573   5.616  -2.543
  560   2HG2  ILE  55          3HG2      ILE  55  -4.522   5.206  -1.114
  561   3HG2  ILE  55          2HG2      ILE  55  -3.556   3.967  -1.916
  562   1HD1  ILE  55          1HD1      ILE  55  -5.426   6.949  -2.689
  563   2HD1  ILE  55          3HD1      ILE  55  -7.067   7.066  -3.324
  564   3HD1  ILE  55          2HD1      ILE  55  -6.786   7.159  -1.586
  565    MG   ILE  55           QG2      ILE  55  -3.883   4.929  -1.857
  566    MD   ILE  55           QD1      ILE  55  -6.426   7.058  -2.533
  567    QG   ILE  55           QG1      ILE  55  -7.104   4.884  -2.165
  568    H    ASN  56           H        ASN  56  -3.507   5.943  -6.152
  569    HA   ASN  56           HA       ASN  56  -1.954   3.781  -6.999
  570   1HB   ASN  56          2HB       ASN  56  -0.264   5.563  -7.505
  571   2HB   ASN  56          1HB       ASN  56  -1.900   6.017  -7.981
  572   1HD2  ASN  56          1HD2      ASN  56  -0.306   8.173  -7.623
  573   2HD2  ASN  56          2HD2      ASN  56  -0.593   8.938  -6.135
  574    QB   ASN  56           QB       ASN  56  -1.082   5.790  -7.743
  575    QD   ASN  56           QD2      ASN  56  -0.450   8.555  -6.879
  576    H    ALA  57           H        ALA  57  -0.018   2.811  -6.251
  577    HA   ALA  57           HA       ALA  57   0.380   2.507  -3.459
  578   1HB   ALA  57          2HB       ALA  57   1.546   1.681  -5.972
  579   2HB   ALA  57          3HB       ALA  57   1.583   0.850  -4.417
  580   3HB   ALA  57          1HB       ALA  57   2.826   2.038  -4.811
  581    MB   ALA  57           QB       ALA  57   1.985   1.523  -5.067
  582    HA   PRO  58           HA       PRO  58   2.628   6.151  -2.396
  583   1HB   PRO  58          2HB       PRO  58   4.075   5.227  -0.265
  584   2HB   PRO  58          1HB       PRO  58   2.333   5.555  -0.178
  585   1HG   PRO  58          2HG       PRO  58   3.759   2.962  -0.479
  586   2HG   PRO  58          1HG       PRO  58   2.302   3.349   0.450
  587   1HD   PRO  58          2HD       PRO  58   2.263   2.094  -1.976
  588   2HD   PRO  58          1HD       PRO  58   0.923   3.085  -1.355
  589    QB   PRO  58           QB       PRO  58   3.204   5.391  -0.221
  590    QG   PRO  58           QG       PRO  58   3.030   3.155  -0.015
  591    QD   PRO  58           QD       PRO  58   1.593   2.589  -1.666
  592    H    THR  59           H        THR  59   4.323   3.123  -2.960
  593    HA   THR  59           HA       THR  59   6.414   4.431  -4.491
  594    HB   THR  59           HB       THR  59   8.087   3.333  -2.628
  595    HG1  THR  59           HG1      THR  59   7.290   3.721  -0.622
  596   1HG2  THR  59          3HG2      THR  59   7.433   5.874  -3.591
  597   2HG2  THR  59          2HG2      THR  59   7.354   6.029  -1.836
  598   3HG2  THR  59          1HG2      THR  59   8.834   5.454  -2.605
  599    MG   THR  59           QG2      THR  59   7.873   5.786  -2.677
  600    H    ASP  60           H        ASP  60   8.359   2.561  -4.562
  601    HA   ASP  60           HA       ASP  60   6.893   0.090  -5.378
  602   1HB   ASP  60          2HB       ASP  60   8.206   1.307  -7.073
  603   2HB   ASP  60          1HB       ASP  60   9.643   1.186  -6.056
  604    QB   ASP  60           QB       ASP  60   8.924   1.246  -6.565
  605    H    GLY  61           H        GLY  61   7.520  -1.927  -4.548
  606   1HA   GLY  61          1HA       GLY  61   9.032  -1.861  -2.032
  607   2HA   GLY  61          2HA       GLY  61   9.798  -2.788  -3.322
  608    QA   GLY  61           QA       GLY  61   9.415  -2.325  -2.677
  609    H    LYS  62           H        LYS  62   8.770  -3.854  -0.822
  610    HA   LYS  62           HA       LYS  62   6.500  -5.541  -1.834
  611   1HB   LYS  62          2HB       LYS  62   8.913  -6.489  -1.803
  612   2HB   LYS  62          1HB       LYS  62   8.745  -6.493  -0.047
  613   1HG   LYS  62          2HG       LYS  62   6.794  -7.940  -0.190
  614   2HG   LYS  62          1HG       LYS  62   6.817  -7.853  -1.951
  615   1HD   LYS  62          2HD       LYS  62   8.873  -9.062  -2.080
  616   2HD   LYS  62          1HD       LYS  62   9.161  -8.894  -0.349
  617   1HE   LYS  62          2HE       LYS  62   8.221 -10.970  -0.194
  618   2HE   LYS  62          1HE       LYS  62   6.677 -10.126  -0.432
  619   1HZ   LYS  62          3HZ       LYS  62   8.441 -11.055  -2.637
  620   2HZ   LYS  62          2HZ       LYS  62   7.071 -11.898  -2.094
  621   3HZ   LYS  62          1HZ       LYS  62   6.902 -10.361  -2.795
  622    QB   LYS  62           QB       LYS  62   8.829  -6.491  -0.925
  623    QD   LYS  62           QD       LYS  62   9.017  -8.978  -1.215
  624    QG   LYS  62           QG       LYS  62   6.805  -7.897  -1.070
  625    QE   LYS  62           QE       LYS  62   7.449 -10.548  -0.313
  626    QZ   LYS  62           QZ       LYS  62   7.471 -11.105  -2.509
  627    H    VAL  63           H        VAL  63   4.909  -6.036  -0.268
  628    HA   VAL  63           HA       VAL  63   4.792  -4.307   2.073
  629    HB   VAL  63           HB       VAL  63   3.094  -6.522   0.897
  630   1HG1  VAL  63          1HG1      VAL  63   3.342  -4.077  -0.019
  631   2HG1  VAL  63          3HG1      VAL  63   1.733  -4.785   0.127
  632   3HG1  VAL  63          2HG1      VAL  63   2.316  -3.659   1.353
  633   1HG2  VAL  63          1HG2      VAL  63   2.761  -5.018   3.493
  634   2HG2  VAL  63          3HG2      VAL  63   1.355  -5.594   2.599
  635   3HG2  VAL  63          2HG2      VAL  63   2.557  -6.742   3.187
  636    MG1  VAL  63           QG1      VAL  63   2.463  -4.173   0.487
  637    MG2  VAL  63           QG2      VAL  63   2.224  -5.785   3.093
  638    QG   VAL  63           QQG      VAL  63   2.344  -4.979   1.790
  639    H    GLU  64           H        GLU  64   6.353  -4.871   3.613
  640    HA   GLU  64           HA       GLU  64   7.059  -7.581   4.300
  641   1HB   GLU  64          2HB       GLU  64   7.277  -4.950   5.805
  642   2HB   GLU  64          1HB       GLU  64   8.152  -6.426   6.217
  643   1HG   GLU  64          2HG       GLU  64   8.394  -5.588   3.393
  644   2HG   GLU  64          1HG       GLU  64   9.131  -4.488   4.558
  645    QB   GLU  64           QB       GLU  64   7.715  -5.688   6.011
  646    QG   GLU  64           QG       GLU  64   8.762  -5.038   3.976
  647    H    LYS  65           H        LYS  65   4.323  -5.608   5.054
  648    HA   LYS  65           HA       LYS  65   2.939  -7.654   6.484
  649   1HB   LYS  65          2HB       LYS  65   4.915  -6.176   7.975
  650   2HB   LYS  65          1HB       LYS  65   3.314  -5.816   8.621
  651   1HG   LYS  65          2HG       LYS  65   3.057  -8.478   8.330
  652   2HG   LYS  65          1HG       LYS  65   4.803  -8.394   8.576
  653   1HD   LYS  65          2HD       LYS  65   4.013  -8.559  10.771
  654   2HD   LYS  65          1HD       LYS  65   4.178  -6.815  10.572
  655   1HE   LYS  65          2HE       LYS  65   1.953  -6.516  10.880
  656   2HE   LYS  65          1HE       LYS  65   1.574  -7.721   9.633
  657   1HZ   LYS  65          1HZ       LYS  65   2.424  -8.338  12.415
  658   2HZ   LYS  65          3HZ       LYS  65   0.834  -8.450  11.835
  659   3HZ   LYS  65          2HZ       LYS  65   2.038  -9.476  11.214
  660    QB   LYS  65           QB       LYS  65   4.114  -5.996   8.298
  661    QD   LYS  65           QD       LYS  65   4.096  -7.687  10.672
  662    QG   LYS  65           QG       LYS  65   3.930  -8.436   8.453
  663    QE   LYS  65           QE       LYS  65   1.764  -7.118  10.257
  664    QZ   LYS  65           QZ       LYS  65   1.765  -8.755  11.821
  665    H    VAL  66           H        VAL  66   0.856  -6.835   7.348
  666    HA   VAL  66           HA       VAL  66   0.178  -4.068   6.410
  667    HB   VAL  66           HB       VAL  66  -1.350  -6.668   6.052
  668   1HG1  VAL  66          2HG1      VAL  66  -2.373  -4.076   6.318
  669   2HG1  VAL  66          1HG1      VAL  66  -2.315  -4.352   4.578
  670   3HG1  VAL  66          3HG1      VAL  66  -3.207  -5.463   5.616
  671   1HG2  VAL  66          1HG2      VAL  66   0.566  -6.359   4.516
  672   2HG2  VAL  66          3HG2      VAL  66  -0.970  -6.252   3.656
  673   3HG2  VAL  66          2HG2      VAL  66  -0.074  -4.784   4.045
  674    MG1  VAL  66           QG1      VAL  66  -2.632  -4.630   5.504
  675    MG2  VAL  66           QG2      VAL  66  -0.159  -5.798   4.073
  676    QG   VAL  66           QQG      VAL  66  -1.396  -5.214   4.788
  677    H    LEU  67           H        LEU  67  -0.835  -2.901   8.017
  678    HA   LEU  67           HA       LEU  67  -1.877  -4.424  10.374
  679   1HB   LEU  67          2HB       LEU  67  -1.311  -2.430  11.642
  680   2HB   LEU  67          1HB       LEU  67   0.070  -2.847  10.629
  681    HG   LEU  67           HG       LEU  67  -1.267  -1.215   8.930
  682   1HD1  LEU  67          1HD1      LEU  67   0.877  -0.819  10.959
  683   2HD1  LEU  67          3HD1      LEU  67   0.937  -0.626   9.207
  684   3HD1  LEU  67          2HD1      LEU  67   0.217   0.635  10.208
  685   1HD2  LEU  67          1HD2      LEU  67  -2.846  -0.903  11.065
  686   2HD2  LEU  67          3HD2      LEU  67  -1.608   0.277  11.497
  687   3HD2  LEU  67          2HD2      LEU  67  -2.490   0.441   9.981
  688    MD1  LEU  67           QD1      LEU  67   0.677  -0.270  10.124
  689    MD2  LEU  67           QD2      LEU  67  -2.314  -0.062  10.848
  690    QB   LEU  67           QB       LEU  67  -0.621  -2.639  11.135
  691    QD   LEU  67           QQD      LEU  67  -0.819  -0.166  10.486
  692    H    VAL  68           H        VAL  68  -2.710  -2.022   7.925
  693    HA   VAL  68           HA       VAL  68  -5.221  -1.235   9.206
  694    HB   VAL  68           HB       VAL  68  -5.543  -0.077   7.020
  695   1HG1  VAL  68          2HG1      VAL  68  -3.615  -2.095   6.207
  696   2HG1  VAL  68          1HG1      VAL  68  -4.634  -1.061   5.208
  697   3HG1  VAL  68          3HG1      VAL  68  -3.067  -0.478   5.768
  698   1HG2  VAL  68          3HG2      VAL  68  -4.076   0.847   8.859
  699   2HG2  VAL  68          2HG2      VAL  68  -2.689   0.174   8.004
  700   3HG2  VAL  68          1HG2      VAL  68  -3.671   1.427   7.244
  701    MG1  VAL  68           QG1      VAL  68  -3.772  -1.211   5.727
  702    MG2  VAL  68           QG2      VAL  68  -3.479   0.816   8.036
  703    QG   VAL  68           QQG      VAL  68  -3.625  -0.198   6.882
  704    H    LYS  69           H        LYS  69  -7.214  -1.420   7.490
  705    HA   LYS  69           HA       LYS  69  -7.357  -4.013   6.120
  706   1HB   LYS  69          2HB       LYS  69  -8.064  -3.664   8.913
  707   2HB   LYS  69          1HB       LYS  69  -9.474  -4.162   7.976
  708   1HG   LYS  69          2HG       LYS  69  -8.473  -6.162   7.282
  709   2HG   LYS  69          1HG       LYS  69  -6.841  -5.559   7.578
  710   1HD   LYS  69          2HD       LYS  69  -7.911  -5.389  10.083
  711   2HD   LYS  69          1HD       LYS  69  -8.756  -6.804   9.455
  712   1HE   LYS  69          2HE       LYS  69  -6.893  -8.063   9.715
  713   2HE   LYS  69          1HE       LYS  69  -5.962  -6.934   8.712
  714   1HZ   LYS  69          3HZ       LYS  69  -5.768  -5.458  10.624
  715   2HZ   LYS  69          2HZ       LYS  69  -6.626  -6.564  11.587
  716   3HZ   LYS  69          1HZ       LYS  69  -5.098  -6.977  10.971
  717    QB   LYS  69           QB       LYS  69  -8.769  -3.913   8.445
  718    QD   LYS  69           QD       LYS  69  -8.334  -6.097   9.769
  719    QG   LYS  69           QG       LYS  69  -7.657  -5.860   7.430
  720    QE   LYS  69           QE       LYS  69  -6.428  -7.498   9.214
  721    QZ   LYS  69           QZ       LYS  69  -5.831  -6.333  11.060
  722    H    GLU  70           H        GLU  70  -9.369  -4.215   4.916
  723    HA   GLU  70           HA       GLU  70 -10.409  -1.896   3.738
  724   1HB   GLU  70          2HB       GLU  70 -10.652  -4.554   3.389
  725   2HB   GLU  70          1HB       GLU  70 -12.217  -4.234   4.139
  726   1HG   GLU  70          2HG       GLU  70 -11.621  -2.213   2.152
  727   2HG   GLU  70          1HG       GLU  70 -11.522  -3.824   1.441
  728    QB   GLU  70           QB       GLU  70 -11.435  -4.394   3.764
  729    QG   GLU  70           QG       GLU  70 -11.571  -3.019   1.796
  730    H    ARG  71           H        ARG  71 -12.668  -1.027   3.942
  731    HA   ARG  71           HA       ARG  71 -14.514  -0.190   5.146
  732   1HB   ARG  71          2HB       ARG  71 -14.081  -2.704   6.180
  733   2HB   ARG  71          1HB       ARG  71 -13.990  -1.690   7.621
  734   1HG   ARG  71          2HG       ARG  71 -16.150  -0.620   6.947
  735   2HG   ARG  71          1HG       ARG  71 -16.257  -1.764   5.608
  736   1HD   ARG  71          2HD       ARG  71 -15.785  -3.445   7.742
  737   2HD   ARG  71          1HD       ARG  71 -16.809  -2.190   8.469
  738    HE   ARG  71           HE       ARG  71 -17.551  -3.731   6.011
  739   1HH1  ARG  71          1HH1      ARG  71 -19.574  -4.766   6.908
  740   2HH1  ARG  71          2HH1      ARG  71 -20.721  -3.643   7.557
  741   1HH2  ARG  71          1HH2      ARG  71 -18.478  -1.000   7.662
  742   2HH2  ARG  71          2HH2      ARG  71 -20.101  -1.512   7.983
  743    QB   ARG  71           QB       ARG  71 -14.036  -2.197   6.901
  744    QG   ARG  71           QG       ARG  71 -16.204  -1.192   6.278
  745    QD   ARG  71           QD       ARG  71 -16.297  -2.817   8.106
  746    QH1  ARG  71           QH1      ARG  71 -20.147  -4.204   7.232
  747    QH2  ARG  71           QH2      ARG  71 -19.290  -1.256   7.822
  748    H    ASP  72           H        ASP  72 -11.538  -0.572   7.146
  749    HA   ASP  72           HA       ASP  72 -12.027   1.435   9.051
  750   1HB   ASP  72          2HB       ASP  72 -10.031  -0.264   8.505
  751   2HB   ASP  72          1HB       ASP  72  -9.324   1.188   7.795
  752    QB   ASP  72           QB       ASP  72  -9.677   0.462   8.150
  753    H    ALA  73           H        ALA  73 -12.265   3.636   8.861
  754    HA   ALA  73           HA       ALA  73 -10.834   5.172   6.817
  755   1HB   ALA  73          1HB       ALA  73 -13.033   3.922   5.924
  756   2HB   ALA  73          3HB       ALA  73 -13.806   5.351   6.608
  757   3HB   ALA  73          2HB       ALA  73 -12.582   5.528   5.352
  758    MB   ALA  73           QB       ALA  73 -13.140   4.933   5.961
  759    H    VAL  74           H        VAL  74 -12.665   7.367   6.806
  760    HA   VAL  74           HA       VAL  74 -13.209   9.278   8.066
  761    HB   VAL  74           HB       VAL  74 -13.693   7.080  10.100
  762   1HG1  VAL  74          1HG1      VAL  74 -14.094  10.022  10.144
  763   2HG1  VAL  74          3HG1      VAL  74 -15.443   9.046  10.728
  764   3HG1  VAL  74          2HG1      VAL  74 -13.855   8.899  11.483
  765   1HG2  VAL  74          3HG2      VAL  74 -15.250   8.269   7.836
  766   2HG2  VAL  74          2HG2      VAL  74 -15.163   6.592   8.374
  767   3HG2  VAL  74          1HG2      VAL  74 -16.125   7.761   9.278
  768    MG1  VAL  74           QG1      VAL  74 -14.464   9.322  10.785
  769    MG2  VAL  74           QG2      VAL  74 -15.513   7.541   8.496
  770    QG   VAL  74           QQG      VAL  74 -14.988   8.431   9.641
  771    H    GLN  75           H        GLN  75 -11.568  10.632   8.611
  772    HA   GLN  75           HA       GLN  75  -9.655  11.483   9.706
  773   1HB   GLN  75          2HB       GLN  75 -10.938   9.739  11.832
  774   2HB   GLN  75          1HB       GLN  75  -9.691  10.943  12.159
  775   1HG   GLN  75          2HG       GLN  75 -11.199  12.659  11.066
  776   2HG   GLN  75          1HG       GLN  75 -12.464  11.429  11.047
  777   1HE2  GLN  75          1HE2      GLN  75 -13.828  12.461  12.632
  778   2HE2  GLN  75          2HE2      GLN  75 -13.364  12.630  14.257
  779    QB   GLN  75           QB       GLN  75 -10.315  10.341  11.995
  780    QG   GLN  75           QG       GLN  75 -11.831  12.044  11.056
  781    QE   GLN  75           QE2      GLN  75 -13.596  12.545  13.445
  782    H    GLY  76           H        GLY  76  -8.012  10.409   8.465
  783   1HA   GLY  76          1HA       GLY  76  -6.295   8.844   8.059
  784   2HA   GLY  76          2HA       GLY  76  -7.185   7.689   9.053
  785    QA   GLY  76           QA       GLY  76  -6.740   8.266   8.556
  786    H    GLY  77           H        GLY  77  -4.253   8.799   8.957
  787   1HA   GLY  77          1HA       GLY  77  -4.022   9.774  11.747
  788   2HA   GLY  77          2HA       GLY  77  -2.719   9.742  10.557
  789    QA   GLY  77           QA       GLY  77  -3.371   9.758  11.152
  790    H    GLN  78           H        GLN  78  -3.249   6.965   9.764
  791    HA   GLN  78           HA       GLN  78  -2.001   5.633  12.128
  792   1HB   GLN  78          2HB       GLN  78  -4.619   5.140  10.842
  793   2HB   GLN  78          1HB       GLN  78  -3.653   3.691  11.121
  794   1HG   GLN  78          2HG       GLN  78  -3.339   5.090  13.485
  795   2HG   GLN  78          1HG       GLN  78  -5.018   5.423  13.058
  796   1HE2  GLN  78          1HE2      GLN  78  -2.892   2.508  12.762
  797   2HE2  GLN  78          2HE2      GLN  78  -4.005   1.450  13.485
  798    QB   GLN  78           QB       GLN  78  -4.136   4.416  10.982
  799    QG   GLN  78           QG       GLN  78  -4.178   5.257  13.271
  800    QE   GLN  78           QE2      GLN  78  -3.448   1.979  13.124
  801    H    GLY  79           H        GLY  79  -0.406   4.157  11.523
  802   1HA   GLY  79          1HA       GLY  79   0.997   2.892  10.119
  803   2HA   GLY  79          2HA       GLY  79   0.855   4.275   9.036
  804    QA   GLY  79           QA       GLY  79   0.926   3.584   9.577
  805    H    LEU  80           H        LEU  80   0.775   2.990   7.138
  806    HA   LEU  80           HA       LEU  80  -1.872   1.781   6.594
  807   1HB   LEU  80          2HB       LEU  80   0.551   2.605   4.985
  808   2HB   LEU  80          1HB       LEU  80  -0.780   1.711   4.250
  809    HG   LEU  80           HG       LEU  80  -1.571   4.053   5.884
  810   1HD1  LEU  80          3HD1      LEU  80  -3.118   2.601   4.538
  811   2HD1  LEU  80          2HD1      LEU  80  -3.189   4.306   4.091
  812   3HD1  LEU  80          1HD1      LEU  80  -2.303   3.164   3.079
  813   1HD2  LEU  80          1HD2      LEU  80   0.480   4.279   3.866
  814   2HD2  LEU  80          3HD2      LEU  80  -0.983   5.099   3.320
  815   3HD2  LEU  80          2HD2      LEU  80  -0.240   5.550   4.854
  816    MD1  LEU  80           QD1      LEU  80  -2.870   3.357   3.903
  817    MD2  LEU  80           QD2      LEU  80  -0.247   4.976   4.014
  818    QB   LEU  80           QB       LEU  80  -0.114   2.158   4.618
  819    QD   LEU  80           QQD      LEU  80  -1.559   4.167   3.958
  820    H    ILE  81           H        ILE  81   1.404   0.796   5.579
  821    HA   ILE  81           HA       ILE  81   1.009  -1.910   6.722
  822    HB   ILE  81           HB       ILE  81   1.345  -2.913   4.455
  823   1HG1  ILE  81          2HG1      ILE  81   0.707  -1.060   2.615
  824   2HG1  ILE  81          1HG1      ILE  81   1.540  -0.015   3.767
  825   1HG2  ILE  81          3HG2      ILE  81  -0.944  -2.340   5.505
  826   2HG2  ILE  81          2HG2      ILE  81  -0.987  -1.000   4.358
  827   3HG2  ILE  81          1HG2      ILE  81  -0.906  -2.661   3.772
  828   1HD1  ILE  81          3HD1      ILE  81   2.781  -2.625   2.935
  829   2HD1  ILE  81          2HD1      ILE  81   2.939  -1.202   1.905
  830   3HD1  ILE  81          1HD1      ILE  81   3.566  -1.172   3.553
  831    MG   ILE  81           QG2      ILE  81  -0.946  -2.000   4.545
  832    MD   ILE  81           QD1      ILE  81   3.095  -1.666   2.797
  833    QG   ILE  81           QG1      ILE  81   1.124  -0.538   3.191
  834    H    LYS  82           H        LYS  82   3.023  -3.121   6.759
  835    HA   LYS  82           HA       LYS  82   5.388  -1.548   7.137
  836   1HB   LYS  82          2HB       LYS  82   4.568  -3.965   7.904
  837   2HB   LYS  82          1HB       LYS  82   5.490  -4.469   6.486
  838   1HG   LYS  82          2HG       LYS  82   7.285  -4.421   7.870
  839   2HG   LYS  82          1HG       LYS  82   7.201  -2.670   7.673
  840   1HD   LYS  82          2HD       LYS  82   5.320  -3.086   9.622
  841   2HD   LYS  82          1HD       LYS  82   6.507  -4.333  10.009
  842   1HE   LYS  82          2HE       LYS  82   7.439  -1.529   9.412
  843   2HE   LYS  82          1HE       LYS  82   6.844  -1.945  11.033
  844   1HZ   LYS  82          3HZ       LYS  82   8.826  -3.603   9.579
  845   2HZ   LYS  82          2HZ       LYS  82   9.285  -2.354  10.638
  846   3HZ   LYS  82          1HZ       LYS  82   8.403  -3.685  11.220
  847    QB   LYS  82           QB       LYS  82   5.029  -4.217   7.195
  848    QD   LYS  82           QD       LYS  82   5.914  -3.709   9.816
  849    QG   LYS  82           QG       LYS  82   7.243  -3.546   7.772
  850    QE   LYS  82           QE       LYS  82   7.141  -1.737  10.222
  851    QZ   LYS  82           QZ       LYS  82   8.838  -3.214  10.479
  852    H    ILE  83           H        ILE  83   6.874  -0.850   5.644
  853    HA   ILE  83           HA       ILE  83   7.186  -2.313   3.080
  854    HB   ILE  83           HB       ILE  83   5.344  -0.657   2.808
  855   1HG1  ILE  83          2HG1      ILE  83   7.289   0.748   1.199
  856   2HG1  ILE  83          1HG1      ILE  83   7.657  -0.978   1.211
  857   1HG2  ILE  83          3HG2      ILE  83   6.834   0.910   4.499
  858   2HG2  ILE  83          2HG2      ILE  83   7.179   1.650   2.936
  859   3HG2  ILE  83          1HG2      ILE  83   5.512   1.506   3.494
  860   1HD1  ILE  83          1HD1      ILE  83   5.321  -1.480   0.582
  861   2HD1  ILE  83          3HD1      ILE  83   4.958   0.245   0.559
  862   3HD1  ILE  83          2HD1      ILE  83   6.089  -0.434  -0.612
  863    MG   ILE  83           QG2      ILE  83   6.508   1.355   3.643
  864    MD   ILE  83           QD1      ILE  83   5.456  -0.556   0.176
  865    QG   ILE  83           QG1      ILE  83   7.473  -0.115   1.205
  866    H    GLY  84           H        GLY  84   8.780  -1.467   5.599
  867   1HA   GLY  84          1HA       GLY  84  10.938  -0.669   6.085
  868   2HA   GLY  84          2HA       GLY  84  10.766   0.430   4.717
  869    QA   GLY  84           QA       GLY  84  10.852  -0.119   5.401

  No H/Q in entry =         869
  Start of MODEL   18
    1    H1   MET   1          2H        MET   1  10.257  25.763  18.128
    2    H2   MET   1          1H        MET   1  11.501  26.918  18.180
    3    H3   MET   1          3H        MET   1  10.524  26.788  16.798
    4    HA   MET   1           HA       MET   1  11.418  24.615  16.294
    5   1HB   MET   1          2HB       MET   1  12.516  26.974  15.838
    6   2HB   MET   1          1HB       MET   1  13.754  26.388  16.951
    7   1HG   MET   1          2HG       MET   1  14.226  24.489  15.562
    8   2HG   MET   1          1HG       MET   1  12.814  24.800  14.552
    9   1HE   MET   1          3HE       MET   1  15.658  26.216  16.215
   10   2HE   MET   1          2HE       MET   1  16.842  26.296  14.912
   11   3HE   MET   1          1HE       MET   1  15.983  27.754  15.405
   12    QB   MET   1           QB       MET   1  13.135  26.681  16.395
   13    QG   MET   1           QG       MET   1  13.520  24.645  15.057
   14    ME   MET   1           QE       MET   1  16.161  26.755  15.511
   15    H    LYS   2           H        LYS   2  11.758  22.756  17.447
   16    HA   LYS   2           HA       LYS   2  12.570  21.290  19.115
   17   1HB   LYS   2          2HB       LYS   2  14.620  22.271  17.870
   18   2HB   LYS   2          1HB       LYS   2  14.848  23.265  19.309
   19   1HG   LYS   2          2HG       LYS   2  15.342  21.439  20.661
   20   2HG   LYS   2          1HG       LYS   2  14.448  20.311  19.641
   21   1HD   LYS   2          2HD       LYS   2  16.172  20.505  17.894
   22   2HD   LYS   2          1HD       LYS   2  17.066  21.648  18.897
   23   1HE   LYS   2          2HE       LYS   2  18.048  19.948  20.023
   24   2HE   LYS   2          1HE       LYS   2  16.463  19.255  20.420
   25   1HZ   LYS   2          1HZ       LYS   2  16.373  18.420  18.095
   26   2HZ   LYS   2          3HZ       LYS   2  17.985  18.911  17.892
   27   3HZ   LYS   2          2HZ       LYS   2  17.601  17.706  19.028
   28    QB   LYS   2           QB       LYS   2  14.734  22.768  18.590
   29    QD   LYS   2           QD       LYS   2  16.619  21.077  18.396
   30    QG   LYS   2           QG       LYS   2  14.895  20.875  20.151
   31    QE   LYS   2           QE       LYS   2  17.256  19.602  20.221
   32    QZ   LYS   2           QZ       LYS   2  17.320  18.345  18.338
   33    H    LEU   3           H        LEU   3  10.667  22.909  20.204
   34    HA   LEU   3           HA       LEU   3  11.866  23.778  22.816
   35   1HB   LEU   3          2HB       LEU   3  10.784  25.409  20.963
   36   2HB   LEU   3          1HB       LEU   3   9.311  24.946  21.816
   37    HG   LEU   3           HG       LEU   3  11.231  25.473  23.818
   38   1HD1  LEU   3          1HD1      LEU   3  12.241  26.716  21.674
   39   2HD1  LEU   3          3HD1      LEU   3  11.054  27.936  22.137
   40   3HD1  LEU   3          2HD1      LEU   3  12.305  27.445  23.278
   41   1HD2  LEU   3          2HD2      LEU   3   8.818  26.942  22.742
   42   2HD2  LEU   3          1HD2      LEU   3   8.918  25.916  24.172
   43   3HD2  LEU   3          3HD2      LEU   3   9.693  27.500  24.167
   44    MD1  LEU   3           QD1      LEU   3  11.867  27.365  22.363
   45    MD2  LEU   3           QD2      LEU   3   9.143  26.786  23.694
   46    QB   LEU   3           QB       LEU   3  10.048  25.178  21.390
   47    QD   LEU   3           QQD      LEU   3  10.505  27.076  23.028
   48    H    LYS   4           H        LYS   4   8.660  23.004  21.401
   49    HA   LYS   4           HA       LYS   4   8.232  20.854  23.364
   50   1HB   LYS   4          2HB       LYS   4   6.265  22.035  24.357
   51   2HB   LYS   4          1HB       LYS   4   7.781  22.885  24.663
   52   1HG   LYS   4          2HG       LYS   4   6.701  24.699  23.828
   53   2HG   LYS   4          1HG       LYS   4   7.008  23.962  22.255
   54   1HD   LYS   4          2HD       LYS   4   4.788  23.796  21.940
   55   2HD   LYS   4          1HD       LYS   4   4.711  22.679  23.305
   56   1HE   LYS   4          2HE       LYS   4   4.733  25.684  23.704
   57   2HE   LYS   4          1HE       LYS   4   3.229  24.763  23.503
   58   1HZ   LYS   4          2HZ       LYS   4   4.193  23.212  25.246
   59   2HZ   LYS   4          1HZ       LYS   4   5.300  24.452  25.594
   60   3HZ   LYS   4          3HZ       LYS   4   3.638  24.721  25.795
   61    QB   LYS   4           QB       LYS   4   7.023  22.460  24.510
   62    QD   LYS   4           QD       LYS   4   4.750  23.238  22.622
   63    QG   LYS   4           QG       LYS   4   6.855  24.331  23.042
   64    QE   LYS   4           QE       LYS   4   3.981  25.223  23.604
   65    QZ   LYS   4           QZ       LYS   4   4.377  24.128  25.545
   66    H    VAL   5           H        VAL   5   6.937  19.339  22.371
   67    HA   VAL   5           HA       VAL   5   5.566  20.108  19.847
   68    HB   VAL   5           HB       VAL   5   6.134  17.433  21.166
   69   1HG1  VAL   5          3HG1      VAL   5   7.624  19.174  19.226
   70   2HG1  VAL   5          2HG1      VAL   5   8.244  18.245  20.592
   71   3HG1  VAL   5          1HG1      VAL   5   7.776  17.421  19.105
   72   1HG2  VAL   5          1HG2      VAL   5   5.032  18.218  18.460
   73   2HG2  VAL   5          3HG2      VAL   5   5.741  16.633  18.767
   74   3HG2  VAL   5          2HG2      VAL   5   4.305  17.144  19.655
   75    MG1  VAL   5           QG1      VAL   5   7.882  18.280  19.641
   76    MG2  VAL   5           QG2      VAL   5   5.026  17.332  18.960
   77    QG   VAL   5           QQG      VAL   5   6.454  17.806  19.301
   78    H    THR   6           H        THR   6   3.390  20.442  19.842
   79    HA   THR   6           HA       THR   6   1.756  19.216  22.044
   80    HB   THR   6           HB       THR   6   0.330  21.349  21.553
   81    HG1  THR   6           HG1      THR   6   1.177  22.352  19.904
   82   1HG2  THR   6          2HG2      THR   6   2.212  20.758  23.427
   83   2HG2  THR   6          1HG2      THR   6   2.917  22.206  22.707
   84   3HG2  THR   6          3HG2      THR   6   1.298  22.266  23.402
   85    MG   THR   6           QG2      THR   6   2.143  21.743  23.179
   86    H    VAL   7           H        VAL   7  -0.623  19.058  21.349
   87    HA   VAL   7           HA       VAL   7  -2.254  18.200  19.877
   88    HB   VAL   7           HB       VAL   7  -0.522  19.540  17.775
   89   1HG1  VAL   7          3HG1      VAL   7  -2.858  18.047  17.552
   90   2HG1  VAL   7          2HG1      VAL   7  -3.431  19.715  17.565
   91   3HG1  VAL   7          1HG1      VAL   7  -2.251  19.198  16.361
   92   1HG2  VAL   7          1HG2      VAL   7  -2.248  20.645  19.933
   93   2HG2  VAL   7          3HG2      VAL   7  -0.847  21.361  19.136
   94   3HG2  VAL   7          2HG2      VAL   7  -2.419  21.374  18.337
   95    MG1  VAL   7           QG1      VAL   7  -2.846  18.987  17.159
   96    MG2  VAL   7           QG2      VAL   7  -1.838  21.127  19.135
   97    QG   VAL   7           QQG      VAL   7  -2.342  20.057  18.147
   98    H    ASN   8           H        ASN   8  -2.573  16.374  18.483
   99    HA   ASN   8           HA       ASN   8  -1.973  14.268  17.588
  100   1HB   ASN   8          2HB       ASN   8  -0.783  16.293  16.200
  101   2HB   ASN   8          1HB       ASN   8   0.629  15.345  16.666
  102   1HD2  ASN   8          1HD2      ASN   8  -2.287  15.339  14.689
  103   2HD2  ASN   8          2HD2      ASN   8  -1.970  13.872  13.897
  104    QB   ASN   8           QB       ASN   8  -0.077  15.819  16.433
  105    QD   ASN   8           QD2      ASN   8  -2.128  14.605  14.293
  106    H    GLY   9           H        GLY   9  -1.621  13.628  19.954
  107   1HA   GLY   9          1HA       GLY   9  -0.310  12.648  21.642
  108   2HA   GLY   9          2HA       GLY   9   1.052  13.597  21.045
  109    QA   GLY   9           QA       GLY   9   0.371  13.123  21.344
  110    H    ALA  10           H        ALA  10  -0.272  10.479  21.250
  111    HA   ALA  10           HA       ALA  10   1.870   9.445  19.442
  112   1HB   ALA  10          1HB       ALA  10   0.210   8.024  21.544
  113   2HB   ALA  10          2HB       ALA  10   1.729   8.847  21.896
  114   3HB   ALA  10          3HB       ALA  10   1.710   7.455  20.813
  115    MB   ALA  10           QB       ALA  10   1.216   8.109  21.418
  116    H    GLY  11           H        GLY  11   1.228   7.317  18.319
  117   1HA   GLY  11          1HA       GLY  11  -0.523   7.481  16.309
  118   2HA   GLY  11          2HA       GLY  11  -1.646   7.151  17.628
  119    QA   GLY  11           QA       GLY  11  -1.085   7.316  16.968
  120    H    LYS  12           H        LYS  12  -1.103   5.429  15.340
  121    HA   LYS  12           HA       LYS  12  -0.027   3.041  16.803
  122   1HB   LYS  12          2HB       LYS  12  -2.536   3.439  15.959
  123   2HB   LYS  12          1HB       LYS  12  -1.856   2.840  14.446
  124   1HG   LYS  12          2HG       LYS  12  -1.185   0.780  15.447
  125   2HG   LYS  12          1HG       LYS  12  -1.462   1.401  17.076
  126   1HD   LYS  12          2HD       LYS  12  -3.708   1.029  16.978
  127   2HD   LYS  12          1HD       LYS  12  -3.811   1.503  15.280
  128   1HE   LYS  12          2HE       LYS  12  -2.701  -0.690  14.680
  129   2HE   LYS  12          1HE       LYS  12  -2.880  -1.168  16.380
  130   1HZ   LYS  12          3HZ       LYS  12  -5.265  -0.583  16.186
  131   2HZ   LYS  12          2HZ       LYS  12  -5.046  -0.352  14.517
  132   3HZ   LYS  12          1HZ       LYS  12  -4.817  -1.889  15.201
  133    QB   LYS  12           QB       LYS  12  -2.196   3.139  15.202
  134    QD   LYS  12           QD       LYS  12  -3.760   1.266  16.129
  135    QG   LYS  12           QG       LYS  12  -1.323   1.091  16.261
  136    QE   LYS  12           QE       LYS  12  -2.790  -0.929  15.530
  137    QZ   LYS  12           QZ       LYS  12  -5.043  -0.942  15.301
  138    H    ALA  13           H        ALA  13   1.655   4.865  15.270
  139    HA   ALA  13           HA       ALA  13   2.163   3.511  12.688
  140   1HB   ALA  13          3HB       ALA  13   4.102   5.367  12.937
  141   2HB   ALA  13          2HB       ALA  13   2.460   5.785  12.446
  142   3HB   ALA  13          1HB       ALA  13   2.960   6.000  14.124
  143    MB   ALA  13           QB       ALA  13   3.174   5.717  13.169
  144    H    GLY  14           H        GLY  14   3.352   1.637  12.802
  145   1HA   GLY  14          1HA       GLY  14   5.032   0.124  13.435
  146   2HA   GLY  14          2HA       GLY  14   5.030   0.917  15.011
  147    QA   GLY  14           QA       GLY  14   5.031   0.521  14.223
  148    H    GLU  15           H        GLU  15   7.037   0.179  12.552
  149    HA   GLU  15           HA       GLU  15   8.677   2.662  12.947
  150   1HB   GLU  15          2HB       GLU  15   9.220  -0.263  13.121
  151   2HB   GLU  15          1HB       GLU  15  10.501   0.742  12.442
  152   1HG   GLU  15          2HG       GLU  15  10.813   1.922  14.414
  153   2HG   GLU  15          1HG       GLU  15   9.157   1.652  14.958
  154    QB   GLU  15           QB       GLU  15   9.861   0.239  12.782
  155    QG   GLU  15           QG       GLU  15   9.985   1.787  14.686
  156    H    GLY  16           H        GLY  16   7.470   0.270  10.670
  157   1HA   GLY  16          1HA       GLY  16   8.669   0.114   8.402
  158   2HA   GLY  16          2HA       GLY  16   8.699   1.876   8.467
  159    QA   GLY  16           QA       GLY  16   8.684   0.995   8.435
  160    H    GLU  17           H        GLU  17   6.368   2.809   8.943
  161    HA   GLU  17           HA       GLU  17   4.460   1.372   7.127
  162   1HB   GLU  17          2HB       GLU  17   2.682   2.197   8.684
  163   2HB   GLU  17          1HB       GLU  17   3.820   1.107   9.477
  164   1HG   GLU  17          2HG       GLU  17   4.472   4.018   9.514
  165   2HG   GLU  17          1HG       GLU  17   3.149   3.472  10.547
  166    QB   GLU  17           QB       GLU  17   3.251   1.652   9.081
  167    QG   GLU  17           QG       GLU  17   3.811   3.745  10.031
  168    H    ILE  18           H        ILE  18   2.785   2.931   6.226
  169    HA   ILE  18           HA       ILE  18   4.003   5.641   5.796
  170    HB   ILE  18           HB       ILE  18   2.330   3.866   3.986
  171   1HG1  ILE  18          2HG1      ILE  18   4.833   4.541   2.850
  172   2HG1  ILE  18          1HG1      ILE  18   5.165   4.063   4.516
  173   1HG2  ILE  18          2HG2      ILE  18   2.473   6.631   3.963
  174   2HG2  ILE  18          1HG2      ILE  18   3.730   6.165   2.817
  175   3HG2  ILE  18          3HG2      ILE  18   2.070   5.620   2.575
  176   1HD1  ILE  18          1HD1      ILE  18   3.302   2.401   2.849
  177   2HD1  ILE  18          3HD1      ILE  18   5.044   2.224   2.640
  178   3HD1  ILE  18          2HD1      ILE  18   4.307   1.914   4.213
  179    MG   ILE  18           QG2      ILE  18   2.758   6.139   3.118
  180    MD   ILE  18           QD1      ILE  18   4.218   2.180   3.234
  181    QG   ILE  18           QG1      ILE  18   4.999   4.302   3.683
  182    HA   PRO  19           HA       PRO  19   0.032   6.580   7.797
  183   1HB   PRO  19          2HB       PRO  19   0.703   9.140   8.496
  184   2HB   PRO  19          1HB       PRO  19   1.179   7.721   9.451
  185   1HG   PRO  19          2HG       PRO  19   2.774   9.314   7.506
  186   2HG   PRO  19          1HG       PRO  19   3.264   8.594   9.048
  187   1HD   PRO  19          2HD       PRO  19   3.848   7.494   6.625
  188   2HD   PRO  19          1HD       PRO  19   3.659   6.542   8.114
  189    QB   PRO  19           QB       PRO  19   0.941   8.431   8.974
  190    QG   PRO  19           QG       PRO  19   3.019   8.954   8.277
  191    QD   PRO  19           QD       PRO  19   3.754   7.018   7.370
  192    H    ALA  20           H        ALA  20  -1.742   7.532   6.798
  193    HA   ALA  20           HA       ALA  20  -1.223   9.054   4.285
  194   1HB   ALA  20          1HB       ALA  20  -3.156   7.104   5.298
  195   2HB   ALA  20          3HB       ALA  20  -3.940   8.472   4.507
  196   3HB   ALA  20          2HB       ALA  20  -2.750   7.510   3.630
  197    MB   ALA  20           QB       ALA  20  -3.282   7.695   4.478
  198    HA   PRO  21           HA       PRO  21  -2.650  12.774   6.190
  199   1HB   PRO  21          2HB       PRO  21  -3.508  14.129   3.972
  200   2HB   PRO  21          1HB       PRO  21  -1.790  13.903   4.359
  201   1HG   PRO  21          2HG       PRO  21  -3.500  12.437   2.414
  202   2HG   PRO  21          1HG       PRO  21  -1.810  12.945   2.274
  203   1HD   PRO  21          2HD       PRO  21  -2.572  10.392   2.859
  204   2HD   PRO  21          1HD       PRO  21  -1.027  11.101   3.379
  205    QB   PRO  21           QB       PRO  21  -2.649  14.016   4.166
  206    QG   PRO  21           QG       PRO  21  -2.655  12.691   2.344
  207    QD   PRO  21           QD       PRO  21  -1.799  10.747   3.119
  208    H    LEU  22           H        LEU  22  -4.715  10.842   4.132
  209    HA   LEU  22           HA       LEU  22  -7.060  11.542   5.791
  210   1HB   LEU  22          2HB       LEU  22  -6.477  12.622   3.143
  211   2HB   LEU  22          1HB       LEU  22  -8.020  11.768   3.172
  212    HG   LEU  22           HG       LEU  22  -7.281  13.773   5.306
  213   1HD1  LEU  22          1HD1      LEU  22  -8.282  14.207   2.523
  214   2HD1  LEU  22          3HD1      LEU  22  -8.978  15.189   3.811
  215   3HD1  LEU  22          2HD1      LEU  22  -7.240  15.230   3.511
  216   1HD2  LEU  22          1HD2      LEU  22  -9.568  12.080   4.632
  217   2HD2  LEU  22          3HD2      LEU  22  -9.205  12.924   6.138
  218   3HD2  LEU  22          2HD2      LEU  22 -10.019  13.775   4.824
  219    MD1  LEU  22           QD1      LEU  22  -8.166  14.875   3.281
  220    MD2  LEU  22           QD2      LEU  22  -9.597  12.927   5.198
  221    QB   LEU  22           QB       LEU  22  -7.249  12.195   3.158
  222    QD   LEU  22           QQD      LEU  22  -8.882  13.901   4.240
  223    H    ALA  23           H        ALA  23  -7.184   9.317   6.362
  224    HA   ALA  23           HA       ALA  23  -6.848   7.054   4.762
  225   1HB   ALA  23          1HB       ALA  23  -8.494   7.790   7.139
  226   2HB   ALA  23          2HB       ALA  23  -7.222   6.580   6.993
  227   3HB   ALA  23          3HB       ALA  23  -8.835   6.245   6.365
  228    MB   ALA  23           QB       ALA  23  -8.183   6.872   6.832
  229    H    GLY  24           H        GLY  24 -10.037   8.518   5.492
  230   1HA   GLY  24          1HA       GLY  24 -10.844   8.109   2.670
  231   2HA   GLY  24          2HA       GLY  24 -11.766   8.987   3.891
  232    QA   GLY  24           QA       GLY  24 -11.305   8.548   3.280
  233    H    THR  25           H        THR  25 -13.143   7.185   2.367
  234    HA   THR  25           HA       THR  25 -13.983   5.221   4.395
  235    HB   THR  25           HB       THR  25 -15.185   5.267   1.679
  236    HG1  THR  25           HG1      THR  25 -15.282   7.489   3.440
  237   1HG2  THR  25          3HG2      THR  25 -16.014   4.161   3.886
  238   2HG2  THR  25          2HG2      THR  25 -16.530   5.791   4.317
  239   3HG2  THR  25          1HG2      THR  25 -17.184   5.013   2.877
  240    MG   THR  25           QG2      THR  25 -16.576   4.988   3.693
  241    H    VAL  26           H        VAL  26 -11.948   3.902   4.231
  242    HA   VAL  26           HA       VAL  26 -11.014   2.606   1.899
  243    HB   VAL  26           HB       VAL  26 -11.208   1.521   4.729
  244   1HG1  VAL  26          2HG1      VAL  26  -9.520   0.872   2.319
  245   2HG1  VAL  26          1HG1      VAL  26  -8.921   0.549   3.945
  246   3HG1  VAL  26          3HG1      VAL  26 -10.398  -0.229   3.379
  247   1HG2  VAL  26          2HG2      VAL  26  -9.644   3.719   3.518
  248   2HG2  VAL  26          1HG2      VAL  26 -10.055   3.429   5.208
  249   3HG2  VAL  26          3HG2      VAL  26  -8.699   2.575   4.471
  250    MG1  VAL  26           QG1      VAL  26  -9.613   0.397   3.214
  251    MG2  VAL  26           QG2      VAL  26  -9.466   3.241   4.399
  252    QG   VAL  26           QQG      VAL  26  -9.540   1.819   3.807
  253    H    SER  27           H        SER  27 -12.288   1.420   0.510
  254    HA   SER  27           HA       SER  27 -14.467  -0.264   1.691
  255   1HB   SER  27          2HB       SER  27 -14.070   0.835  -1.109
  256   2HB   SER  27          1HB       SER  27 -15.495  -0.025  -0.532
  257    HG   SER  27           HG       SER  27 -15.074   2.534  -0.423
  258    QB   SER  27           QB       SER  27 -14.783   0.405  -0.821
  259    H    LYS  28           H        LYS  28 -11.747  -0.282  -0.615
  260    HA   LYS  28           HA       LYS  28 -11.717  -3.260  -0.410
  261   1HB   LYS  28          2HB       LYS  28 -12.107  -1.523  -2.824
  262   2HB   LYS  28          1HB       LYS  28 -11.253  -3.055  -3.008
  263   1HG   LYS  28          2HG       LYS  28 -13.274  -4.046  -3.137
  264   2HG   LYS  28          1HG       LYS  28 -13.467  -3.686  -1.422
  265   1HD   LYS  28          2HD       LYS  28 -15.119  -2.238  -1.891
  266   2HD   LYS  28          1HD       LYS  28 -14.030  -1.306  -2.918
  267   1HE   LYS  28          2HE       LYS  28 -15.142  -2.030  -4.751
  268   2HE   LYS  28          1HE       LYS  28 -14.773  -3.711  -4.316
  269   1HZ   LYS  28          1HZ       LYS  28 -16.591  -3.422  -2.577
  270   2HZ   LYS  28          3HZ       LYS  28 -17.070  -2.056  -3.460
  271   3HZ   LYS  28          2HZ       LYS  28 -17.089  -3.589  -4.192
  272    QB   LYS  28           QB       LYS  28 -11.680  -2.289  -2.916
  273    QD   LYS  28           QD       LYS  28 -14.575  -1.772  -2.405
  274    QG   LYS  28           QG       LYS  28 -13.370  -3.866  -2.279
  275    QE   LYS  28           QE       LYS  28 -14.957  -2.871  -4.533
  276    QZ   LYS  28           QZ       LYS  28 -16.917  -3.022  -3.410
  277    H    ILE  29           H        ILE  29  -9.631  -4.119  -0.508
  278    HA   ILE  29           HA       ILE  29  -7.397  -2.137  -0.700
  279    HB   ILE  29           HB       ILE  29  -7.711  -3.368   1.428
  280   1HG1  ILE  29          2HG1      ILE  29  -5.300  -4.751   0.606
  281   2HG1  ILE  29          1HG1      ILE  29  -5.348  -3.132  -0.089
  282   1HG2  ILE  29          2HG2      ILE  29  -8.343  -5.510  -0.261
  283   2HG2  ILE  29          1HG2      ILE  29  -6.792  -5.952   0.451
  284   3HG2  ILE  29          3HG2      ILE  29  -8.166  -5.578   1.491
  285   1HD1  ILE  29          3HD1      ILE  29  -6.246  -2.962   2.623
  286   2HD1  ILE  29          2HD1      ILE  29  -4.736  -3.871   2.598
  287   3HD1  ILE  29          1HD1      ILE  29  -4.801  -2.252   1.905
  288    MG   ILE  29           QG2      ILE  29  -7.767  -5.680   0.560
  289    MD   ILE  29           QD1      ILE  29  -5.261  -3.028   2.375
  290    QG   ILE  29           QG1      ILE  29  -5.324  -3.942   0.259
  291    H    LEU  30           H        LEU  30  -6.474  -2.184  -2.718
  292    HA   LEU  30           HA       LEU  30  -6.657  -4.531  -4.449
  293   1HB   LEU  30          2HB       LEU  30  -5.786  -1.712  -4.539
  294   2HB   LEU  30          1HB       LEU  30  -4.883  -2.786  -5.609
  295    HG   LEU  30           HG       LEU  30  -6.865  -1.858  -6.755
  296   1HD1  LEU  30          2HD1      LEU  30  -8.091  -2.005  -4.336
  297   2HD1  LEU  30          1HD1      LEU  30  -8.969  -1.884  -5.860
  298   3HD1  LEU  30          3HD1      LEU  30  -8.736  -3.458  -5.100
  299   1HD2  LEU  30          1HD2      LEU  30  -6.228  -4.646  -6.407
  300   2HD2  LEU  30          3HD2      LEU  30  -7.964  -4.472  -6.666
  301   3HD2  LEU  30          2HD2      LEU  30  -6.827  -3.826  -7.850
  302    MD1  LEU  30           QD1      LEU  30  -8.599  -2.449  -5.099
  303    MD2  LEU  30           QD2      LEU  30  -7.007  -4.315  -6.974
  304    QB   LEU  30           QB       LEU  30  -5.335  -2.249  -5.074
  305    QD   LEU  30           QQD      LEU  30  -7.803  -3.382  -6.037
  306    H    VAL  31           H        VAL  31  -4.289  -3.205  -2.227
  307    HA   VAL  31           HA       VAL  31  -2.115  -4.908  -3.290
  308    HB   VAL  31           HB       VAL  31  -1.710  -2.598  -2.525
  309   1HG1  VAL  31          3HG1      VAL  31  -0.076  -4.615  -2.125
  310   2HG1  VAL  31          2HG1      VAL  31   0.270  -3.061  -1.368
  311   3HG1  VAL  31          1HG1      VAL  31  -0.468  -4.356  -0.426
  312   1HG2  VAL  31          3HG2      VAL  31  -3.253  -3.588  -0.221
  313   2HG2  VAL  31          2HG2      VAL  31  -1.813  -2.673   0.226
  314   3HG2  VAL  31          1HG2      VAL  31  -3.040  -1.938  -0.806
  315    MG1  VAL  31           QG1      VAL  31  -0.091  -4.010  -1.306
  316    MG2  VAL  31           QG2      VAL  31  -2.702  -2.733  -0.267
  317    QG   VAL  31           QQG      VAL  31  -1.397  -3.372  -0.787
  318    H    LYS  32           H        LYS  32  -0.985  -6.418  -1.801
  319    HA   LYS  32           HA       LYS  32  -2.728  -7.486   0.389
  320   1HB   LYS  32          2HB       LYS  32  -2.378  -8.598  -2.133
  321   2HB   LYS  32          1HB       LYS  32  -1.221  -9.485  -1.140
  322   1HG   LYS  32          2HG       LYS  32  -3.139  -9.771   0.548
  323   2HG   LYS  32          1HG       LYS  32  -4.207  -9.241  -0.753
  324   1HD   LYS  32          2HD       LYS  32  -4.237 -11.546  -1.070
  325   2HD   LYS  32          1HD       LYS  32  -2.922 -11.076  -2.147
  326   1HE   LYS  32          2HE       LYS  32  -1.256 -11.678  -0.489
  327   2HE   LYS  32          1HE       LYS  32  -2.514 -11.967   0.730
  328   1HZ   LYS  32          1HZ       LYS  32  -2.514 -13.348  -1.889
  329   2HZ   LYS  32          3HZ       LYS  32  -1.698 -13.986  -0.547
  330   3HZ   LYS  32          2HZ       LYS  32  -3.381 -13.756  -0.486
  331    QB   LYS  32           QB       LYS  32  -1.799  -9.042  -1.637
  332    QD   LYS  32           QD       LYS  32  -3.579 -11.311  -1.609
  333    QG   LYS  32           QG       LYS  32  -3.673  -9.506  -0.103
  334    QE   LYS  32           QE       LYS  32  -1.885 -11.823   0.120
  335    QZ   LYS  32           QZ       LYS  32  -2.531 -13.697  -0.974
  336    H    GLU  33           H        GLU  33  -1.113  -9.523   1.263
  337    HA   GLU  33           HA       GLU  33   1.247  -8.042   2.291
  338   1HB   GLU  33          2HB       GLU  33  -0.325  -9.174   3.826
  339   2HB   GLU  33          1HB       GLU  33  -0.010 -10.709   3.017
  340   1HG   GLU  33          2HG       GLU  33   2.370 -10.560   3.644
  341   2HG   GLU  33          1HG       GLU  33   2.063  -9.021   4.450
  342    QB   GLU  33           QB       GLU  33  -0.168  -9.941   3.422
  343    QG   GLU  33           QG       GLU  33   2.216  -9.790   4.047
  344    H    GLY  34           H        GLY  34   3.317  -8.558   1.652
  345   1HA   GLY  34          1HA       GLY  34   3.921 -11.198   0.514
  346   2HA   GLY  34          2HA       GLY  34   5.086  -9.913   0.825
  347    QA   GLY  34           QA       GLY  34   4.503 -10.556   0.669
  348    H    ASP  35           H        ASP  35   2.540  -8.497  -0.798
  349    HA   ASP  35           HA       ASP  35   3.409  -9.282  -3.517
  350   1HB   ASP  35          2HB       ASP  35   1.086  -8.166  -2.186
  351   2HB   ASP  35          1HB       ASP  35   1.529  -7.182  -3.583
  352    QB   ASP  35           QB       ASP  35   1.307  -7.674  -2.884
  353    H    THR  36           H        THR  36   4.674  -7.971  -4.819
  354    HA   THR  36           HA       THR  36   5.977  -5.640  -3.577
  355    HB   THR  36           HB       THR  36   6.277  -6.812  -6.356
  356    HG1  THR  36           HG1      THR  36   7.423  -8.367  -5.500
  357   1HG2  THR  36          3HG2      THR  36   7.867  -4.969  -4.605
  358   2HG2  THR  36          2HG2      THR  36   8.710  -6.003  -5.758
  359   3HG2  THR  36          1HG2      THR  36   7.513  -4.839  -6.326
  360    MG   THR  36           QG2      THR  36   8.030  -5.270  -5.563
  361    H    VAL  37           H        VAL  37   5.221  -3.585  -3.854
  362    HA   VAL  37           HA       VAL  37   3.266  -3.054  -6.047
  363    HB   VAL  37           HB       VAL  37   2.690  -1.109  -4.636
  364   1HG1  VAL  37          1HG1      VAL  37   2.097  -3.691  -4.111
  365   2HG1  VAL  37          3HG1      VAL  37   2.921  -3.272  -2.608
  366   3HG1  VAL  37          2HG1      VAL  37   1.502  -2.358  -3.122
  367   1HG2  VAL  37          2HG2      VAL  37   5.322  -1.600  -3.605
  368   2HG2  VAL  37          1HG2      VAL  37   4.244  -0.248  -3.254
  369   3HG2  VAL  37          3HG2      VAL  37   4.169  -1.713  -2.275
  370    MG1  VAL  37           QG1      VAL  37   2.173  -3.107  -3.280
  371    MG2  VAL  37           QG2      VAL  37   4.579  -1.187  -3.045
  372    QG   VAL  37           QQG      VAL  37   3.376  -2.147  -3.162
  373    H    LYS  38           H        LYS  38   3.523  -0.471  -6.606
  374    HA   LYS  38           HA       LYS  38   6.417   0.104  -7.086
  375   1HB   LYS  38          2HB       LYS  38   4.152  -0.125  -9.077
  376   2HB   LYS  38          1HB       LYS  38   5.637   0.748  -9.453
  377   1HG   LYS  38          2HG       LYS  38   5.528  -2.139  -8.533
  378   2HG   LYS  38          1HG       LYS  38   5.709  -1.627 -10.213
  379   1HD   LYS  38          2HD       LYS  38   7.664  -0.156  -8.952
  380   2HD   LYS  38          1HD       LYS  38   7.696  -1.668  -8.044
  381   1HE   LYS  38          2HE       LYS  38   7.655  -2.800 -10.412
  382   2HE   LYS  38          1HE       LYS  38   8.234  -1.219 -10.971
  383   1HZ   LYS  38          2HZ       LYS  38   9.847  -1.368  -9.028
  384   2HZ   LYS  38          1HZ       LYS  38   9.467  -3.024  -8.978
  385   3HZ   LYS  38          3HZ       LYS  38  10.170  -2.358 -10.371
  386    QB   LYS  38           QB       LYS  38   4.894   0.311  -9.265
  387    QD   LYS  38           QD       LYS  38   7.680  -0.912  -8.498
  388    QG   LYS  38           QG       LYS  38   5.619  -1.883  -9.373
  389    QE   LYS  38           QE       LYS  38   7.944  -2.009 -10.692
  390    QZ   LYS  38           QZ       LYS  38   9.828  -2.250  -9.459
  391    H    ALA  39           H        ALA  39   6.724   2.422  -7.777
  392    HA   ALA  39           HA       ALA  39   5.163   4.220  -6.119
  393   1HB   ALA  39          1HB       ALA  39   7.672   4.151  -7.227
  394   2HB   ALA  39          3HB       ALA  39   6.865   5.321  -8.271
  395   3HB   ALA  39          2HB       ALA  39   6.939   5.596  -6.530
  396    MB   ALA  39           QB       ALA  39   7.159   5.023  -7.343
  397    H    GLY  40           H        GLY  40   3.002   4.333  -6.851
  398   1HA   GLY  40          1HA       GLY  40   2.652   5.474  -9.593
  399   2HA   GLY  40          2HA       GLY  40   1.610   5.870  -8.225
  400    QA   GLY  40           QA       GLY  40   2.131   5.672  -8.909
  401    H    GLN  41           H        GLN  41   1.824   2.863  -7.485
  402    HA   GLN  41           HA       GLN  41   0.031   1.767  -9.617
  403   1HB   GLN  41          2HB       GLN  41   2.256   0.703  -8.729
  404   2HB   GLN  41          1HB       GLN  41   1.277   0.232  -7.340
  405   1HG   GLN  41          2HG       GLN  41  -0.317  -0.904  -8.845
  406   2HG   GLN  41          1HG       GLN  41   0.663  -0.436 -10.234
  407   1HE2  GLN  41          1HE2      GLN  41   2.975  -1.298 -10.239
  408   2HE2  GLN  41          2HE2      GLN  41   3.275  -2.796  -9.502
  409    QB   GLN  41           QB       GLN  41   1.766   0.468  -8.035
  410    QG   GLN  41           QG       GLN  41   0.173  -0.670  -9.540
  411    QE   GLN  41           QE2      GLN  41   3.125  -2.047  -9.870
  412    H    THR  42           H        THR  42  -2.132   1.895  -9.110
  413    HA   THR  42           HA       THR  42  -3.282   2.729  -6.706
  414    HB   THR  42           HB       THR  42  -4.324   0.719  -8.732
  415    HG1  THR  42           HG1      THR  42  -4.607   3.534  -8.574
  416   1HG2  THR  42          1HG2      THR  42  -5.478   1.845  -6.325
  417   2HG2  THR  42          3HG2      THR  42  -6.397   2.340  -7.747
  418   3HG2  THR  42          2HG2      THR  42  -6.145   0.627  -7.413
  419    MG   THR  42           QG2      THR  42  -6.006   1.604  -7.162
  420    H    VAL  43           H        VAL  43  -3.445   1.812  -4.705
  421    HA   VAL  43           HA       VAL  43  -3.176  -1.165  -4.479
  422    HB   VAL  43           HB       VAL  43  -1.916  -0.640  -2.343
  423   1HG1  VAL  43          2HG1      VAL  43  -2.893   1.744  -2.282
  424   2HG1  VAL  43          1HG1      VAL  43  -1.184   1.571  -1.888
  425   3HG1  VAL  43          3HG1      VAL  43  -1.667   2.146  -3.484
  426   1HG2  VAL  43          3HG2      VAL  43  -1.022  -0.826  -4.916
  427   2HG2  VAL  43          2HG2      VAL  43  -0.361   0.738  -4.443
  428   3HG2  VAL  43          1HG2      VAL  43   0.037  -0.704  -3.512
  429    MG1  VAL  43           QG1      VAL  43  -1.914   1.820  -2.552
  430    MG2  VAL  43           QG2      VAL  43  -0.449  -0.264  -4.290
  431    QG   VAL  43           QQG      VAL  43  -1.182   0.778  -3.421
  432    H    LEU  44           H        LEU  44  -4.607   1.819  -3.183
  433    HA   LEU  44           HA       LEU  44  -6.492   0.092  -1.601
  434   1HB   LEU  44          2HB       LEU  44  -4.664   2.148  -0.810
  435   2HB   LEU  44          1HB       LEU  44  -6.305   2.737  -0.537
  436    HG   LEU  44           HG       LEU  44  -6.472   0.141   0.365
  437   1HD1  LEU  44          3HD1      LEU  44  -7.348   2.171   1.471
  438   2HD1  LEU  44          2HD1      LEU  44  -6.461   1.160   2.611
  439   3HD1  LEU  44          1HD1      LEU  44  -5.710   2.613   1.953
  440   1HD2  LEU  44          2HD2      LEU  44  -3.676   0.918   0.344
  441   2HD2  LEU  44          1HD2      LEU  44  -4.234   0.637   1.993
  442   3HD2  LEU  44          3HD2      LEU  44  -4.395  -0.632   0.779
  443    MD1  LEU  44           QD1      LEU  44  -6.506   1.981   2.012
  444    MD2  LEU  44           QD2      LEU  44  -4.102   0.308   1.039
  445    QB   LEU  44           QB       LEU  44  -5.485   2.443  -0.673
  446    QD   LEU  44           QQD      LEU  44  -5.304   1.144   1.525
  447    H    VAL  45           H        VAL  45  -8.659   1.068  -1.312
  448    HA   VAL  45           HA       VAL  45  -9.365   3.076  -3.421
  449    HB   VAL  45           HB       VAL  45 -10.875   0.558  -2.661
  450   1HG1  VAL  45          3HG1      VAL  45  -9.155   1.207  -5.074
  451   2HG1  VAL  45          2HG1      VAL  45  -8.805   0.000  -3.836
  452   3HG1  VAL  45          1HG1      VAL  45 -10.174  -0.225  -4.924
  453   1HG2  VAL  45          1HG2      VAL  45 -11.288   2.620  -4.850
  454   2HG2  VAL  45          3HG2      VAL  45 -12.194   1.113  -4.704
  455   3HG2  VAL  45          2HG2      VAL  45 -12.337   2.353  -3.457
  456    MG1  VAL  45           QG1      VAL  45  -9.378   0.328  -4.611
  457    MG2  VAL  45           QG2      VAL  45 -11.940   2.028  -4.337
  458    QG   VAL  45           QQG      VAL  45 -10.659   1.178  -4.474
  459    H    LEU  46           H        LEU  46 -10.465   4.789  -2.517
  460    HA   LEU  46           HA       LEU  46 -12.095   4.262  -0.059
  461   1HB   LEU  46          2HB       LEU  46 -11.117   6.191   0.994
  462   2HB   LEU  46          1HB       LEU  46  -9.779   5.240   0.353
  463    HG   LEU  46           HG       LEU  46 -10.534   6.938  -1.755
  464   1HD1  LEU  46          3HD1      LEU  46  -8.247   6.133  -0.542
  465   2HD1  LEU  46          2HD1      LEU  46  -8.312   7.455  -1.707
  466   3HD1  LEU  46          1HD1      LEU  46  -8.322   7.803   0.021
  467   1HD2  LEU  46          2HD2      LEU  46 -11.498   8.080   0.600
  468   2HD2  LEU  46          1HD2      LEU  46  -9.951   8.886   0.341
  469   3HD2  LEU  46          3HD2      LEU  46 -11.190   8.931  -0.913
  470    MD1  LEU  46           QD1      LEU  46  -8.294   7.131  -0.742
  471    MD2  LEU  46           QD2      LEU  46 -10.880   8.632   0.009
  472    QB   LEU  46           QB       LEU  46 -10.448   5.716   0.673
  473    QD   LEU  46           QQD      LEU  46  -9.587   7.881  -0.367
  474    H    GLU  47           H        GLU  47 -13.661   6.114   0.347
  475    HA   GLU  47           HA       GLU  47 -14.494   7.450  -2.207
  476   1HB   GLU  47          2HB       GLU  47 -15.781   5.414  -0.613
  477   2HB   GLU  47          1HB       GLU  47 -16.768   6.877  -0.611
  478   1HG   GLU  47          2HG       GLU  47 -15.703   6.348  -3.261
  479   2HG   GLU  47          1HG       GLU  47 -16.621   4.967  -2.660
  480    QB   GLU  47           QB       GLU  47 -16.274   6.145  -0.612
  481    QG   GLU  47           QG       GLU  47 -16.162   5.657  -2.961
  482    H    ALA  48           H        ALA  48 -13.507   9.427  -1.377
  483    HA   ALA  48           HA       ALA  48 -15.263  11.129   0.122
  484   1HB   ALA  48          2HB       ALA  48 -12.988  10.916   1.879
  485   2HB   ALA  48          3HB       ALA  48 -13.680   9.312   1.640
  486   3HB   ALA  48          1HB       ALA  48 -14.688  10.626   2.250
  487    MB   ALA  48           QB       ALA  48 -13.786  10.285   1.923
  488    H    MET  49           H        MET  49 -14.360  13.304   0.285
  489    HA   MET  49           HA       MET  49 -13.050  15.080  -0.575
  490   1HB   MET  49          2HB       MET  49 -11.134  12.896   0.235
  491   2HB   MET  49          1HB       MET  49 -10.525  14.408  -0.442
  492   1HG   MET  49          2HG       MET  49 -12.506  14.424   1.829
  493   2HG   MET  49          1HG       MET  49 -10.779  14.247   2.136
  494   1HE   MET  49          1HE       MET  49 -10.923  15.868   3.560
  495   2HE   MET  49          3HE       MET  49  -9.805  17.116   2.993
  496   3HE   MET  49          2HE       MET  49 -11.476  17.531   3.371
  497    QB   MET  49           QB       MET  49 -10.830  13.652  -0.104
  498    QG   MET  49           QG       MET  49 -11.643  14.335   1.982
  499    ME   MET  49           QE       MET  49 -10.735  16.838   3.308
  500    H    LYS  50           H        LYS  50 -13.887  14.992  -2.758
  501    HA   LYS  50           HA       LYS  50 -13.702  14.759  -5.098
  502   1HB   LYS  50          2HB       LYS  50 -10.804  14.274  -4.327
  503   2HB   LYS  50          1HB       LYS  50 -11.384  14.802  -5.906
  504   1HG   LYS  50          2HG       LYS  50 -12.541  16.652  -4.233
  505   2HG   LYS  50          1HG       LYS  50 -10.992  16.357  -3.439
  506   1HD   LYS  50          2HD       LYS  50 -11.213  16.914  -6.405
  507   2HD   LYS  50          1HD       LYS  50 -10.999  18.198  -5.213
  508   1HE   LYS  50          2HE       LYS  50  -8.933  17.044  -4.393
  509   2HE   LYS  50          1HE       LYS  50  -9.119  15.860  -5.702
  510   1HZ   LYS  50          3HZ       LYS  50  -9.126  17.676  -7.297
  511   2HZ   LYS  50          2HZ       LYS  50  -8.928  18.807  -6.045
  512   3HZ   LYS  50          1HZ       LYS  50  -7.693  17.694  -6.391
  513    QB   LYS  50           QB       LYS  50 -11.094  14.538  -5.117
  514    QD   LYS  50           QD       LYS  50 -11.106  17.556  -5.809
  515    QG   LYS  50           QG       LYS  50 -11.766  16.504  -3.836
  516    QE   LYS  50           QE       LYS  50  -9.026  16.452  -5.047
  517    QZ   LYS  50           QZ       LYS  50  -8.582  18.059  -6.578
  518    H    MET  51           H        MET  51 -14.107  12.323  -3.313
  519    HA   MET  51           HA       MET  51 -14.428  10.017  -3.664
  520   1HB   MET  51          2HB       MET  51 -13.477  10.590  -6.487
  521   2HB   MET  51          1HB       MET  51 -14.523   9.279  -5.955
  522   1HG   MET  51          2HG       MET  51 -15.817  11.582  -5.052
  523   2HG   MET  51          1HG       MET  51 -15.218  12.023  -6.650
  524   1HE   MET  51          1HE       MET  51 -16.007  11.519  -8.622
  525   2HE   MET  51          3HE       MET  51 -15.507   9.826  -8.739
  526   3HE   MET  51          2HE       MET  51 -17.159  10.290  -9.137
  527    QB   MET  51           QB       MET  51 -14.000   9.934  -6.221
  528    QG   MET  51           QG       MET  51 -15.518  11.803  -5.851
  529    ME   MET  51           QE       MET  51 -16.225  10.545  -8.833
  530    H    GLU  52           H        GLU  52 -11.601  10.850  -5.720
  531    HA   GLU  52           HA       GLU  52  -9.364  10.096  -5.610
  532   1HB   GLU  52          2HB       GLU  52 -10.141  10.499  -3.028
  533   2HB   GLU  52          1HB       GLU  52  -9.767   8.776  -2.980
  534   1HG   GLU  52          2HG       GLU  52  -7.649   9.575  -2.587
  535   2HG   GLU  52          1HG       GLU  52  -7.615   9.633  -4.349
  536    QB   GLU  52           QB       GLU  52  -9.954   9.638  -3.004
  537    QG   GLU  52           QG       GLU  52  -7.632   9.604  -3.468
  538    H    THR  53           H        THR  53 -11.229   7.621  -3.799
  539    HA   THR  53           HA       THR  53 -11.399   5.302  -4.158
  540    HB   THR  53           HB       THR  53 -11.264   6.354  -7.003
  541    HG1  THR  53           HG1      THR  53 -13.381   5.975  -5.161
  542   1HG2  THR  53          1HG2      THR  53 -11.043   3.800  -6.527
  543   2HG2  THR  53          3HG2      THR  53 -12.747   3.902  -6.082
  544   3HG2  THR  53          2HG2      THR  53 -12.233   4.335  -7.713
  545    MG   THR  53           QG2      THR  53 -12.008   4.012  -6.774
  546    H    GLU  54           H        GLU  54  -9.697   5.227  -7.172
  547    HA   GLU  54           HA       GLU  54  -7.770   3.363  -6.413
  548   1HB   GLU  54          2HB       GLU  54  -7.869   5.535  -8.507
  549   2HB   GLU  54          1HB       GLU  54  -6.528   4.391  -8.434
  550   1HG   GLU  54          2HG       GLU  54  -8.288   2.538  -8.447
  551   2HG   GLU  54          1HG       GLU  54  -9.459   3.785  -8.878
  552    QB   GLU  54           QB       GLU  54  -7.199   4.963  -8.471
  553    QG   GLU  54           QG       GLU  54  -8.873   3.161  -8.662
  554    H    ILE  55           H        ILE  55  -6.273   3.571  -4.792
  555    HA   ILE  55           HA       ILE  55  -4.953   6.229  -4.392
  556    HB   ILE  55           HB       ILE  55  -5.448   3.801  -2.642
  557   1HG1  ILE  55          2HG1      ILE  55  -7.259   5.455  -2.808
  558   2HG1  ILE  55          1HG1      ILE  55  -6.535   5.505  -1.202
  559   1HG2  ILE  55          1HG2      ILE  55  -3.502   6.075  -2.270
  560   2HG2  ILE  55          3HG2      ILE  55  -4.256   5.305  -0.873
  561   3HG2  ILE  55          2HG2      ILE  55  -3.258   4.353  -1.972
  562   1HD1  ILE  55          3HD1      ILE  55  -4.967   7.298  -2.554
  563   2HD1  ILE  55          2HD1      ILE  55  -6.532   7.552  -3.328
  564   3HD1  ILE  55          1HD1      ILE  55  -6.370   7.741  -1.582
  565    MG   ILE  55           QG2      ILE  55  -3.672   5.244  -1.705
  566    MD   ILE  55           QD1      ILE  55  -5.956   7.531  -2.488
  567    QG   ILE  55           QG1      ILE  55  -6.897   5.480  -2.005
  568    H    ASN  56           H        ASN  56  -3.241   6.137  -5.867
  569    HA   ASN  56           HA       ASN  56  -1.691   3.819  -6.501
  570   1HB   ASN  56          2HB       ASN  56  -1.020   6.779  -6.571
  571   2HB   ASN  56          1HB       ASN  56  -0.163   5.519  -7.461
  572   1HD2  ASN  56          1HD2      ASN  56  -0.861   5.364  -9.591
  573   2HD2  ASN  56          2HD2      ASN  56  -2.437   5.686 -10.131
  574    QB   ASN  56           QB       ASN  56  -0.592   6.149  -7.016
  575    QD   ASN  56           QD2      ASN  56  -1.649   5.525  -9.861
  576    H    ALA  57           H        ALA  57   0.025   2.891  -5.441
  577    HA   ALA  57           HA       ALA  57   0.627   3.336  -2.732
  578   1HB   ALA  57          2HB       ALA  57   1.814   1.966  -5.070
  579   2HB   ALA  57          1HB       ALA  57   2.947   2.308  -3.763
  580   3HB   ALA  57          3HB       ALA  57   1.501   1.349  -3.447
  581    MB   ALA  57           QB       ALA  57   2.087   1.874  -4.094
  582    HA   PRO  58           HA       PRO  58   3.155   6.946  -2.763
  583   1HB   PRO  58          2HB       PRO  58   4.651   6.529  -0.516
  584   2HB   PRO  58          1HB       PRO  58   2.930   6.957  -0.461
  585   1HG   PRO  58          2HG       PRO  58   4.238   4.325  -0.066
  586   2HG   PRO  58          1HG       PRO  58   2.797   5.000   0.707
  587   1HD   PRO  58          2HD       PRO  58   2.772   3.141  -1.336
  588   2HD   PRO  58          1HD       PRO  58   1.416   4.207  -0.913
  589    QB   PRO  58           QB       PRO  58   3.790   6.743  -0.489
  590    QG   PRO  58           QG       PRO  58   3.517   4.662   0.320
  591    QD   PRO  58           QD       PRO  58   2.094   3.674  -1.124
  592    H    THR  59           H        THR  59   4.856   3.853  -2.230
  593    HA   THR  59           HA       THR  59   6.946   4.701  -4.155
  594    HB   THR  59           HB       THR  59   7.861   3.653  -1.502
  595    HG1  THR  59           HG1      THR  59   6.536   5.275  -0.825
  596   1HG2  THR  59          3HG2      THR  59   8.901   5.364  -3.730
  597   2HG2  THR  59          2HG2      THR  59   9.600   5.541  -2.121
  598   3HG2  THR  59          1HG2      THR  59   9.654   3.979  -2.939
  599    MG   THR  59           QG2      THR  59   9.385   4.961  -2.930
  600    H    ASP  60           H        ASP  60   8.071   2.899  -5.042
  601    HA   ASP  60           HA       ASP  60   6.683   0.387  -5.096
  602   1HB   ASP  60          2HB       ASP  60   8.674  -0.291  -6.417
  603   2HB   ASP  60          1HB       ASP  60   8.091   1.299  -6.909
  604    QB   ASP  60           QB       ASP  60   8.383   0.504  -6.663
  605    H    GLY  61           H        GLY  61   7.383  -1.662  -4.208
  606   1HA   GLY  61          1HA       GLY  61   8.770  -1.389  -1.617
  607   2HA   GLY  61          2HA       GLY  61   9.547  -2.445  -2.797
  608    QA   GLY  61           QA       GLY  61   9.158  -1.917  -2.207
  609    H    LYS  62           H        LYS  62   9.116  -4.157  -1.163
  610    HA   LYS  62           HA       LYS  62   6.583  -5.532  -1.745
  611   1HB   LYS  62          2HB       LYS  62   8.828  -6.625  -1.678
  612   2HB   LYS  62          1HB       LYS  62   8.931  -6.247   0.041
  613   1HG   LYS  62          2HG       LYS  62   6.454  -7.461  -0.166
  614   2HG   LYS  62          1HG       LYS  62   7.436  -8.377  -1.311
  615   1HD   LYS  62          2HD       LYS  62   9.184  -8.214   0.743
  616   2HD   LYS  62          1HD       LYS  62   7.668  -8.179   1.645
  617   1HE   LYS  62          2HE       LYS  62   7.960 -10.481   1.479
  618   2HE   LYS  62          1HE       LYS  62   7.084 -10.198  -0.040
  619   1HZ   LYS  62          2HZ       LYS  62  10.023  -9.914   0.127
  620   2HZ   LYS  62          1HZ       LYS  62   9.305 -11.420  -0.190
  621   3HZ   LYS  62          3HZ       LYS  62   9.058 -10.124  -1.255
  622    QB   LYS  62           QB       LYS  62   8.880  -6.436  -0.819
  623    QD   LYS  62           QD       LYS  62   8.426  -8.196   1.194
  624    QG   LYS  62           QG       LYS  62   6.945  -7.919  -0.738
  625    QE   LYS  62           QE       LYS  62   7.522 -10.340   0.719
  626    QZ   LYS  62           QZ       LYS  62   9.462 -10.486  -0.439
  627    H    VAL  63           H        VAL  63   4.921  -5.879  -0.246
  628    HA   VAL  63           HA       VAL  63   4.751  -4.041   2.014
  629    HB   VAL  63           HB       VAL  63   3.024  -6.225   0.825
  630   1HG1  VAL  63          1HG1      VAL  63   3.487  -3.641   0.053
  631   2HG1  VAL  63          3HG1      VAL  63   2.000  -4.528  -0.290
  632   3HG1  VAL  63          2HG1      VAL  63   2.081  -3.445   1.101
  633   1HG2  VAL  63          2HG2      VAL  63   2.648  -6.121   3.296
  634   2HG2  VAL  63          1HG2      VAL  63   2.303  -4.397   3.141
  635   3HG2  VAL  63          3HG2      VAL  63   1.245  -5.581   2.375
  636    MG1  VAL  63           QG1      VAL  63   2.523  -3.871   0.288
  637    MG2  VAL  63           QG2      VAL  63   2.065  -5.366   2.937
  638    QG   VAL  63           QQG      VAL  63   2.294  -4.619   1.613
  639    H    GLU  64           H        GLU  64   5.250  -4.499   4.116
  640    HA   GLU  64           HA       GLU  64   6.270  -7.200   4.783
  641   1HB   GLU  64          2HB       GLU  64   6.368  -4.421   5.904
  642   2HB   GLU  64          1HB       GLU  64   6.654  -5.772   7.001
  643   1HG   GLU  64          2HG       GLU  64   8.261  -6.581   5.050
  644   2HG   GLU  64          1HG       GLU  64   8.273  -4.863   4.652
  645    QB   GLU  64           QB       GLU  64   6.511  -5.097   6.452
  646    QG   GLU  64           QG       GLU  64   8.267  -5.722   4.851
  647    H    LYS  65           H        LYS  65   3.376  -5.337   5.113
  648    HA   LYS  65           HA       LYS  65   1.905  -7.450   6.374
  649   1HB   LYS  65          2HB       LYS  65   3.561  -5.847   8.078
  650   2HB   LYS  65          1HB       LYS  65   1.876  -5.476   8.448
  651   1HG   LYS  65          2HG       LYS  65   1.372  -7.728   8.969
  652   2HG   LYS  65          1HG       LYS  65   2.828  -8.326   8.172
  653   1HD   LYS  65          2HD       LYS  65   3.245  -6.401  10.398
  654   2HD   LYS  65          1HD       LYS  65   2.661  -8.003  10.848
  655   1HE   LYS  65          2HE       LYS  65   4.539  -9.034   9.586
  656   2HE   LYS  65          1HE       LYS  65   5.144  -7.412   9.196
  657   1HZ   LYS  65          1HZ       LYS  65   5.201  -6.919  11.576
  658   2HZ   LYS  65          3HZ       LYS  65   4.698  -8.501  11.926
  659   3HZ   LYS  65          2HZ       LYS  65   6.208  -8.233  11.195
  660    QB   LYS  65           QB       LYS  65   2.719  -5.661   8.263
  661    QD   LYS  65           QD       LYS  65   2.953  -7.202  10.623
  662    QG   LYS  65           QG       LYS  65   2.100  -8.027   8.571
  663    QE   LYS  65           QE       LYS  65   4.841  -8.223   9.391
  664    QZ   LYS  65           QZ       LYS  65   5.369  -7.884  11.566
  665    H    VAL  66           H        VAL  66  -0.315  -6.655   7.042
  666    HA   VAL  66           HA       VAL  66  -1.011  -4.036   5.759
  667    HB   VAL  66           HB       VAL  66  -3.103  -5.284   4.976
  668   1HG1  VAL  66          2HG1      VAL  66  -0.905  -4.790   3.660
  669   2HG1  VAL  66          1HG1      VAL  66  -0.609  -6.520   3.831
  670   3HG1  VAL  66          3HG1      VAL  66  -2.050  -5.950   2.987
  671   1HG2  VAL  66          2HG2      VAL  66  -2.265  -7.254   6.661
  672   2HG2  VAL  66          1HG2      VAL  66  -3.339  -7.534   5.290
  673   3HG2  VAL  66          3HG2      VAL  66  -1.609  -7.837   5.132
  674    MG1  VAL  66           QG1      VAL  66  -1.188  -5.753   3.493
  675    MG2  VAL  66           QG2      VAL  66  -2.404  -7.542   5.695
  676    QG   VAL  66           QQG      VAL  66  -1.796  -6.647   4.594
  677    H    LEU  67           H        LEU  67  -1.549  -2.849   7.574
  678    HA   LEU  67           HA       LEU  67  -3.121  -4.133   9.743
  679   1HB   LEU  67          2HB       LEU  67  -2.485  -2.132  10.986
  680   2HB   LEU  67          1HB       LEU  67  -1.064  -2.769  10.161
  681    HG   LEU  67           HG       LEU  67  -2.000  -1.100   8.243
  682   1HD1  LEU  67          2HD1      LEU  67  -0.268  -0.311  10.604
  683   2HD1  LEU  67          1HD1      LEU  67   0.290  -1.157   9.160
  684   3HD1  LEU  67          3HD1      LEU  67  -0.297   0.501   9.039
  685   1HD2  LEU  67          3HD2      LEU  67  -3.652  -0.478  10.350
  686   2HD2  LEU  67          2HD2      LEU  67  -2.367   0.717  10.530
  687   3HD2  LEU  67          1HD2      LEU  67  -3.270   0.615   9.019
  688    MD1  LEU  67           QD1      LEU  67  -0.092  -0.322   9.601
  689    MD2  LEU  67           QD2      LEU  67  -3.096   0.285   9.966
  690    QB   LEU  67           QB       LEU  67  -1.775  -2.450  10.574
  691    QD   LEU  67           QQD      LEU  67  -1.594  -0.019   9.784
  692    H    VAL  68           H        VAL  68  -3.481  -1.736   7.174
  693    HA   VAL  68           HA       VAL  68  -5.849  -0.435   8.116
  694    HB   VAL  68           HB       VAL  68  -4.389   0.320   6.260
  695   1HG1  VAL  68          2HG1      VAL  68  -4.968  -2.364   5.319
  696   2HG1  VAL  68          1HG1      VAL  68  -5.350  -1.169   4.080
  697   3HG1  VAL  68          3HG1      VAL  68  -3.728  -1.236   4.770
  698   1HG2  VAL  68          3HG2      VAL  68  -7.153   0.468   6.391
  699   2HG2  VAL  68          2HG2      VAL  68  -6.130   1.421   5.318
  700   3HG2  VAL  68          1HG2      VAL  68  -6.864  -0.073   4.737
  701    MG1  VAL  68           QG1      VAL  68  -4.682  -1.590   4.723
  702    MG2  VAL  68           QG2      VAL  68  -6.716   0.605   5.482
  703    QG   VAL  68           QQG      VAL  68  -5.699  -0.492   5.103
  704    H    LYS  69           H        LYS  69  -8.092  -0.849   7.479
  705    HA   LYS  69           HA       LYS  69  -8.607  -3.637   6.501
  706   1HB   LYS  69          2HB       LYS  69  -8.924  -2.591   9.121
  707   2HB   LYS  69          1HB       LYS  69 -10.547  -2.791   8.458
  708   1HG   LYS  69          2HG       LYS  69 -10.000  -5.120   7.831
  709   2HG   LYS  69          1HG       LYS  69  -8.387  -4.920   8.517
  710   1HD   LYS  69          2HD       LYS  69  -9.285  -4.597  10.730
  711   2HD   LYS  69          1HD       LYS  69 -10.934  -4.522  10.106
  712   1HE   LYS  69          2HE       LYS  69 -10.442  -6.914   9.169
  713   2HE   LYS  69          1HE       LYS  69  -9.127  -6.922  10.361
  714   1HZ   LYS  69          3HZ       LYS  69 -11.883  -6.088  11.052
  715   2HZ   LYS  69          2HZ       LYS  69 -11.374  -7.704  11.182
  716   3HZ   LYS  69          1HZ       LYS  69 -10.618  -6.495  12.105
  717    QB   LYS  69           QB       LYS  69  -9.735  -2.691   8.790
  718    QD   LYS  69           QD       LYS  69 -10.110  -4.560  10.418
  719    QG   LYS  69           QG       LYS  69  -9.193  -5.020   8.174
  720    QE   LYS  69           QE       LYS  69  -9.785  -6.918   9.765
  721    QZ   LYS  69           QZ       LYS  69 -11.292  -6.763  11.446
  722    H    GLU  70           H        GLU  70 -10.788  -3.899   5.594
  723    HA   GLU  70           HA       GLU  70 -11.650  -1.555   4.070
  724   1HB   GLU  70          2HB       GLU  70 -12.429  -4.459   4.319
  725   2HB   GLU  70          1HB       GLU  70 -13.389  -3.351   3.339
  726   1HG   GLU  70          2HG       GLU  70 -11.918  -3.640   1.661
  727   2HG   GLU  70          1HG       GLU  70 -10.693  -2.855   2.657
  728    QB   GLU  70           QB       GLU  70 -12.909  -3.905   3.829
  729    QG   GLU  70           QG       GLU  70 -11.305  -3.247   2.159
  730    H    ARG  71           H        ARG  71 -12.217  -0.340   6.165
  731    HA   ARG  71           HA       ARG  71 -15.072  -0.281   6.536
  732   1HB   ARG  71          2HB       ARG  71 -13.775  -2.336   7.883
  733   2HB   ARG  71          1HB       ARG  71 -13.915  -1.080   9.114
  734   1HG   ARG  71          2HG       ARG  71 -15.983  -2.055   9.385
  735   2HG   ARG  71          1HG       ARG  71 -16.394  -0.924   8.096
  736   1HD   ARG  71          2HD       ARG  71 -16.303  -2.609   6.428
  737   2HD   ARG  71          1HD       ARG  71 -15.405  -3.718   7.483
  738    HE   ARG  71           HE       ARG  71 -17.555  -3.591   8.961
  739   1HH1  ARG  71          1HH1      ARG  71 -17.208  -4.426   5.721
  740   2HH1  ARG  71          2HH1      ARG  71 -18.905  -4.536   5.388
  741   1HH2  ARG  71          1HH2      ARG  71 -19.861  -3.247   8.463
  742   2HH2  ARG  71          2HH2      ARG  71 -20.407  -3.868   6.941
  743    QB   ARG  71           QB       ARG  71 -13.845  -1.708   8.498
  744    QG   ARG  71           QG       ARG  71 -16.188  -1.489   8.741
  745    QD   ARG  71           QD       ARG  71 -15.854  -3.164   6.955
  746    QH1  ARG  71           QH1      ARG  71 -18.057  -4.481   5.555
  747    QH2  ARG  71           QH2      ARG  71 -20.134  -3.558   7.702
  748    H    ASP  72           H        ASP  72 -11.881   0.419   7.925
  749    HA   ASP  72           HA       ASP  72 -12.488   2.524   9.683
  750   1HB   ASP  72          2HB       ASP  72 -10.279   1.582   9.481
  751   2HB   ASP  72          1HB       ASP  72 -10.178   2.021   7.777
  752    QB   ASP  72           QB       ASP  72 -10.229   1.801   8.629
  753    H    ALA  73           H        ALA  73 -13.924   4.146   9.120
  754    HA   ALA  73           HA       ALA  73 -13.730   5.377   6.411
  755   1HB   ALA  73          1HB       ALA  73 -15.774   5.320   8.635
  756   2HB   ALA  73          2HB       ALA  73 -15.925   4.675   7.001
  757   3HB   ALA  73          3HB       ALA  73 -15.929   6.418   7.264
  758    MB   ALA  73           QB       ALA  73 -15.876   5.471   7.633
  759    H    VAL  74           H        VAL  74 -12.674   7.287   6.219
  760    HA   VAL  74           HA       VAL  74 -11.690   9.360   6.753
  761    HB   VAL  74           HB       VAL  74 -13.842   9.293   8.893
  762   1HG1  VAL  74          1HG1      VAL  74 -13.919  10.092   5.971
  763   2HG1  VAL  74          3HG1      VAL  74 -14.869   8.831   6.756
  764   3HG1  VAL  74          2HG1      VAL  74 -15.173  10.527   7.133
  765   1HG2  VAL  74          2HG2      VAL  74 -11.832  11.145   8.471
  766   2HG2  VAL  74          1HG2      VAL  74 -13.178  11.819   7.552
  767   3HG2  VAL  74          3HG2      VAL  74 -13.368  11.478   9.273
  768    MG1  VAL  74           QG1      VAL  74 -14.654   9.817   6.620
  769    MG2  VAL  74           QG2      VAL  74 -12.793  11.481   8.432
  770    QG   VAL  74           QQG      VAL  74 -13.723  10.649   7.526
  771    H    GLN  75           H        GLN  75  -9.648   9.221   7.649
  772    HA   GLN  75           HA       GLN  75  -9.456   8.989  10.574
  773   1HB   GLN  75          2HB       GLN  75  -9.461   6.679   9.324
  774   2HB   GLN  75          1HB       GLN  75  -7.788   7.086   8.961
  775   1HG   GLN  75          2HG       GLN  75  -7.448   7.518  11.426
  776   2HG   GLN  75          1HG       GLN  75  -9.057   6.850  11.696
  777   1HE2  GLN  75          1HE2      GLN  75  -6.057   5.934   9.892
  778   2HE2  GLN  75          2HE2      GLN  75  -6.132   4.293  10.322
  779    QB   GLN  75           QB       GLN  75  -8.624   6.883   9.142
  780    QG   GLN  75           QG       GLN  75  -8.252   7.184  11.561
  781    QE   GLN  75           QE2      GLN  75  -6.094   5.113  10.107
  782    H    GLY  76           H        GLY  76  -6.937   8.447   8.073
  783   1HA   GLY  76          1HA       GLY  76  -5.923  11.120   8.114
  784   2HA   GLY  76          2HA       GLY  76  -5.024   9.701   7.577
  785    QA   GLY  76           QA       GLY  76  -5.474  10.410   7.845
  786    H    GLY  77           H        GLY  77  -3.104   9.791   8.682
  787   1HA   GLY  77          1HA       GLY  77  -3.197  10.437  11.593
  788   2HA   GLY  77          2HA       GLY  77  -1.765  10.590  10.577
  789    QA   GLY  77           QA       GLY  77  -2.481  10.513  11.085
  790    H    GLN  78           H        GLN  78  -3.145   7.750   9.611
  791    HA   GLN  78           HA       GLN  78  -1.531   6.186  11.596
  792   1HB   GLN  78          2HB       GLN  78  -4.341   6.155  10.970
  793   2HB   GLN  78          1HB       GLN  78  -3.634   4.601  10.521
  794   1HG   GLN  78          2HG       GLN  78  -2.450   4.791  12.866
  795   2HG   GLN  78          1HG       GLN  78  -3.769   5.908  13.219
  796   1HE2  GLN  78          1HE2      GLN  78  -3.296   2.619  11.796
  797   2HE2  GLN  78          2HE2      GLN  78  -4.709   1.967  12.475
  798    QB   GLN  78           QB       GLN  78  -3.987   5.378  10.746
  799    QG   GLN  78           QG       GLN  78  -3.110   5.350  13.043
  800    QE   GLN  78           QE2      GLN  78  -4.003   2.293  12.135
  801    H    GLY  79           H        GLY  79  -0.334   4.450  10.708
  802   1HA   GLY  79          1HA       GLY  79   0.862   3.315   9.038
  803   2HA   GLY  79          2HA       GLY  79   0.489   4.676   7.979
  804    QA   GLY  79           QA       GLY  79   0.675   3.996   8.509
  805    H    LEU  80           H        LEU  80  -0.133   3.531   6.147
  806    HA   LEU  80           HA       LEU  80  -2.780   2.245   6.237
  807   1HB   LEU  80          2HB       LEU  80  -0.813   2.707   3.968
  808   2HB   LEU  80          1HB       LEU  80  -2.524   2.318   3.795
  809    HG   LEU  80           HG       LEU  80  -1.606   4.752   5.331
  810   1HD1  LEU  80          1HD1      LEU  80  -1.602   4.270   2.429
  811   2HD1  LEU  80          3HD1      LEU  80  -2.530   5.691   2.912
  812   3HD1  LEU  80          2HD1      LEU  80  -0.829   5.556   3.356
  813   1HD2  LEU  80          3HD2      LEU  80  -4.168   3.633   4.281
  814   2HD2  LEU  80          2HD2      LEU  80  -3.853   4.490   5.790
  815   3HD2  LEU  80          1HD2      LEU  80  -3.983   5.387   4.277
  816    MD1  LEU  80           QD1      LEU  80  -1.653   5.172   2.899
  817    MD2  LEU  80           QD2      LEU  80  -4.002   4.503   4.783
  818    QB   LEU  80           QB       LEU  80  -1.669   2.513   3.881
  819    QD   LEU  80           QQD      LEU  80  -2.827   4.838   3.841
  820    H    ILE  81           H        ILE  81   0.528   1.308   5.226
  821    HA   ILE  81           HA       ILE  81  -0.062  -1.497   6.009
  822    HB   ILE  81           HB       ILE  81   0.737  -2.245   3.747
  823   1HG1  ILE  81          2HG1      ILE  81   0.459   0.704   3.078
  824   2HG1  ILE  81          1HG1      ILE  81   1.992  -0.156   3.221
  825   1HG2  ILE  81          1HG2      ILE  81  -1.715  -1.863   4.398
  826   2HG2  ILE  81          3HG2      ILE  81  -1.609  -0.354   3.492
  827   3HG2  ILE  81          2HG2      ILE  81  -1.360  -1.895   2.671
  828   1HD1  ILE  81          1HD1      ILE  81  -0.001  -1.425   1.437
  829   2HD1  ILE  81          3HD1      ILE  81   0.630   0.124   0.878
  830   3HD1  ILE  81          2HD1      ILE  81   1.736  -1.208   1.214
  831    MG   ILE  81           QG2      ILE  81  -1.561  -1.371   3.520
  832    MD   ILE  81           QD1      ILE  81   0.789  -0.836   1.176
  833    QG   ILE  81           QG1      ILE  81   1.225   0.274   3.149
  834    H    LYS  82           H        LYS  82   1.892  -2.722   6.362
  835    HA   LYS  82           HA       LYS  82   4.182  -1.158   7.208
  836   1HB   LYS  82          2HB       LYS  82   3.078  -3.618   7.745
  837   2HB   LYS  82          1HB       LYS  82   4.493  -4.064   6.790
  838   1HG   LYS  82          2HG       LYS  82   5.681  -3.838   8.699
  839   2HG   LYS  82          1HG       LYS  82   5.463  -2.099   8.499
  840   1HD   LYS  82          2HD       LYS  82   3.156  -2.524   9.672
  841   2HD   LYS  82          1HD       LYS  82   3.924  -4.008  10.238
  842   1HE   LYS  82          2HE       LYS  82   5.455  -1.445  10.524
  843   2HE   LYS  82          1HE       LYS  82   4.132  -1.770  11.661
  844   1HZ   LYS  82          3HZ       LYS  82   5.125  -4.082  11.838
  845   2HZ   LYS  82          2HZ       LYS  82   6.512  -3.439  11.096
  846   3HZ   LYS  82          1HZ       LYS  82   5.987  -2.830  12.593
  847    QB   LYS  82           QB       LYS  82   3.786  -3.841   7.268
  848    QD   LYS  82           QD       LYS  82   3.540  -3.266   9.955
  849    QG   LYS  82           QG       LYS  82   5.572  -2.968   8.599
  850    QE   LYS  82           QE       LYS  82   4.793  -1.608  11.093
  851    QZ   LYS  82           QZ       LYS  82   5.875  -3.450  11.842
  852    H    ILE  83           H        ILE  83   6.372  -1.381   6.322
  853    HA   ILE  83           HA       ILE  83   6.758  -2.611   3.689
  854    HB   ILE  83           HB       ILE  83   5.528  -0.544   3.158
  855   1HG1  ILE  83          2HG1      ILE  83   8.254   0.291   2.380
  856   2HG1  ILE  83          1HG1      ILE  83   7.865  -1.389   2.007
  857   1HG2  ILE  83          2HG2      ILE  83   7.778   0.764   4.713
  858   2HG2  ILE  83          1HG2      ILE  83   6.644   1.650   3.692
  859   3HG2  ILE  83          3HG2      ILE  83   6.060   0.785   5.113
  860   1HD1  ILE  83          1HD1      ILE  83   6.083   0.947   1.271
  861   2HD1  ILE  83          3HD1      ILE  83   7.267   0.238   0.173
  862   3HD1  ILE  83          2HD1      ILE  83   5.910  -0.730   0.751
  863    MG   ILE  83           QG2      ILE  83   6.827   1.066   4.506
  864    MD   ILE  83           QD1      ILE  83   6.420   0.152   0.732
  865    QG   ILE  83           QG1      ILE  83   8.060  -0.549   2.194
  866    H    GLY  84           H        GLY  84   8.999  -2.716   3.154
  867   1HA   GLY  84          1HA       GLY  84  11.002  -3.166   4.776
  868   2HA   GLY  84          2HA       GLY  84  10.886  -1.430   5.069
  869    QA   GLY  84           QA       GLY  84  10.944  -2.298   4.923

  No H/Q in entry =         869
  Start of MODEL   19
    1    H1   MET   1          2H        MET   1   5.514  22.331  17.849
    2    H2   MET   1          1H        MET   1   5.769  23.973  17.497
    3    H3   MET   1          3H        MET   1   7.073  22.890  17.474
    4    HA   MET   1           HA       MET   1   7.144  22.696  19.785
    5   1HB   MET   1          2HB       MET   1   7.906  24.854  18.844
    6   2HB   MET   1          1HB       MET   1   6.278  25.509  19.032
    7   1HG   MET   1          2HG       MET   1   6.497  25.763  21.292
    8   2HG   MET   1          1HG       MET   1   7.459  24.294  21.466
    9   1HE   MET   1          2HE       MET   1   8.865  24.992  23.004
   10   2HE   MET   1          1HE       MET   1  10.185  24.497  21.948
   11   3HE   MET   1          3HE       MET   1  10.279  26.028  22.829
   12    QB   MET   1           QB       MET   1   7.092  25.181  18.938
   13    QG   MET   1           QG       MET   1   6.978  25.028  21.379
   14    ME   MET   1           QE       MET   1   9.776  25.172  22.594
   15    H    LYS   2           H        LYS   2   4.777  21.458  19.589
   16    HA   LYS   2           HA       LYS   2   3.035  22.897  21.557
   17   1HB   LYS   2          2HB       LYS   2   2.516  22.377  18.838
   18   2HB   LYS   2          1HB       LYS   2   1.567  21.188  19.728
   19   1HG   LYS   2          2HG       LYS   2   0.218  22.775  20.683
   20   2HG   LYS   2          1HG       LYS   2   1.519  23.961  20.791
   21   1HD   LYS   2          2HD       LYS   2   0.551  23.192  18.070
   22   2HD   LYS   2          1HD       LYS   2  -0.466  24.257  19.040
   23   1HE   LYS   2          2HE       LYS   2   2.348  25.057  19.138
   24   2HE   LYS   2          1HE       LYS   2   1.695  25.078  17.488
   25   1HZ   LYS   2          3HZ       LYS   2  -0.338  26.155  18.549
   26   2HZ   LYS   2          2HZ       LYS   2   0.659  26.454  19.893
   27   3HZ   LYS   2          1HZ       LYS   2   1.045  27.122  18.380
   28    QB   LYS   2           QB       LYS   2   2.041  21.783  19.283
   29    QD   LYS   2           QD       LYS   2   0.043  23.724  18.555
   30    QG   LYS   2           QG       LYS   2   0.868  23.368  20.737
   31    QE   LYS   2           QE       LYS   2   2.021  25.068  18.313
   32    QZ   LYS   2           QZ       LYS   2   0.455  26.577  18.940
   33    H    LEU   3           H        LEU   3   2.053  21.513  23.097
   34    HA   LEU   3           HA       LEU   3   3.377  18.991  23.619
   35   1HB   LEU   3          2HB       LEU   3   1.456  20.826  24.836
   36   2HB   LEU   3          1HB       LEU   3   1.054  19.140  25.160
   37    HG   LEU   3           HG       LEU   3   3.655  18.964  25.655
   38   1HD1  LEU   3          2HD1      LEU   3   1.348  19.110  27.181
   39   2HD1  LEU   3          1HD1      LEU   3   2.950  18.696  27.791
   40   3HD1  LEU   3          3HD1      LEU   3   2.370  20.358  27.893
   41   1HD2  LEU   3          3HD2      LEU   3   3.845  21.454  24.957
   42   2HD2  LEU   3          2HD2      LEU   3   3.126  21.803  26.529
   43   3HD2  LEU   3          1HD2      LEU   3   4.669  20.953  26.433
   44    MD1  LEU   3           QD1      LEU   3   2.223  19.388  27.622
   45    MD2  LEU   3           QD2      LEU   3   3.880  21.403  25.973
   46    QB   LEU   3           QB       LEU   3   1.255  19.983  24.998
   47    QD   LEU   3           QQD      LEU   3   3.051  20.396  26.797
   48    H    LYS   4           H        LYS   4   1.955  16.965  24.034
   49    HA   LYS   4           HA       LYS   4  -0.292  16.719  22.087
   50   1HB   LYS   4          2HB       LYS   4   0.819  14.657  21.198
   51   2HB   LYS   4          1HB       LYS   4   1.758  16.119  20.895
   52   1HG   LYS   4          2HG       LYS   4   2.309  14.729  23.461
   53   2HG   LYS   4          1HG       LYS   4   2.826  13.889  21.999
   54   1HD   LYS   4          2HD       LYS   4   3.437  16.797  22.150
   55   2HD   LYS   4          1HD       LYS   4   4.361  15.738  23.215
   56   1HE   LYS   4          2HE       LYS   4   4.141  14.601  20.538
   57   2HE   LYS   4          1HE       LYS   4   4.905  16.203  20.513
   58   1HZ   LYS   4          1HZ       LYS   4   5.618  14.056  22.437
   59   2HZ   LYS   4          3HZ       LYS   4   6.474  14.352  21.002
   60   3HZ   LYS   4          2HZ       LYS   4   6.415  15.541  22.215
   61    QB   LYS   4           QB       LYS   4   1.289  15.388  21.047
   62    QD   LYS   4           QD       LYS   4   3.899  16.267  22.682
   63    QG   LYS   4           QG       LYS   4   2.568  14.309  22.730
   64    QE   LYS   4           QE       LYS   4   4.523  15.402  20.525
   65    QZ   LYS   4           QZ       LYS   4   6.169  14.650  21.885
   66    H    VAL   5           H        VAL   5  -1.128  14.273  22.332
   67    HA   VAL   5           HA       VAL   5  -1.514  13.851  25.254
   68    HB   VAL   5           HB       VAL   5  -3.469  12.569  24.504
   69   1HG1  VAL   5          2HG1      VAL   5  -2.947  15.330  23.847
   70   2HG1  VAL   5          1HG1      VAL   5  -4.057  14.635  22.666
   71   3HG1  VAL   5          3HG1      VAL   5  -4.454  14.589  24.385
   72   1HG2  VAL   5          3HG2      VAL   5  -1.939  12.536  22.005
   73   2HG2  VAL   5          2HG2      VAL   5  -3.217  11.452  22.552
   74   3HG2  VAL   5          1HG2      VAL   5  -3.631  12.976  21.766
   75    MG1  VAL   5           QG1      VAL   5  -3.819  14.851  23.633
   76    MG2  VAL   5           QG2      VAL   5  -2.929  12.321  22.108
   77    QG   VAL   5           QQG      VAL   5  -3.374  13.586  22.870
   78    H    THR   6           H        THR   6  -1.029  11.847  26.233
   79    HA   THR   6           HA       THR   6   1.140  10.308  25.169
   80    HB   THR   6           HB       THR   6  -0.851   9.382  27.245
   81    HG1  THR   6           HG1      THR   6   1.259  11.227  27.645
   82   1HG2  THR   6          2HG2      THR   6   2.131   9.100  26.830
   83   2HG2  THR   6          1HG2      THR   6   1.324   8.653  28.333
   84   3HG2  THR   6          3HG2      THR   6   0.918   7.821  26.832
   85    MG   THR   6           QG2      THR   6   1.458   8.525  27.331
   86    H    VAL   7           H        VAL   7   1.077   8.666  23.681
   87    HA   VAL   7           HA       VAL   7  -1.575   7.371  23.131
   88    HB   VAL   7           HB       VAL   7   0.815   7.982  21.361
   89   1HG1  VAL   7          3HG1      VAL   7  -0.748   9.866  22.006
   90   2HG1  VAL   7          2HG1      VAL   7  -0.656   9.549  20.273
   91   3HG1  VAL   7          1HG1      VAL   7  -2.042   8.976  21.202
   92   1HG2  VAL   7          2HG2      VAL   7  -1.256   5.988  21.104
   93   2HG2  VAL   7          1HG2      VAL   7  -1.439   7.202  19.838
   94   3HG2  VAL   7          3HG2      VAL   7   0.086   6.332  20.013
   95    MG1  VAL   7           QG1      VAL   7  -1.149   9.464  21.160
   96    MG2  VAL   7           QG2      VAL   7  -0.870   6.507  20.318
   97    QG   VAL   7           QQG      VAL   7  -1.009   7.985  20.739
   98    H    ASN   8           H        ASN   8   1.735   6.479  22.155
   99    HA   ASN   8           HA       ASN   8   2.868   4.415  22.359
  100   1HB   ASN   8          2HB       ASN   8   2.729   5.454  24.709
  101   2HB   ASN   8          1HB       ASN   8   1.431   4.299  25.018
  102   1HD2  ASN   8          1HD2      ASN   8   2.937   3.302  26.655
  103   2HD2  ASN   8          2HD2      ASN   8   4.154   2.245  26.120
  104    QB   ASN   8           QB       ASN   8   2.080   4.876  24.864
  105    QD   ASN   8           QD2      ASN   8   3.546   2.773  26.388
  106    H    GLY   9           H        GLY   9   0.196   4.332  21.116
  107   1HA   GLY   9          1HA       GLY   9  -0.804   1.687  22.064
  108   2HA   GLY   9          2HA       GLY   9  -0.405   1.913  20.361
  109    QA   GLY   9           QA       GLY   9  -0.605   1.800  21.212
  110    H    ALA  10           H        ALA  10  -2.777   1.314  20.155
  111    HA   ALA  10           HA       ALA  10  -4.966   2.004  19.597
  112   1HB   ALA  10          2HB       ALA  10  -4.965   2.005  22.095
  113   2HB   ALA  10          1HB       ALA  10  -4.489   3.704  22.067
  114   3HB   ALA  10          3HB       ALA  10  -6.058   3.218  21.427
  115    MB   ALA  10           QB       ALA  10  -5.171   2.976  21.863
  116    H    GLY  11           H        GLY  11  -2.881   3.413  18.218
  117   1HA   GLY  11          1HA       GLY  11  -3.484   6.276  18.331
  118   2HA   GLY  11          2HA       GLY  11  -4.138   5.464  16.908
  119    QA   GLY  11           QA       GLY  11  -3.811   5.870  17.619
  120    H    LYS  12           H        LYS  12  -2.660   6.790  15.617
  121    HA   LYS  12           HA       LYS  12  -0.662   7.090  14.394
  122   1HB   LYS  12          2HB       LYS  12  -0.130   7.143  17.208
  123   2HB   LYS  12          1HB       LYS  12   1.227   6.347  16.408
  124   1HG   LYS  12          2HG       LYS  12   1.114   8.312  14.720
  125   2HG   LYS  12          1HG       LYS  12   0.142   9.123  15.948
  126   1HD   LYS  12          2HD       LYS  12   1.960   9.575  17.202
  127   2HD   LYS  12          1HD       LYS  12   2.504   7.899  17.118
  128   1HE   LYS  12          2HE       LYS  12   4.028   8.385  15.503
  129   2HE   LYS  12          1HE       LYS  12   2.839   9.314  14.568
  130   1HZ   LYS  12          3HZ       LYS  12   3.059  11.116  16.192
  131   2HZ   LYS  12          2HZ       LYS  12   4.262  10.240  17.009
  132   3HZ   LYS  12          1HZ       LYS  12   4.537  10.789  15.426
  133    QB   LYS  12           QB       LYS  12   0.548   6.745  16.808
  134    QD   LYS  12           QD       LYS  12   2.232   8.737  17.160
  135    QG   LYS  12           QG       LYS  12   0.628   8.718  15.334
  136    QE   LYS  12           QE       LYS  12   3.433   8.849  15.036
  137    QZ   LYS  12           QZ       LYS  12   3.952  10.715  16.209
  138    H    ALA  13           H        ALA  13   1.263   5.858  13.550
  139    HA   ALA  13           HA       ALA  13   0.638   2.962  13.425
  140   1HB   ALA  13          2HB       ALA  13   1.287   4.812  11.561
  141   2HB   ALA  13          3HB       ALA  13   1.643   3.098  11.358
  142   3HB   ALA  13          1HB       ALA  13   2.897   4.196  11.930
  143    MB   ALA  13           QB       ALA  13   1.943   4.035  11.616
  144    H    GLY  14           H        GLY  14   3.336   2.143  12.789
  145   1HA   GLY  14          1HA       GLY  14   4.443   1.036  14.931
  146   2HA   GLY  14          2HA       GLY  14   4.865   2.715  15.273
  147    QA   GLY  14           QA       GLY  14   4.654   1.876  15.102
  148    H    GLU  15           H        GLU  15   6.735   0.550  14.760
  149    HA   GLU  15           HA       GLU  15   8.441   1.859  12.816
  150   1HB   GLU  15          2HB       GLU  15   8.480  -0.639  14.496
  151   2HB   GLU  15          1HB       GLU  15   9.739  -0.378  13.287
  152   1HG   GLU  15          2HG       GLU  15  10.429   1.674  14.319
  153   2HG   GLU  15          1HG       GLU  15   9.013   1.693  15.372
  154    QB   GLU  15           QB       GLU  15   9.109  -0.508  13.891
  155    QG   GLU  15           QG       GLU  15   9.721   1.683  14.846
  156    H    GLY  16           H        GLY  16   8.473   1.505  10.629
  157   1HA   GLY  16          1HA       GLY  16   7.544  -1.119   9.585
  158   2HA   GLY  16          2HA       GLY  16   8.512   0.052   8.688
  159    QA   GLY  16           QA       GLY  16   8.028  -0.534   9.137
  160    H    GLU  17           H        GLU  17   5.364   0.121  10.412
  161    HA   GLU  17           HA       GLU  17   3.794   0.555   8.047
  162   1HB   GLU  17          2HB       GLU  17   3.271   1.274  10.951
  163   2HB   GLU  17          1HB       GLU  17   2.044   1.083   9.700
  164   1HG   GLU  17          2HG       GLU  17   2.029  -1.154   9.953
  165   2HG   GLU  17          1HG       GLU  17   3.785  -1.236   9.799
  166    QB   GLU  17           QB       GLU  17   2.658   1.179  10.325
  167    QG   GLU  17           QG       GLU  17   2.907  -1.195   9.876
  168    H    ILE  18           H        ILE  18   2.611   2.591   7.544
  169    HA   ILE  18           HA       ILE  18   4.077   5.059   8.396
  170    HB   ILE  18           HB       ILE  18   3.899   5.774   5.998
  171   1HG1  ILE  18          2HG1      ILE  18   2.904   2.925   5.655
  172   2HG1  ILE  18          1HG1      ILE  18   1.971   4.393   5.368
  173   1HG2  ILE  18          2HG2      ILE  18   5.840   4.373   7.098
  174   2HG2  ILE  18          1HG2      ILE  18   5.253   3.090   6.038
  175   3HG2  ILE  18          3HG2      ILE  18   5.820   4.613   5.351
  176   1HD1  ILE  18          2HD1      ILE  18   4.211   4.827   3.828
  177   2HD1  ILE  18          1HD1      ILE  18   3.982   3.085   3.663
  178   3HD1  ILE  18          3HD1      ILE  18   2.681   4.193   3.222
  179    MG   ILE  18           QG2      ILE  18   5.638   4.026   6.162
  180    MD   ILE  18           QD1      ILE  18   3.625   4.035   3.571
  181    QG   ILE  18           QG1      ILE  18   2.437   3.659   5.511
  182    HA   PRO  19           HA       PRO  19  -0.120   6.322   9.140
  183   1HB   PRO  19          2HB       PRO  19   0.349   8.978   9.595
  184   2HB   PRO  19          1HB       PRO  19   0.718   7.714  10.786
  185   1HG   PRO  19          2HG       PRO  19   2.540   9.136   8.910
  186   2HG   PRO  19          1HG       PRO  19   2.810   8.642  10.588
  187   1HD   PRO  19          2HD       PRO  19   3.800   7.282   8.446
  188   2HD   PRO  19          1HD       PRO  19   3.415   6.514  10.002
  189    QB   PRO  19           QB       PRO  19   0.534   8.346  10.190
  190    QG   PRO  19           QG       PRO  19   2.675   8.889   9.749
  191    QD   PRO  19           QD       PRO  19   3.607   6.898   9.224
  192    H    ALA  20           H        ALA  20  -1.774   7.594   8.058
  193    HA   ALA  20           HA       ALA  20  -1.186   8.113   5.227
  194   1HB   ALA  20          2HB       ALA  20  -3.302   7.136   6.621
  195   2HB   ALA  20          1HB       ALA  20  -3.801   8.819   6.449
  196   3HB   ALA  20          3HB       ALA  20  -3.459   7.849   5.016
  197    MB   ALA  20           QB       ALA  20  -3.520   7.934   6.029
  198    HA   PRO  21           HA       PRO  21  -0.491  12.435   6.084
  199   1HB   PRO  21          2HB       PRO  21  -0.278  13.287   3.495
  200   2HB   PRO  21          1HB       PRO  21   1.021  12.417   4.334
  201   1HG   PRO  21          2HG       PRO  21  -0.942  11.423   2.340
  202   2HG   PRO  21          1HG       PRO  21   0.755  10.980   2.577
  203   1HD   PRO  21          2HD       PRO  21  -1.381   9.466   3.420
  204   2HD   PRO  21          1HD       PRO  21   0.251   9.384   4.119
  205    QB   PRO  21           QB       PRO  21   0.372  12.852   3.914
  206    QG   PRO  21           QG       PRO  21  -0.093  11.201   2.458
  207    QD   PRO  21           QD       PRO  21  -0.565   9.425   3.769
  208    H    LEU  22           H        LEU  22  -3.084  11.131   4.158
  209    HA   LEU  22           HA       LEU  22  -4.640  13.659   4.601
  210   1HB   LEU  22          2HB       LEU  22  -3.737  12.612   2.190
  211   2HB   LEU  22          1HB       LEU  22  -5.400  12.030   2.280
  212    HG   LEU  22           HG       LEU  22  -5.272  14.244   1.176
  213   1HD1  LEU  22          1HD1      LEU  22  -7.017  13.437   3.163
  214   2HD1  LEU  22          3HD1      LEU  22  -6.533  15.045   3.703
  215   3HD1  LEU  22          2HD1      LEU  22  -7.254  14.830   2.107
  216   1HD2  LEU  22          1HD2      LEU  22  -3.453  14.755   3.326
  217   2HD2  LEU  22          3HD2      LEU  22  -3.850  15.800   1.963
  218   3HD2  LEU  22          2HD2      LEU  22  -4.791  15.897   3.452
  219    MD1  LEU  22           QD1      LEU  22  -6.935  14.437   2.991
  220    MD2  LEU  22           QD2      LEU  22  -4.032  15.484   2.914
  221    QB   LEU  22           QB       LEU  22  -4.569  12.321   2.235
  222    QD   LEU  22           QQD      LEU  22  -5.483  14.961   2.952
  223    H    ALA  23           H        ALA  23  -6.855  13.336   5.131
  224    HA   ALA  23           HA       ALA  23  -7.489  10.703   6.285
  225   1HB   ALA  23          1HB       ALA  23  -8.197  13.467   6.622
  226   2HB   ALA  23          2HB       ALA  23  -8.567  12.109   7.684
  227   3HB   ALA  23          3HB       ALA  23  -9.673  12.533   6.377
  228    MB   ALA  23           QB       ALA  23  -8.813  12.703   6.895
  229    H    GLY  24           H        GLY  24  -9.686   9.731   5.798
  230   1HA   GLY  24          1HA       GLY  24 -10.018   9.403   2.933
  231   2HA   GLY  24          2HA       GLY  24 -11.347  10.317   3.649
  232    QA   GLY  24           QA       GLY  24 -10.683   9.860   3.291
  233    H    THR  25           H        THR  25 -12.247   8.081   2.631
  234    HA   THR  25           HA       THR  25 -12.497   6.197   4.953
  235    HB   THR  25           HB       THR  25 -14.421   6.668   2.660
  236    HG1  THR  25           HG1      THR  25 -15.513   7.978   4.244
  237   1HG2  THR  25          1HG2      THR  25 -14.414   5.101   5.188
  238   2HG2  THR  25          3HG2      THR  25 -15.920   5.910   4.761
  239   3HG2  THR  25          2HG2      THR  25 -15.197   4.750   3.648
  240    MG   THR  25           QG2      THR  25 -15.177   5.253   4.532
  241    H    VAL  26           H        VAL  26 -11.715   4.153   4.600
  242    HA   VAL  26           HA       VAL  26 -10.645   3.376   2.002
  243    HB   VAL  26           HB       VAL  26 -11.114   1.795   4.553
  244   1HG1  VAL  26          2HG1      VAL  26  -9.664   1.290   1.995
  245   2HG1  VAL  26          1HG1      VAL  26  -8.892   0.744   3.484
  246   3HG1  VAL  26          3HG1      VAL  26 -10.498   0.155   3.055
  247   1HG2  VAL  26          1HG2      VAL  26  -9.392   4.023   4.004
  248   2HG2  VAL  26          3HG2      VAL  26  -9.511   3.070   5.484
  249   3HG2  VAL  26          2HG2      VAL  26  -8.399   2.580   4.206
  250    MG1  VAL  26           QG1      VAL  26  -9.684   0.730   2.845
  251    MG2  VAL  26           QG2      VAL  26  -9.101   3.224   4.564
  252    QG   VAL  26           QQG      VAL  26  -9.393   1.977   3.705
  253    H    SER  27           H        SER  27 -11.598   1.984   0.503
  254    HA   SER  27           HA       SER  27 -14.231   0.758   1.235
  255   1HB   SER  27          2HB       SER  27 -13.471   2.442  -1.165
  256   2HB   SER  27          1HB       SER  27 -14.941   1.475  -1.102
  257    HG   SER  27           HG       SER  27 -15.582   2.663   0.705
  258    QB   SER  27           QB       SER  27 -14.206   1.958  -1.133
  259    H    LYS  28           H        LYS  28 -11.470   0.794  -1.027
  260    HA   LYS  28           HA       LYS  28 -11.852  -2.153  -1.383
  261   1HB   LYS  28          2HB       LYS  28 -12.144   0.021  -3.297
  262   2HB   LYS  28          1HB       LYS  28 -10.916  -1.132  -3.822
  263   1HG   LYS  28          2HG       LYS  28 -12.714  -2.921  -3.108
  264   2HG   LYS  28          1HG       LYS  28 -13.840  -1.579  -3.318
  265   1HD   LYS  28          2HD       LYS  28 -11.838  -1.990  -5.481
  266   2HD   LYS  28          1HD       LYS  28 -13.126  -3.189  -5.355
  267   1HE   LYS  28          2HE       LYS  28 -14.275  -0.567  -5.043
  268   2HE   LYS  28          1HE       LYS  28 -13.304  -0.607  -6.528
  269   1HZ   LYS  28          2HZ       LYS  28 -14.365  -2.881  -6.887
  270   2HZ   LYS  28          1HZ       LYS  28 -15.510  -2.406  -5.724
  271   3HZ   LYS  28          3HZ       LYS  28 -15.344  -1.520  -7.160
  272    QB   LYS  28           QB       LYS  28 -11.530  -0.556  -3.559
  273    QD   LYS  28           QD       LYS  28 -12.482  -2.589  -5.418
  274    QG   LYS  28           QG       LYS  28 -13.277  -2.250  -3.213
  275    QE   LYS  28           QE       LYS  28 -13.789  -0.587  -5.786
  276    QZ   LYS  28           QZ       LYS  28 -15.073  -2.269  -6.590
  277    H    ILE  29           H        ILE  29  -9.896  -3.302  -1.698
  278    HA   ILE  29           HA       ILE  29  -7.383  -1.696  -1.340
  279    HB   ILE  29           HB       ILE  29  -8.058  -2.999   0.641
  280   1HG1  ILE  29          2HG1      ILE  29  -5.932  -4.802  -0.166
  281   2HG1  ILE  29          1HG1      ILE  29  -5.588  -3.157  -0.701
  282   1HG2  ILE  29          2HG2      ILE  29  -8.092  -5.285  -1.346
  283   2HG2  ILE  29          1HG2      ILE  29  -8.067  -5.527   0.400
  284   3HG2  ILE  29          3HG2      ILE  29  -9.431  -4.703  -0.357
  285   1HD1  ILE  29          2HD1      ILE  29  -6.425  -2.585   1.773
  286   2HD1  ILE  29          1HD1      ILE  29  -5.868  -4.233   2.070
  287   3HD1  ILE  29          3HD1      ILE  29  -4.748  -3.022   1.443
  288    MG   ILE  29           QG2      ILE  29  -8.530  -5.172  -0.434
  289    MD   ILE  29           QD1      ILE  29  -5.680  -3.280   1.762
  290    QG   ILE  29           QG1      ILE  29  -5.760  -3.980  -0.434
  291    H    LEU  30           H        LEU  30  -5.534  -2.462  -2.534
  292    HA   LEU  30           HA       LEU  30  -6.145  -4.514  -4.638
  293   1HB   LEU  30          2HB       LEU  30  -4.972  -1.743  -4.781
  294   2HB   LEU  30          1HB       LEU  30  -4.578  -2.936  -6.020
  295    HG   LEU  30           HG       LEU  30  -7.279  -3.247  -5.876
  296   1HD1  LEU  30          2HD1      LEU  30  -7.452  -1.374  -4.247
  297   2HD1  LEU  30          1HD1      LEU  30  -6.726  -0.296  -5.439
  298   3HD1  LEU  30          3HD1      LEU  30  -8.301  -1.024  -5.753
  299   1HD2  LEU  30          3HD2      LEU  30  -5.362  -1.868  -7.611
  300   2HD2  LEU  30          2HD2      LEU  30  -6.709  -2.923  -8.042
  301   3HD2  LEU  30          1HD2      LEU  30  -6.993  -1.208  -7.737
  302    MD1  LEU  30           QD1      LEU  30  -7.493  -0.898  -5.147
  303    MD2  LEU  30           QD2      LEU  30  -6.355  -2.000  -7.797
  304    QB   LEU  30           QB       LEU  30  -4.775  -2.339  -5.400
  305    QD   LEU  30           QQD      LEU  30  -6.924  -1.449  -6.472
  306    H    VAL  31           H        VAL  31  -3.482  -2.708  -3.052
  307    HA   VAL  31           HA       VAL  31  -1.308  -4.309  -3.808
  308    HB   VAL  31           HB       VAL  31  -1.210  -2.189  -2.545
  309   1HG1  VAL  31          3HG1      VAL  31   0.551  -4.178  -2.379
  310   2HG1  VAL  31          2HG1      VAL  31   0.734  -2.720  -1.405
  311   3HG1  VAL  31          1HG1      VAL  31   0.042  -4.177  -0.691
  312   1HG2  VAL  31          1HG2      VAL  31  -3.193  -3.108  -1.030
  313   2HG2  VAL  31          3HG2      VAL  31  -1.858  -3.645  -0.010
  314   3HG2  VAL  31          2HG2      VAL  31  -2.041  -1.934  -0.397
  315    MG1  VAL  31           QG1      VAL  31   0.442  -3.692  -1.491
  316    MG2  VAL  31           QG2      VAL  31  -2.364  -2.896  -0.479
  317    QG   VAL  31           QQG      VAL  31  -0.961  -3.294  -0.985
  318    H    LYS  32           H        LYS  32  -0.442  -6.264  -3.042
  319    HA   LYS  32           HA       LYS  32  -2.262  -7.904  -1.331
  320   1HB   LYS  32          2HB       LYS  32   0.039  -8.637  -3.172
  321   2HB   LYS  32          1HB       LYS  32  -1.043  -9.781  -2.378
  322   1HG   LYS  32          2HG       LYS  32  -2.966  -8.792  -3.571
  323   2HG   LYS  32          1HG       LYS  32  -1.880  -7.656  -4.373
  324   1HD   LYS  32          2HD       LYS  32  -1.982  -9.314  -5.988
  325   2HD   LYS  32          1HD       LYS  32  -0.601  -9.883  -5.050
  326   1HE   LYS  32          2HE       LYS  32  -1.741 -11.697  -4.240
  327   2HE   LYS  32          1HE       LYS  32  -3.254 -10.783  -4.065
  328   1HZ   LYS  32          3HZ       LYS  32  -2.063 -11.621  -6.656
  329   2HZ   LYS  32          2HZ       LYS  32  -3.363 -12.403  -5.892
  330   3HZ   LYS  32          1HZ       LYS  32  -3.535 -10.807  -6.447
  331    QB   LYS  32           QB       LYS  32  -0.502  -9.209  -2.775
  332    QD   LYS  32           QD       LYS  32  -1.292  -9.599  -5.519
  333    QG   LYS  32           QG       LYS  32  -2.423  -8.224  -3.972
  334    QE   LYS  32           QE       LYS  32  -2.498 -11.240  -4.152
  335    QZ   LYS  32           QZ       LYS  32  -2.987 -11.610  -6.332
  336    H    GLU  33           H        GLU  33  -1.257  -9.236   0.358
  337    HA   GLU  33           HA       GLU  33   0.904  -7.820   1.761
  338   1HB   GLU  33          2HB       GLU  33   0.387  -9.539   3.502
  339   2HB   GLU  33          1HB       GLU  33  -1.056  -8.691   2.946
  340   1HG   GLU  33          2HG       GLU  33  -1.849 -10.528   1.761
  341   2HG   GLU  33          1HG       GLU  33  -0.242 -11.223   1.560
  342    QB   GLU  33           QB       GLU  33  -0.334  -9.115   3.224
  343    QG   GLU  33           QG       GLU  33  -1.045 -10.876   1.661
  344    H    GLY  34           H        GLY  34   2.979  -8.682   2.170
  345   1HA   GLY  34          1HA       GLY  34   3.781 -11.351   1.488
  346   2HA   GLY  34          2HA       GLY  34   4.881 -10.005   1.793
  347    QA   GLY  34           QA       GLY  34   4.331 -10.678   1.640
  348    H    ASP  35           H        ASP  35   3.162  -8.618  -0.484
  349    HA   ASP  35           HA       ASP  35   4.486 -10.012  -2.781
  350   1HB   ASP  35          2HB       ASP  35   1.864  -9.039  -2.267
  351   2HB   ASP  35          1HB       ASP  35   2.556  -8.004  -3.517
  352    QB   ASP  35           QB       ASP  35   2.210  -8.521  -2.892
  353    H    THR  36           H        THR  36   5.036  -8.334  -4.595
  354    HA   THR  36           HA       THR  36   6.515  -6.079  -3.303
  355    HB   THR  36           HB       THR  36   6.889  -7.269  -6.064
  356    HG1  THR  36           HG1      THR  36   8.052  -8.039  -3.594
  357   1HG2  THR  36          1HG2      THR  36   7.960  -5.067  -5.485
  358   2HG2  THR  36          3HG2      THR  36   8.840  -5.894  -4.200
  359   3HG2  THR  36          2HG2      THR  36   9.113  -6.340  -5.883
  360    MG   THR  36           QG2      THR  36   8.637  -5.767  -5.189
  361    H    VAL  37           H        VAL  37   5.294  -4.220  -3.446
  362    HA   VAL  37           HA       VAL  37   3.476  -3.776  -5.725
  363    HB   VAL  37           HB       VAL  37   2.899  -3.244  -3.361
  364   1HG1  VAL  37          3HG1      VAL  37   2.555  -1.614  -5.648
  365   2HG1  VAL  37          2HG1      VAL  37   1.550  -1.648  -4.199
  366   3HG1  VAL  37          1HG1      VAL  37   2.899  -0.518  -4.309
  367   1HG2  VAL  37          2HG2      VAL  37   5.502  -2.205  -3.316
  368   2HG2  VAL  37          1HG2      VAL  37   4.456  -0.790  -3.211
  369   3HG2  VAL  37          3HG2      VAL  37   4.304  -2.088  -2.026
  370    MG1  VAL  37           QG1      VAL  37   2.335  -1.260  -4.719
  371    MG2  VAL  37           QG2      VAL  37   4.754  -1.695  -2.851
  372    QG   VAL  37           QQG      VAL  37   3.544  -1.477  -3.785
  373    H    LYS  38           H        LYS  38   3.793  -2.167  -7.312
  374    HA   LYS  38           HA       LYS  38   6.582  -1.131  -7.525
  375   1HB   LYS  38          2HB       LYS  38   4.869  -2.422  -9.267
  376   2HB   LYS  38          1HB       LYS  38   4.695  -0.734  -9.749
  377   1HG   LYS  38          2HG       LYS  38   6.961  -0.519 -10.297
  378   2HG   LYS  38          1HG       LYS  38   7.433  -1.890  -9.291
  379   1HD   LYS  38          2HD       LYS  38   6.682  -3.464 -10.855
  380   2HD   LYS  38          1HD       LYS  38   5.610  -2.309 -11.648
  381   1HE   LYS  38          2HE       LYS  38   7.395  -2.430 -13.174
  382   2HE   LYS  38          1HE       LYS  38   7.878  -1.042 -12.179
  383   1HZ   LYS  38          3HZ       LYS  38   8.967  -2.736 -10.677
  384   2HZ   LYS  38          2HZ       LYS  38   8.767  -3.858 -11.938
  385   3HZ   LYS  38          1HZ       LYS  38   9.725  -2.475 -12.171
  386    QB   LYS  38           QB       LYS  38   4.782  -1.578  -9.508
  387    QD   LYS  38           QD       LYS  38   6.146  -2.887 -11.251
  388    QG   LYS  38           QG       LYS  38   7.197  -1.204  -9.794
  389    QE   LYS  38           QE       LYS  38   7.637  -1.736 -12.677
  390    QZ   LYS  38           QZ       LYS  38   9.153  -3.023 -11.596
  391    H    ALA  39           H        ALA  39   6.929   1.125  -7.994
  392    HA   ALA  39           HA       ALA  39   5.242   2.974  -6.596
  393   1HB   ALA  39          1HB       ALA  39   7.775   2.871  -7.837
  394   2HB   ALA  39          2HB       ALA  39   7.119   4.203  -6.886
  395   3HB   ALA  39          3HB       ALA  39   6.910   4.182  -8.637
  396    MB   ALA  39           QB       ALA  39   7.268   3.752  -7.787
  397    H    GLY  40           H        GLY  40   3.430   4.049  -7.302
  398   1HA   GLY  40          1HA       GLY  40   3.028   4.457 -10.209
  399   2HA   GLY  40          2HA       GLY  40   2.106   5.236  -8.923
  400    QA   GLY  40           QA       GLY  40   2.567   4.846  -9.566
  401    H    GLN  41           H        GLN  41   1.883   2.451  -7.619
  402    HA   GLN  41           HA       GLN  41  -0.208   1.350  -9.470
  403   1HB   GLN  41          2HB       GLN  41   2.048   0.151  -8.544
  404   2HB   GLN  41          1HB       GLN  41   0.914  -0.297  -7.269
  405   1HG   GLN  41          2HG       GLN  41  -0.675  -1.058  -9.095
  406   2HG   GLN  41          1HG       GLN  41   0.653  -0.839 -10.236
  407   1HE2  GLN  41          1HE2      GLN  41  -0.390  -2.736  -7.401
  408   2HE2  GLN  41          2HE2      GLN  41   0.735  -3.987  -7.619
  409    QB   GLN  41           QB       GLN  41   1.481  -0.073  -7.906
  410    QG   GLN  41           QG       GLN  41  -0.011  -0.949  -9.666
  411    QE   GLN  41           QE2      GLN  41   0.173  -3.361  -7.510
  412    H    THR  42           H        THR  42  -2.255   1.684  -8.726
  413    HA   THR  42           HA       THR  42  -2.985   2.852  -6.270
  414    HB   THR  42           HB       THR  42  -4.474   0.922  -8.080
  415    HG1  THR  42           HG1      THR  42  -5.061   2.717  -9.156
  416   1HG2  THR  42          3HG2      THR  42  -5.510   1.190  -5.823
  417   2HG2  THR  42          2HG2      THR  42  -5.575   2.931  -6.097
  418   3HG2  THR  42          1HG2      THR  42  -6.511   1.841  -7.121
  419    MG   THR  42           QG2      THR  42  -5.866   1.988  -6.347
  420    H    VAL  43           H        VAL  43  -2.116   1.913  -4.396
  421    HA   VAL  43           HA       VAL  43  -2.294  -1.000  -3.968
  422    HB   VAL  43           HB       VAL  43  -1.155  -0.378  -1.833
  423   1HG1  VAL  43          3HG1      VAL  43  -0.098  -0.445  -4.300
  424   2HG1  VAL  43          2HG1      VAL  43   0.250   1.238  -3.906
  425   3HG1  VAL  43          1HG1      VAL  43   0.869  -0.053  -2.878
  426   1HG2  VAL  43          1HG2      VAL  43  -2.437   2.025  -2.122
  427   2HG2  VAL  43          3HG2      VAL  43  -1.055   1.761  -1.060
  428   3HG2  VAL  43          2HG2      VAL  43  -0.813   2.433  -2.672
  429    MG1  VAL  43           QG1      VAL  43   0.341   0.246  -3.695
  430    MG2  VAL  43           QG2      VAL  43  -1.435   2.073  -1.951
  431    QG   VAL  43           QQG      VAL  43  -0.547   1.160  -2.823
  432    H    LEU  44           H        LEU  44  -4.119   1.865  -3.205
  433    HA   LEU  44           HA       LEU  44  -6.137   0.192  -1.806
  434   1HB   LEU  44          2HB       LEU  44  -4.308   2.169  -0.607
  435   2HB   LEU  44          1HB       LEU  44  -6.005   2.423  -0.192
  436    HG   LEU  44           HG       LEU  44  -5.171  -0.394  -0.075
  437   1HD1  LEU  44          1HD1      LEU  44  -3.230   1.287   0.812
  438   2HD1  LEU  44          3HD1      LEU  44  -4.223   1.163   2.264
  439   3HD1  LEU  44          2HD1      LEU  44  -3.547  -0.292   1.532
  440   1HD2  LEU  44          2HD2      LEU  44  -6.663   1.575   1.661
  441   2HD2  LEU  44          1HD2      LEU  44  -7.299   0.172   0.803
  442   3HD2  LEU  44          3HD2      LEU  44  -6.282  -0.051   2.228
  443    MD1  LEU  44           QD1      LEU  44  -3.667   0.719   1.536
  444    MD2  LEU  44           QD2      LEU  44  -6.748   0.565   1.564
  445    QB   LEU  44           QB       LEU  44  -5.157   2.296  -0.400
  446    QD   LEU  44           QQD      LEU  44  -5.207   0.642   1.550
  447    H    VAL  45           H        VAL  45  -8.150   1.618  -1.367
  448    HA   VAL  45           HA       VAL  45  -8.381   3.827  -3.373
  449    HB   VAL  45           HB       VAL  45 -10.239   1.462  -2.959
  450   1HG1  VAL  45          1HG1      VAL  45 -10.418   3.903  -4.746
  451   2HG1  VAL  45          3HG1      VAL  45 -11.409   2.461  -4.966
  452   3HG1  VAL  45          2HG1      VAL  45 -11.557   3.414  -3.491
  453   1HG2  VAL  45          1HG2      VAL  45  -8.346   2.264  -5.184
  454   2HG2  VAL  45          3HG2      VAL  45  -8.299   0.790  -4.217
  455   3HG2  VAL  45          2HG2      VAL  45  -9.602   1.041  -5.380
  456    MG1  VAL  45           QG1      VAL  45 -11.128   3.259  -4.401
  457    MG2  VAL  45           QG2      VAL  45  -8.749   1.365  -4.927
  458    QG   VAL  45           QQG      VAL  45  -9.939   2.312  -4.664
  459    H    LEU  46           H        LEU  46  -9.658   5.535  -2.660
  460    HA   LEU  46           HA       LEU  46 -10.843   5.264   0.079
  461   1HB   LEU  46          2HB       LEU  46  -9.461   7.418  -1.485
  462   2HB   LEU  46          1HB       LEU  46 -10.614   7.893  -0.237
  463    HG   LEU  46           HG       LEU  46  -8.460   5.866   0.345
  464   1HD1  LEU  46          2HD1      LEU  46  -8.206   8.803  -0.023
  465   2HD1  LEU  46          1HD1      LEU  46  -7.454   8.136   1.426
  466   3HD1  LEU  46          3HD1      LEU  46  -6.983   7.541  -0.166
  467   1HD2  LEU  46          2HD2      LEU  46 -10.625   7.000   1.770
  468   2HD2  LEU  46          1HD2      LEU  46  -9.352   5.961   2.411
  469   3HD2  LEU  46          3HD2      LEU  46  -9.163   7.714   2.448
  470    MD1  LEU  46           QD1      LEU  46  -7.548   8.160   0.412
  471    MD2  LEU  46           QD2      LEU  46  -9.713   6.892   2.210
  472    QB   LEU  46           QB       LEU  46 -10.037   7.655  -0.861
  473    QD   LEU  46           QQD      LEU  46  -8.631   7.526   1.311
  474    H    GLU  47           H        GLU  47 -12.772   6.805   0.394
  475    HA   GLU  47           HA       GLU  47 -14.355   7.339  -2.054
  476   1HB   GLU  47          2HB       GLU  47 -14.635   4.915  -1.259
  477   2HB   GLU  47          1HB       GLU  47 -15.428   5.583   0.167
  478   1HG   GLU  47          2HG       GLU  47 -16.486   6.799  -2.238
  479   2HG   GLU  47          1HG       GLU  47 -16.618   5.042  -2.324
  480    QB   GLU  47           QB       GLU  47 -15.031   5.249  -0.546
  481    QG   GLU  47           QG       GLU  47 -16.552   5.921  -2.281
  482    H    ALA  48           H        ALA  48 -15.377   9.278  -1.724
  483    HA   ALA  48           HA       ALA  48 -16.032  10.062   1.099
  484   1HB   ALA  48          1HB       ALA  48 -15.371  12.340   0.445
  485   2HB   ALA  48          2HB       ALA  48 -15.050  11.788  -1.199
  486   3HB   ALA  48          3HB       ALA  48 -14.049  11.215   0.135
  487    MB   ALA  48           QB       ALA  48 -14.823  11.781  -0.206
  488    H    MET  49           H        MET  49 -17.306  12.512   0.278
  489    HA   MET  49           HA       MET  49 -19.868  11.394  -0.710
  490   1HB   MET  49          2HB       MET  49 -19.340  12.980   1.340
  491   2HB   MET  49          1HB       MET  49 -19.397  14.244   0.111
  492   1HG   MET  49          2HG       MET  49 -21.628  14.118   0.871
  493   2HG   MET  49          1HG       MET  49 -21.639  13.155  -0.607
  494   1HE   MET  49          3HE       MET  49 -23.857  13.020   1.458
  495   2HE   MET  49          2HE       MET  49 -23.844  11.921   0.082
  496   3HE   MET  49          1HE       MET  49 -24.132  11.290   1.702
  497    QB   MET  49           QB       MET  49 -19.369  13.612   0.725
  498    QG   MET  49           QG       MET  49 -21.633  13.636   0.132
  499    ME   MET  49           QE       MET  49 -23.944  12.077   1.081
  500    H    LYS  50           H        LYS  50 -17.762  11.639  -2.679
  501    HA   LYS  50           HA       LYS  50 -19.134  13.442  -4.587
  502   1HB   LYS  50          2HB       LYS  50 -17.305  14.655  -3.219
  503   2HB   LYS  50          1HB       LYS  50 -16.156  13.674  -4.129
  504   1HG   LYS  50          2HG       LYS  50 -17.004  14.560  -6.237
  505   2HG   LYS  50          1HG       LYS  50 -18.258  15.463  -5.387
  506   1HD   LYS  50          2HD       LYS  50 -16.499  17.026  -5.841
  507   2HD   LYS  50          1HD       LYS  50 -16.388  16.639  -4.123
  508   1HE   LYS  50          2HE       LYS  50 -14.305  15.783  -4.385
  509   2HE   LYS  50          1HE       LYS  50 -14.838  14.761  -5.736
  510   1HZ   LYS  50          3HZ       LYS  50 -14.490  17.688  -6.023
  511   2HZ   LYS  50          2HZ       LYS  50 -13.208  16.606  -6.293
  512   3HZ   LYS  50          1HZ       LYS  50 -14.609  16.520  -7.247
  513    QB   LYS  50           QB       LYS  50 -16.730  14.165  -3.674
  514    QD   LYS  50           QD       LYS  50 -16.443  16.833  -4.982
  515    QG   LYS  50           QG       LYS  50 -17.631  15.011  -5.812
  516    QE   LYS  50           QE       LYS  50 -14.572  15.272  -5.061
  517    QZ   LYS  50           QZ       LYS  50 -14.102  16.938  -6.521
  518    H    MET  51           H        MET  51 -16.289  11.327  -4.077
  519    HA   MET  51           HA       MET  51 -17.051   9.571  -6.266
  520   1HB   MET  51          2HB       MET  51 -15.532  11.976  -6.778
  521   2HB   MET  51          1HB       MET  51 -14.555  10.559  -7.163
  522   1HG   MET  51          2HG       MET  51 -15.790  10.101  -8.993
  523   2HG   MET  51          1HG       MET  51 -17.294  10.232  -8.084
  524   1HE   MET  51          1HE       MET  51 -14.688  11.433 -10.067
  525   2HE   MET  51          3HE       MET  51 -15.732  12.185 -11.281
  526   3HE   MET  51          2HE       MET  51 -14.754  13.188 -10.211
  527    QB   MET  51           QB       MET  51 -15.043  11.267  -6.971
  528    QG   MET  51           QG       MET  51 -16.542  10.167  -8.539
  529    ME   MET  51           QE       MET  51 -15.058  12.269 -10.520
  530    H    GLU  52           H        GLU  52 -14.795   8.287  -6.866
  531    HA   GLU  52           HA       GLU  52 -13.691   7.462  -4.210
  532   1HB   GLU  52          2HB       GLU  52 -14.258   6.138  -6.849
  533   2HB   GLU  52          1HB       GLU  52 -13.057   5.429  -5.770
  534   1HG   GLU  52          2HG       GLU  52 -14.998   5.832  -3.973
  535   2HG   GLU  52          1HG       GLU  52 -16.008   5.691  -5.413
  536    QB   GLU  52           QB       GLU  52 -13.658   5.784  -6.309
  537    QG   GLU  52           QG       GLU  52 -15.503   5.762  -4.693
  538    H    THR  53           H        THR  53 -11.475   7.567  -3.869
  539    HA   THR  53           HA       THR  53  -9.821   8.701  -6.096
  540    HB   THR  53           HB       THR  53  -9.401   8.699  -3.088
  541    HG1  THR  53           HG1      THR  53 -10.270  10.800  -4.775
  542   1HG2  THR  53          2HG2      THR  53  -7.346   8.943  -4.474
  543   2HG2  THR  53          1HG2      THR  53  -8.085  10.328  -5.279
  544   3HG2  THR  53          3HG2      THR  53  -7.717  10.402  -3.556
  545    MG   THR  53           QG2      THR  53  -7.716   9.891  -4.436
  546    H    GLU  54           H        GLU  54  -7.750   7.748  -6.501
  547    HA   GLU  54           HA       GLU  54  -7.491   4.939  -5.523
  548   1HB   GLU  54          2HB       GLU  54  -6.352   6.478  -7.876
  549   2HB   GLU  54          1HB       GLU  54  -5.970   4.791  -7.531
  550   1HG   GLU  54          2HG       GLU  54  -7.795   4.258  -8.748
  551   2HG   GLU  54          1HG       GLU  54  -8.750   4.880  -7.401
  552    QB   GLU  54           QB       GLU  54  -6.161   5.634  -7.703
  553    QG   GLU  54           QG       GLU  54  -8.273   4.569  -8.075
  554    H    ILE  55           H        ILE  55  -5.796   4.405  -4.191
  555    HA   ILE  55           HA       ILE  55  -3.830   6.538  -3.515
  556    HB   ILE  55           HB       ILE  55  -4.545   3.884  -2.224
  557   1HG1  ILE  55          2HG1      ILE  55  -5.236   6.721  -1.392
  558   2HG1  ILE  55          1HG1      ILE  55  -6.346   5.641  -2.238
  559   1HG2  ILE  55          3HG2      ILE  55  -2.248   5.445  -1.891
  560   2HG2  ILE  55          2HG2      ILE  55  -3.292   5.914  -0.549
  561   3HG2  ILE  55          1HG2      ILE  55  -2.849   4.221  -0.771
  562   1HD1  ILE  55          2HD1      ILE  55  -5.082   4.434   0.130
  563   2HD1  ILE  55          1HD1      ILE  55  -6.113   5.816   0.496
  564   3HD1  ILE  55          3HD1      ILE  55  -6.773   4.427  -0.369
  565    MG   ILE  55           QG2      ILE  55  -2.796   5.193  -1.070
  566    MD   ILE  55           QD1      ILE  55  -5.989   4.892   0.086
  567    QG   ILE  55           QG1      ILE  55  -5.791   6.181  -1.815
  568    H    ASN  56           H        ASN  56  -2.504   6.251  -5.443
  569    HA   ASN  56           HA       ASN  56  -1.325   3.693  -6.146
  570   1HB   ASN  56          2HB       ASN  56  -0.684   6.583  -6.803
  571   2HB   ASN  56          1HB       ASN  56   0.085   5.204  -7.589
  572   1HD2  ASN  56          1HD2      ASN  56  -0.986   6.139  -9.613
  573   2HD2  ASN  56          2HD2      ASN  56  -2.603   5.725  -9.924
  574    QB   ASN  56           QB       ASN  56  -0.300   5.893  -7.196
  575    QD   ASN  56           QD2      ASN  56  -1.794   5.932  -9.768
  576    H    ALA  57           H        ALA  57   0.431   2.744  -5.225
  577    HA   ALA  57           HA       ALA  57   1.686   3.530  -2.858
  578   1HB   ALA  57          2HB       ALA  57   2.075   1.648  -5.027
  579   2HB   ALA  57          1HB       ALA  57   3.632   2.211  -4.420
  580   3HB   ALA  57          3HB       ALA  57   2.475   1.463  -3.319
  581    MB   ALA  57           QB       ALA  57   2.727   1.774  -4.255
  582    HA   PRO  58           HA       PRO  58   4.100   7.025  -4.129
  583   1HB   PRO  58          2HB       PRO  58   5.742   7.200  -1.947
  584   2HB   PRO  58          1HB       PRO  58   4.043   7.713  -1.923
  585   1HG   PRO  58          2HG       PRO  58   5.279   5.210  -0.899
  586   2HG   PRO  58          1HG       PRO  58   3.964   6.181  -0.219
  587   1HD   PRO  58          2HD       PRO  58   3.580   3.853  -1.599
  588   2HD   PRO  58          1HD       PRO  58   2.373   5.154  -1.496
  589    QB   PRO  58           QB       PRO  58   4.892   7.456  -1.935
  590    QG   PRO  58           QG       PRO  58   4.621   5.696  -0.559
  591    QD   PRO  58           QD       PRO  58   2.977   4.503  -1.548
  592    H    THR  59           H        THR  59   5.751   4.120  -2.880
  593    HA   THR  59           HA       THR  59   7.795   4.455  -5.027
  594    HB   THR  59           HB       THR  59   8.556   3.817  -2.176
  595    HG1  THR  59           HG1      THR  59   8.654   6.392  -3.321
  596   1HG2  THR  59          2HG2      THR  59   9.946   3.838  -4.585
  597   2HG2  THR  59          1HG2      THR  59  10.366   5.383  -3.846
  598   3HG2  THR  59          3HG2      THR  59  10.665   3.879  -2.976
  599    MG   THR  59           QG2      THR  59  10.326   4.367  -3.802
  600    H    ASP  60           H        ASP  60   8.735   2.462  -5.677
  601    HA   ASP  60           HA       ASP  60   7.158   0.097  -5.412
  602   1HB   ASP  60          2HB       ASP  60   9.154  -0.931  -6.520
  603   2HB   ASP  60          1HB       ASP  60   8.661   0.579  -7.286
  604    QB   ASP  60           QB       ASP  60   8.908  -0.176  -6.903
  605    H    GLY  61           H        GLY  61   7.634  -1.861  -4.232
  606   1HA   GLY  61          1HA       GLY  61   8.670  -1.436  -1.568
  607   2HA   GLY  61          2HA       GLY  61   9.815  -2.355  -2.545
  608    QA   GLY  61           QA       GLY  61   9.242  -1.895  -2.057
  609    H    LYS  62           H        LYS  62   8.675  -3.550  -0.324
  610    HA   LYS  62           HA       LYS  62   6.644  -5.416  -1.503
  611   1HB   LYS  62          2HB       LYS  62   8.961  -6.320  -1.458
  612   2HB   LYS  62          1HB       LYS  62   9.016  -6.043   0.282
  613   1HG   LYS  62          2HG       LYS  62   6.852  -7.484   0.356
  614   2HG   LYS  62          1HG       LYS  62   7.337  -8.017  -1.254
  615   1HD   LYS  62          2HD       LYS  62   9.644  -8.102   0.431
  616   2HD   LYS  62          1HD       LYS  62   8.326  -8.920   1.271
  617   1HE   LYS  62          2HE       LYS  62   8.910 -10.717  -0.020
  618   2HE   LYS  62          1HE       LYS  62   8.043  -9.864  -1.313
  619   1HZ   LYS  62          2HZ       LYS  62  10.915  -9.501  -0.633
  620   2HZ   LYS  62          1HZ       LYS  62  10.328 -10.372  -1.969
  621   3HZ   LYS  62          3HZ       LYS  62  10.077  -8.697  -1.874
  622    QB   LYS  62           QB       LYS  62   8.989  -6.182  -0.588
  623    QD   LYS  62           QD       LYS  62   8.985  -8.511   0.851
  624    QG   LYS  62           QG       LYS  62   7.095  -7.751  -0.449
  625    QE   LYS  62           QE       LYS  62   8.477 -10.291  -0.667
  626    QZ   LYS  62           QZ       LYS  62  10.440  -9.523  -1.492
  627    H    VAL  63           H        VAL  63   4.993  -6.049  -0.090
  628    HA   VAL  63           HA       VAL  63   4.679  -4.444   2.358
  629    HB   VAL  63           HB       VAL  63   3.024  -6.377   0.733
  630   1HG1  VAL  63          3HG1      VAL  63   3.332  -3.908   0.175
  631   2HG1  VAL  63          2HG1      VAL  63   1.663  -4.450   0.349
  632   3HG1  VAL  63          1HG1      VAL  63   2.441  -3.560   1.658
  633   1HG2  VAL  63          3HG2      VAL  63   2.296  -5.209   3.441
  634   2HG2  VAL  63          2HG2      VAL  63   1.151  -5.977   2.343
  635   3HG2  VAL  63          1HG2      VAL  63   2.460  -6.921   3.051
  636    MG1  VAL  63           QG1      VAL  63   2.478  -3.972   0.727
  637    MG2  VAL  63           QG2      VAL  63   1.969  -6.035   2.945
  638    QG   VAL  63           QQG      VAL  63   2.224  -5.004   1.836
  639    H    GLU  64           H        GLU  64   4.753  -5.237   4.450
  640    HA   GLU  64           HA       GLU  64   5.567  -8.105   4.794
  641   1HB   GLU  64          2HB       GLU  64   6.372  -5.662   6.408
  642   2HB   GLU  64          1HB       GLU  64   7.004  -7.298   6.604
  643   1HG   GLU  64          2HG       GLU  64   7.389  -6.805   3.905
  644   2HG   GLU  64          1HG       GLU  64   7.737  -5.243   4.648
  645    QB   GLU  64           QB       GLU  64   6.688  -6.480   6.506
  646    QG   GLU  64           QG       GLU  64   7.563  -6.024   4.277
  647    H    LYS  65           H        LYS  65   3.265  -5.674   5.578
  648    HA   LYS  65           HA       LYS  65   1.620  -7.415   7.143
  649   1HB   LYS  65          2HB       LYS  65   3.834  -6.100   8.495
  650   2HB   LYS  65          1HB       LYS  65   2.292  -5.605   9.194
  651   1HG   LYS  65          2HG       LYS  65   1.823  -7.699   9.987
  652   2HG   LYS  65          1HG       LYS  65   2.584  -8.502   8.612
  653   1HD   LYS  65          2HD       LYS  65   4.467  -8.814   9.799
  654   2HD   LYS  65          1HD       LYS  65   4.595  -7.080  10.094
  655   1HE   LYS  65          2HE       LYS  65   4.424  -8.005  12.274
  656   2HE   LYS  65          1HE       LYS  65   2.760  -7.501  11.915
  657   1HZ   LYS  65          2HZ       LYS  65   2.329  -9.724  11.035
  658   2HZ   LYS  65          1HZ       LYS  65   3.902 -10.207  11.461
  659   3HZ   LYS  65          3HZ       LYS  65   2.788  -9.790  12.670
  660    QB   LYS  65           QB       LYS  65   3.063  -5.852   8.845
  661    QD   LYS  65           QD       LYS  65   4.531  -7.947   9.946
  662    QG   LYS  65           QG       LYS  65   2.203  -8.100   9.300
  663    QE   LYS  65           QE       LYS  65   3.592  -7.753  12.095
  664    QZ   LYS  65           QZ       LYS  65   3.006  -9.907  11.722
  665    H    VAL  66           H        VAL  66  -0.217  -6.495   6.229
  666    HA   VAL  66           HA       VAL  66  -0.478  -3.530   6.169
  667    HB   VAL  66           HB       VAL  66  -2.400  -4.079   4.696
  668   1HG1  VAL  66          1HG1      VAL  66   0.349  -5.132   4.247
  669   2HG1  VAL  66          3HG1      VAL  66  -0.891  -5.651   3.105
  670   3HG1  VAL  66          2HG1      VAL  66  -0.560  -3.932   3.327
  671   1HG2  VAL  66          3HG2      VAL  66  -2.157  -6.603   6.044
  672   2HG2  VAL  66          2HG2      VAL  66  -3.413  -6.076   4.923
  673   3HG2  VAL  66          1HG2      VAL  66  -1.960  -6.865   4.311
  674    MG1  VAL  66           QG1      VAL  66  -0.367  -4.905   3.560
  675    MG2  VAL  66           QG2      VAL  66  -2.510  -6.515   5.093
  676    QG   VAL  66           QQG      VAL  66  -1.439  -5.710   4.326
  677    H    LEU  67           H        LEU  67  -2.111  -2.462   7.353
  678    HA   LEU  67           HA       LEU  67  -3.622  -4.173   9.299
  679   1HB   LEU  67          2HB       LEU  67  -3.383  -2.275  10.838
  680   2HB   LEU  67          1HB       LEU  67  -1.801  -2.757  10.231
  681    HG   LEU  67           HG       LEU  67  -2.723  -0.902   8.354
  682   1HD1  LEU  67          3HD1      LEU  67  -0.469  -1.372   9.820
  683   2HD1  LEU  67          2HD1      LEU  67  -0.707   0.060   8.818
  684   3HD1  LEU  67          1HD1      LEU  67  -1.032   0.131  10.550
  685   1HD2  LEU  67          1HD2      LEU  67  -4.061  -0.462  10.850
  686   2HD2  LEU  67          3HD2      LEU  67  -2.893   0.837  10.608
  687   3HD2  LEU  67          2HD2      LEU  67  -4.126   0.521   9.388
  688    MD1  LEU  67           QD1      LEU  67  -0.736  -0.394   9.729
  689    MD2  LEU  67           QD2      LEU  67  -3.693   0.299  10.282
  690    QB   LEU  67           QB       LEU  67  -2.592  -2.516  10.535
  691    QD   LEU  67           QQD      LEU  67  -2.215  -0.048  10.006
  692    H    VAL  68           H        VAL  68  -3.810  -1.607   6.914
  693    HA   VAL  68           HA       VAL  68  -6.347  -0.489   7.609
  694    HB   VAL  68           HB       VAL  68  -6.325   0.190   5.205
  695   1HG1  VAL  68          2HG1      VAL  68  -4.095   0.519   7.106
  696   2HG1  VAL  68          1HG1      VAL  68  -3.684   0.897   5.433
  697   3HG1  VAL  68          3HG1      VAL  68  -5.014   1.741   6.227
  698   1HG2  VAL  68          3HG2      VAL  68  -5.327  -2.090   4.517
  699   2HG2  VAL  68          2HG2      VAL  68  -4.717  -0.659   3.685
  700   3HG2  VAL  68          1HG2      VAL  68  -3.769  -1.402   4.975
  701    MG1  VAL  68           QG1      VAL  68  -4.264   1.052   6.255
  702    MG2  VAL  68           QG2      VAL  68  -4.604  -1.384   4.393
  703    QG   VAL  68           QQG      VAL  68  -4.434  -0.166   5.324
  704    H    LYS  69           H        LYS  69  -8.423  -0.894   6.422
  705    HA   LYS  69           HA       LYS  69  -8.754  -3.526   5.130
  706   1HB   LYS  69          2HB       LYS  69  -9.480  -2.873   7.948
  707   2HB   LYS  69          1HB       LYS  69 -10.645  -3.829   7.030
  708   1HG   LYS  69          2HG       LYS  69  -8.574  -5.260   6.348
  709   2HG   LYS  69          1HG       LYS  69  -7.797  -4.502   7.738
  710   1HD   LYS  69          2HD       LYS  69 -10.431  -5.363   8.498
  711   2HD   LYS  69          1HD       LYS  69  -9.582  -6.712   7.742
  712   1HE   LYS  69          2HE       LYS  69  -7.697  -6.448   9.276
  713   2HE   LYS  69          1HE       LYS  69  -8.446  -5.004   9.988
  714   1HZ   LYS  69          3HZ       LYS  69 -10.440  -6.441  10.418
  715   2HZ   LYS  69          2HZ       LYS  69  -9.481  -7.786  10.016
  716   3HZ   LYS  69          1HZ       LYS  69  -9.075  -6.816  11.352
  717    QB   LYS  69           QB       LYS  69 -10.062  -3.351   7.489
  718    QD   LYS  69           QD       LYS  69 -10.006  -6.037   8.120
  719    QG   LYS  69           QG       LYS  69  -8.186  -4.881   7.043
  720    QE   LYS  69           QE       LYS  69  -8.072  -5.726   9.632
  721    QZ   LYS  69           QZ       LYS  69  -9.665  -7.014  10.595
  722    H    GLU  70           H        GLU  70 -10.943  -3.754   4.227
  723    HA   GLU  70           HA       GLU  70 -12.041  -1.282   3.220
  724   1HB   GLU  70          2HB       GLU  70 -12.933  -4.178   3.255
  725   2HB   GLU  70          1HB       GLU  70 -13.806  -2.922   2.377
  726   1HG   GLU  70          2HG       GLU  70 -12.310  -2.957   0.692
  727   2HG   GLU  70          1HG       GLU  70 -10.961  -2.791   1.816
  728    QB   GLU  70           QB       GLU  70 -13.370  -3.550   2.816
  729    QG   GLU  70           QG       GLU  70 -11.635  -2.874   1.254
  730    H    ARG  71           H        ARG  71 -12.274  -0.460   5.633
  731    HA   ARG  71           HA       ARG  71 -15.098  -0.379   6.263
  732   1HB   ARG  71          2HB       ARG  71 -13.878  -2.673   7.071
  733   2HB   ARG  71          1HB       ARG  71 -13.594  -1.655   8.483
  734   1HG   ARG  71          2HG       ARG  71 -15.882  -1.364   8.899
  735   2HG   ARG  71          1HG       ARG  71 -16.334  -1.782   7.246
  736   1HD   ARG  71          2HD       ARG  71 -16.747  -3.881   8.008
  737   2HD   ARG  71          1HD       ARG  71 -14.995  -4.058   8.232
  738    HE   ARG  71           HE       ARG  71 -16.542  -2.690  10.373
  739   1HH1  ARG  71          1HH1      ARG  71 -13.721  -4.270   9.858
  740   2HH1  ARG  71          2HH1      ARG  71 -13.892  -5.439  11.125
  741   1HH2  ARG  71          1HH2      ARG  71 -17.220  -4.682  11.736
  742   2HH2  ARG  71          2HH2      ARG  71 -15.874  -5.672  12.186
  743    QB   ARG  71           QB       ARG  71 -13.736  -2.164   7.777
  744    QG   ARG  71           QG       ARG  71 -16.108  -1.573   8.073
  745    QD   ARG  71           QD       ARG  71 -15.871  -3.970   8.120
  746    QH1  ARG  71           QH1      ARG  71 -13.807  -4.854  10.491
  747    QH2  ARG  71           QH2      ARG  71 -16.547  -5.177  11.961
  748    H    ASP  72           H        ASP  72 -11.806  -0.057   7.609
  749    HA   ASP  72           HA       ASP  72 -12.352   1.886   9.605
  750   1HB   ASP  72          2HB       ASP  72 -10.231   0.487   8.921
  751   2HB   ASP  72          1HB       ASP  72  -9.849   1.900   7.936
  752    QB   ASP  72           QB       ASP  72 -10.040   1.194   8.429
  753    H    ALA  73           H        ALA  73 -12.274   4.184   9.546
  754    HA   ALA  73           HA       ALA  73 -12.357   5.425   6.814
  755   1HB   ALA  73          1HB       ALA  73 -14.109   5.781   9.255
  756   2HB   ALA  73          2HB       ALA  73 -14.600   5.322   7.624
  757   3HB   ALA  73          3HB       ALA  73 -14.072   6.971   7.954
  758    MB   ALA  73           QB       ALA  73 -14.260   6.025   8.278
  759    H    VAL  74           H        VAL  74 -12.210   7.978   7.216
  760    HA   VAL  74           HA       VAL  74 -10.559   9.639   7.626
  761    HB   VAL  74           HB       VAL  74 -10.662  10.238  10.060
  762   1HG1  VAL  74          2HG1      VAL  74 -13.125   9.530   8.481
  763   2HG1  VAL  74          1HG1      VAL  74 -13.268  10.249  10.085
  764   3HG1  VAL  74          3HG1      VAL  74 -12.433  11.121   8.799
  765   1HG2  VAL  74          2HG2      VAL  74 -10.706   7.815  10.835
  766   2HG2  VAL  74          1HG2      VAL  74 -11.883   8.874  11.607
  767   3HG2  VAL  74          3HG2      VAL  74 -12.394   7.771  10.332
  768    MG1  VAL  74           QG1      VAL  74 -12.942  10.300   9.122
  769    MG2  VAL  74           QG2      VAL  74 -11.661   8.153  10.925
  770    QG   VAL  74           QQG      VAL  74 -12.302   9.227  10.023
  771    H    GLN  75           H        GLN  75  -8.846   7.962   6.825
  772    HA   GLN  75           HA       GLN  75  -7.154   6.693   8.821
  773   1HB   GLN  75          2HB       GLN  75  -6.974   7.304   5.865
  774   2HB   GLN  75          1HB       GLN  75  -5.680   6.468   6.725
  775   1HG   GLN  75          2HG       GLN  75  -8.550   5.535   6.859
  776   2HG   GLN  75          1HG       GLN  75  -7.446   4.985   5.596
  777   1HE2  GLN  75          1HE2      GLN  75  -8.563   4.203   8.671
  778   2HE2  GLN  75          2HE2      GLN  75  -7.270   3.229   9.180
  779    QB   GLN  75           QB       GLN  75  -6.327   6.886   6.295
  780    QG   GLN  75           QG       GLN  75  -7.998   5.260   6.228
  781    QE   GLN  75           QE2      GLN  75  -7.916   3.716   8.926
  782    H    GLY  76           H        GLY  76  -7.538   9.938   8.070
  783   1HA   GLY  76          1HA       GLY  76  -6.235  11.819   8.587
  784   2HA   GLY  76          2HA       GLY  76  -4.922  10.950   7.789
  785    QA   GLY  76           QA       GLY  76  -5.578  11.385   8.188
  786    H    GLY  77           H        GLY  77  -3.287  10.152   9.066
  787   1HA   GLY  77          1HA       GLY  77  -3.428  10.737  11.955
  788   2HA   GLY  77          2HA       GLY  77  -1.986  10.237  11.069
  789    QA   GLY  77           QA       GLY  77  -2.707  10.487  11.512
  790    H    GLN  78           H        GLN  78  -2.506   7.887   9.983
  791    HA   GLN  78           HA       GLN  78  -2.843   6.095  12.280
  792   1HB   GLN  78          2HB       GLN  78  -5.110   6.900  10.908
  793   2HB   GLN  78          1HB       GLN  78  -4.713   5.363  10.135
  794   1HG   GLN  78          2HG       GLN  78  -4.453   4.431  12.523
  795   2HG   GLN  78          1HG       GLN  78  -5.286   5.894  13.053
  796   1HE2  GLN  78          1HE2      GLN  78  -7.489   6.289  11.997
  797   2HE2  GLN  78          2HE2      GLN  78  -8.420   4.937  11.565
  798    QB   GLN  78           QB       GLN  78  -4.912   6.131  10.521
  799    QG   GLN  78           QG       GLN  78  -4.869   5.163  12.788
  800    QE   GLN  78           QE2      GLN  78  -7.955   5.613  11.781
  801    H    GLY  79           H        GLY  79  -1.705   4.198  11.893
  802   1HA   GLY  79          1HA       GLY  79  -0.452   2.586  10.731
  803   2HA   GLY  79          2HA       GLY  79   0.100   3.951   9.759
  804    QA   GLY  79           QA       GLY  79  -0.176   3.269  10.245
  805    H    LEU  80           H        LEU  80  -0.037   3.152   7.688
  806    HA   LEU  80           HA       LEU  80  -2.751   2.374   6.720
  807   1HB   LEU  80          2HB       LEU  80  -0.295   3.668   5.619
  808   2HB   LEU  80          1HB       LEU  80  -1.293   2.745   4.496
  809    HG   LEU  80           HG       LEU  80  -2.451   4.833   6.351
  810   1HD1  LEU  80          3HD1      LEU  80  -3.455   2.971   4.324
  811   2HD1  LEU  80          2HD1      LEU  80  -4.339   3.864   5.563
  812   3HD1  LEU  80          1HD1      LEU  80  -3.952   4.638   4.025
  813   1HD2  LEU  80          1HD2      LEU  80  -1.199   5.100   3.626
  814   2HD2  LEU  80          3HD2      LEU  80  -2.519   6.168   4.106
  815   3HD2  LEU  80          2HD2      LEU  80  -1.019   6.147   5.034
  816    MD1  LEU  80           QD1      LEU  80  -3.916   3.824   4.637
  817    MD2  LEU  80           QD2      LEU  80  -1.579   5.805   4.256
  818    QB   LEU  80           QB       LEU  80  -0.794   3.206   5.057
  819    QD   LEU  80           QQD      LEU  80  -2.747   4.815   4.446
  820    H    ILE  81           H        ILE  81   0.540   1.534   5.631
  821    HA   ILE  81           HA       ILE  81  -0.006  -1.354   6.063
  822    HB   ILE  81           HB       ILE  81   0.564  -1.777   3.652
  823   1HG1  ILE  81          2HG1      ILE  81   0.134   1.191   3.268
  824   2HG1  ILE  81          1HG1      ILE  81   1.746   0.500   3.462
  825   1HG2  ILE  81          2HG2      ILE  81  -1.830  -1.310   4.670
  826   2HG2  ILE  81          1HG2      ILE  81  -1.741   0.141   3.672
  827   3HG2  ILE  81          3HG2      ILE  81  -1.621  -1.451   2.926
  828   1HD1  ILE  81          3HD1      ILE  81  -0.163  -0.646   1.435
  829   2HD1  ILE  81          2HD1      ILE  81   0.795   0.784   1.049
  830   3HD1  ILE  81          1HD1      ILE  81   1.599  -0.729   1.466
  831    MG   ILE  81           QG2      ILE  81  -1.731  -0.873   3.756
  832    MD   ILE  81           QD1      ILE  81   0.744  -0.197   1.317
  833    QG   ILE  81           QG1      ILE  81   0.940   0.846   3.365
  834    H    LYS  82           H        LYS  82   1.977  -2.600   6.064
  835    HA   LYS  82           HA       LYS  82   4.384  -0.971   6.617
  836   1HB   LYS  82          2HB       LYS  82   3.295  -3.103   7.827
  837   2HB   LYS  82          1HB       LYS  82   4.349  -3.955   6.697
  838   1HG   LYS  82          2HG       LYS  82   5.347  -1.697   8.442
  839   2HG   LYS  82          1HG       LYS  82   5.369  -3.379   8.974
  840   1HD   LYS  82          2HD       LYS  82   6.515  -3.728   6.586
  841   2HD   LYS  82          1HD       LYS  82   6.978  -2.044   6.841
  842   1HE   LYS  82          2HE       LYS  82   7.510  -3.190   9.309
  843   2HE   LYS  82          1HE       LYS  82   7.989  -4.460   8.165
  844   1HZ   LYS  82          3HZ       LYS  82   8.696  -1.631   7.695
  845   2HZ   LYS  82          2HZ       LYS  82   9.679  -2.622   8.663
  846   3HZ   LYS  82          1HZ       LYS  82   9.407  -3.023   7.035
  847    QB   LYS  82           QB       LYS  82   3.822  -3.529   7.262
  848    QD   LYS  82           QD       LYS  82   6.747  -2.886   6.714
  849    QG   LYS  82           QG       LYS  82   5.358  -2.538   8.708
  850    QE   LYS  82           QE       LYS  82   7.750  -3.825   8.737
  851    QZ   LYS  82           QZ       LYS  82   9.261  -2.425   7.798
  852    H    ILE  83           H        ILE  83   5.882  -0.616   5.037
  853    HA   ILE  83           HA       ILE  83   6.155  -2.655   2.855
  854    HB   ILE  83           HB       ILE  83   4.888  -0.615   2.172
  855   1HG1  ILE  83          2HG1      ILE  83   7.610  -0.498   0.882
  856   2HG1  ILE  83          1HG1      ILE  83   6.587  -1.923   0.691
  857   1HG2  ILE  83          2HG2      ILE  83   6.404   0.794   3.839
  858   2HG2  ILE  83          1HG2      ILE  83   7.409   0.989   2.404
  859   3HG2  ILE  83          3HG2      ILE  83   5.734   1.536   2.388
  860   1HD1  ILE  83          1HD1      ILE  83   4.742  -0.130   0.084
  861   2HD1  ILE  83          3HD1      ILE  83   6.142   0.874  -0.291
  862   3HD1  ILE  83          2HD1      ILE  83   5.903  -0.656  -1.134
  863    MG   ILE  83           QG2      ILE  83   6.515   1.107   2.877
  864    MD   ILE  83           QD1      ILE  83   5.596   0.029  -0.447
  865    QG   ILE  83           QG1      ILE  83   7.099  -1.211   0.786
  866    H    GLY  84           H        GLY  84   8.289  -3.115   2.266
  867   1HA   GLY  84          1HA       GLY  84  10.431  -1.535   3.630
  868   2HA   GLY  84          2HA       GLY  84  10.657  -2.394   2.104
  869    QA   GLY  84           QA       GLY  84  10.544  -1.964   2.867

  No H/Q in entry =         869
  Start of MODEL   20
    1    H1   MET   1          3H        MET   1  -3.334 -18.217  23.572
    2    H2   MET   1          2H        MET   1  -3.106 -19.084  22.128
    3    H3   MET   1          1H        MET   1  -2.113 -19.390  23.472
    4    HA   MET   1           HA       MET   1  -0.928 -18.054  21.824
    5   1HB   MET   1          2HB       MET   1  -3.515 -16.583  22.118
    6   2HB   MET   1          1HB       MET   1  -2.073 -15.635  21.754
    7   1HG   MET   1          2HG       MET   1  -2.724 -18.118  20.174
    8   2HG   MET   1          1HG       MET   1  -3.449 -16.566  19.758
    9   1HE   MET   1          1HE       MET   1  -2.499 -16.661  17.442
   10   2HE   MET   1          3HE       MET   1  -0.795 -16.863  17.012
   11   3HE   MET   1          2HE       MET   1  -1.691 -18.200  17.729
   12    QB   MET   1           QB       MET   1  -2.794 -16.109  21.936
   13    QG   MET   1           QG       MET   1  -3.086 -17.342  19.966
   14    ME   MET   1           QE       MET   1  -1.662 -17.242  17.394
   15    H    LYS   2           H        LYS   2   0.612 -16.471  22.599
   16    HA   LYS   2           HA       LYS   2   0.245 -15.666  25.465
   17   1HB   LYS   2          2HB       LYS   2   1.974 -17.581  24.413
   18   2HB   LYS   2          1HB       LYS   2   2.997 -16.156  24.594
   19   1HG   LYS   2          2HG       LYS   2   2.492 -15.972  26.924
   20   2HG   LYS   2          1HG       LYS   2   1.181 -17.144  26.801
   21   1HD   LYS   2          2HD       LYS   2   3.943 -17.991  26.002
   22   2HD   LYS   2          1HD       LYS   2   3.555 -17.881  27.719
   23   1HE   LYS   2          2HE       LYS   2   1.846 -19.423  25.737
   24   2HE   LYS   2          1HE       LYS   2   3.123 -20.170  26.718
   25   1HZ   LYS   2          2HZ       LYS   2   2.002 -18.964  28.656
   26   2HZ   LYS   2          1HZ       LYS   2   0.657 -18.816  27.628
   27   3HZ   LYS   2          3HZ       LYS   2   1.236 -20.354  28.049
   28    QB   LYS   2           QB       LYS   2   2.485 -16.869  24.503
   29    QD   LYS   2           QD       LYS   2   3.749 -17.936  26.861
   30    QG   LYS   2           QG       LYS   2   1.836 -16.558  26.863
   31    QE   LYS   2           QE       LYS   2   2.484 -19.796  26.228
   32    QZ   LYS   2           QZ       LYS   2   1.299 -19.378  28.111
   33    H    LEU   3           H        LEU   3  -0.351 -13.955  23.254
   34    HA   LEU   3           HA       LEU   3   1.861 -12.294  22.471
   35   1HB   LEU   3          2HB       LEU   3  -1.117 -12.248  22.444
   36   2HB   LEU   3          1HB       LEU   3  -0.306 -10.692  22.250
   37    HG   LEU   3           HG       LEU   3   0.414 -13.137  20.617
   38   1HD1  LEU   3          1HD1      LEU   3   1.656 -10.644  21.015
   39   2HD1  LEU   3          3HD1      LEU   3   2.024 -11.819  19.752
   40   3HD1  LEU   3          2HD1      LEU   3   0.867 -10.525  19.441
   41   1HD2  LEU   3          2HD2      LEU   3  -1.956 -11.576  20.470
   42   2HD2  LEU   3          1HD2      LEU   3  -0.938 -11.092  19.113
   43   3HD2  LEU   3          3HD2      LEU   3  -1.389 -12.785  19.317
   44    MD1  LEU   3           QD1      LEU   3   1.516 -10.996  20.069
   45    MD2  LEU   3           QD2      LEU   3  -1.428 -11.818  19.634
   46    QB   LEU   3           QB       LEU   3  -0.711 -11.470  22.347
   47    QD   LEU   3           QQD      LEU   3   0.044 -11.407  19.851
   48    H    LYS   4           H        LYS   4   3.059 -11.708  24.360
   49    HA   LYS   4           HA       LYS   4   1.862 -10.587  26.734
   50   1HB   LYS   4          2HB       LYS   4   4.213 -10.062  27.262
   51   2HB   LYS   4          1HB       LYS   4   4.085 -11.685  26.582
   52   1HG   LYS   4          2HG       LYS   4   4.848 -10.940  24.432
   53   2HG   LYS   4          1HG       LYS   4   4.709  -9.246  24.901
   54   1HD   LYS   4          2HD       LYS   4   6.713  -9.253  25.963
   55   2HD   LYS   4          1HD       LYS   4   6.420 -10.833  26.692
   56   1HE   LYS   4          2HE       LYS   4   7.210 -11.994  24.787
   57   2HE   LYS   4          1HE       LYS   4   7.047 -10.567  23.744
   58   1HZ   LYS   4          2HZ       LYS   4   8.691  -9.444  25.192
   59   2HZ   LYS   4          1HZ       LYS   4   8.942 -10.915  26.007
   60   3HZ   LYS   4          3HZ       LYS   4   9.337 -10.779  24.362
   61    QB   LYS   4           QB       LYS   4   4.149 -10.873  26.922
   62    QD   LYS   4           QD       LYS   4   6.567 -10.043  26.328
   63    QG   LYS   4           QG       LYS   4   4.779 -10.093  24.666
   64    QE   LYS   4           QE       LYS   4   7.129 -11.281  24.265
   65    QZ   LYS   4           QZ       LYS   4   8.990 -10.379  25.187
   66    H    VAL   5           H        VAL   5   2.863  -9.236  23.654
   67    HA   VAL   5           HA       VAL   5   3.213  -6.508  24.357
   68    HB   VAL   5           HB       VAL   5   3.740  -7.532  22.174
   69   1HG1  VAL   5          1HG1      VAL   5   1.148  -8.577  22.414
   70   2HG1  VAL   5          3HG1      VAL   5   1.051  -7.435  21.074
   71   3HG1  VAL   5          2HG1      VAL   5   2.226  -8.749  21.028
   72   1HG2  VAL   5          2HG2      VAL   5   1.708  -5.283  22.112
   73   2HG2  VAL   5          1HG2      VAL   5   3.465  -5.131  22.166
   74   3HG2  VAL   5          3HG2      VAL   5   2.677  -5.761  20.718
   75    MG1  VAL   5           QG1      VAL   5   1.475  -8.253  21.505
   76    MG2  VAL   5           QG2      VAL   5   2.617  -5.391  21.665
   77    QG   VAL   5           QQG      VAL   5   2.046  -6.822  21.585
   78    H    THR   6           H        THR   6   1.697  -4.738  24.309
   79    HA   THR   6           HA       THR   6  -1.023  -5.480  25.197
   80    HB   THR   6           HB       THR   6  -1.117  -3.113  25.816
   81    HG1  THR   6           HG1      THR   6   1.423  -2.840  24.610
   82   1HG2  THR   6          1HG2      THR   6   0.157  -4.645  27.283
   83   2HG2  THR   6          3HG2      THR   6   1.625  -4.280  26.374
   84   3HG2  THR   6          2HG2      THR   6   0.830  -3.015  27.311
   85    MG   THR   6           QG2      THR   6   0.871  -3.980  26.989
   86    H    VAL   7           H        VAL   7  -2.918  -4.367  24.215
   87    HA   VAL   7           HA       VAL   7  -2.953  -4.571  21.337
   88    HB   VAL   7           HB       VAL   7  -4.875  -3.306  23.321
   89   1HG1  VAL   7          1HG1      VAL   7  -4.552  -6.118  22.248
   90   2HG1  VAL   7          3HG1      VAL   7  -4.510  -5.597  23.931
   91   3HG1  VAL   7          2HG1      VAL   7  -6.028  -5.559  23.035
   92   1HG2  VAL   7          3HG2      VAL   7  -5.202  -2.703  20.886
   93   2HG2  VAL   7          2HG2      VAL   7  -5.430  -4.420  20.558
   94   3HG2  VAL   7          1HG2      VAL   7  -6.559  -3.566  21.611
   95    MG1  VAL   7           QG1      VAL   7  -5.030  -5.758  23.071
   96    MG2  VAL   7           QG2      VAL   7  -5.730  -3.563  21.018
   97    QG   VAL   7           QQG      VAL   7  -5.380  -4.660  22.045
   98    H    ASN   8           H        ASN   8  -2.069  -3.052  19.988
   99    HA   ASN   8           HA       ASN   8  -1.823  -0.234  20.931
  100   1HB   ASN   8          2HB       ASN   8  -0.008  -1.874  19.856
  101   2HB   ASN   8          1HB       ASN   8  -0.702  -1.264  18.353
  102   1HD2  ASN   8          1HD2      ASN   8   0.085   0.728  17.636
  103   2HD2  ASN   8          2HD2      ASN   8   0.957   1.825  18.596
  104    QB   ASN   8           QB       ASN   8  -0.355  -1.569  19.104
  105    QD   ASN   8           QD2      ASN   8   0.521   1.277  18.116
  106    H    GLY   9           H        GLY   9  -4.156   0.208  20.566
  107   1HA   GLY   9          1HA       GLY   9  -5.971   0.927  19.254
  108   2HA   GLY   9          2HA       GLY   9  -5.350  -0.096  17.958
  109    QA   GLY   9           QA       GLY   9  -5.660   0.416  18.606
  110    H    ALA  10           H        ALA  10  -6.247   2.914  18.330
  111    HA   ALA  10           HA       ALA  10  -4.553   3.964  16.228
  112   1HB   ALA  10          1HB       ALA  10  -6.680   5.062  18.075
  113   2HB   ALA  10          2HB       ALA  10  -6.827   4.667  16.363
  114   3HB   ALA  10          3HB       ALA  10  -5.888   6.074  16.867
  115    MB   ALA  10           QB       ALA  10  -6.465   5.268  17.102
  116    H    GLY  11           H        GLY  11  -3.948   6.536  16.926
  117   1HA   GLY  11          1HA       GLY  11  -1.954   6.169  19.121
  118   2HA   GLY  11          2HA       GLY  11  -2.920   7.643  19.018
  119    QA   GLY  11           QA       GLY  11  -2.437   6.906  19.070
  120    H    LYS  12           H        LYS  12  -0.542   5.690  17.226
  121    HA   LYS  12           HA       LYS  12   0.077   7.984  15.452
  122   1HB   LYS  12          2HB       LYS  12   1.368   7.522  17.930
  123   2HB   LYS  12          1HB       LYS  12   2.510   7.024  16.681
  124   1HG   LYS  12          2HG       LYS  12   2.272   9.182  15.556
  125   2HG   LYS  12          1HG       LYS  12   1.058   9.685  16.731
  126   1HD   LYS  12          2HD       LYS  12   2.791  10.564  17.895
  127   2HD   LYS  12          1HD       LYS  12   3.163   8.899  18.340
  128   1HE   LYS  12          2HE       LYS  12   4.784   8.684  16.597
  129   2HE   LYS  12          1HE       LYS  12   4.221  10.165  15.796
  130   1HZ   LYS  12          1HZ       LYS  12   5.148  10.208  18.600
  131   2HZ   LYS  12          3HZ       LYS  12   6.258  10.334  17.324
  132   3HZ   LYS  12          2HZ       LYS  12   5.031  11.497  17.499
  133    QB   LYS  12           QB       LYS  12   1.939   7.273  17.305
  134    QD   LYS  12           QD       LYS  12   2.977   9.732  18.117
  135    QG   LYS  12           QG       LYS  12   1.665   9.434  16.144
  136    QE   LYS  12           QE       LYS  12   4.502   9.424  16.196
  137    QZ   LYS  12           QZ       LYS  12   5.479  10.680  17.808
  138    H    ALA  13           H        ALA  13   1.514   7.334  13.690
  139    HA   ALA  13           HA       ALA  13   1.231   4.491  12.985
  140   1HB   ALA  13          3HB       ALA  13   2.655   5.647  10.981
  141   2HB   ALA  13          2HB       ALA  13   0.901   5.780  11.114
  142   3HB   ALA  13          1HB       ALA  13   1.932   7.082  11.710
  143    MB   ALA  13           QB       ALA  13   1.829   6.170  11.268
  144    H    GLY  14           H        GLY  14   3.540   3.999  11.545
  145   1HA   GLY  14          1HA       GLY  14   5.385   2.704  12.794
  146   2HA   GLY  14          2HA       GLY  14   5.737   4.256  13.555
  147    QA   GLY  14           QA       GLY  14   5.561   3.480  13.175
  148    H    GLU  15           H        GLU  15   7.894   4.139  12.602
  149    HA   GLU  15           HA       GLU  15   8.273   5.655  10.258
  150   1HB   GLU  15          2HB       GLU  15   9.913   5.107  12.091
  151   2HB   GLU  15          1HB       GLU  15  10.086   3.498  11.386
  152   1HG   GLU  15          2HG       GLU  15  11.772   4.467  10.196
  153   2HG   GLU  15          1HG       GLU  15  10.458   5.064   9.183
  154    QB   GLU  15           QB       GLU  15  10.000   4.302  11.739
  155    QG   GLU  15           QG       GLU  15  11.115   4.765   9.690
  156    H    GLY  16           H        GLY  16   8.257   5.140   8.087
  157   1HA   GLY  16          1HA       GLY  16   8.402   2.280   7.291
  158   2HA   GLY  16          2HA       GLY  16   8.621   3.656   6.208
  159    QA   GLY  16           QA       GLY  16   8.511   2.968   6.750
  160    H    GLU  17           H        GLU  17   5.983   3.721   8.473
  161    HA   GLU  17           HA       GLU  17   4.042   2.668   6.497
  162   1HB   GLU  17          2HB       GLU  17   3.921   3.640   9.364
  163   2HB   GLU  17          1HB       GLU  17   2.487   3.135   8.470
  164   1HG   GLU  17          2HG       GLU  17   3.114   0.915   8.441
  165   2HG   GLU  17          1HG       GLU  17   4.837   1.292   8.469
  166    QB   GLU  17           QB       GLU  17   3.204   3.387   8.917
  167    QG   GLU  17           QG       GLU  17   3.975   1.103   8.455
  168    H    ILE  18           H        ILE  18   2.216   3.982   5.793
  169    HA   ILE  18           HA       ILE  18   2.815   6.920   5.784
  170    HB   ILE  18           HB       ILE  18   1.321   5.141   3.828
  171   1HG1  ILE  18          2HG1      ILE  18   3.470   6.172   2.499
  172   2HG1  ILE  18          1HG1      ILE  18   4.142   5.999   4.121
  173   1HG2  ILE  18          2HG2      ILE  18   1.824   8.095   3.989
  174   2HG2  ILE  18          1HG2      ILE  18   1.758   7.322   2.405
  175   3HG2  ILE  18          3HG2      ILE  18   0.367   7.238   3.486
  176   1HD1  ILE  18          2HD1      ILE  18   2.693   3.792   2.628
  177   2HD1  ILE  18          1HD1      ILE  18   4.448   3.952   2.711
  178   3HD1  ILE  18          3HD1      ILE  18   3.520   3.647   4.180
  179    MG   ILE  18           QG2      ILE  18   1.316   7.552   3.293
  180    MD   ILE  18           QD1      ILE  18   3.554   3.797   3.173
  181    QG   ILE  18           QG1      ILE  18   3.806   6.085   3.310
  182    HA   PRO  19           HA       PRO  19  -1.054   6.727   8.157
  183   1HB   PRO  19          2HB       PRO  19  -0.805   9.213   9.270
  184   2HB   PRO  19          1HB       PRO  19   0.014   7.778   9.917
  185   1HG   PRO  19          2HG       PRO  19   1.093   9.973   8.230
  186   2HG   PRO  19          1HG       PRO  19   1.859   9.083   9.554
  187   1HD   PRO  19          2HD       PRO  19   2.352   8.610   6.901
  188   2HD   PRO  19          1HD       PRO  19   2.558   7.397   8.184
  189    QB   PRO  19           QB       PRO  19  -0.396   8.495   9.594
  190    QG   PRO  19           QG       PRO  19   1.476   9.528   8.892
  191    QD   PRO  19           QD       PRO  19   2.455   8.003   7.542
  192    H    ALA  20           H        ALA  20  -3.037   8.114   8.069
  193    HA   ALA  20           HA       ALA  20  -3.438   9.210   5.379
  194   1HB   ALA  20          1HB       ALA  20  -5.211   7.923   6.267
  195   2HB   ALA  20          2HB       ALA  20  -5.773   9.581   6.473
  196   3HB   ALA  20          3HB       ALA  20  -5.099   8.700   7.845
  197    MB   ALA  20           QB       ALA  20  -5.361   8.735   6.862
  198    HA   PRO  21           HA       PRO  21  -2.835  13.446   6.421
  199   1HB   PRO  21          2HB       PRO  21  -4.578  14.662   4.701
  200   2HB   PRO  21          1HB       PRO  21  -3.056  13.919   4.168
  201   1HG   PRO  21          2HG       PRO  21  -5.833  12.865   4.012
  202   2HG   PRO  21          1HG       PRO  21  -4.503  12.720   2.853
  203   1HD   PRO  21          2HD       PRO  21  -5.257  10.722   4.560
  204   2HD   PRO  21          1HD       PRO  21  -3.615  10.896   3.902
  205    QB   PRO  21           QB       PRO  21  -3.817  14.290   4.434
  206    QG   PRO  21           QG       PRO  21  -5.168  12.793   3.433
  207    QD   PRO  21           QD       PRO  21  -4.436  10.809   4.231
  208    H    LEU  22           H        LEU  22  -6.217  12.340   6.228
  209    HA   LEU  22           HA       LEU  22  -6.817  13.773   8.746
  210   1HB   LEU  22          2HB       LEU  22  -7.344  14.829   6.134
  211   2HB   LEU  22          1HB       LEU  22  -8.888  14.440   6.894
  212    HG   LEU  22           HG       LEU  22  -6.863  15.812   8.593
  213   1HD1  LEU  22          3HD1      LEU  22  -9.234  15.071   9.243
  214   2HD1  LEU  22          2HD1      LEU  22  -8.806  16.742   9.611
  215   3HD1  LEU  22          1HD1      LEU  22  -9.808  16.377   8.206
  216   1HD2  LEU  22          1HD2      LEU  22  -6.915  16.919   6.250
  217   2HD2  LEU  22          3HD2      LEU  22  -8.555  17.414   6.675
  218   3HD2  LEU  22          2HD2      LEU  22  -7.189  17.956   7.650
  219    MD1  LEU  22           QD1      LEU  22  -9.283  16.063   9.020
  220    MD2  LEU  22           QD2      LEU  22  -7.553  17.430   6.858
  221    QB   LEU  22           QB       LEU  22  -8.116  14.634   6.514
  222    QD   LEU  22           QQD      LEU  22  -8.418  16.747   7.939
  223    H    ALA  23           H        ALA  23  -8.395  12.115   5.980
  224    HA   ALA  23           HA       ALA  23  -9.347   9.947   7.685
  225   1HB   ALA  23          2HB       ALA  23 -10.851  12.405   7.393
  226   2HB   ALA  23          3HB       ALA  23 -11.210  11.006   8.404
  227   3HB   ALA  23          1HB       ALA  23 -11.767  11.052   6.732
  228    MB   ALA  23           QB       ALA  23 -11.276  11.488   7.510
  229    H    GLY  24           H        GLY  24 -11.146   8.697   6.318
  230   1HA   GLY  24          1HA       GLY  24  -9.954   7.939   3.835
  231   2HA   GLY  24          2HA       GLY  24 -11.326   9.001   3.507
  232    QA   GLY  24           QA       GLY  24 -10.640   8.470   3.671
  233    H    THR  25           H        THR  25 -12.306   7.049   2.494
  234    HA   THR  25           HA       THR  25 -13.557   5.276   4.567
  235    HB   THR  25           HB       THR  25 -15.431   5.188   2.878
  236    HG1  THR  25           HG1      THR  25 -15.257   6.960   1.305
  237   1HG2  THR  25          1HG2      THR  25 -15.052   6.959   4.804
  238   2HG2  THR  25          3HG2      THR  25 -14.869   8.074   3.450
  239   3HG2  THR  25          2HG2      THR  25 -16.368   7.167   3.649
  240    MG   THR  25           QG2      THR  25 -15.430   7.400   3.968
  241    H    VAL  26           H        VAL  26 -11.917   3.612   4.362
  242    HA   VAL  26           HA       VAL  26 -11.022   2.510   1.872
  243    HB   VAL  26           HB       VAL  26 -11.331   1.209   4.600
  244   1HG1  VAL  26          3HG1      VAL  26 -10.736  -0.179   2.483
  245   2HG1  VAL  26          2HG1      VAL  26  -9.188   0.664   2.551
  246   3HG1  VAL  26          1HG1      VAL  26  -9.704  -0.345   3.903
  247   1HG2  VAL  26          3HG2      VAL  26  -9.925   3.523   3.982
  248   2HG2  VAL  26          2HG2      VAL  26  -9.602   2.462   5.353
  249   3HG2  VAL  26          1HG2      VAL  26  -8.702   2.260   3.850
  250    MG1  VAL  26           QG1      VAL  26  -9.876   0.046   2.979
  251    MG2  VAL  26           QG2      VAL  26  -9.410   2.748   4.395
  252    QG   VAL  26           QQG      VAL  26  -9.643   1.397   3.687
  253    H    SER  27           H        SER  27 -11.993   0.988   0.532
  254    HA   SER  27           HA       SER  27 -14.553  -0.246   1.498
  255   1HB   SER  27          2HB       SER  27 -13.841   0.872  -1.230
  256   2HB   SER  27          1HB       SER  27 -15.370   0.100  -0.822
  257    HG   SER  27           HG       SER  27 -15.748   1.744   0.668
  258    QB   SER  27           QB       SER  27 -14.606   0.486  -1.026
  259    H    LYS  28           H        LYS  28 -11.625  -0.615  -0.468
  260    HA   LYS  28           HA       LYS  28 -11.948  -3.555  -0.321
  261   1HB   LYS  28          2HB       LYS  28 -12.579  -1.893  -2.625
  262   2HB   LYS  28          1HB       LYS  28 -11.322  -3.068  -3.012
  263   1HG   LYS  28          2HG       LYS  28 -13.641  -4.062  -1.432
  264   2HG   LYS  28          1HG       LYS  28 -13.940  -3.676  -3.128
  265   1HD   LYS  28          2HD       LYS  28 -11.473  -5.227  -2.548
  266   2HD   LYS  28          1HD       LYS  28 -13.002  -6.078  -2.325
  267   1HE   LYS  28          2HE       LYS  28 -13.499  -6.046  -4.573
  268   2HE   LYS  28          1HE       LYS  28 -12.725  -4.468  -4.823
  269   1HZ   LYS  28          1HZ       LYS  28 -10.567  -5.535  -4.444
  270   2HZ   LYS  28          3HZ       LYS  28 -11.332  -7.043  -4.310
  271   3HZ   LYS  28          2HZ       LYS  28 -11.366  -6.203  -5.787
  272    QB   LYS  28           QB       LYS  28 -11.950  -2.480  -2.818
  273    QD   LYS  28           QD       LYS  28 -12.238  -5.653  -2.437
  274    QG   LYS  28           QG       LYS  28 -13.790  -3.869  -2.280
  275    QE   LYS  28           QE       LYS  28 -13.112  -5.257  -4.698
  276    QZ   LYS  28           QZ       LYS  28 -11.088  -6.260  -4.847
  277    H    ILE  29           H        ILE  29  -9.947  -4.669  -0.948
  278    HA   ILE  29           HA       ILE  29  -7.544  -2.874  -1.048
  279    HB   ILE  29           HB       ILE  29  -7.870  -3.774   1.200
  280   1HG1  ILE  29          2HG1      ILE  29  -5.726  -5.288  -0.326
  281   2HG1  ILE  29          1HG1      ILE  29  -5.555  -3.678   0.375
  282   1HG2  ILE  29          3HG2      ILE  29  -7.963  -6.470  -0.189
  283   2HG2  ILE  29          2HG2      ILE  29  -7.946  -6.229   1.557
  284   3HG2  ILE  29          1HG2      ILE  29  -9.318  -5.667   0.603
  285   1HD1  ILE  29          1HD1      ILE  29  -6.258  -4.834   2.606
  286   2HD1  ILE  29          3HD1      ILE  29  -5.810  -6.329   1.783
  287   3HD1  ILE  29          2HD1      ILE  29  -4.609  -5.061   2.024
  288    MG   ILE  29           QG2      ILE  29  -8.409  -6.122   0.657
  289    MD   ILE  29           QD1      ILE  29  -5.559  -5.408   2.137
  290    QG   ILE  29           QG1      ILE  29  -5.640  -4.483   0.025
  291    H    LEU  30           H        LEU  30  -6.066  -3.455  -2.623
  292    HA   LEU  30           HA       LEU  30  -6.707  -5.807  -4.315
  293   1HB   LEU  30          2HB       LEU  30  -5.328  -3.205  -4.537
  294   2HB   LEU  30          1HB       LEU  30  -4.552  -4.513  -5.430
  295    HG   LEU  30           HG       LEU  30  -6.233  -3.362  -6.828
  296   1HD1  LEU  30          2HD1      LEU  30  -7.679  -2.733  -4.833
  297   2HD1  LEU  30          1HD1      LEU  30  -8.561  -3.337  -6.236
  298   3HD1  LEU  30          3HD1      LEU  30  -8.282  -4.390  -4.849
  299   1HD2  LEU  30          2HD2      LEU  30  -5.805  -5.950  -6.798
  300   2HD2  LEU  30          1HD2      LEU  30  -7.431  -6.028  -6.118
  301   3HD2  LEU  30          3HD2      LEU  30  -7.174  -5.315  -7.711
  302    MD1  LEU  30           QD1      LEU  30  -8.174  -3.487  -5.306
  303    MD2  LEU  30           QD2      LEU  30  -6.804  -5.764  -6.875
  304    QB   LEU  30           QB       LEU  30  -4.940  -3.859  -4.983
  305    QD   LEU  30           QQD      LEU  30  -7.489  -4.626  -6.091
  306    H    VAL  31           H        VAL  31  -4.029  -4.510  -2.345
  307    HA   VAL  31           HA       VAL  31  -2.419  -6.954  -2.819
  308    HB   VAL  31           HB       VAL  31  -0.758  -5.679  -1.458
  309   1HG1  VAL  31          3HG1      VAL  31  -2.953  -4.481  -0.345
  310   2HG1  VAL  31          2HG1      VAL  31  -1.314  -3.842  -0.234
  311   3HG1  VAL  31          1HG1      VAL  31  -2.415  -3.234  -1.470
  312   1HG2  VAL  31          2HG2      VAL  31  -2.149  -4.249  -3.735
  313   2HG2  VAL  31          1HG2      VAL  31  -0.630  -3.683  -3.039
  314   3HG2  VAL  31          3HG2      VAL  31  -0.709  -5.263  -3.817
  315    MG1  VAL  31           QG1      VAL  31  -2.227  -3.852  -0.683
  316    MG2  VAL  31           QG2      VAL  31  -1.163  -4.398  -3.530
  317    QG   VAL  31           QQG      VAL  31  -1.695  -4.125  -2.107
  318    H    LYS  32           H        LYS  32  -1.232  -7.429  -0.412
  319    HA   LYS  32           HA       LYS  32  -3.150  -7.516   1.787
  320   1HB   LYS  32          2HB       LYS  32  -3.317 -10.034   1.719
  321   2HB   LYS  32          1HB       LYS  32  -4.117  -9.226   0.373
  322   1HG   LYS  32          2HG       LYS  32  -1.699  -9.550  -0.748
  323   2HG   LYS  32          1HG       LYS  32  -1.647 -10.901   0.383
  324   1HD   LYS  32          2HD       LYS  32  -3.952 -11.554  -0.504
  325   2HD   LYS  32          1HD       LYS  32  -3.678 -10.384  -1.795
  326   1HE   LYS  32          2HE       LYS  32  -1.598 -12.487  -1.197
  327   2HE   LYS  32          1HE       LYS  32  -2.985 -12.858  -2.240
  328   1HZ   LYS  32          1HZ       LYS  32  -2.428 -10.655  -3.369
  329   2HZ   LYS  32          3HZ       LYS  32  -0.920 -10.771  -2.602
  330   3HZ   LYS  32          2HZ       LYS  32  -1.409 -11.975  -3.696
  331    QB   LYS  32           QB       LYS  32  -3.717  -9.630   1.046
  332    QD   LYS  32           QD       LYS  32  -3.815 -10.969  -1.150
  333    QG   LYS  32           QG       LYS  32  -1.673 -10.225  -0.183
  334    QE   LYS  32           QE       LYS  32  -2.292 -12.673  -1.719
  335    QZ   LYS  32           QZ       LYS  32  -1.586 -11.134  -3.222
  336    H    GLU  33           H        GLU  33  -0.231  -9.102   0.423
  337    HA   GLU  33           HA       GLU  33   1.492  -8.272   2.552
  338   1HB   GLU  33          2HB       GLU  33  -0.333 -10.339   3.205
  339   2HB   GLU  33          1HB       GLU  33   1.244 -11.113   3.036
  340   1HG   GLU  33          2HG       GLU  33   2.143  -9.988   4.822
  341   2HG   GLU  33          1HG       GLU  33   1.179  -8.541   4.530
  342    QB   GLU  33           QB       GLU  33   0.455 -10.726   3.120
  343    QG   GLU  33           QG       GLU  33   1.661  -9.264   4.676
  344    H    GLY  34           H        GLY  34   3.256  -8.152   1.187
  345   1HA   GLY  34          1HA       GLY  34   4.122 -10.685  -0.123
  346   2HA   GLY  34          2HA       GLY  34   5.188  -9.341   0.287
  347    QA   GLY  34           QA       GLY  34   4.655 -10.013   0.082
  348    H    ASP  35           H        ASP  35   2.091  -8.676  -1.164
  349    HA   ASP  35           HA       ASP  35   2.676  -8.815  -3.920
  350   1HB   ASP  35          2HB       ASP  35   0.550  -8.163  -2.481
  351   2HB   ASP  35          1HB       ASP  35   1.132  -6.520  -2.748
  352    QB   ASP  35           QB       ASP  35   0.841  -7.342  -2.615
  353    H    THR  36           H        THR  36   4.433  -7.902  -4.919
  354    HA   THR  36           HA       THR  36   5.862  -5.625  -3.806
  355    HB   THR  36           HB       THR  36   6.051  -6.870  -6.562
  356    HG1  THR  36           HG1      THR  36   7.270  -8.428  -5.665
  357   1HG2  THR  36          1HG2      THR  36   7.327  -4.773  -6.153
  358   2HG2  THR  36          3HG2      THR  36   8.125  -5.553  -4.787
  359   3HG2  THR  36          2HG2      THR  36   8.384  -6.159  -6.424
  360    MG   THR  36           QG2      THR  36   7.945  -5.495  -5.788
  361    H    VAL  37           H        VAL  37   4.442  -3.816  -3.799
  362    HA   VAL  37           HA       VAL  37   2.821  -3.038  -6.054
  363    HB   VAL  37           HB       VAL  37   2.576  -0.971  -4.731
  364   1HG1  VAL  37          1HG1      VAL  37   1.421  -3.092  -4.036
  365   2HG1  VAL  37          3HG1      VAL  37   2.752  -3.395  -2.921
  366   3HG1  VAL  37          2HG1      VAL  37   1.719  -1.984  -2.696
  367   1HG2  VAL  37          3HG2      VAL  37   5.191  -1.827  -3.753
  368   2HG2  VAL  37          2HG2      VAL  37   4.432  -0.237  -3.670
  369   3HG2  VAL  37          1HG2      VAL  37   4.086  -1.444  -2.433
  370    MG1  VAL  37           QG1      VAL  37   1.964  -2.824  -3.218
  371    MG2  VAL  37           QG2      VAL  37   4.569  -1.169  -3.285
  372    QG   VAL  37           QQG      VAL  37   3.267  -1.997  -3.251
  373    H    LYS  38           H        LYS  38   3.208  -0.963  -7.278
  374    HA   LYS  38           HA       LYS  38   6.132  -0.529  -7.797
  375   1HB   LYS  38          2HB       LYS  38   3.768  -1.062  -9.548
  376   2HB   LYS  38          1HB       LYS  38   5.010   0.027 -10.169
  377   1HG   LYS  38          2HG       LYS  38   6.732  -1.705  -9.679
  378   2HG   LYS  38          1HG       LYS  38   5.449  -2.799  -9.161
  379   1HD   LYS  38          2HD       LYS  38   4.540  -1.948 -11.624
  380   2HD   LYS  38          1HD       LYS  38   6.282  -2.052 -11.877
  381   1HE   LYS  38          2HE       LYS  38   6.031  -4.293 -12.111
  382   2HE   LYS  38          1HE       LYS  38   5.574  -4.363 -10.397
  383   1HZ   LYS  38          1HZ       LYS  38   3.313  -3.554 -11.198
  384   2HZ   LYS  38          3HZ       LYS  38   3.817  -4.013 -12.751
  385   3HZ   LYS  38          2HZ       LYS  38   3.708  -5.176 -11.517
  386    QB   LYS  38           QB       LYS  38   4.389  -0.518  -9.858
  387    QD   LYS  38           QD       LYS  38   5.411  -2.000 -11.751
  388    QG   LYS  38           QG       LYS  38   6.090  -2.252  -9.420
  389    QE   LYS  38           QE       LYS  38   5.803  -4.328 -11.254
  390    QZ   LYS  38           QZ       LYS  38   3.613  -4.248 -11.822
  391    H    ALA  39           H        ALA  39   6.558   1.673  -8.766
  392    HA   ALA  39           HA       ALA  39   5.380   3.775  -7.215
  393   1HB   ALA  39          3HB       ALA  39   7.605   3.392  -8.758
  394   2HB   ALA  39          1HB       ALA  39   7.076   4.972  -8.179
  395   3HB   ALA  39          2HB       ALA  39   6.649   4.440  -9.806
  396    MB   ALA  39           QB       ALA  39   7.110   4.268  -8.915
  397    H    GLY  40           H        GLY  40   3.234   4.326  -7.484
  398   1HA   GLY  40          1HA       GLY  40   2.355   5.235 -10.138
  399   2HA   GLY  40          2HA       GLY  40   1.451   5.405  -8.632
  400    QA   GLY  40           QA       GLY  40   1.903   5.320  -9.385
  401    H    GLN  41           H        GLN  41   1.620   2.625  -7.863
  402    HA   GLN  41           HA       GLN  41  -0.004   1.328 -10.029
  403   1HB   GLN  41          2HB       GLN  41   2.271   0.390  -9.317
  404   2HB   GLN  41          1HB       GLN  41   1.516   0.000  -7.772
  405   1HG   GLN  41          2HG       GLN  41  -0.317  -1.004  -9.554
  406   2HG   GLN  41          1HG       GLN  41   1.206  -1.308 -10.393
  407   1HE2  GLN  41          1HE2      GLN  41   1.799  -3.438  -9.939
  408   2HE2  GLN  41          2HE2      GLN  41   1.758  -4.149  -8.399
  409    QB   GLN  41           QB       GLN  41   1.894   0.195  -8.544
  410    QG   GLN  41           QG       GLN  41   0.445  -1.156  -9.973
  411    QE   GLN  41           QE2      GLN  41   1.779  -3.794  -9.169
  412    H    THR  42           H        THR  42  -2.157   1.439  -9.469
  413    HA   THR  42           HA       THR  42  -3.262   2.040  -6.953
  414    HB   THR  42           HB       THR  42  -4.579   0.113  -8.851
  415    HG1  THR  42           HG1      THR  42  -4.752   1.662 -10.367
  416   1HG2  THR  42          3HG2      THR  42  -5.726   1.119  -6.829
  417   2HG2  THR  42          2HG2      THR  42  -5.568   2.691  -7.613
  418   3HG2  THR  42          1HG2      THR  42  -6.534   1.424  -8.367
  419    MG   THR  42           QG2      THR  42  -5.943   1.744  -7.603
  420    H    VAL  43           H        VAL  43  -3.046   0.905  -5.062
  421    HA   VAL  43           HA       VAL  43  -2.957  -2.092  -5.224
  422    HB   VAL  43           HB       VAL  43  -1.438  -1.918  -3.254
  423   1HG1  VAL  43          2HG1      VAL  43  -0.899  -0.976  -5.960
  424   2HG1  VAL  43          1HG1      VAL  43   0.217  -0.274  -4.789
  425   3HG1  VAL  43          3HG1      VAL  43   0.072  -2.025  -4.930
  426   1HG2  VAL  43          3HG2      VAL  43  -2.494   0.446  -2.733
  427   2HG2  VAL  43          2HG2      VAL  43  -0.811   0.120  -2.321
  428   3HG2  VAL  43          1HG2      VAL  43  -1.200   1.025  -3.783
  429    MG1  VAL  43           QG1      VAL  43  -0.204  -1.091  -5.227
  430    MG2  VAL  43           QG2      VAL  43  -1.502   0.530  -2.946
  431    QG   VAL  43           QQG      VAL  43  -0.853  -0.281  -4.086
  432    H    LEU  44           H        LEU  44  -4.619   0.636  -3.968
  433    HA   LEU  44           HA       LEU  44  -6.226  -1.168  -2.216
  434   1HB   LEU  44          2HB       LEU  44  -4.412   1.029  -1.432
  435   2HB   LEU  44          1HB       LEU  44  -6.004   1.085  -0.676
  436    HG   LEU  44           HG       LEU  44  -5.335  -1.596  -0.503
  437   1HD1  LEU  44          2HD1      LEU  44  -5.518   0.745   1.276
  438   2HD1  LEU  44          1HD1      LEU  44  -6.209  -0.867   1.464
  439   3HD1  LEU  44          3HD1      LEU  44  -4.530  -0.568   1.916
  440   1HD2  LEU  44          1HD2      LEU  44  -2.882   0.140  -0.289
  441   2HD2  LEU  44          3HD2      LEU  44  -3.020  -1.337   0.665
  442   3HD2  LEU  44          2HD2      LEU  44  -3.064  -1.417  -1.096
  443    MD1  LEU  44           QD1      LEU  44  -5.419  -0.230   1.552
  444    MD2  LEU  44           QD2      LEU  44  -2.989  -0.871  -0.240
  445    QB   LEU  44           QB       LEU  44  -5.208   1.057  -1.054
  446    QD   LEU  44           QQD      LEU  44  -4.204  -0.551   0.656
  447    H    VAL  45           H        VAL  45  -8.334  -0.191  -1.648
  448    HA   VAL  45           HA       VAL  45  -9.204   1.842  -3.668
  449    HB   VAL  45           HB       VAL  45 -10.698  -0.302  -2.124
  450   1HG1  VAL  45          2HG1      VAL  45 -11.800   2.007  -3.009
  451   2HG1  VAL  45          1HG1      VAL  45 -11.897   1.047  -4.484
  452   3HG1  VAL  45          3HG1      VAL  45 -12.668   0.473  -3.006
  453   1HG2  VAL  45          2HG2      VAL  45  -9.235  -0.265  -4.646
  454   2HG2  VAL  45          1HG2      VAL  45  -9.891  -1.639  -3.755
  455   3HG2  VAL  45          3HG2      VAL  45 -10.918  -0.740  -4.872
  456    MG1  VAL  45           QG1      VAL  45 -12.122   1.176  -3.500
  457    MG2  VAL  45           QG2      VAL  45 -10.015  -0.881  -4.424
  458    QG   VAL  45           QQG      VAL  45 -11.068   0.147  -3.962
  459    H    LEU  46           H        LEU  46  -9.437   3.852  -2.764
  460    HA   LEU  46           HA       LEU  46 -10.825   4.087  -0.146
  461   1HB   LEU  46          2HB       LEU  46  -8.109   3.974  -0.233
  462   2HB   LEU  46          1HB       LEU  46  -8.356   5.707  -0.444
  463    HG   LEU  46           HG       LEU  46  -9.751   4.153   1.741
  464   1HD1  LEU  46          1HD1      LEU  46 -10.579   6.427   1.052
  465   2HD1  LEU  46          3HD1      LEU  46 -10.033   6.351   2.726
  466   3HD1  LEU  46          2HD1      LEU  46  -9.003   7.082   1.494
  467   1HD2  LEU  46          2HD2      LEU  46  -7.056   5.545   1.813
  468   2HD2  LEU  46          1HD2      LEU  46  -7.950   5.040   3.248
  469   3HD2  LEU  46          3HD2      LEU  46  -7.367   3.832   2.101
  470    MD1  LEU  46           QD1      LEU  46  -9.872   6.620   1.757
  471    MD2  LEU  46           QD2      LEU  46  -7.458   4.806   2.387
  472    QB   LEU  46           QB       LEU  46  -8.233   4.841  -0.338
  473    QD   LEU  46           QQD      LEU  46  -8.665   5.713   2.072
  474    H    GLU  47           H        GLU  47 -12.152   5.875  -0.153
  475    HA   GLU  47           HA       GLU  47 -11.765   7.872  -2.360
  476   1HB   GLU  47          2HB       GLU  47 -14.158   6.560  -1.081
  477   2HB   GLU  47          1HB       GLU  47 -14.336   8.108  -1.908
  478   1HG   GLU  47          2HG       GLU  47 -13.652   7.212  -3.987
  479   2HG   GLU  47          1HG       GLU  47 -12.952   5.779  -3.235
  480    QB   GLU  47           QB       GLU  47 -14.247   7.334  -1.495
  481    QG   GLU  47           QG       GLU  47 -13.302   6.496  -3.611
  482    H    ALA  48           H        ALA  48 -10.733   9.572  -1.291
  483    HA   ALA  48           HA       ALA  48 -12.111  10.647   1.149
  484   1HB   ALA  48          1HB       ALA  48  -9.386  11.396   1.165
  485   2HB   ALA  48          2HB       ALA  48  -9.415   9.694   0.703
  486   3HB   ALA  48          3HB       ALA  48 -10.166  10.210   2.213
  487    MB   ALA  48           QB       ALA  48  -9.656  10.433   1.361
  488    H    MET  49           H        MET  49 -10.515  12.977   1.332
  489    HA   MET  49           HA       MET  49 -11.746  14.647  -0.715
  490   1HB   MET  49          2HB       MET  49 -10.603  14.875   1.872
  491   2HB   MET  49          1HB       MET  49  -9.668  15.935   0.818
  492   1HG   MET  49          2HG       MET  49 -11.559  17.201   0.206
  493   2HG   MET  49          1HG       MET  49 -12.680  15.944   0.729
  494   1HE   MET  49          2HE       MET  49 -13.525  15.502   2.501
  495   2HE   MET  49          1HE       MET  49 -12.612  15.441   4.007
  496   3HE   MET  49          3HE       MET  49 -13.859  16.674   3.774
  497    QB   MET  49           QB       MET  49 -10.135  15.405   1.345
  498    QG   MET  49           QG       MET  49 -12.119  16.572   0.467
  499    ME   MET  49           QE       MET  49 -13.332  15.872   3.428
  500    H    LYS  50           H        LYS  50  -8.558  13.231  -0.195
  501    HA   LYS  50           HA       LYS  50  -7.557  14.670  -2.629
  502   1HB   LYS  50          2HB       LYS  50  -6.509  14.088   0.011
  503   2HB   LYS  50          1HB       LYS  50  -5.435  13.448  -1.235
  504   1HG   LYS  50          2HG       LYS  50  -5.540  15.688  -2.375
  505   2HG   LYS  50          1HG       LYS  50  -6.436  16.298  -0.984
  506   1HD   LYS  50          2HD       LYS  50  -4.527  15.574   0.482
  507   2HD   LYS  50          1HD       LYS  50  -3.623  15.169  -0.978
  508   1HE   LYS  50          2HE       LYS  50  -4.742  17.833  -1.219
  509   2HE   LYS  50          1HE       LYS  50  -3.757  17.700   0.252
  510   1HZ   LYS  50          1HZ       LYS  50  -2.012  16.648  -1.058
  511   2HZ   LYS  50          3HZ       LYS  50  -2.944  16.814  -2.466
  512   3HZ   LYS  50          2HZ       LYS  50  -2.365  18.196  -1.664
  513    QB   LYS  50           QB       LYS  50  -5.972  13.768  -0.612
  514    QD   LYS  50           QD       LYS  50  -4.075  15.372  -0.248
  515    QG   LYS  50           QG       LYS  50  -5.988  15.993  -1.680
  516    QE   LYS  50           QE       LYS  50  -4.249  17.767  -0.483
  517    QZ   LYS  50           QZ       LYS  50  -2.440  17.219  -1.729
  518    H    MET  51           H        MET  51  -9.013  11.854  -2.024
  519    HA   MET  51           HA       MET  51  -7.279  10.357  -3.953
  520   1HB   MET  51          2HB       MET  51  -8.202   9.677  -1.199
  521   2HB   MET  51          1HB       MET  51  -8.204   8.368  -2.384
  522   1HG   MET  51          2HG       MET  51  -5.915   8.364  -2.592
  523   2HG   MET  51          1HG       MET  51  -5.782  10.098  -2.303
  524   1HE   MET  51          2HE       MET  51  -3.681   9.670  -0.884
  525   2HE   MET  51          1HE       MET  51  -3.589   8.583   0.499
  526   3HE   MET  51          3HE       MET  51  -3.822   7.931  -1.128
  527    QB   MET  51           QB       MET  51  -8.203   9.023  -1.792
  528    QG   MET  51           QG       MET  51  -5.849   9.231  -2.447
  529    ME   MET  51           QE       MET  51  -3.697   8.728  -0.504
  530    H    GLU  52           H        GLU  52  -8.589   8.472  -4.933
  531    HA   GLU  52           HA       GLU  52 -11.527   8.838  -4.854
  532   1HB   GLU  52          2HB       GLU  52 -10.339  10.481  -6.473
  533   2HB   GLU  52          1HB       GLU  52 -10.056   9.060  -7.477
  534   1HG   GLU  52          2HG       GLU  52 -12.352   8.691  -7.827
  535   2HG   GLU  52          1HG       GLU  52 -12.814   9.670  -6.433
  536    QB   GLU  52           QB       GLU  52 -10.198   9.770  -6.975
  537    QG   GLU  52           QG       GLU  52 -12.583   9.181  -7.130
  538    H    THR  53           H        THR  53 -10.959   6.555  -3.981
  539    HA   THR  53           HA       THR  53 -11.168   4.232  -4.325
  540    HB   THR  53           HB       THR  53 -11.465   4.712  -7.270
  541    HG1  THR  53           HG1      THR  53 -13.530   5.521  -6.905
  542   1HG2  THR  53          2HG2      THR  53 -12.884   3.031  -5.189
  543   2HG2  THR  53          1HG2      THR  53 -13.366   3.114  -6.884
  544   3HG2  THR  53          3HG2      THR  53 -11.787   2.460  -6.447
  545    MG   THR  53           QG2      THR  53 -12.679   2.868  -6.173
  546    H    GLU  54           H        GLU  54  -9.500   5.515  -7.249
  547    HA   GLU  54           HA       GLU  54  -7.660   3.284  -7.357
  548   1HB   GLU  54          2HB       GLU  54  -8.418   5.596  -8.869
  549   2HB   GLU  54          1HB       GLU  54  -6.662   5.603  -8.701
  550   1HG   GLU  54          2HG       GLU  54  -6.473   3.938 -10.200
  551   2HG   GLU  54          1HG       GLU  54  -7.557   2.921  -9.253
  552    QB   GLU  54           QB       GLU  54  -7.540   5.600  -8.785
  553    QG   GLU  54           QG       GLU  54  -7.015   3.429  -9.727
  554    H    ILE  55           H        ILE  55  -6.441   3.095  -5.424
  555    HA   ILE  55           HA       ILE  55  -4.879   5.500  -4.568
  556    HB   ILE  55           HB       ILE  55  -5.298   2.852  -3.152
  557   1HG1  ILE  55          2HG1      ILE  55  -7.464   4.008  -3.603
  558   2HG1  ILE  55          1HG1      ILE  55  -7.081   3.944  -1.887
  559   1HG2  ILE  55          2HG2      ILE  55  -3.385   4.223  -2.389
  560   2HG2  ILE  55          1HG2      ILE  55  -4.473   5.589  -2.142
  561   3HG2  ILE  55          3HG2      ILE  55  -4.648   4.134  -1.161
  562   1HD1  ILE  55          1HD1      ILE  55  -6.096   6.331  -3.361
  563   2HD1  ILE  55          3HD1      ILE  55  -7.840   6.219  -3.133
  564   3HD1  ILE  55          2HD1      ILE  55  -6.765   6.208  -1.736
  565    MG   ILE  55           QG2      ILE  55  -4.169   4.649  -1.897
  566    MD   ILE  55           QD1      ILE  55  -6.900   6.253  -2.743
  567    QG   ILE  55           QG1      ILE  55  -7.272   3.976  -2.745
  568    H    ASN  56           H        ASN  56  -3.099   5.434  -5.963
  569    HA   ASN  56           HA       ASN  56  -1.669   2.996  -6.633
  570   1HB   ASN  56          2HB       ASN  56  -1.120   5.965  -6.863
  571   2HB   ASN  56          1HB       ASN  56  -0.025   4.740  -7.504
  572   1HD2  ASN  56          1HD2      ASN  56  -0.599   5.741  -9.680
  573   2HD2  ASN  56          2HD2      ASN  56  -2.024   5.233 -10.448
  574    QB   ASN  56           QB       ASN  56  -0.573   5.353  -7.184
  575    QD   ASN  56           QD2      ASN  56  -1.311   5.487 -10.064
  576    H    ALA  57           H        ALA  57  -0.014   2.055  -5.501
  577    HA   ALA  57           HA       ALA  57   0.593   2.531  -2.821
  578   1HB   ALA  57          2HB       ALA  57   1.852   1.216  -5.153
  579   2HB   ALA  57          1HB       ALA  57   2.954   1.578  -3.823
  580   3HB   ALA  57          3HB       ALA  57   1.531   0.575  -3.541
  581    MB   ALA  57           QB       ALA  57   2.112   1.123  -4.172
  582    HA   PRO  58           HA       PRO  58   3.126   6.119  -2.636
  583   1HB   PRO  58          2HB       PRO  58   5.053   5.432  -0.819
  584   2HB   PRO  58          1HB       PRO  58   3.368   5.757  -0.364
  585   1HG   PRO  58          2HG       PRO  58   4.762   3.154  -0.726
  586   2HG   PRO  58          1HG       PRO  58   3.549   3.629   0.472
  587   1HD   PRO  58          2HD       PRO  58   2.988   2.128  -1.740
  588   2HD   PRO  58          1HD       PRO  58   1.800   3.169  -0.926
  589    QB   PRO  58           QB       PRO  58   4.210   5.595  -0.592
  590    QG   PRO  58           QG       PRO  58   4.155   3.391  -0.127
  591    QD   PRO  58           QD       PRO  58   2.394   2.649  -1.333
  592    H    THR  59           H        THR  59   4.854   3.068  -3.141
  593    HA   THR  59           HA       THR  59   6.399   4.143  -5.340
  594    HB   THR  59           HB       THR  59   7.506   5.268  -3.448
  595    HG1  THR  59           HG1      THR  59   8.718   4.299  -5.252
  596   1HG2  THR  59          2HG2      THR  59   7.241   2.582  -2.290
  597   2HG2  THR  59          1HG2      THR  59   8.831   3.303  -2.046
  598   3HG2  THR  59          3HG2      THR  59   7.385   4.144  -1.486
  599    MG   THR  59           QG2      THR  59   7.819   3.343  -1.941
  600    H    ASP  60           H        ASP  60   8.138   2.469  -5.996
  601    HA   ASP  60           HA       ASP  60   6.977  -0.151  -6.109
  602   1HB   ASP  60          2HB       ASP  60   9.119  -0.694  -7.214
  603   2HB   ASP  60          1HB       ASP  60   8.506   0.860  -7.781
  604    QB   ASP  60           QB       ASP  60   8.813   0.083  -7.498
  605    H    GLY  61           H        GLY  61   7.170  -1.854  -4.691
  606   1HA   GLY  61          1HA       GLY  61   8.489  -1.492  -2.146
  607   2HA   GLY  61          2HA       GLY  61   9.418  -2.575  -3.185
  608    QA   GLY  61           QA       GLY  61   8.954  -2.034  -2.665
  609    H    LYS  62           H        LYS  62   8.559  -3.780  -0.987
  610    HA   LYS  62           HA       LYS  62   6.274  -5.466  -1.927
  611   1HB   LYS  62          2HB       LYS  62   8.832  -5.854  -0.495
  612   2HB   LYS  62          1HB       LYS  62   7.482  -6.797   0.139
  613   1HG   LYS  62          2HG       LYS  62   7.091  -7.840  -1.976
  614   2HG   LYS  62          1HG       LYS  62   8.151  -6.702  -2.809
  615   1HD   LYS  62          2HD       LYS  62   9.834  -7.751  -0.902
  616   2HD   LYS  62          1HD       LYS  62   8.832  -9.143  -1.314
  617   1HE   LYS  62          2HE       LYS  62   9.641  -9.256  -3.470
  618   2HE   LYS  62          1HE       LYS  62   9.844  -7.497  -3.592
  619   1HZ   LYS  62          2HZ       LYS  62  11.598  -7.792  -1.797
  620   2HZ   LYS  62          1HZ       LYS  62  11.561  -9.447  -2.176
  621   3HZ   LYS  62          3HZ       LYS  62  12.009  -8.319  -3.360
  622    QB   LYS  62           QB       LYS  62   8.157  -6.326  -0.178
  623    QD   LYS  62           QD       LYS  62   9.333  -8.447  -1.108
  624    QG   LYS  62           QG       LYS  62   7.621  -7.271  -2.392
  625    QE   LYS  62           QE       LYS  62   9.742  -8.377  -3.531
  626    QZ   LYS  62           QZ       LYS  62  11.723  -8.519  -2.444
  627    H    VAL  63           H        VAL  63   4.474  -5.758  -0.582
  628    HA   VAL  63           HA       VAL  63   4.066  -3.785   1.540
  629    HB   VAL  63           HB       VAL  63   2.457  -5.996   0.245
  630   1HG1  VAL  63          2HG1      VAL  63   2.302  -2.974   0.328
  631   2HG1  VAL  63          1HG1      VAL  63   2.704  -3.980  -1.065
  632   3HG1  VAL  63          3HG1      VAL  63   1.067  -3.996  -0.408
  633   1HG2  VAL  63          3HG2      VAL  63   1.949  -4.580   2.799
  634   2HG2  VAL  63          2HG2      VAL  63   0.600  -4.589   1.664
  635   3HG2  VAL  63          1HG2      VAL  63   1.300  -6.112   2.214
  636    MG1  VAL  63           QG1      VAL  63   2.024  -3.650  -0.382
  637    MG2  VAL  63           QG2      VAL  63   1.283  -5.094   2.226
  638    QG   VAL  63           QQG      VAL  63   1.654  -4.372   0.922
  639    H    GLU  64           H        GLU  64   5.063  -4.200   3.483
  640    HA   GLU  64           HA       GLU  64   5.611  -6.891   4.450
  641   1HB   GLU  64          2HB       GLU  64   5.741  -4.084   5.576
  642   2HB   GLU  64          1HB       GLU  64   6.184  -5.493   6.539
  643   1HG   GLU  64          2HG       GLU  64   7.459  -5.737   3.994
  644   2HG   GLU  64          1HG       GLU  64   7.773  -4.113   4.607
  645    QB   GLU  64           QB       GLU  64   5.963  -4.789   6.057
  646    QG   GLU  64           QG       GLU  64   7.616  -4.925   4.301
  647    H    LYS  65           H        LYS  65   2.889  -4.741   4.574
  648    HA   LYS  65           HA       LYS  65   1.141  -6.631   5.811
  649   1HB   LYS  65          2HB       LYS  65   2.927  -5.242   7.577
  650   2HB   LYS  65          1HB       LYS  65   1.285  -4.681   7.898
  651   1HG   LYS  65          2HG       LYS  65   0.512  -6.848   8.408
  652   2HG   LYS  65          1HG       LYS  65   1.882  -7.621   7.609
  653   1HD   LYS  65          2HD       LYS  65   2.297  -5.829   9.998
  654   2HD   LYS  65          1HD       LYS  65   1.884  -7.532  10.203
  655   1HE   LYS  65          2HE       LYS  65   3.852  -8.206   8.905
  656   2HE   LYS  65          1HE       LYS  65   4.250  -6.505   8.592
  657   1HZ   LYS  65          3HZ       LYS  65   3.926  -7.660  11.309
  658   2HZ   LYS  65          2HZ       LYS  65   5.429  -7.459  10.544
  659   3HZ   LYS  65          1HZ       LYS  65   4.476  -6.104  10.921
  660    QB   LYS  65           QB       LYS  65   2.106  -4.962   7.737
  661    QD   LYS  65           QD       LYS  65   2.090  -6.681  10.100
  662    QG   LYS  65           QG       LYS  65   1.197  -7.234   8.009
  663    QE   LYS  65           QE       LYS  65   4.051  -7.356   8.749
  664    QZ   LYS  65           QZ       LYS  65   4.610  -7.074  10.925
  665    H    VAL  66           H        VAL  66  -0.996  -5.593   6.358
  666    HA   VAL  66           HA       VAL  66  -1.314  -2.939   4.992
  667    HB   VAL  66           HB       VAL  66  -3.173  -5.339   5.036
  668   1HG1  VAL  66          2HG1      VAL  66  -0.838  -5.057   3.600
  669   2HG1  VAL  66          1HG1      VAL  66  -2.207  -6.056   3.110
  670   3HG1  VAL  66          3HG1      VAL  66  -2.042  -4.416   2.481
  671   1HG2  VAL  66          1HG2      VAL  66  -3.837  -2.703   4.673
  672   2HG2  VAL  66          3HG2      VAL  66  -3.505  -3.214   3.018
  673   3HG2  VAL  66          2HG2      VAL  66  -4.723  -4.057   3.973
  674    MG1  VAL  66           QG1      VAL  66  -1.696  -5.176   3.063
  675    MG2  VAL  66           QG2      VAL  66  -4.022  -3.324   3.888
  676    QG   VAL  66           QQG      VAL  66  -2.859  -4.250   3.476
  677    H    LEU  67           H        LEU  67  -1.243  -1.862   7.096
  678    HA   LEU  67           HA       LEU  67  -2.731  -2.532   9.396
  679   1HB   LEU  67          2HB       LEU  67  -1.695  -0.013   8.128
  680   2HB   LEU  67          1HB       LEU  67  -2.706   0.112   9.568
  681    HG   LEU  67           HG       LEU  67  -0.601  -1.939   9.758
  682   1HD1  LEU  67          1HD1      LEU  67   0.031   0.962   9.258
  683   2HD1  LEU  67          3HD1      LEU  67   1.069  -0.004  10.305
  684   3HD1  LEU  67          2HD1      LEU  67   0.837  -0.470   8.620
  685   1HD2  LEU  67          2HD2      LEU  67  -2.256  -0.668  11.491
  686   2HD2  LEU  67          1HD2      LEU  67  -0.720  -1.387  11.978
  687   3HD2  LEU  67          3HD2      LEU  67  -0.818   0.343  11.646
  688    MD1  LEU  67           QD1      LEU  67   0.646   0.163   9.395
  689    MD2  LEU  67           QD2      LEU  67  -1.265  -0.571  11.705
  690    QB   LEU  67           QB       LEU  67  -2.201   0.049   8.848
  691    QD   LEU  67           QQD      LEU  67  -0.309  -0.204  10.550
  692    H    VAL  68           H        VAL  68  -3.726  -0.635   6.538
  693    HA   VAL  68           HA       VAL  68  -6.422  -0.179   7.589
  694    HB   VAL  68           HB       VAL  68  -5.170   1.392   6.113
  695   1HG1  VAL  68          3HG1      VAL  68  -5.447  -0.901   4.157
  696   2HG1  VAL  68          2HG1      VAL  68  -5.105   0.751   3.648
  697   3HG1  VAL  68          1HG1      VAL  68  -3.964  -0.106   4.683
  698   1HG2  VAL  68          3HG2      VAL  68  -7.760   1.101   6.168
  699   2HG2  VAL  68          2HG2      VAL  68  -7.048   2.059   4.870
  700   3HG2  VAL  68          1HG2      VAL  68  -7.553   0.396   4.565
  701    MG1  VAL  68           QG1      VAL  68  -4.839  -0.085   4.163
  702    MG2  VAL  68           QG2      VAL  68  -7.454   1.186   5.201
  703    QG   VAL  68           QQG      VAL  68  -6.146   0.550   4.682
  704    H    LYS  69           H        LYS  69  -8.332  -1.215   6.837
  705    HA   LYS  69           HA       LYS  69  -8.036  -3.469   4.915
  706   1HB   LYS  69          2HB       LYS  69  -7.903  -3.803   7.664
  707   2HB   LYS  69          1HB       LYS  69  -9.599  -4.143   7.308
  708   1HG   LYS  69          2HG       LYS  69  -9.091  -5.956   5.940
  709   2HG   LYS  69          1HG       LYS  69  -7.477  -5.351   5.565
  710   1HD   LYS  69          2HD       LYS  69  -7.628  -5.758   8.389
  711   2HD   LYS  69          1HD       LYS  69  -8.229  -7.214   7.596
  712   1HE   LYS  69          2HE       LYS  69  -6.181  -7.279   6.184
  713   2HE   LYS  69          1HE       LYS  69  -5.566  -5.853   7.045
  714   1HZ   LYS  69          1HZ       LYS  69  -6.031  -7.161   9.144
  715   2HZ   LYS  69          3HZ       LYS  69  -6.187  -8.529   8.155
  716   3HZ   LYS  69          2HZ       LYS  69  -4.711  -7.689   8.212
  717    QB   LYS  69           QB       LYS  69  -8.751  -3.973   7.486
  718    QD   LYS  69           QD       LYS  69  -7.928  -6.486   7.992
  719    QG   LYS  69           QG       LYS  69  -8.284  -5.653   5.753
  720    QE   LYS  69           QE       LYS  69  -5.874  -6.566   6.615
  721    QZ   LYS  69           QZ       LYS  69  -5.643  -7.793   8.504
  722    H    GLU  70           H        GLU  70 -10.357  -4.452   4.571
  723    HA   GLU  70           HA       GLU  70 -12.117  -2.365   3.682
  724   1HB   GLU  70          2HB       GLU  70 -12.392  -5.347   4.137
  725   2HB   GLU  70          1HB       GLU  70 -13.660  -4.379   3.385
  726   1HG   GLU  70          2HG       GLU  70 -12.064  -3.644   1.646
  727   2HG   GLU  70          1HG       GLU  70 -10.807  -4.633   2.389
  728    QB   GLU  70           QB       GLU  70 -13.026  -4.863   3.761
  729    QG   GLU  70           QG       GLU  70 -11.435  -4.139   2.017
  730    H    ARG  71           H        ARG  71 -12.218  -1.178   5.846
  731    HA   ARG  71           HA       ARG  71 -14.743  -1.593   7.138
  732   1HB   ARG  71          2HB       ARG  71 -12.741  -3.376   7.938
  733   2HB   ARG  71          1HB       ARG  71 -12.758  -2.153   9.210
  734   1HG   ARG  71          2HG       ARG  71 -15.277  -3.474   8.180
  735   2HG   ARG  71          1HG       ARG  71 -14.362  -4.101   9.551
  736   1HD   ARG  71          2HD       ARG  71 -15.403  -1.251   9.402
  737   2HD   ARG  71          1HD       ARG  71 -16.247  -2.571  10.236
  738    HE   ARG  71           HE       ARG  71 -13.581  -2.639  11.146
  739   1HH1  ARG  71          1HH1      ARG  71 -14.466   0.387  10.747
  740   2HH1  ARG  71          2HH1      ARG  71 -14.826   0.778  12.396
  741   1HH2  ARG  71          1HH2      ARG  71 -14.823  -2.522  13.459
  742   2HH2  ARG  71          2HH2      ARG  71 -15.028  -0.868  13.931
  743    QB   ARG  71           QB       ARG  71 -12.749  -2.764   8.574
  744    QG   ARG  71           QG       ARG  71 -14.820  -3.788   8.865
  745    QD   ARG  71           QD       ARG  71 -15.825  -1.911   9.819
  746    QH1  ARG  71           QH1      ARG  71 -14.646   0.582  11.571
  747    QH2  ARG  71           QH2      ARG  71 -14.925  -1.695  13.695
  748    H    ASP  72           H        ASP  72 -11.408  -0.551   7.946
  749    HA   ASP  72           HA       ASP  72 -12.035   1.592   9.667
  750   1HB   ASP  72          2HB       ASP  72  -9.802   0.449   8.765
  751   2HB   ASP  72          1HB       ASP  72  -9.818   1.828   7.665
  752    QB   ASP  72           QB       ASP  72  -9.810   1.139   8.215
  753    H    ALA  73           H        ALA  73 -12.730   3.701   9.313
  754    HA   ALA  73           HA       ALA  73 -12.711   4.867   6.606
  755   1HB   ALA  73          1HB       ALA  73 -15.040   3.572   7.885
  756   2HB   ALA  73          2HB       ALA  73 -14.733   3.893   6.178
  757   3HB   ALA  73          3HB       ALA  73 -15.366   5.171   7.216
  758    MB   ALA  73           QB       ALA  73 -15.046   4.212   7.093
  759    H    VAL  74           H        VAL  74 -13.369   7.134   6.652
  760    HA   VAL  74           HA       VAL  74 -13.029   9.275   7.624
  761    HB   VAL  74           HB       VAL  74 -14.925   9.739   9.128
  762   1HG1  VAL  74          1HG1      VAL  74 -14.565   7.550  10.425
  763   2HG1  VAL  74          3HG1      VAL  74 -16.235   8.022  10.118
  764   3HG1  VAL  74          2HG1      VAL  74 -15.478   6.770   9.135
  765   1HG2  VAL  74          2HG2      VAL  74 -15.372   7.867   6.802
  766   2HG2  VAL  74          1HG2      VAL  74 -16.723   8.586   7.679
  767   3HG2  VAL  74          3HG2      VAL  74 -15.560   9.620   6.848
  768    MG1  VAL  74           QG1      VAL  74 -15.426   7.447   9.893
  769    MG2  VAL  74           QG2      VAL  74 -15.885   8.691   7.109
  770    QG   VAL  74           QQG      VAL  74 -15.656   8.069   8.501
  771    H    GLN  75           H        GLN  75 -10.942   7.736   8.583
  772    HA   GLN  75           HA       GLN  75 -10.576   8.878  11.290
  773   1HB   GLN  75          2HB       GLN  75 -11.711   6.578  11.391
  774   2HB   GLN  75          1HB       GLN  75 -10.193   5.919  10.777
  775   1HG   GLN  75          2HG       GLN  75  -9.245   7.472  12.785
  776   2HG   GLN  75          1HG       GLN  75 -10.822   7.045  13.450
  777   1HE2  GLN  75          1HE2      GLN  75 -10.332   5.385  14.926
  778   2HE2  GLN  75          2HE2      GLN  75  -9.464   3.981  14.530
  779    QB   GLN  75           QB       GLN  75 -10.952   6.248  11.084
  780    QG   GLN  75           QG       GLN  75 -10.034   7.259  13.117
  781    QE   GLN  75           QE2      GLN  75  -9.898   4.683  14.728
  782    H    GLY  76           H        GLY  76  -8.916  10.095  10.083
  783   1HA   GLY  76          1HA       GLY  76  -6.850  10.265   8.865
  784   2HA   GLY  76          2HA       GLY  76  -6.667   8.514   8.983
  785    QA   GLY  76           QA       GLY  76  -6.759   9.390   8.924
  786    H    GLY  77           H        GLY  77  -4.452   9.929   9.606
  787   1HA   GLY  77          1HA       GLY  77  -4.427  10.329  12.550
  788   2HA   GLY  77          2HA       GLY  77  -3.147  10.817  11.439
  789    QA   GLY  77           QA       GLY  77  -3.787  10.573  11.995
  790    H    GLN  78           H        GLN  78  -4.577   7.640  11.170
  791    HA   GLN  78           HA       GLN  78  -2.287   6.419  12.642
  792   1HB   GLN  78          2HB       GLN  78  -4.900   5.939  12.830
  793   2HB   GLN  78          1HB       GLN  78  -4.567   4.879  11.461
  794   1HG   GLN  78          2HG       GLN  78  -2.511   4.528  13.438
  795   2HG   GLN  78          1HG       GLN  78  -4.088   4.354  14.208
  796   1HE2  GLN  78          1HE2      GLN  78  -5.024   2.317  14.005
  797   2HE2  GLN  78          2HE2      GLN  78  -4.624   1.175  12.813
  798    QB   GLN  78           QB       GLN  78  -4.734   5.409  12.146
  799    QG   GLN  78           QG       GLN  78  -3.299   4.441  13.823
  800    QE   GLN  78           QE2      GLN  78  -4.824   1.746  13.409
  801    H    GLY  79           H        GLY  79  -1.169   4.581  11.594
  802   1HA   GLY  79          1HA       GLY  79  -0.019   3.616   9.792
  803   2HA   GLY  79          2HA       GLY  79  -0.267   5.149   8.959
  804    QA   GLY  79           QA       GLY  79  -0.143   4.382   9.376
  805    H    LEU  80           H        LEU  80  -0.454   3.452   7.123
  806    HA   LEU  80           HA       LEU  80  -3.259   2.399   6.960
  807   1HB   LEU  80          2HB       LEU  80  -1.680   3.858   4.816
  808   2HB   LEU  80          1HB       LEU  80  -3.346   3.296   4.679
  809    HG   LEU  80           HG       LEU  80  -2.442   5.251   6.804
  810   1HD1  LEU  80          3HD1      LEU  80  -2.326   5.870   4.191
  811   2HD1  LEU  80          2HD1      LEU  80  -4.049   6.138   4.455
  812   3HD1  LEU  80          1HD1      LEU  80  -2.862   7.030   5.406
  813   1HD2  LEU  80          1HD2      LEU  80  -5.105   4.266   5.764
  814   2HD2  LEU  80          3HD2      LEU  80  -4.490   4.198   7.416
  815   3HD2  LEU  80          2HD2      LEU  80  -4.958   5.745   6.713
  816    MD1  LEU  80           QD1      LEU  80  -3.079   6.346   4.684
  817    MD2  LEU  80           QD2      LEU  80  -4.851   4.736   6.631
  818    QB   LEU  80           QB       LEU  80  -2.513   3.577   4.747
  819    QD   LEU  80           QQD      LEU  80  -3.965   5.541   5.658
  820    H    ILE  81           H        ILE  81  -0.174   2.403   5.121
  821    HA   ILE  81           HA       ILE  81  -0.330  -0.584   5.015
  822    HB   ILE  81           HB       ILE  81   0.164   1.368   2.743
  823   1HG1  ILE  81          2HG1      ILE  81  -1.900  -0.482   2.174
  824   2HG1  ILE  81          1HG1      ILE  81  -2.201   0.093   3.814
  825   1HG2  ILE  81          2HG2      ILE  81   0.595  -1.574   3.042
  826   2HG2  ILE  81          1HG2      ILE  81  -0.043  -0.989   1.505
  827   3HG2  ILE  81          3HG2      ILE  81   1.508  -0.397   2.099
  828   1HD1  ILE  81          3HD1      ILE  81  -1.407   2.281   2.073
  829   2HD1  ILE  81          2HD1      ILE  81  -2.819   1.441   1.433
  830   3HD1  ILE  81          1HD1      ILE  81  -2.857   2.115   3.063
  831    MG   ILE  81           QG2      ILE  81   0.687  -0.987   2.215
  832    MD   ILE  81           QD1      ILE  81  -2.361   1.945   2.190
  833    QG   ILE  81           QG1      ILE  81  -2.051  -0.194   2.994
  834    H    LYS  82           H        LYS  82   1.723  -1.600   5.020
  835    HA   LYS  82           HA       LYS  82   4.032   0.211   5.603
  836   1HB   LYS  82          2HB       LYS  82   3.124  -1.574   7.223
  837   2HB   LYS  82          1HB       LYS  82   3.795  -2.763   6.106
  838   1HG   LYS  82          2HG       LYS  82   5.939  -2.314   6.719
  839   2HG   LYS  82          1HG       LYS  82   5.645  -0.578   6.819
  840   1HD   LYS  82          2HD       LYS  82   4.858  -0.701   9.017
  841   2HD   LYS  82          1HD       LYS  82   4.447  -2.410   8.878
  842   1HE   LYS  82          2HE       LYS  82   7.299  -1.952   8.429
  843   2HE   LYS  82          1HE       LYS  82   6.775  -1.402  10.033
  844   1HZ   LYS  82          2HZ       LYS  82   5.885  -3.987   8.900
  845   2HZ   LYS  82          1HZ       LYS  82   7.325  -3.861   9.791
  846   3HZ   LYS  82          3HZ       LYS  82   5.842  -3.475  10.520
  847    QB   LYS  82           QB       LYS  82   3.459  -2.168   6.665
  848    QD   LYS  82           QD       LYS  82   4.652  -1.555   8.947
  849    QG   LYS  82           QG       LYS  82   5.792  -1.446   6.769
  850    QE   LYS  82           QE       LYS  82   7.037  -1.677   9.231
  851    QZ   LYS  82           QZ       LYS  82   6.351  -3.774   9.737
  852    H    ILE  83           H        ILE  83   5.729   0.253   4.165
  853    HA   ILE  83           HA       ILE  83   5.974  -1.984   2.191
  854    HB   ILE  83           HB       ILE  83   6.284  -0.294   0.435
  855   1HG1  ILE  83          2HG1      ILE  83   5.380   2.050   1.820
  856   2HG1  ILE  83          1HG1      ILE  83   6.776   1.398   2.681
  857   1HG2  ILE  83          1HG2      ILE  83   3.931  -1.025   1.469
  858   2HG2  ILE  83          3HG2      ILE  83   3.846   0.695   1.853
  859   3HG2  ILE  83          2HG2      ILE  83   4.037   0.174   0.178
  860   1HD1  ILE  83          1HD1      ILE  83   7.699   1.148   0.174
  861   2HD1  ILE  83          3HD1      ILE  83   6.599   2.502  -0.082
  862   3HD1  ILE  83          2HD1      ILE  83   7.900   2.636   1.100
  863    MG   ILE  83           QG2      ILE  83   3.938  -0.052   1.166
  864    MD   ILE  83           QD1      ILE  83   7.399   2.095   0.397
  865    QG   ILE  83           QG1      ILE  83   6.078   1.724   2.251
  866    H    GLY  84           H        GLY  84   7.516  -1.438   4.630
  867   1HA   GLY  84          1HA       GLY  84  10.076  -0.334   3.645
  868   2HA   GLY  84          2HA       GLY  84  10.073  -2.040   4.093
  869    QA   GLY  84           QA       GLY  84  10.074  -1.187   3.869

  No H/Q in entry =         869