*HEADER    ALLERGEN                                26-FEB-03   1H4B
*TITLE     SOLUTION STRUCTURE OF THE BIRCH POLLEN ALLERGEN BET V 4
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: POLCALCIN BET V 4;
*COMPND   3 SYNONYM: CALCIUM-BINDING POLLEN ALLERGEN BET V 4;
*COMPND   4 CHAIN: A;
*COMPND   5 ENGINEERED: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: BETULA VERRUCOSA;
*SOURCE   3 ORGANISM_COMMON: WHITE BIRCH;
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   5 EXPRESSION_SYSTEM_STRAIN: BL21/DE3;
*SOURCE   6 EXPRESSION_SYSTEM_PLASMID: PMW175
*KEYWDS    BIRCH POLLEN ALLERGEN, CALCIUM-BINDING POLCALCIN,
*KEYWDS   2 HETERONUCLEAR NMR, STRUCTURE
*EXPDTA    NMR, 25 STRUCTURES
*AUTHOR    P.NEUDECKER,J.NERKAMP,A.EISENMANN,T.LAUBER,K.LEHMANN,
*AUTHOR   2 K.SCHWEIMER,P.ROESCH
*REVDAT   1   26-FEB-04 1H4B    0




! NOE distance restraints taken from 3D-1H,15N-NOESY-HSQC
assign (resid   2 and name HN   ) (resid   1 and name HA   ) 0.0 0.0 3.5
assign (resid   2 and name HN   ) (resid   1 and name HB*  ) 0.0 0.0 5.0
assign (resid   2 and name HN   ) (resid   2 and name HA   ) 0.0 0.0 3.5
assign (resid   2 and name HN   ) (resid   2 and name HB1  ) 0.0 0.0 5.0
assign (resid   2 and name HN   ) (resid   2 and name HB2  ) 0.0 0.0 5.0
assign (resid   2 and name HN   ) (resid   3 and name HB*  ) 0.0 0.0 5.0
assign (resid   3 and name HN   ) (resid   1 and name HB*  ) 0.0 0.0 5.0
assign (resid   3 and name HN   ) (resid   2 and name HA   ) 0.0 0.0 3.5
assign (resid   3 and name HN   ) (resid   2 and name HN   ) 0.0 0.0 5.0
assign (resid   3 and name HN   ) (resid   3 and name HA   ) 0.0 0.0 3.5
assign (resid   3 and name HN   ) (resid   3 and name HB*  ) 0.0 0.0 3.5
assign (resid   3 and name HN   ) (resid   4 and name HN   ) 0.0 0.0 5.0
assign (resid   4 and name HN   ) (resid   3 and name HA   ) 0.0 0.0 3.5
assign (resid   4 and name HN   ) (resid   3 and name HB*  ) 0.0 0.0 5.0
assign (resid   4 and name HN   ) (resid   4 and name HA   ) 0.0 0.0 3.5
assign (resid   4 and name HN   ) (resid   4 and name HB1  ) 0.0 0.0 5.0
assign (resid   4 and name HN   ) (resid   4 and name HB2  ) 0.0 0.0 3.5
assign (resid   4 and name HN   ) (resid   4 and name HD2  ) 0.0 0.0 5.0
assign (resid   4 and name HN   ) (resid   5 and name HD*  ) 0.0 0.0 5.0
assign (resid   4 and name HN   ) (resid   6 and name HB1  ) 0.0 0.0 5.0
assign (resid   4 and name HN   ) (resid   6 and name HN   ) 0.0 0.0 5.0
assign (resid   4 and name HN   ) (resid   7 and name HB1  ) 0.0 0.0 5.0
assign (resid   4 and name HN   ) (resid   7 and name HB2  ) 0.0 0.0 5.0
assign (resid   6 and name HE21 ) (resid   6 and name HB1  ) 0.0 0.0 5.0
assign (resid   6 and name HE21 ) (resid   6 and name HB2  ) 0.0 0.0 5.0
assign (resid   6 and name HE21 ) (resid   6 and name HG*  ) 0.0 0.0 2.7
assign (resid   6 and name HE22 ) (resid   6 and name HB1  ) 0.0 0.0 5.0
assign (resid   6 and name HE22 ) (resid   6 and name HB2  ) 0.0 0.0 5.0
assign (resid   6 and name HE22 ) (resid   6 and name HG*  ) 0.0 0.0 3.5
assign (resid   6 and name HE22 ) (resid   6 and name HN   ) 0.0 0.0 5.0
assign (resid   6 and name HN   ) (resid   4 and name HA   ) 0.0 0.0 5.0
assign (resid   6 and name HN   ) (resid   4 and name HB1  ) 0.0 0.0 5.0
assign (resid   6 and name HN   ) (resid   4 and name HB2  ) 0.0 0.0 5.0
assign (resid   6 and name HN   ) (resid   5 and name HA   ) 0.0 0.0 3.5
assign (resid   6 and name HN   ) (resid   5 and name HB1  ) 0.0 0.0 5.0
assign (resid   6 and name HN   ) (resid   5 and name HB2  ) 0.0 0.0 3.5
assign (resid   6 and name HN   ) (resid   5 and name HD1  ) 0.0 0.0 5.0
assign (resid   6 and name HN   ) (resid   5 and name HD2  ) 0.0 0.0 5.0
assign (resid   6 and name HN   ) (resid   5 and name HG*  ) 0.0 0.0 5.0
assign (resid   6 and name HN   ) (resid   6 and name HA   ) 0.0 0.0 3.5
assign (resid   6 and name HN   ) (resid   6 and name HB1  ) 0.0 0.0 2.7
assign (resid   6 and name HN   ) (resid   6 and name HB2  ) 0.0 0.0 3.5
assign (resid   6 and name HN   ) (resid   6 and name HG*  ) 0.0 0.0 3.5
assign (resid   7 and name HN   ) (resid   4 and name HB1  ) 0.0 0.0 5.0
assign (resid   7 and name HN   ) (resid   4 and name HB2  ) 0.0 0.0 5.0
assign (resid   7 and name HN   ) (resid   5 and name HA   ) 0.0 0.0 5.0
assign (resid   7 and name HN   ) (resid   6 and name HA   ) 0.0 0.0 3.5
assign (resid   7 and name HN   ) (resid   6 and name HB1  ) 0.0 0.0 3.5
assign (resid   7 and name HN   ) (resid   6 and name HB2  ) 0.0 0.0 3.5
assign (resid   7 and name HN   ) (resid   6 and name HG*  ) 0.0 0.0 5.0
assign (resid   7 and name HN   ) (resid   6 and name HN   ) 0.0 0.0 3.5
assign (resid   7 and name HN   ) (resid   7 and name HA   ) 0.0 0.0 3.5
assign (resid   7 and name HN   ) (resid   7 and name HB1  ) 0.0 0.0 3.5
assign (resid   7 and name HN   ) (resid   7 and name HB2  ) 0.0 0.0 5.0
assign (resid   7 and name HN   ) (resid   8 and name HB*  ) 0.0 0.0 5.0
assign (resid   7 and name HN   ) (resid  10 and name HG*  ) 0.0 0.0 5.0
assign (resid   8 and name HN   ) (resid   5 and name HA   ) 0.0 0.0 5.0
assign (resid   8 and name HN   ) (resid   6 and name HA   ) 0.0 0.0 5.0
assign (resid   8 and name HN   ) (resid   6 and name HN   ) 0.0 0.0 5.0
assign (resid   8 and name HN   ) (resid   7 and name HA   ) 0.0 0.0 3.5
assign (resid   8 and name HN   ) (resid   7 and name HB1  ) 0.0 0.0 3.5
assign (resid   8 and name HN   ) (resid   7 and name HB2  ) 0.0 0.0 5.0
assign (resid   8 and name HN   ) (resid   8 and name HA   ) 0.0 0.0 3.5
assign (resid   8 and name HN   ) (resid   8 and name HB*  ) 0.0 0.0 2.7
assign (resid   8 and name HN   ) (resid   8 and name HD*  ) 0.0 0.0 5.0
assign (resid   8 and name HN   ) (resid   8 and name HG1  ) 0.0 0.0 3.5
assign (resid   8 and name HN   ) (resid   8 and name HG2  ) 0.0 0.0 3.5
assign (resid   8 and name HN   ) (resid   9 and name HB*  ) 0.0 0.0 5.0
assign (resid   8 and name HN   ) (resid  10 and name HN   ) 0.0 0.0 5.0
assign (resid   9 and name HN   ) (resid   5 and name HA   ) 0.0 0.0 5.0
assign (resid   9 and name HN   ) (resid   6 and name HA   ) 0.0 0.0 5.0
assign (resid   9 and name HN   ) (resid   7 and name HA   ) 0.0 0.0 5.0
assign (resid   9 and name HN   ) (resid   7 and name HB1  ) 0.0 0.0 5.0
assign (resid   9 and name HN   ) (resid   8 and name HA   ) 0.0 0.0 3.5
assign (resid   9 and name HN   ) (resid   8 and name HB*  ) 0.0 0.0 2.7
assign (resid   9 and name HN   ) (resid   8 and name HD*  ) 0.0 0.0 5.0
assign (resid   9 and name HN   ) (resid   8 and name HG1  ) 0.0 0.0 5.0
assign (resid   9 and name HN   ) (resid   8 and name HG2  ) 0.0 0.0 5.0
assign (resid   9 and name HN   ) (resid   9 and name HA   ) 0.0 0.0 3.5
assign (resid   9 and name HN   ) (resid   9 and name HB*  ) 0.0 0.0 2.7
assign (resid   9 and name HN   ) (resid  10 and name HG*  ) 0.0 0.0 5.0
assign (resid   9 and name HN   ) (resid  10 and name HN   ) 0.0 0.0 2.7
assign (resid   9 and name HN   ) (resid  11 and name HN   ) 0.0 0.0 5.0
assign (resid  10 and name HN   ) (resid   6 and name HA   ) 0.0 0.0 5.0
assign (resid  10 and name HN   ) (resid   7 and name HA   ) 0.0 0.0 5.0
assign (resid  10 and name HN   ) (resid   7 and name HB2  ) 0.0 0.0 5.0
assign (resid  10 and name HN   ) (resid   8 and name HA   ) 0.0 0.0 5.0
assign (resid  10 and name HN   ) (resid   9 and name HA   ) 0.0 0.0 3.5
assign (resid  10 and name HN   ) (resid   9 and name HB*  ) 0.0 0.0 2.7
assign (resid  10 and name HN   ) (resid  10 and name HA   ) 0.0 0.0 3.5
assign (resid  10 and name HN   ) (resid  10 and name HB1  ) 0.0 0.0 2.7
assign (resid  10 and name HN   ) (resid  10 and name HB2  ) 0.0 0.0 5.0
assign (resid  10 and name HN   ) (resid  10 and name HG*  ) 0.0 0.0 3.5
assign (resid  10 and name HN   ) (resid  11 and name HN   ) 0.0 0.0 2.7
assign (resid  10 and name HN   ) (resid  12 and name HN   ) 0.0 0.0 5.0
assign (resid  10 and name HN   ) (resid  13 and name HD1  ) 0.0 0.0 5.0
assign (resid  10 and name HN   ) (resid  14 and name HD1* ) 0.0 0.0 5.0
assign (resid  11 and name HE   ) (resid   8 and name HA   ) 0.0 0.0 5.0
assign (resid  11 and name HE   ) (resid  11 and name HB1  ) 0.0 0.0 5.0
assign (resid  11 and name HE   ) (resid  11 and name HB2  ) 0.0 0.0 5.0
assign (resid  11 and name HE   ) (resid  11 and name HD1  ) 0.0 0.0 3.5
assign (resid  11 and name HE   ) (resid  11 and name HD2  ) 0.0 0.0 3.5
assign (resid  11 and name HE   ) (resid  11 and name HG1  ) 0.0 0.0 3.5
assign (resid  11 and name HE   ) (resid  11 and name HG2  ) 0.0 0.0 3.5
assign (resid  11 and name HE   ) (resid  11 and name HN   ) 0.0 0.0 5.0
assign (resid  11 and name HE   ) (resid  67 and name HA   ) 0.0 0.0 5.0
assign (resid  11 and name HE   ) (resid  67 and name HG2* ) 0.0 0.0 3.5
assign (resid  11 and name HN   ) (resid   7 and name HA   ) 0.0 0.0 5.0
assign (resid  11 and name HN   ) (resid   8 and name HA   ) 0.0 0.0 3.5
assign (resid  11 and name HN   ) (resid   8 and name HB*  ) 0.0 0.0 5.0
assign (resid  11 and name HN   ) (resid   8 and name HG*  ) 0.0 0.0 5.0
assign (resid  11 and name HN   ) (resid   9 and name HA   ) 0.0 0.0 5.0
assign (resid  11 and name HN   ) (resid   9 and name HB*  ) 0.0 0.0 5.0
assign (resid  11 and name HN   ) (resid  10 and name HA   ) 0.0 0.0 3.5
assign (resid  11 and name HN   ) (resid  10 and name HB1  ) 0.0 0.0 2.7
assign (resid  11 and name HN   ) (resid  10 and name HB2  ) 0.0 0.0 5.0
assign (resid  11 and name HN   ) (resid  10 and name HG*  ) 0.0 0.0 5.0
assign (resid  11 and name HN   ) (resid  11 and name HA   ) 0.0 0.0 3.5
assign (resid  11 and name HN   ) (resid  11 and name HB1  ) 0.0 0.0 3.5
assign (resid  11 and name HN   ) (resid  11 and name HB2  ) 0.0 0.0 5.0
assign (resid  11 and name HN   ) (resid  11 and name HD1  ) 0.0 0.0 5.0
assign (resid  11 and name HN   ) (resid  11 and name HD2  ) 0.0 0.0 5.0
assign (resid  11 and name HN   ) (resid  11 and name HG1  ) 0.0 0.0 2.7
assign (resid  11 and name HN   ) (resid  11 and name HG2  ) 0.0 0.0 3.5
assign (resid  11 and name HN   ) (resid  14 and name HD1* ) 0.0 0.0 5.0
assign (resid  11 and name HN   ) (resid  63 and name HE*  ) 0.0 0.0 5.0
assign (resid  12 and name HN   ) (resid   8 and name HA   ) 0.0 0.0 5.0
assign (resid  12 and name HN   ) (resid   8 and name HB*  ) 0.0 0.0 5.0
assign (resid  12 and name HN   ) (resid   8 and name HG*  ) 0.0 0.0 5.0
assign (resid  12 and name HN   ) (resid   9 and name HA   ) 0.0 0.0 3.5
assign (resid  12 and name HN   ) (resid   9 and name HB*  ) 0.0 0.0 5.0
assign (resid  12 and name HN   ) (resid   9 and name HN   ) 0.0 0.0 5.0
assign (resid  12 and name HN   ) (resid  10 and name HA   ) 0.0 0.0 5.0
assign (resid  12 and name HN   ) (resid  11 and name HA   ) 0.0 0.0 3.5
assign (resid  12 and name HN   ) (resid  11 and name HB1  ) 0.0 0.0 3.5
assign (resid  12 and name HN   ) (resid  11 and name HB2  ) 0.0 0.0 3.5
assign (resid  12 and name HN   ) (resid  11 and name HG2  ) 0.0 0.0 5.0
assign (resid  12 and name HN   ) (resid  11 and name HN   ) 0.0 0.0 3.5
assign (resid  12 and name HN   ) (resid  12 and name HA   ) 0.0 0.0 3.5
assign (resid  12 and name HN   ) (resid  12 and name HB1  ) 0.0 0.0 3.5
assign (resid  12 and name HN   ) (resid  12 and name HB2  ) 0.0 0.0 3.5
assign (resid  12 and name HN   ) (resid  12 and name HG1  ) 0.0 0.0 3.5
assign (resid  12 and name HN   ) (resid  12 and name HG2  ) 0.0 0.0 5.0
assign (resid  12 and name HN   ) (resid  15 and name HB1  ) 0.0 0.0 5.0
assign (resid  12 and name HN   ) (resid  63 and name HE*  ) 0.0 0.0 5.0
assign (resid  12 and name HN   ) (resid  63 and name HZ   ) 0.0 0.0 5.0
assign (resid  13 and name HE   ) (resid  13 and name HB1  ) 0.0 0.0 5.0
assign (resid  13 and name HE   ) (resid  13 and name HB2  ) 0.0 0.0 5.0
assign (resid  13 and name HE   ) (resid  13 and name HD1  ) 0.0 0.0 3.5
assign (resid  13 and name HE   ) (resid  13 and name HD2  ) 0.0 0.0 3.5
assign (resid  13 and name HE   ) (resid  13 and name HG1  ) 0.0 0.0 5.0
assign (resid  13 and name HE   ) (resid  13 and name HG2  ) 0.0 0.0 3.5
assign (resid  13 and name HE   ) (resid  13 and name HH*  ) 0.0 0.0 3.5
assign (resid  13 and name HH*  ) (resid  13 and name HD*  ) 0.0 0.0 3.5
assign (resid  13 and name HN   ) (resid   9 and name HA   ) 0.0 0.0 5.0
assign (resid  13 and name HN   ) (resid  10 and name HA   ) 0.0 0.0 3.5
assign (resid  13 and name HN   ) (resid  11 and name HA   ) 0.0 0.0 5.0
assign (resid  13 and name HN   ) (resid  11 and name HN   ) 0.0 0.0 5.0
assign (resid  13 and name HN   ) (resid  12 and name HA   ) 0.0 0.0 3.5
assign (resid  13 and name HN   ) (resid  12 and name HB1  ) 0.0 0.0 5.0
assign (resid  13 and name HN   ) (resid  12 and name HB2  ) 0.0 0.0 5.0
assign (resid  13 and name HN   ) (resid  12 and name HG2  ) 0.0 0.0 5.0
assign (resid  13 and name HN   ) (resid  12 and name HN   ) 0.0 0.0 3.5
assign (resid  13 and name HN   ) (resid  13 and name HA   ) 0.0 0.0 3.5
assign (resid  13 and name HN   ) (resid  13 and name HB*  ) 0.0 0.0 2.7
assign (resid  13 and name HN   ) (resid  13 and name HD1  ) 0.0 0.0 5.0
assign (resid  13 and name HN   ) (resid  13 and name HD2  ) 0.0 0.0 5.0
assign (resid  13 and name HN   ) (resid  13 and name HG2  ) 0.0 0.0 3.5
assign (resid  13 and name HN   ) (resid  14 and name HB   ) 0.0 0.0 5.0
assign (resid  13 and name HN   ) (resid  63 and name HE*  ) 0.0 0.0 5.0
assign (resid  14 and name HN   ) (resid  11 and name HA   ) 0.0 0.0 3.5
assign (resid  14 and name HN   ) (resid  12 and name HA   ) 0.0 0.0 5.0
assign (resid  14 and name HN   ) (resid  12 and name HN   ) 0.0 0.0 5.0
assign (resid  14 and name HN   ) (resid  13 and name HA   ) 0.0 0.0 3.5
assign (resid  14 and name HN   ) (resid  13 and name HB*  ) 0.0 0.0 2.7
assign (resid  14 and name HN   ) (resid  13 and name HD2  ) 0.0 0.0 5.0
assign (resid  14 and name HN   ) (resid  13 and name HG2  ) 0.0 0.0 5.0
assign (resid  14 and name HN   ) (resid  13 and name HN   ) 0.0 0.0 2.7
assign (resid  14 and name HN   ) (resid  14 and name HA   ) 0.0 0.0 3.5
assign (resid  14 and name HN   ) (resid  14 and name HB   ) 0.0 0.0 2.7
assign (resid  14 and name HN   ) (resid  14 and name HD1* ) 0.0 0.0 3.5
assign (resid  14 and name HN   ) (resid  14 and name HG11 ) 0.0 0.0 3.5
assign (resid  14 and name HN   ) (resid  14 and name HG12 ) 0.0 0.0 3.5
assign (resid  14 and name HN   ) (resid  14 and name HG2* ) 0.0 0.0 5.0
assign (resid  14 and name HN   ) (resid  15 and name HB1  ) 0.0 0.0 5.0
assign (resid  14 and name HN   ) (resid  16 and name HB*  ) 0.0 0.0 5.0
assign (resid  14 and name HN   ) (resid  16 and name HN   ) 0.0 0.0 5.0
assign (resid  14 and name HN   ) (resid  63 and name HE*  ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  11 and name HA   ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  12 and name HA   ) 0.0 0.0 3.5
assign (resid  15 and name HN   ) (resid  12 and name HN   ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  13 and name HN   ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  14 and name HA   ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  14 and name HB   ) 0.0 0.0 2.7
assign (resid  15 and name HN   ) (resid  14 and name HD1* ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  14 and name HG12 ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  14 and name HG2* ) 0.0 0.0 3.5
assign (resid  15 and name HN   ) (resid  14 and name HN   ) 0.0 0.0 2.7
assign (resid  15 and name HN   ) (resid  15 and name HA   ) 0.0 0.0 3.5
assign (resid  15 and name HN   ) (resid  15 and name HB1  ) 0.0 0.0 3.5
assign (resid  15 and name HN   ) (resid  15 and name HB2  ) 0.0 0.0 2.7
assign (resid  15 and name HN   ) (resid  15 and name HD*  ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  16 and name HB*  ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  16 and name HN   ) 0.0 0.0 2.7
assign (resid  15 and name HN   ) (resid  17 and name HN   ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  18 and name HD*  ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  63 and name HD*  ) 0.0 0.0 5.0
assign (resid  15 and name HN   ) (resid  63 and name HE*  ) 0.0 0.0 5.0
assign (resid  16 and name HN   ) (resid  13 and name HA   ) 0.0 0.0 3.5
assign (resid  16 and name HN   ) (resid  15 and name HA   ) 0.0 0.0 3.5
assign (resid  16 and name HN   ) (resid  15 and name HB1  ) 0.0 0.0 2.7
assign (resid  16 and name HN   ) (resid  15 and name HB2  ) 0.0 0.0 5.0
assign (resid  16 and name HN   ) (resid  15 and name HD*  ) 0.0 0.0 3.5
assign (resid  16 and name HN   ) (resid  16 and name HA   ) 0.0 0.0 3.5
assign (resid  16 and name HN   ) (resid  16 and name HB*  ) 0.0 0.0 2.7
assign (resid  16 and name HN   ) (resid  16 and name HD*  ) 0.0 0.0 5.0
assign (resid  16 and name HN   ) (resid  16 and name HG1  ) 0.0 0.0 2.7
assign (resid  16 and name HN   ) (resid  16 and name HG2  ) 0.0 0.0 5.0
assign (resid  16 and name HN   ) (resid  17 and name HB1  ) 0.0 0.0 5.0
assign (resid  16 and name HN   ) (resid  18 and name HD*  ) 0.0 0.0 5.0
assign (resid  17 and name HE   ) (resid  17 and name HA   ) 0.0 0.0 5.0
assign (resid  17 and name HE   ) (resid  17 and name HB1  ) 0.0 0.0 5.0
assign (resid  17 and name HE   ) (resid  17 and name HB2  ) 0.0 0.0 5.0
assign (resid  17 and name HE   ) (resid  17 and name HD1  ) 0.0 0.0 3.5
assign (resid  17 and name HE   ) (resid  17 and name HD2  ) 0.0 0.0 3.5
assign (resid  17 and name HE   ) (resid  17 and name HG1  ) 0.0 0.0 3.5
assign (resid  17 and name HE   ) (resid  17 and name HG2  ) 0.0 0.0 3.5
assign (resid  17 and name HN   ) (resid  13 and name HA   ) 0.0 0.0 5.0
assign (resid  17 and name HN   ) (resid  14 and name HA   ) 0.0 0.0 3.5
assign (resid  17 and name HN   ) (resid  14 and name HG2* ) 0.0 0.0 5.0
assign (resid  17 and name HN   ) (resid  15 and name HA   ) 0.0 0.0 5.0
assign (resid  17 and name HN   ) (resid  16 and name HA   ) 0.0 0.0 3.5
assign (resid  17 and name HN   ) (resid  16 and name HB*  ) 0.0 0.0 3.5
assign (resid  17 and name HN   ) (resid  16 and name HN   ) 0.0 0.0 3.5
assign (resid  17 and name HN   ) (resid  17 and name HA   ) 0.0 0.0 3.5
assign (resid  17 and name HN   ) (resid  17 and name HB*  ) 0.0 0.0 2.7
assign (resid  17 and name HN   ) (resid  17 and name HD2  ) 0.0 0.0 5.0
assign (resid  17 and name HN   ) (resid  17 and name HG1  ) 0.0 0.0 3.5
assign (resid  17 and name HN   ) (resid  17 and name HG2  ) 0.0 0.0 3.5
assign (resid  17 and name HN   ) (resid  18 and name HB1  ) 0.0 0.0 5.0
assign (resid  17 and name HN   ) (resid  18 and name HD*  ) 0.0 0.0 5.0
assign (resid  18 and name HN   ) (resid  14 and name HA   ) 0.0 0.0 5.0
assign (resid  18 and name HN   ) (resid  14 and name HG2* ) 0.0 0.0 5.0
assign (resid  18 and name HN   ) (resid  15 and name HA   ) 0.0 0.0 3.5
assign (resid  18 and name HN   ) (resid  16 and name HA   ) 0.0 0.0 5.0
assign (resid  18 and name HN   ) (resid  16 and name HN   ) 0.0 0.0 5.0
assign (resid  18 and name HN   ) (resid  17 and name HA   ) 0.0 0.0 3.5
assign (resid  18 and name HN   ) (resid  17 and name HB*  ) 0.0 0.0 3.5
assign (resid  18 and name HN   ) (resid  17 and name HG1  ) 0.0 0.0 5.0
assign (resid  18 and name HN   ) (resid  17 and name HG2  ) 0.0 0.0 5.0
assign (resid  18 and name HN   ) (resid  17 and name HN   ) 0.0 0.0 2.7
assign (resid  18 and name HN   ) (resid  18 and name HA   ) 0.0 0.0 3.5
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assign (resid  69 and name HN   ) (resid  71 and name HN   ) 0.0 0.0 5.0
assign (resid  69 and name HN   ) (resid  72 and name HB*  ) 0.0 0.0 5.0
assign (resid  70 and name HN   ) (resid  53 and name HG2* ) 0.0 0.0 5.0
assign (resid  70 and name HN   ) (resid  66 and name HA   ) 0.0 0.0 5.0
assign (resid  70 and name HN   ) (resid  68 and name HA   ) 0.0 0.0 5.0
assign (resid  70 and name HN   ) (resid  69 and name HA   ) 0.0 0.0 3.5
assign (resid  70 and name HN   ) (resid  69 and name HB1  ) 0.0 0.0 5.0
assign (resid  70 and name HN   ) (resid  69 and name HB2  ) 0.0 0.0 3.5
assign (resid  70 and name HN   ) (resid  69 and name HD*  ) 0.0 0.0 3.5
assign (resid  70 and name HN   ) (resid  70 and name HA1  ) 0.0 0.0 3.5
assign (resid  70 and name HN   ) (resid  70 and name HA2  ) 0.0 0.0 2.7
assign (resid  70 and name HN   ) (resid  71 and name HG1  ) 0.0 0.0 5.0
assign (resid  71 and name HE   ) (resid  67 and name HG2* ) 0.0 0.0 5.0
assign (resid  71 and name HE   ) (resid  68 and name HA   ) 0.0 0.0 5.0
assign (resid  71 and name HE   ) (resid  71 and name HB1  ) 0.0 0.0 3.5
assign (resid  71 and name HE   ) (resid  71 and name HB2  ) 0.0 0.0 3.5
assign (resid  71 and name HE   ) (resid  71 and name HD1  ) 0.0 0.0 3.5
assign (resid  71 and name HE   ) (resid  71 and name HD2  ) 0.0 0.0 3.5
assign (resid  71 and name HE   ) (resid  71 and name HG1  ) 0.0 0.0 3.5
assign (resid  71 and name HE   ) (resid  71 and name HG2  ) 0.0 0.0 5.0
assign (resid  71 and name HN   ) (resid  67 and name HG2* ) 0.0 0.0 5.0
assign (resid  71 and name HN   ) (resid  68 and name HA   ) 0.0 0.0 5.0
assign (resid  71 and name HN   ) (resid  69 and name HA   ) 0.0 0.0 5.0
assign (resid  71 and name HN   ) (resid  69 and name HD*  ) 0.0 0.0 5.0
assign (resid  71 and name HN   ) (resid  70 and name HA1  ) 0.0 0.0 5.0
assign (resid  71 and name HN   ) (resid  70 and name HA2  ) 0.0 0.0 3.5
assign (resid  71 and name HN   ) (resid  70 and name HN   ) 0.0 0.0 3.5
assign (resid  71 and name HN   ) (resid  71 and name HA   ) 0.0 0.0 3.5
assign (resid  71 and name HN   ) (resid  71 and name HB*  ) 0.0 0.0 2.7
assign (resid  71 and name HN   ) (resid  71 and name HD*  ) 0.0 0.0 5.0
assign (resid  71 and name HN   ) (resid  71 and name HG1  ) 0.0 0.0 5.0
assign (resid  71 and name HN   ) (resid  71 and name HG2  ) 0.0 0.0 5.0
assign (resid  71 and name HN   ) (resid  72 and name HB*  ) 0.0 0.0 5.0
assign (resid  72 and name HN   ) (resid  69 and name HA   ) 0.0 0.0 5.0
assign (resid  72 and name HN   ) (resid  70 and name HA1  ) 0.0 0.0 5.0
assign (resid  72 and name HN   ) (resid  70 and name HA2  ) 0.0 0.0 5.0
assign (resid  72 and name HN   ) (resid  71 and name HA   ) 0.0 0.0 3.5
assign (resid  72 and name HN   ) (resid  71 and name HB*  ) 0.0 0.0 3.5
assign (resid  72 and name HN   ) (resid  71 and name HG2  ) 0.0 0.0 5.0
assign (resid  72 and name HN   ) (resid  71 and name HN   ) 0.0 0.0 3.5
assign (resid  72 and name HN   ) (resid  72 and name HA   ) 0.0 0.0 3.5
assign (resid  72 and name HN   ) (resid  72 and name HB*  ) 0.0 0.0 2.7
assign (resid  72 and name HN   ) (resid  73 and name HD21 ) 0.0 0.0 5.0
assign (resid  72 and name HN   ) (resid  73 and name HN   ) 0.0 0.0 2.7
assign (resid  73 and name HD21 ) (resid  69 and name HA   ) 0.0 0.0 5.0
assign (resid  73 and name HD21 ) (resid  72 and name HB*  ) 0.0 0.0 3.5
assign (resid  73 and name HD21 ) (resid  73 and name HB1  ) 0.0 0.0 3.5
assign (resid  73 and name HD21 ) (resid  73 and name HB2  ) 0.0 0.0 3.5
assign (resid  73 and name HD22 ) (resid  69 and name HA   ) 0.0 0.0 5.0
assign (resid  73 and name HD22 ) (resid  72 and name HB*  ) 0.0 0.0 3.5
assign (resid  73 and name HD22 ) (resid  73 and name HB1  ) 0.0 0.0 5.0
assign (resid  73 and name HD22 ) (resid  73 and name HB2  ) 0.0 0.0 3.5
assign (resid  73 and name HN   ) (resid  70 and name HA1  ) 0.0 0.0 5.0
assign (resid  73 and name HN   ) (resid  70 and name HA2  ) 0.0 0.0 5.0
assign (resid  73 and name HN   ) (resid  71 and name HA   ) 0.0 0.0 5.0
assign (resid  73 and name HN   ) (resid  72 and name HA   ) 0.0 0.0 3.5
assign (resid  73 and name HN   ) (resid  72 and name HB*  ) 0.0 0.0 3.5
assign (resid  73 and name HN   ) (resid  73 and name HA   ) 0.0 0.0 3.5
assign (resid  73 and name HN   ) (resid  73 and name HB1  ) 0.0 0.0 5.0
assign (resid  73 and name HN   ) (resid  73 and name HB2  ) 0.0 0.0 3.5
assign (resid  73 and name HN   ) (resid  73 and name HD21 ) 0.0 0.0 3.5
assign (resid  73 and name HN   ) (resid  73 and name HD22 ) 0.0 0.0 5.0
assign (resid  74 and name HE   ) (resid  74 and name HA   ) 0.0 0.0 5.0
assign (resid  74 and name HE   ) (resid  74 and name HB1  ) 0.0 0.0 5.0
assign (resid  74 and name HE   ) (resid  74 and name HB2  ) 0.0 0.0 5.0
assign (resid  74 and name HE   ) (resid  74 and name HD1  ) 0.0 0.0 3.5
assign (resid  74 and name HE   ) (resid  74 and name HD2  ) 0.0 0.0 3.5
assign (resid  74 and name HE   ) (resid  74 and name HG1  ) 0.0 0.0 5.0
assign (resid  74 and name HE   ) (resid  74 and name HG2  ) 0.0 0.0 5.0
assign (resid  74 and name HN   ) (resid  72 and name HA   ) 0.0 0.0 5.0
assign (resid  74 and name HN   ) (resid  72 and name HB*  ) 0.0 0.0 5.0
assign (resid  74 and name HN   ) (resid  72 and name HN   ) 0.0 0.0 5.0
assign (resid  74 and name HN   ) (resid  73 and name HA   ) 0.0 0.0 2.7
assign (resid  74 and name HN   ) (resid  73 and name HB1  ) 0.0 0.0 5.0
assign (resid  74 and name HN   ) (resid  73 and name HB2  ) 0.0 0.0 5.0
assign (resid  74 and name HN   ) (resid  73 and name HN   ) 0.0 0.0 3.5
assign (resid  74 and name HN   ) (resid  74 and name HA   ) 0.0 0.0 3.5
assign (resid  74 and name HN   ) (resid  74 and name HB1  ) 0.0 0.0 2.7
assign (resid  74 and name HN   ) (resid  74 and name HB2  ) 0.0 0.0 5.0
assign (resid  74 and name HN   ) (resid  74 and name HD*  ) 0.0 0.0 5.0
assign (resid  74 and name HN   ) (resid  74 and name HG*  ) 0.0 0.0 2.7
assign (resid  74 and name HN   ) (resid  75 and name HA2  ) 0.0 0.0 5.0
assign (resid  74 and name HN   ) (resid  75 and name HN   ) 0.0 0.0 3.5
assign (resid  75 and name HN   ) (resid  73 and name HA   ) 0.0 0.0 5.0
assign (resid  75 and name HN   ) (resid  73 and name HB1  ) 0.0 0.0 5.0
assign (resid  75 and name HN   ) (resid  74 and name HA   ) 0.0 0.0 3.5
assign (resid  75 and name HN   ) (resid  74 and name HB1  ) 0.0 0.0 5.0
assign (resid  75 and name HN   ) (resid  74 and name HB2  ) 0.0 0.0 5.0
assign (resid  75 and name HN   ) (resid  74 and name HG1  ) 0.0 0.0 5.0
assign (resid  75 and name HN   ) (resid  74 and name HG2  ) 0.0 0.0 5.0
assign (resid  75 and name HN   ) (resid  75 and name HA1  ) 0.0 0.0 3.5
assign (resid  75 and name HN   ) (resid  75 and name HA2  ) 0.0 0.0 2.7
assign (resid  75 and name HN   ) (resid  76 and name HB2  ) 0.0 0.0 5.0
assign (resid  76 and name HN   ) (resid  73 and name HA   ) 0.0 0.0 5.0
assign (resid  76 and name HN   ) (resid  73 and name HN   ) 0.0 0.0 5.0
assign (resid  76 and name HN   ) (resid  74 and name HN   ) 0.0 0.0 5.0
assign (resid  76 and name HN   ) (resid  75 and name HA1  ) 0.0 0.0 3.5
assign (resid  76 and name HN   ) (resid  75 and name HA2  ) 0.0 0.0 3.5
assign (resid  76 and name HN   ) (resid  75 and name HN   ) 0.0 0.0 3.5
assign (resid  76 and name HN   ) (resid  76 and name HA   ) 0.0 0.0 3.5
assign (resid  76 and name HN   ) (resid  76 and name HB1  ) 0.0 0.0 5.0
assign (resid  76 and name HN   ) (resid  76 and name HB2  ) 0.0 0.0 2.7
assign (resid  76 and name HN   ) (resid  76 and name HD1* ) 0.0 0.0 5.0
assign (resid  76 and name HN   ) (resid  76 and name HD2* ) 0.0 0.0 5.0
assign (resid  76 and name HN   ) (resid  76 and name HG   ) 0.0 0.0 3.5
assign (resid  76 and name HN   ) (resid  77 and name HN   ) 0.0 0.0 2.7
assign (resid  76 and name HN   ) (resid  78 and name HN   ) 0.0 0.0 5.0
assign (resid  77 and name HN   ) (resid  74 and name HA   ) 0.0 0.0 5.0
assign (resid  77 and name HN   ) (resid  75 and name HA1  ) 0.0 0.0 5.0
assign (resid  77 and name HN   ) (resid  75 and name HA2  ) 0.0 0.0 5.0
assign (resid  77 and name HN   ) (resid  75 and name HN   ) 0.0 0.0 5.0
assign (resid  77 and name HN   ) (resid  76 and name HA   ) 0.0 0.0 3.5
assign (resid  77 and name HN   ) (resid  76 and name HB*  ) 0.0 0.0 2.7
assign (resid  77 and name HN   ) (resid  77 and name HA   ) 0.0 0.0 3.5
assign (resid  77 and name HN   ) (resid  77 and name HB*  ) 0.0 0.0 2.7
assign (resid  77 and name HN   ) (resid  77 and name HD1* ) 0.0 0.0 5.0
assign (resid  77 and name HN   ) (resid  77 and name HD2* ) 0.0 0.0 5.0
assign (resid  77 and name HN   ) (resid  77 and name HG   ) 0.0 0.0 3.5
assign (resid  78 and name HN   ) (resid  75 and name HA1  ) 0.0 0.0 5.0
assign (resid  78 and name HN   ) (resid  75 and name HA2  ) 0.0 0.0 5.0
assign (resid  78 and name HN   ) (resid  77 and name HA   ) 0.0 0.0 3.5
assign (resid  78 and name HN   ) (resid  77 and name HB1  ) 0.0 0.0 5.0
assign (resid  78 and name HN   ) (resid  77 and name HB2  ) 0.0 0.0 3.5
assign (resid  78 and name HN   ) (resid  77 and name HD1* ) 0.0 0.0 5.0
assign (resid  78 and name HN   ) (resid  77 and name HD2* ) 0.0 0.0 5.0
assign (resid  78 and name HN   ) (resid  77 and name HG   ) 0.0 0.0 5.0
assign (resid  78 and name HN   ) (resid  77 and name HN   ) 0.0 0.0 2.7
assign (resid  78 and name HN   ) (resid  78 and name HA   ) 0.0 0.0 3.5
assign (resid  78 and name HN   ) (resid  78 and name HB*  ) 0.0 0.0 2.7
assign (resid  78 and name HN   ) (resid  78 and name HD*  ) 0.0 0.0 5.0
assign (resid  78 and name HN   ) (resid  78 and name HG1  ) 0.0 0.0 3.5
assign (resid  78 and name HN   ) (resid  78 and name HG2  ) 0.0 0.0 3.5
assign (resid  78 and name HN   ) (resid  79 and name HB1  ) 0.0 0.0 5.0
assign (resid  78 and name HN   ) (resid  79 and name HN   ) 0.0 0.0 2.7
assign (resid  78 and name HN   ) (resid  80 and name HG2* ) 0.0 0.0 5.0
assign (resid  79 and name HN   ) (resid  75 and name HA1  ) 0.0 0.0 5.0
assign (resid  79 and name HN   ) (resid  76 and name HA   ) 0.0 0.0 3.5
assign (resid  79 and name HN   ) (resid  77 and name HD1* ) 0.0 0.0 5.0
assign (resid  79 and name HN   ) (resid  78 and name HA   ) 0.0 0.0 3.5
assign (resid  79 and name HN   ) (resid  78 and name HB*  ) 0.0 0.0 3.5
assign (resid  79 and name HN   ) (resid  78 and name HE*  ) 0.0 0.0 5.0
assign (resid  79 and name HN   ) (resid  78 and name HG1  ) 0.0 0.0 5.0
assign (resid  79 and name HN   ) (resid  78 and name HG2  ) 0.0 0.0 5.0
assign (resid  79 and name HN   ) (resid  79 and name HA   ) 0.0 0.0 3.5
assign (resid  79 and name HN   ) (resid  79 and name HB1  ) 0.0 0.0 2.7
assign (resid  79 and name HN   ) (resid  79 and name HB2  ) 0.0 0.0 3.5
assign (resid  79 and name HN   ) (resid  80 and name HG2* ) 0.0 0.0 5.0
assign (resid  79 and name HN   ) (resid  80 and name HN   ) 0.0 0.0 2.7
assign (resid  79 and name HN   ) (resid  81 and name HB*  ) 0.0 0.0 5.0
assign (resid  80 and name HN   ) (resid  77 and name HA   ) 0.0 0.0 3.5
assign (resid  80 and name HN   ) (resid  77 and name HD1* ) 0.0 0.0 5.0
assign (resid  80 and name HN   ) (resid  79 and name HA   ) 0.0 0.0 3.5
assign (resid  80 and name HN   ) (resid  79 and name HB1  ) 0.0 0.0 3.5
assign (resid  80 and name HN   ) (resid  79 and name HB2  ) 0.0 0.0 5.0
assign (resid  80 and name HN   ) (resid  80 and name HA   ) 0.0 0.0 3.5
assign (resid  80 and name HN   ) (resid  80 and name HB   ) 0.0 0.0 3.5
assign (resid  80 and name HN   ) (resid  80 and name HG1* ) 0.0 0.0 5.0
assign (resid  80 and name HN   ) (resid  80 and name HG2* ) 0.0 0.0 2.7
assign (resid  80 and name HN   ) (resid  81 and name HB*  ) 0.0 0.0 5.0
assign (resid  80 and name HN   ) (resid  82 and name HN   ) 0.0 0.0 5.0
assign (resid  81 and name HN   ) (resid  77 and name HB*  ) 0.0 0.0 5.0
assign (resid  81 and name HN   ) (resid  77 and name HD1* ) 0.0 0.0 5.0
assign (resid  81 and name HN   ) (resid  78 and name HA   ) 0.0 0.0 5.0
assign (resid  81 and name HN   ) (resid  79 and name HA   ) 0.0 0.0 5.0
assign (resid  81 and name HN   ) (resid  79 and name HB1  ) 0.0 0.0 5.0
assign (resid  81 and name HN   ) (resid  79 and name HN   ) 0.0 0.0 5.0
assign (resid  81 and name HN   ) (resid  80 and name HA   ) 0.0 0.0 3.5
assign (resid  81 and name HN   ) (resid  80 and name HB   ) 0.0 0.0 3.5
assign (resid  81 and name HN   ) (resid  80 and name HG1* ) 0.0 0.0 5.0
assign (resid  81 and name HN   ) (resid  80 and name HG2* ) 0.0 0.0 5.0
assign (resid  81 and name HN   ) (resid  80 and name HN   ) 0.0 0.0 2.7
assign (resid  81 and name HN   ) (resid  81 and name HA   ) 0.0 0.0 3.5
assign (resid  81 and name HN   ) (resid  81 and name HB*  ) 0.0 0.0 2.7
assign (resid  81 and name HN   ) (resid  82 and name HB*  ) 0.0 0.0 5.0
assign (resid  81 and name HN   ) (resid  82 and name HN   ) 0.0 0.0 3.5
assign (resid  81 and name HN   ) (resid  83 and name HN   ) 0.0 0.0 5.0
assign (resid  82 and name HN   ) (resid  79 and name HA   ) 0.0 0.0 5.0
assign (resid  82 and name HN   ) (resid  80 and name HA   ) 0.0 0.0 5.0
assign (resid  82 and name HN   ) (resid  80 and name HG1* ) 0.0 0.0 5.0
assign (resid  82 and name HN   ) (resid  81 and name HA   ) 0.0 0.0 3.5
assign (resid  82 and name HN   ) (resid  81 and name HB*  ) 0.0 0.0 3.5
assign (resid  82 and name HN   ) (resid  82 and name HA   ) 0.0 0.0 3.5
assign (resid  82 and name HN   ) (resid  82 and name HB*  ) 0.0 0.0 2.7
assign (resid  82 and name HN   ) (resid  82 and name HD*  ) 0.0 0.0 5.0
assign (resid  82 and name HN   ) (resid  82 and name HG1  ) 0.0 0.0 3.5
assign (resid  82 and name HN   ) (resid  82 and name HG2  ) 0.0 0.0 3.5
assign (resid  82 and name HN   ) (resid  83 and name HB   ) 0.0 0.0 5.0
assign (resid  82 and name HN   ) (resid  83 and name HG12 ) 0.0 0.0 5.0
assign (resid  83 and name HN   ) (resid  80 and name HA   ) 0.0 0.0 5.0
assign (resid  83 and name HN   ) (resid  80 and name HG1* ) 0.0 0.0 5.0
assign (resid  83 and name HN   ) (resid  81 and name HA   ) 0.0 0.0 5.0
assign (resid  83 and name HN   ) (resid  82 and name HA   ) 0.0 0.0 3.5
assign (resid  83 and name HN   ) (resid  82 and name HB*  ) 0.0 0.0 3.5
assign (resid  83 and name HN   ) (resid  82 and name HG1  ) 0.0 0.0 5.0
assign (resid  83 and name HN   ) (resid  82 and name HG2  ) 0.0 0.0 5.0
assign (resid  83 and name HN   ) (resid  82 and name HN   ) 0.0 0.0 2.7
assign (resid  83 and name HN   ) (resid  83 and name HA   ) 0.0 0.0 3.5
assign (resid  83 and name HN   ) (resid  83 and name HB   ) 0.0 0.0 3.5
assign (resid  83 and name HN   ) (resid  83 and name HD1* ) 0.0 0.0 5.0
assign (resid  83 and name HN   ) (resid  83 and name HG11 ) 0.0 0.0 3.5
assign (resid  83 and name HN   ) (resid  83 and name HG12 ) 0.0 0.0 3.5
assign (resid  83 and name HN   ) (resid  83 and name HG2* ) 0.0 0.0 5.0
assign (resid  83 and name HN   ) (resid  84 and name HB2  ) 0.0 0.0 5.0
assign (resid  83 and name HN   ) (resid  84 and name HD*  ) 0.0 0.0 5.0
assign (resid  84 and name HN   ) (resid  80 and name HG1* ) 0.0 0.0 5.0
assign (resid  84 and name HN   ) (resid  81 and name HB*  ) 0.0 0.0 5.0
assign (resid  84 and name HN   ) (resid  82 and name HA   ) 0.0 0.0 5.0
assign (resid  84 and name HN   ) (resid  82 and name HB*  ) 0.0 0.0 5.0
assign (resid  84 and name HN   ) (resid  82 and name HN   ) 0.0 0.0 5.0
assign (resid  84 and name HN   ) (resid  83 and name HA   ) 0.0 0.0 3.5
assign (resid  84 and name HN   ) (resid  83 and name HB   ) 0.0 0.0 3.5
assign (resid  84 and name HN   ) (resid  83 and name HD1* ) 0.0 0.0 5.0
assign (resid  84 and name HN   ) (resid  83 and name HG11 ) 0.0 0.0 5.0
assign (resid  84 and name HN   ) (resid  83 and name HG12 ) 0.0 0.0 5.0
assign (resid  84 and name HN   ) (resid  83 and name HG2* ) 0.0 0.0 3.5
assign (resid  84 and name HN   ) (resid  83 and name HN   ) 0.0 0.0 2.7
assign (resid  84 and name HN   ) (resid  84 and name HA   ) 0.0 0.0 3.5
assign (resid  84 and name HN   ) (resid  84 and name HB1  ) 0.0 0.0 5.0
assign (resid  84 and name HN   ) (resid  84 and name HB2  ) 0.0 0.0 2.7
assign (resid  84 and name HN   ) (resid  84 and name HD*  ) 0.0 0.0 3.5

! NOE distance restraints taken from 3D-1H,13C-NOESY-HSQC
assign (resid   4 and name HA   ) (resid   5 and name HG*  ) 0.0 0.0 5.0
assign (resid   4 and name HA   ) (resid   5 and name HD*  ) 0.0 0.0 2.7
assign (resid  36 and name HA   ) (resid  41 and name HG2* ) 0.0 0.0 5.0
assign (resid  37 and name HB   ) (resid  83 and name HD1* ) 0.0 0.0 5.0
assign (resid  37 and name HG2* ) (resid  83 and name HD1* ) 0.0 0.0 5.0
assign (resid  41 and name HG2* ) (resid  49 and name HE*  ) 0.0 0.0 5.0
assign (resid  41 and name HD1* ) (resid  49 and name HG1  ) 0.0 0.0 5.0
assign (resid  41 and name HD1* ) (resid  49 and name HE*  ) 0.0 0.0 5.0

! NOE distance restraints taken from 2D-NOESY for aromatic residues
assign (resid   4 and name HD2  ) (resid   4 and name HA   ) 0.0 0.0 5.0
assign (resid   4 and name HD2  ) (resid   4 and name HB*  ) 0.0 0.0 3.5
assign (resid   4 and name HD2  ) (resid   5 and name HD*  ) 0.0 0.0 5.0
assign (resid   4 and name HE1  ) (resid   6 and name HB1  ) 0.0 0.0 5.0
assign (resid  15 and name HD*  ) (resid  12 and name HA   ) 0.0 0.0 5.0
assign (resid  15 and name HD*  ) (resid  15 and name HA   ) 0.0 0.0 3.5
assign (resid  15 and name HD*  ) (resid  15 and name HB1  ) 0.0 0.0 2.7
assign (resid  15 and name HD*  ) (resid  15 and name HB2  ) 0.0 0.0 2.7
assign (resid  15 and name HD*  ) (resid  16 and name HA   ) 0.0 0.0 5.0
assign (resid  15 and name HD*  ) (resid  16 and name HB*  ) 0.0 0.0 5.0
assign (resid  15 and name HD*  ) (resid  16 and name HG1  ) 0.0 0.0 5.0
assign (resid  15 and name HD*  ) (resid  16 and name HG2  ) 0.0 0.0 5.0
assign (resid  15 and name HD*  ) (resid  26 and name HG11 ) 0.0 0.0 5.0
assign (resid  15 and name HD*  ) (resid  26 and name HD1* ) 0.0 0.0 3.5
assign (resid  15 and name HD*  ) (resid  61 and name HG2* ) 0.0 0.0 5.0
assign (resid  15 and name HD*  ) (resid  63 and name HA   ) 0.0 0.0 5.0
assign (resid  15 and name HD*  ) (resid  66 and name HB1  ) 0.0 0.0 5.0
assign (resid  15 and name HD*  ) (resid  66 and name HB2  ) 0.0 0.0 5.0
assign (resid  15 and name HD*  ) (resid  66 and name HE*  ) 0.0 0.0 5.0
assign (resid  15 and name HE*  ) (resid  19 and name HB2  ) 0.0 0.0 5.0
assign (resid  15 and name HE*  ) (resid  24 and name HA1  ) 0.0 0.0 5.0
assign (resid  15 and name HE*  ) (resid  24 and name HA2  ) 0.0 0.0 5.0
assign (resid  15 and name HE*  ) (resid  25 and name HA   ) 0.0 0.0 5.0
assign (resid  15 and name HE*  ) (resid  26 and name HG11 ) 0.0 0.0 5.0
assign (resid  15 and name HE*  ) (resid  26 and name HG12 ) 0.0 0.0 5.0
assign (resid  15 and name HE*  ) (resid  26 and name HD1* ) 0.0 0.0 2.7
assign (resid  15 and name HE*  ) (resid  61 and name HG2* ) 0.0 0.0 2.7
assign (resid  15 and name HE*  ) (resid  62 and name HA   ) 0.0 0.0 5.0
assign (resid  15 and name HE*  ) (resid  63 and name HA   ) 0.0 0.0 3.5
assign (resid  15 and name HE*  ) (resid  63 and name HB1  ) 0.0 0.0 5.0
assign (resid  15 and name HE*  ) (resid  63 and name HB2  ) 0.0 0.0 5.0
assign (resid  15 and name HZ   ) (resid  25 and name HA   ) 0.0 0.0 3.5
assign (resid  15 and name HZ   ) (resid  26 and name HD1* ) 0.0 0.0 5.0
assign (resid  15 and name HZ   ) (resid  62 and name HA   ) 0.0 0.0 5.0
assign (resid  18 and name HD*  ) (resid  15 and name HA   ) 0.0 0.0 2.7
assign (resid  18 and name HD*  ) (resid  18 and name HA   ) 0.0 0.0 5.0
assign (resid  18 and name HD*  ) (resid  18 and name HB1  ) 0.0 0.0 2.7
assign (resid  18 and name HD*  ) (resid  18 and name HB2  ) 0.0 0.0 3.5
assign (resid  18 and name HD*  ) (resid  14 and name HG2* ) 0.0 0.0 3.5
assign (resid  18 and name HD*  ) (resid  26 and name HG2* ) 0.0 0.0 3.5
assign (resid  18 and name HD*  ) (resid  31 and name HA   ) 0.0 0.0 3.5
assign (resid  18 and name HD*  ) (resid  31 and name HG   ) 0.0 0.0 5.0
assign (resid  18 and name HD*  ) (resid  31 and name HD2* ) 0.0 0.0 5.0
assign (resid  18 and name HD*  ) (resid  34 and name HB*  ) 0.0 0.0 2.7
assign (resid  18 and name HD*  ) (resid  80 and name HG1* ) 0.0 0.0 5.0
assign (resid  18 and name HE*  ) (resid  14 and name HB   ) 0.0 0.0 5.0
assign (resid  18 and name HE*  ) (resid  14 and name HG2* ) 0.0 0.0 3.5
assign (resid  18 and name HE*  ) (resid  14 and name HD1* ) 0.0 0.0 5.0
assign (resid  18 and name HE*  ) (resid  18 and name HA   ) 0.0 0.0 5.0
assign (resid  18 and name HE*  ) (resid  31 and name HD2* ) 0.0 0.0 5.0
assign (resid  18 and name HE*  ) (resid  34 and name HB*  ) 0.0 0.0 3.5
assign (resid  18 and name HE*  ) (resid  35 and name HD2* ) 0.0 0.0 5.0
assign (resid  18 and name HE*  ) (resid  66 and name HE*  ) 0.0 0.0 3.5
assign (resid  18 and name HE*  ) (resid  80 and name HG1* ) 0.0 0.0 3.5
assign (resid  18 and name HE*  ) (resid  80 and name HG2* ) 0.0 0.0 5.0
assign (resid  48 and name HD2  ) (resid  48 and name HA   ) 0.0 0.0 5.0
assign (resid  48 and name HD2  ) (resid  48 and name HB*  ) 0.0 0.0 5.0
assign (resid  48 and name HD2  ) (resid  51 and name HB*  ) 0.0 0.0 5.0
assign (resid  60 and name HD*  ) (resid  25 and name HB1  ) 0.0 0.0 5.0
assign (resid  60 and name HD*  ) (resid  25 and name HB2  ) 0.0 0.0 5.0
assign (resid  60 and name HD*  ) (resid  25 and name HG2  ) 0.0 0.0 3.5
assign (resid  60 and name HD*  ) (resid  25 and name HD1  ) 0.0 0.0 5.0
assign (resid  60 and name HD*  ) (resid  25 and name HD2  ) 0.0 0.0 5.0
assign (resid  60 and name HD*  ) (resid  25 and name HE1  ) 0.0 0.0 5.0
assign (resid  60 and name HD*  ) (resid  25 and name HE2  ) 0.0 0.0 5.0
assign (resid  60 and name HD*  ) (resid  26 and name HA   ) 0.0 0.0 5.0
assign (resid  60 and name HD*  ) (resid  27 and name HA   ) 0.0 0.0 2.7
assign (resid  60 and name HD*  ) (resid  27 and name HB1  ) 0.0 0.0 5.0
assign (resid  60 and name HD*  ) (resid  27 and name HB2  ) 0.0 0.0 3.5
assign (resid  60 and name HD*  ) (resid  59 and name HA1  ) 0.0 0.0 5.0
assign (resid  60 and name HD*  ) (resid  60 and name HA   ) 0.0 0.0 3.5
assign (resid  60 and name HD*  ) (resid  60 and name HB1  ) 0.0 0.0 2.7
assign (resid  60 and name HD*  ) (resid  60 and name HB2  ) 0.0 0.0 2.7
assign (resid  60 and name HE*  ) (resid  25 and name HB2  ) 0.0 0.0 5.0
assign (resid  60 and name HE*  ) (resid  25 and name HG2  ) 0.0 0.0 5.0
assign (resid  60 and name HE*  ) (resid  25 and name HD1  ) 0.0 0.0 5.0
assign (resid  60 and name HE*  ) (resid  25 and name HD2  ) 0.0 0.0 5.0
assign (resid  60 and name HE*  ) (resid  25 and name HE1  ) 0.0 0.0 5.0
assign (resid  60 and name HE*  ) (resid  25 and name HE2  ) 0.0 0.0 3.5
assign (resid  60 and name HE*  ) (resid  27 and name HA   ) 0.0 0.0 3.5
assign (resid  60 and name HE*  ) (resid  27 and name HB1  ) 0.0 0.0 3.5
assign (resid  60 and name HE*  ) (resid  27 and name HB2  ) 0.0 0.0 2.7
assign (resid  60 and name HE*  ) (resid  58 and name HB1  ) 0.0 0.0 5.0
assign (resid  60 and name HE*  ) (resid  60 and name HA   ) 0.0 0.0 5.0
assign (resid  60 and name HE*  ) (resid  60 and name HB1  ) 0.0 0.0 5.0
assign (resid  60 and name HE*  ) (resid  60 and name HB2  ) 0.0 0.0 5.0
assign (resid  63 and name HD*  ) (resid  12 and name HA   ) 0.0 0.0 5.0
assign (resid  63 and name HD*  ) (resid  15 and name HB1  ) 0.0 0.0 5.0
assign (resid  63 and name HD*  ) (resid  15 and name HB2  ) 0.0 0.0 5.0
assign (resid  63 and name HD*  ) (resid  15 and name HD*  ) 0.0 0.0 5.0
assign (resid  63 and name HD*  ) (resid  63 and name HA   ) 0.0 0.0 3.5
assign (resid  63 and name HD*  ) (resid  63 and name HB1  ) 0.0 0.0 3.5
assign (resid  63 and name HD*  ) (resid  63 and name HB2  ) 0.0 0.0 3.5
assign (resid  63 and name HD*  ) (resid  66 and name HD*  ) 0.0 0.0 5.0
assign (resid  63 and name HE*  ) (resid   8 and name HG1  ) 0.0 0.0 5.0
assign (resid  63 and name HE*  ) (resid   8 and name HE*  ) 0.0 0.0 5.0
assign (resid  63 and name HE*  ) (resid  11 and name HA   ) 0.0 0.0 5.0
assign (resid  63 and name HE*  ) (resid  11 and name HB1  ) 0.0 0.0 5.0
assign (resid  63 and name HE*  ) (resid  11 and name HB2  ) 0.0 0.0 3.5
assign (resid  63 and name HE*  ) (resid  11 and name HG2  ) 0.0 0.0 5.0
assign (resid  63 and name HE*  ) (resid  12 and name HA   ) 0.0 0.0 2.7
assign (resid  63 and name HE*  ) (resid  12 and name HG1  ) 0.0 0.0 5.0
assign (resid  63 and name HE*  ) (resid  15 and name HB1  ) 0.0 0.0 3.5
assign (resid  63 and name HE*  ) (resid  15 and name HB2  ) 0.0 0.0 5.0
assign (resid  63 and name HE*  ) (resid  15 and name HD*  ) 0.0 0.0 5.0
assign (resid  63 and name HE*  ) (resid  63 and name HA   ) 0.0 0.0 5.0
assign (resid  63 and name HE*  ) (resid  63 and name HB1  ) 0.0 0.0 5.0
assign (resid  63 and name HE*  ) (resid  64 and name HA   ) 0.0 0.0 5.0
assign (resid  63 and name HZ   ) (resid   8 and name HG1  ) 0.0 0.0 5.0
assign (resid  63 and name HZ   ) (resid   8 and name HE*  ) 0.0 0.0 5.0
assign (resid  63 and name HZ   ) (resid  11 and name HB1  ) 0.0 0.0 5.0
assign (resid  63 and name HZ   ) (resid  11 and name HB2  ) 0.0 0.0 3.5
assign (resid  63 and name HZ   ) (resid  12 and name HA   ) 0.0 0.0 3.5
assign (resid  63 and name HZ   ) (resid  12 and name HB2  ) 0.0 0.0 5.0
assign (resid  63 and name HZ   ) (resid  12 and name HG1  ) 0.0 0.0 5.0
assign (resid  63 and name HZ   ) (resid  15 and name HB1  ) 0.0 0.0 5.0
assign (resid  66 and name HD*  ) (resid  11 and name HB1  ) 0.0 0.0 5.0
assign (resid  66 and name HD*  ) (resid  11 and name HB2  ) 0.0 0.0 3.5
assign (resid  66 and name HD*  ) (resid  53 and name HG2* ) 0.0 0.0 5.0
assign (resid  66 and name HD*  ) (resid  66 and name HA   ) 0.0 0.0 3.5
assign (resid  66 and name HD*  ) (resid  66 and name HB1  ) 0.0 0.0 2.7
assign (resid  66 and name HD*  ) (resid  66 and name HB2  ) 0.0 0.0 2.7
assign (resid  66 and name HD*  ) (resid  67 and name HA   ) 0.0 0.0 5.0
assign (resid  66 and name HE*  ) (resid  11 and name HA   ) 0.0 0.0 5.0
assign (resid  66 and name HE*  ) (resid  11 and name HB2  ) 0.0 0.0 5.0
assign (resid  69 and name HD*  ) (resid  52 and name HB*  ) 0.0 0.0 5.0
assign (resid  69 and name HD*  ) (resid  53 and name HA   ) 0.0 0.0 5.0
assign (resid  69 and name HD*  ) (resid  53 and name HG12 ) 0.0 0.0 5.0
assign (resid  69 and name HD*  ) (resid  53 and name HD1* ) 0.0 0.0 3.5
assign (resid  69 and name HD*  ) (resid  69 and name HA   ) 0.0 0.0 3.5
assign (resid  69 and name HD*  ) (resid  69 and name HB1  ) 0.0 0.0 2.7
assign (resid  69 and name HD*  ) (resid  69 and name HB2  ) 0.0 0.0 2.7
assign (resid  69 and name HD*  ) (resid  77 and name HD1* ) 0.0 0.0 5.0
assign (resid  69 and name HD*  ) (resid  77 and name HD2* ) 0.0 0.0 5.0
assign (resid  69 and name HE*  ) (resid  52 and name HB*  ) 0.0 0.0 5.0
assign (resid  69 and name HE*  ) (resid  53 and name HA   ) 0.0 0.0 5.0
assign (resid  69 and name HE*  ) (resid  53 and name HG11 ) 0.0 0.0 5.0
assign (resid  69 and name HE*  ) (resid  53 and name HG12 ) 0.0 0.0 5.0
assign (resid  69 and name HE*  ) (resid  53 and name HD1* ) 0.0 0.0 5.0
assign (resid  69 and name HE*  ) (resid  69 and name HA   ) 0.0 0.0 5.0
assign (resid  69 and name HE*  ) (resid  69 and name HB1  ) 0.0 0.0 5.0
assign (resid  69 and name HE*  ) (resid  69 and name HB2  ) 0.0 0.0 5.0
assign (resid  69 and name HE*  ) (resid  76 and name HD2* ) 0.0 0.0 3.5
assign (resid  69 and name HE*  ) (resid  77 and name HD1* ) 0.0 0.0 2.7
assign (resid  69 and name HE*  ) (resid  77 and name HD2* ) 0.0 0.0 3.5
assign (resid  84 and name HD*  ) (resid  37 and name HB   ) 0.0 0.0 5.0
assign (resid  84 and name HD*  ) (resid  80 and name HA   ) 0.0 0.0 5.0
assign (resid  84 and name HD*  ) (resid  80 and name HG1* ) 0.0 0.0 5.0
assign (resid  84 and name HD*  ) (resid  80 and name HG2* ) 0.0 0.0 5.0
assign (resid  84 and name HD*  ) (resid  81 and name HB*  ) 0.0 0.0 5.0
assign (resid  84 and name HD*  ) (resid  83 and name HA   ) 0.0 0.0 5.0
assign (resid  84 and name HD*  ) (resid  83 and name HB   ) 0.0 0.0 5.0
assign (resid  84 and name HD*  ) (resid  83 and name HG11 ) 0.0 0.0 5.0
assign (resid  84 and name HD*  ) (resid  83 and name HG2* ) 0.0 0.0 5.0
assign (resid  84 and name HD*  ) (resid  83 and name HD1* ) 0.0 0.0 5.0
assign (resid  84 and name HD*  ) (resid  84 and name HA   ) 0.0 0.0 3.5
assign (resid  84 and name HD*  ) (resid  84 and name HB1  ) 0.0 0.0 3.5
assign (resid  84 and name HD*  ) (resid  84 and name HB2  ) 0.0 0.0 3.5
assign (resid  84 and name HE*  ) (resid  80 and name HA   ) 0.0 0.0 5.0
assign (resid  84 and name HE*  ) (resid  80 and name HG1* ) 0.0 0.0 3.5
assign (resid  84 and name HE*  ) (resid  80 and name HG2* ) 0.0 0.0 5.0
assign (resid  84 and name HE*  ) (resid  84 and name HA   ) 0.0 0.0 5.0
assign (resid  84 and name HE*  ) (resid  84 and name HB1  ) 0.0 0.0 5.0
assign (resid  84 and name HE*  ) (resid  83 and name HG2* ) 0.0 0.0 5.0
assign (resid  84 and name HE*  ) (resid  83 and name HD1* ) 0.0 0.0 5.0

! distance restraints for observed hydrogen bonds
assign (resid  15 and name HN   ) (resid  11 and name  O   ) 0.0 0.0 2.3
assign (resid  15 and name N    ) (resid  11 and name  O   ) 0.0 0.0 3.3
assign (resid  16 and name HN   ) (resid  12 and name  O   ) 0.0 0.0 2.3
assign (resid  16 and name N    ) (resid  12 and name  O   ) 0.0 0.0 3.3
assign (resid  17 and name HN   ) (resid  13 and name  O   ) 0.0 0.0 2.3
assign (resid  17 and name N    ) (resid  13 and name  O   ) 0.0 0.0 3.3
assign (resid  18 and name HN   ) (resid  14 and name  O   ) 0.0 0.0 2.3
assign (resid  18 and name N    ) (resid  14 and name  O   ) 0.0 0.0 3.3
assign (resid  24 and name HN   ) (resid  19 and name  OD2 ) 0.0 0.0 2.3
assign (resid  24 and name N    ) (resid  19 and name  OD2 ) 0.0 0.0 3.3
assign (resid  26 and name HN   ) (resid  61 and name  O   ) 0.0 0.0 2.3
assign (resid  26 and name N    ) (resid  61 and name  O   ) 0.0 0.0 3.3
assign (resid  31 and name HN   ) (resid  27 and name  O   ) 0.0 0.0 2.3
assign (resid  31 and name N    ) (resid  27 and name  O   ) 0.0 0.0 3.3
assign (resid  32 and name HN   ) (resid  28 and name  O   ) 0.0 0.0 2.3
assign (resid  32 and name N    ) (resid  28 and name  O   ) 0.0 0.0 3.3
assign (resid  33 and name HN   ) (resid  29 and name  O   ) 0.0 0.0 2.3
assign (resid  33 and name N    ) (resid  29 and name  O   ) 0.0 0.0 3.3
assign (resid  34 and name HN   ) (resid  30 and name  O   ) 0.0 0.0 2.3
assign (resid  34 and name N    ) (resid  30 and name  O   ) 0.0 0.0 3.3
assign (resid  35 and name HN   ) (resid  31 and name  O   ) 0.0 0.0 2.3
assign (resid  35 and name N    ) (resid  31 and name  O   ) 0.0 0.0 3.3
assign (resid  47 and name HN   ) (resid  43 and name  O   ) 0.0 0.0 2.3
assign (resid  47 and name N    ) (resid  43 and name  O   ) 0.0 0.0 3.3
assign (resid  49 and name HN   ) (resid  45 and name  O   ) 0.0 0.0 2.3
assign (resid  49 and name N    ) (resid  45 and name  O   ) 0.0 0.0 3.3
assign (resid  50 and name HN   ) (resid  46 and name  O   ) 0.0 0.0 2.3
assign (resid  50 and name N    ) (resid  46 and name  O   ) 0.0 0.0 3.3
assign (resid  51 and name HN   ) (resid  47 and name  O   ) 0.0 0.0 2.3
assign (resid  51 and name N    ) (resid  47 and name  O   ) 0.0 0.0 3.3
assign (resid  52 and name HN   ) (resid  48 and name  O   ) 0.0 0.0 2.3
assign (resid  52 and name N    ) (resid  48 and name  O   ) 0.0 0.0 3.3
assign (resid  53 and name HN   ) (resid  49 and name  O   ) 0.0 0.0 2.3
assign (resid  53 and name N    ) (resid  49 and name  O   ) 0.0 0.0 3.3
assign (resid  54 and name HN   ) (resid  50 and name  O   ) 0.0 0.0 2.3
assign (resid  54 and name N    ) (resid  50 and name  O   ) 0.0 0.0 3.3
assign (resid  59 and name HN   ) (resid  54 and name  OD2 ) 0.0 0.0 2.3
assign (resid  59 and name N    ) (resid  54 and name  OD2 ) 0.0 0.0 3.3
assign (resid  61 and name HN   ) (resid  26 and name  O   ) 0.0 0.0 2.3
assign (resid  61 and name N    ) (resid  26 and name  O   ) 0.0 0.0 3.3
assign (resid  66 and name HN   ) (resid  62 and name  O   ) 0.0 0.0 2.3
assign (resid  66 and name N    ) (resid  62 and name  O   ) 0.0 0.0 3.3
assign (resid  67 and name HN   ) (resid  63 and name  O   ) 0.0 0.0 2.3
assign (resid  67 and name N    ) (resid  63 and name  O   ) 0.0 0.0 3.3

! dihedral angle restraints derived from scalar coupling constants
assign (resid   5 and name C    ) (resid   6 and name N    )
       (resid   6 and name CA   ) (resid   6 and name C    ) 10  -60 20 2
assign (resid   6 and name C    ) (resid   7 and name N    )
       (resid   7 and name CA   ) (resid   7 and name C    ) 10  -60 20 2
assign (resid   7 and name C    ) (resid   8 and name N    )
       (resid   8 and name CA   ) (resid   8 and name C    ) 10  -60 20 2
assign (resid   8 and name C    ) (resid   9 and name N    )
       (resid   9 and name CA   ) (resid   9 and name C    ) 10  -60 20 2
assign (resid   9 and name C    ) (resid  10 and name N    )
       (resid  10 and name CA   ) (resid  10 and name C    ) 10  -60 20 2
assign (resid  10 and name C    ) (resid  11 and name N    )
       (resid  11 and name CA   ) (resid  11 and name C    ) 10  -60 20 2
assign (resid  11 and name C    ) (resid  12 and name N    )
       (resid  12 and name CA   ) (resid  12 and name C    ) 10  -60 20 2
assign (resid  12 and name C    ) (resid  13 and name N    )
       (resid  13 and name CA   ) (resid  13 and name C    ) 10  -60 20 2
assign (resid  13 and name C    ) (resid  14 and name N    )
       (resid  14 and name CA   ) (resid  14 and name C    ) 10  -60 20 2
assign (resid  15 and name C    ) (resid  16 and name N    )
       (resid  16 and name CA   ) (resid  16 and name C    ) 10  -60 20 2
assign (resid  16 and name C    ) (resid  17 and name N    )
       (resid  17 and name CA   ) (resid  17 and name C    ) 10  -60 20 2
assign (resid  18 and name C    ) (resid  19 and name N    )
       (resid  19 and name CA   ) (resid  19 and name C    ) 10  -60 20 2
assign (resid  19 and name C    ) (resid  20 and name N    )
       (resid  20 and name CA   ) (resid  20 and name C    ) 10  -60 20 2
assign (resid  20 and name C    ) (resid  21 and name N    )
       (resid  21 and name CA   ) (resid  21 and name C    ) 10 -120 40 2
assign (resid  22 and name C    ) (resid  23 and name N    )
       (resid  23 and name CA   ) (resid  23 and name C    ) 10 -120 40 2
assign (resid  24 and name C    ) (resid  25 and name N    )
       (resid  25 and name CA   ) (resid  25 and name C    ) 10 -120 40 2
assign (resid  25 and name C    ) (resid  26 and name N    )
       (resid  26 and name CA   ) (resid  26 and name C    ) 10 -120 40 2
assign (resid  27 and name C    ) (resid  28 and name N    )
       (resid  28 and name CA   ) (resid  28 and name C    ) 10  -60 20 2
assign (resid  29 and name C    ) (resid  30 and name N    )
       (resid  30 and name CA   ) (resid  30 and name C    ) 10  -60 20 2
assign (resid  30 and name C    ) (resid  31 and name N    )
       (resid  31 and name CA   ) (resid  31 and name C    ) 10  -60 20 2
assign (resid  32 and name C    ) (resid  33 and name N    )
       (resid  33 and name CA   ) (resid  33 and name C    ) 10  -60 20 2
assign (resid  33 and name C    ) (resid  34 and name N    )
       (resid  34 and name CA   ) (resid  34 and name C    ) 10  -60 20 2
assign (resid  34 and name C    ) (resid  35 and name N    )
       (resid  35 and name CA   ) (resid  35 and name C    ) 10  -60 20 2
assign (resid  35 and name C    ) (resid  36 and name N    )
       (resid  36 and name CA   ) (resid  36 and name C    ) 10  -60 20 2
assign (resid  36 and name C    ) (resid  37 and name N    )
       (resid  37 and name CA   ) (resid  37 and name C    ) 10  -60 20 2
assign (resid  40 and name C    ) (resid  41 and name N    )
       (resid  41 and name CA   ) (resid  41 and name C    ) 10 -120 40 2
assign (resid  45 and name C    ) (resid  46 and name N    )
       (resid  46 and name CA   ) (resid  46 and name C    ) 10  -60 20 2
assign (resid  46 and name C    ) (resid  47 and name N    )
       (resid  47 and name CA   ) (resid  47 and name C    ) 10  -60 20 2
assign (resid  47 and name C    ) (resid  48 and name N    )
       (resid  48 and name CA   ) (resid  48 and name C    ) 10  -60 20 2
assign (resid  48 and name C    ) (resid  49 and name N    )
       (resid  49 and name CA   ) (resid  49 and name C    ) 10  -60 20 2
assign (resid  49 and name C    ) (resid  50 and name N    )
       (resid  50 and name CA   ) (resid  50 and name C    ) 10  -60 20 2
assign (resid  50 and name C    ) (resid  51 and name N    )
       (resid  51 and name CA   ) (resid  51 and name C    ) 10  -60 20 2
assign (resid  53 and name C    ) (resid  54 and name N    )
       (resid  54 and name CA   ) (resid  54 and name C    ) 10  -60 20 2
assign (resid  54 and name C    ) (resid  55 and name N    )
       (resid  55 and name CA   ) (resid  55 and name C    ) 10  -60 20 2
assign (resid  55 and name C    ) (resid  56 and name N    )
       (resid  56 and name CA   ) (resid  56 and name C    ) 10 -120 40 2
assign (resid  59 and name C    ) (resid  60 and name N    )
       (resid  60 and name CA   ) (resid  60 and name C    ) 10 -120 40 2
assign (resid  60 and name C    ) (resid  61 and name N    )
       (resid  61 and name CA   ) (resid  61 and name C    ) 10 -120 40 2
assign (resid  62 and name C    ) (resid  63 and name N    )
       (resid  63 and name CA   ) (resid  63 and name C    ) 10  -60 20 2
assign (resid  63 and name C    ) (resid  64 and name N    )
       (resid  64 and name CA   ) (resid  64 and name C    ) 10  -60 20 2
assign (resid  64 and name C    ) (resid  65 and name N    )
       (resid  65 and name CA   ) (resid  65 and name C    ) 10  -60 20 2
assign (resid  65 and name C    ) (resid  66 and name N    )
       (resid  66 and name CA   ) (resid  66 and name C    ) 10  -60 20 2
assign (resid  67 and name C    ) (resid  68 and name N    )
       (resid  68 and name CA   ) (resid  68 and name C    ) 10  -60 20 2
assign (resid  68 and name C    ) (resid  69 and name N    )
       (resid  69 and name CA   ) (resid  69 and name C    ) 10  -60 20 2
assign (resid  70 and name C    ) (resid  71 and name N    )
       (resid  71 and name CA   ) (resid  71 and name C    ) 10  -60 20 2
assign (resid  72 and name C    ) (resid  73 and name N    )
       (resid  73 and name CA   ) (resid  73 and name C    ) 10 -120 40 2
assign (resid  73 and name C    ) (resid  74 and name N    )
       (resid  74 and name CA   ) (resid  74 and name C    ) 10  -60 20 2
assign (resid  75 and name C    ) (resid  76 and name N    )
       (resid  76 and name CA   ) (resid  76 and name C    ) 10  -60 20 2
assign (resid  77 and name C    ) (resid  78 and name N    )
       (resid  78 and name CA   ) (resid  78 and name C    ) 10  -60 20 2
assign (resid  80 and name C    ) (resid  81 and name N    )
       (resid  81 and name CA   ) (resid  81 and name C    ) 10  -60 20 2
assign (resid  83 and name C    ) (resid  84 and name N    )
       (resid  84 and name CA   ) (resid  84 and name C    ) 10 -120 40 2

! SANI restraints derived from dipolar coupling constants
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid   9 and name N    ) (resid   9 and name HN   ) -23.13   0.56
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  10 and name N    ) (resid  10 and name HN   ) -15.65   0.30
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  11 and name N    ) (resid  11 and name HN   ) -15.96   0.44
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  12 and name N    ) (resid  12 and name HN   ) -25.46   0.36
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  13 and name N    ) (resid  13 and name HN   ) -22.60   0.50
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  14 and name N    ) (resid  14 and name HN   ) -15.00   0.33
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  15 and name N    ) (resid  15 and name HN   ) -21.02   0.47
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  17 and name N    ) (resid  17 and name HN   ) -16.44   0.35
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  20 and name N    ) (resid  20 and name HN   )   2.25   0.30
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  21 and name N    ) (resid  21 and name HN   )   9.97   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  22 and name N    ) (resid  22 and name HN   )   3.24   0.30
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  23 and name N    ) (resid  23 and name HN   )   1.34   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  24 and name N    ) (resid  24 and name HN   )  19.83   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  25 and name N    ) (resid  25 and name HN   )  -0.91   0.30
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  26 and name N    ) (resid  26 and name HN   )   5.09   0.30
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  27 and name N    ) (resid  27 and name HN   )  13.93   0.32
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  28 and name N    ) (resid  28 and name HN   )   7.74   0.30
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  29 and name N    ) (resid  29 and name HN   )   7.81   0.41
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  31 and name N    ) (resid  31 and name HN   )  11.70   0.30
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  32 and name N    ) (resid  32 and name HN   )   3.59   0.30
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  33 and name N    ) (resid  33 and name HN   )  12.49   0.34
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  34 and name N    ) (resid  34 and name HN   )  18.51   0.36
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  35 and name N    ) (resid  35 and name HN   )   6.46   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  36 and name N    ) (resid  36 and name HN   )   3.99   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  37 and name N    ) (resid  37 and name HN   )  14.21   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  38 and name N    ) (resid  38 and name HN   )  10.34   0.32
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  42 and name N    ) (resid  42 and name HN   )  -3.06   0.41
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  44 and name N    ) (resid  44 and name HN   )   8.29   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  45 and name N    ) (resid  45 and name HN   )  15.49   0.32
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  47 and name N    ) (resid  47 and name HN   )   2.23   0.37
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  48 and name N    ) (resid  48 and name HN   )  14.43   0.48
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  50 and name N    ) (resid  50 and name HN   )  -2.33   0.30
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  51 and name N    ) (resid  51 and name HN   )   5.07   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  52 and name N    ) (resid  52 and name HN   )  17.17   0.33
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  53 and name N    ) (resid  53 and name HN   )  -4.06   0.32
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  54 and name N    ) (resid  54 and name HN   )  -3.02   0.39
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  56 and name N    ) (resid  56 and name HN   )  13.16   0.37
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  57 and name N    ) (resid  57 and name HN   )   0.89   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  58 and name N    ) (resid  58 and name HN   ) -23.37   0.33
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  59 and name N    ) (resid  59 and name HN   )  -9.06   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  60 and name N    ) (resid  60 and name HN   )  17.80   0.32
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  61 and name N    ) (resid  61 and name HN   )  14.19   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  62 and name N    ) (resid  62 and name HN   )  13.14   0.34
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  63 and name N    ) (resid  63 and name HN   )   1.32   0.30
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  64 and name N    ) (resid  64 and name HN   )  -3.85   0.33
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  66 and name N    ) (resid  66 and name HN   )   0.26   0.30
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  68 and name N    ) (resid  68 and name HN   )  -6.65   0.33
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  69 and name N    ) (resid  69 and name HN   )  -3.39   0.45
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  70 and name N    ) (resid  70 and name HN   )   3.67   0.35
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  71 and name N    ) (resid  71 and name HN   )   1.72   0.33
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  72 and name N    ) (resid  72 and name HN   ) -10.62   0.34
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  73 and name N    ) (resid  73 and name HN   )   5.29   0.40
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  74 and name N    ) (resid  74 and name HN   )   7.74   0.45
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  75 and name N    ) (resid  75 and name HN   )  12.71   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  76 and name N    ) (resid  76 and name HN   )  18.21   0.48
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  77 and name N    ) (resid  77 and name HN   )  10.68   0.35
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  78 and name N    ) (resid  78 and name HN   )  10.03   0.48
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  80 and name N    ) (resid  80 and name HN   )  15.37   0.49
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  81 and name N    ) (resid  81 and name HN   )   6.12   0.31
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  82 and name N    ) (resid  82 and name HN   )   7.70   0.40
assign (resid 500 and name OO   ) (resid 500 and name Z    )
       (resid 500 and name Y    ) (resid 500 and name X    )
       (resid  83 and name N    ) (resid  83 and name HN   )  17.07   0.51
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ALA   1          1H        ALA   1   8.987 -14.476   2.341
    2    H2   ALA   1          3H        ALA   1  10.652 -14.178   2.467
    3    H3   ALA   1          2H        ALA   1   9.712 -14.349   3.872
    4    HA   ALA   1           HA       ALA   1   8.788 -12.283   3.709
    5   1HB   ALA   1          1HB       ALA   1  11.002 -11.693   4.137
    6   2HB   ALA   1          2HB       ALA   1  10.689 -10.783   2.659
    7   3HB   ALA   1          3HB       ALA   1  11.572 -12.307   2.585
    8    H    ASP   2           H        ASP   2   9.620 -13.671   0.622
    9    HA   ASP   2           HA       ASP   2   8.904 -11.616  -1.157
   10   1HB   ASP   2          2HB       ASP   2   8.435 -14.604  -1.348
   11   2HB   ASP   2          1HB       ASP   2   8.172 -13.490  -2.690
   12    H    ASP   3           H        ASP   3   6.869 -13.604   0.890
   13    HA   ASP   3           HA       ASP   3   4.375 -13.010  -0.432
   14   1HB   ASP   3          2HB       ASP   3   5.033 -13.878   2.394
   15   2HB   ASP   3          1HB       ASP   3   3.382 -13.683   1.806
   16    H    HIS   4           H        HIS   4   3.102 -11.204  -0.267
   17    HA   HIS   4           HA       HIS   4   4.023  -9.077   1.620
   18   1HB   HIS   4          2HB       HIS   4   2.370  -7.772  -0.107
   19   2HB   HIS   4          1HB       HIS   4   4.106  -7.923  -0.350
   20    HD1  HIS   4           HD1      HIS   4   0.820  -9.379  -1.487
   21    HD2  HIS   4           HD2      HIS   4   4.864  -9.646  -2.458
   22    HE1  HIS   4           HE1      HIS   4   0.949 -10.666  -3.664
   23    HA   PRO   5           HA       PRO   5   0.142  -9.006   3.753
   24   1HB   PRO   5          2HB       PRO   5  -0.574  -6.397   3.762
   25   2HB   PRO   5          1HB       PRO   5   0.745  -7.032   4.749
   26   1HG   PRO   5          2HG       PRO   5   0.863  -5.610   2.113
   27   2HG   PRO   5          1HG       PRO   5   1.866  -5.372   3.547
   28   1HD   PRO   5          1HD       PRO   5   2.736  -6.805   1.438
   29   2HD   PRO   5          2HD       PRO   5   3.182  -7.228   3.092
   30    H    GLN   6           H        GLN   6   0.264  -7.593   0.564
   31    HA   GLN   6           HA       GLN   6  -2.524  -7.149   0.150
   32   1HB   GLN   6          2HB       GLN   6  -0.149  -7.618  -1.618
   33   2HB   GLN   6          1HB       GLN   6  -1.761  -7.690  -2.329
   34   1HG   GLN   6          2HG       GLN   6  -2.255  -5.446  -1.681
   35   2HG   GLN   6          1HG       GLN   6  -0.859  -5.376  -0.604
   36   1HE2  GLN   6          1HE2      GLN   6   1.344  -5.723  -1.815
   37   2HE2  GLN   6          2HE2      GLN   6   1.488  -4.995  -3.341
   38    H    ASP   7           H        ASP   7  -0.476 -10.009  -0.286
   39    HA   ASP   7           HA       ASP   7  -2.408 -11.686  -1.524
   40   1HB   ASP   7          2HB       ASP   7  -0.067 -12.289   0.290
   41   2HB   ASP   7          1HB       ASP   7  -1.062 -13.563  -0.414
   42    H    LYS   8           H        LYS   8  -1.657 -11.218   1.924
   43    HA   LYS   8           HA       LYS   8  -3.472 -13.039   3.037
   44   1HB   LYS   8          2HB       LYS   8  -2.419 -10.376   3.942
   45   2HB   LYS   8          1HB       LYS   8  -3.672 -11.182   4.888
   46   1HG   LYS   8          2HG       LYS   8  -2.146 -13.273   4.731
   47   2HG   LYS   8          1HG       LYS   8  -0.882 -12.139   4.259
   48   1HD   LYS   8          2HD       LYS   8  -1.422 -10.811   6.342
   49   2HD   LYS   8          1HD       LYS   8  -2.480 -12.134   6.834
   50   1HE   LYS   8          2HE       LYS   8  -0.630 -13.027   7.794
   51   2HE   LYS   8          1HE       LYS   8  -0.145 -13.448   6.152
   52   1HZ   LYS   8          3HZ       LYS   8   0.520 -10.786   6.515
   53   2HZ   LYS   8          2HZ       LYS   8   1.027 -11.588   7.924
   54   3HZ   LYS   8          1HZ       LYS   8   1.579 -12.106   6.403
   55    H    ALA   9           H        ALA   9  -4.076  -9.773   1.816
   56    HA   ALA   9           HA       ALA   9  -6.736  -9.436   2.664
   57   1HB   ALA   9          1HB       ALA   9  -5.980  -8.654  -0.133
   58   2HB   ALA   9          3HB       ALA   9  -6.899  -7.745   1.067
   59   3HB   ALA   9          2HB       ALA   9  -5.148  -7.887   1.219
   60    H    GLU  10           H        GLU  10  -5.460 -11.182  -0.134
   61    HA   GLU  10           HA       GLU  10  -8.028 -11.929  -1.201
   62   1HB   GLU  10          2HB       GLU  10  -5.369 -13.361  -1.479
   63   2HB   GLU  10          1HB       GLU  10  -6.779 -13.582  -2.515
   64   1HG   GLU  10          2HG       GLU  10  -5.293 -10.963  -2.145
   65   2HG   GLU  10          1HG       GLU  10  -5.100 -12.044  -3.525
   66    H    ARG  11           H        ARG  11  -5.718 -13.622   0.910
   67    HA   ARG  11           HA       ARG  11  -7.322 -15.972   1.263
   68   1HB   ARG  11          2HB       ARG  11  -5.127 -14.707   2.914
   69   2HB   ARG  11          1HB       ARG  11  -5.896 -16.226   3.369
   70   1HG   ARG  11          2HG       ARG  11  -5.306 -17.119   1.095
   71   2HG   ARG  11          1HG       ARG  11  -4.391 -15.644   0.802
   72   1HD   ARG  11          2HD       ARG  11  -3.837 -17.866   2.749
   73   2HD   ARG  11          1HD       ARG  11  -2.737 -17.085   1.613
   74    HE   ARG  11           HE       ARG  11  -3.785 -15.546   3.936
   75   1HH1  ARG  11          1HH1      ARG  11  -1.405 -15.770   1.600
   76   2HH1  ARG  11          2HH1      ARG  11  -0.073 -15.465   2.665
   77   1HH2  ARG  11          1HH2      ARG  11  -1.992 -15.649   5.547
   78   2HH2  ARG  11          2HH2      ARG  11  -0.406 -15.398   4.899
   79    H    GLU  12           H        GLU  12  -7.095 -12.919   3.027
   80    HA   GLU  12           HA       GLU  12  -8.844 -13.653   5.178
   81   1HB   GLU  12          2HB       GLU  12  -7.849 -11.068   4.025
   82   2HB   GLU  12          1HB       GLU  12  -9.176 -11.034   5.184
   83   1HG   GLU  12          2HG       GLU  12  -7.714 -12.495   6.689
   84   2HG   GLU  12          1HG       GLU  12  -6.385 -12.127   5.589
   85    H    ARG  13           H        ARG  13  -9.390 -12.113   2.029
   86    HA   ARG  13           HA       ARG  13 -12.199 -11.655   2.423
   87   1HB   ARG  13          2HB       ARG  13 -10.545 -11.990  -0.095
   88   2HB   ARG  13          1HB       ARG  13 -12.249 -11.535  -0.102
   89   1HG   ARG  13          2HG       ARG  13 -11.812  -9.493   1.046
   90   2HG   ARG  13          1HG       ARG  13 -10.185 -10.005   1.493
   91   1HD   ARG  13          2HD       ARG  13  -9.320  -9.335  -0.490
   92   2HD   ARG  13          1HD       ARG  13 -10.644 -10.059  -1.403
   93    HE   ARG  13           HE       ARG  13 -11.583  -7.698  -0.077
   94   1HH1  ARG  13          1HH1      ARG  13 -11.228  -8.901  -3.081
   95   2HH1  ARG  13          2HH1      ARG  13 -10.706  -7.440  -3.850
   96   1HH2  ARG  13          1HH2      ARG  13 -10.185  -5.745  -0.870
   97   2HH2  ARG  13          2HH2      ARG  13 -10.115  -5.653  -2.599
   98    H    ILE  14           H        ILE  14 -10.347 -14.349   1.056
   99    HA   ILE  14           HA       ILE  14 -12.674 -15.878   0.281
  100    HB   ILE  14           HB       ILE  14  -9.889 -16.883   0.940
  101   1HG1  ILE  14          2HG1      ILE  14 -10.870 -16.293  -1.834
  102   2HG1  ILE  14          1HG1      ILE  14 -10.251 -14.973  -0.844
  103   1HG2  ILE  14          1HG2      ILE  14 -12.355 -18.068  -0.188
  104   2HG2  ILE  14          3HG2      ILE  14 -10.876 -18.432  -1.077
  105   3HG2  ILE  14          2HG2      ILE  14 -11.003 -18.850   0.632
  106   1HD1  ILE  14          1HD1      ILE  14  -8.454 -17.168  -0.563
  107   2HD1  ILE  14          3HD1      ILE  14  -8.768 -16.958  -2.286
  108   3HD1  ILE  14          2HD1      ILE  14  -8.148 -15.611  -1.331
  109    H    PHE  15           H        PHE  15 -10.498 -15.970   3.116
  110    HA   PHE  15           HA       PHE  15 -11.916 -18.081   4.447
  111   1HB   PHE  15          2HB       PHE  15  -9.612 -17.408   5.067
  112   2HB   PHE  15          1HB       PHE  15 -10.230 -15.862   5.654
  113    HD1  PHE  15           HD1      PHE  15 -11.655 -15.764   7.673
  114    HD2  PHE  15           HD2      PHE  15 -10.015 -19.478   6.271
  115    HE1  PHE  15           HE1      PHE  15 -12.216 -16.832   9.841
  116    HE2  PHE  15           HE2      PHE  15 -10.576 -20.545   8.437
  117    HZ   PHE  15           HZ       PHE  15 -11.680 -19.226  10.223
  118    H    LYS  16           H        LYS  16 -12.275 -14.570   4.407
  119    HA   LYS  16           HA       LYS  16 -14.154 -14.415   6.575
  120   1HB   LYS  16          2HB       LYS  16 -13.448 -12.632   4.258
  121   2HB   LYS  16          1HB       LYS  16 -14.846 -12.252   5.264
  122   1HG   LYS  16          2HG       LYS  16 -13.324 -12.442   7.279
  123   2HG   LYS  16          1HG       LYS  16 -11.967 -12.551   6.158
  124   1HD   LYS  16          2HD       LYS  16 -12.727 -10.369   5.150
  125   2HD   LYS  16          1HD       LYS  16 -13.917 -10.248   6.446
  126   1HE   LYS  16          2HE       LYS  16 -11.437 -10.863   7.677
  127   2HE   LYS  16          1HE       LYS  16 -11.116  -9.580   6.510
  128   1HZ   LYS  16          3HZ       LYS  16 -13.257  -9.534   8.569
  129   2HZ   LYS  16          2HZ       LYS  16 -11.780  -8.699   8.667
  130   3HZ   LYS  16          1HZ       LYS  16 -12.910  -8.294   7.465
  131    H    ARG  17           H        ARG  17 -14.482 -15.104   3.139
  132    HA   ARG  17           HA       ARG  17 -17.361 -14.872   3.069
  133   1HB   ARG  17          2HB       ARG  17 -15.349 -16.270   1.296
  134   2HB   ARG  17          1HB       ARG  17 -17.082 -16.328   0.978
  135   1HG   ARG  17          2HG       ARG  17 -17.031 -13.765   1.124
  136   2HG   ARG  17          1HG       ARG  17 -15.277 -13.905   1.030
  137   1HD   ARG  17          2HD       ARG  17 -15.846 -15.463  -1.041
  138   2HD   ARG  17          1HD       ARG  17 -17.344 -14.531  -1.045
  139    HE   ARG  17           HE       ARG  17 -15.167 -12.707  -0.860
  140   1HH1  ARG  17          1HH1      ARG  17 -17.341 -12.438  -2.871
  141   2HH1  ARG  17          2HH1      ARG  17 -16.512 -12.736  -4.362
  142   1HH2  ARG  17          1HH2      ARG  17 -13.757 -14.197  -2.846
  143   2HH2  ARG  17          2HH2      ARG  17 -14.483 -13.732  -4.348
  144    H    PHE  18           H        PHE  18 -15.096 -17.485   3.776
  145    HA   PHE  18           HA       PHE  18 -17.064 -19.587   3.830
  146   1HB   PHE  18          2HB       PHE  18 -14.304 -19.279   5.005
  147   2HB   PHE  18          1HB       PHE  18 -15.281 -20.711   5.329
  148    HD1  PHE  18           HD1      PHE  18 -16.387 -21.821   3.190
  149    HD2  PHE  18           HD2      PHE  18 -12.941 -19.258   3.112
  150    HE1  PHE  18           HE1      PHE  18 -15.737 -22.763   0.990
  151    HE2  PHE  18           HE2      PHE  18 -12.290 -20.200   0.912
  152    HZ   PHE  18           HZ       PHE  18 -13.688 -21.952  -0.149
  153    H    ASP  19           H        ASP  19 -15.582 -17.628   6.417
  154    HA   ASP  19           HA       ASP  19 -17.050 -18.751   8.573
  155   1HB   ASP  19          2HB       ASP  19 -15.093 -16.997   8.563
  156   2HB   ASP  19          1HB       ASP  19 -16.400 -15.812   8.501
  157    H    ALA  20           H        ALA  20 -19.254 -19.013   8.305
  158    HA   ALA  20           HA       ALA  20 -20.933 -17.183   6.885
  159   1HB   ALA  20          2HB       ALA  20 -21.333 -19.670   7.502
  160   2HB   ALA  20          1HB       ALA  20 -21.937 -19.037   9.033
  161   3HB   ALA  20          3HB       ALA  20 -22.716 -18.576   7.520
  162    H    ASN  21           H        ASN  21 -20.595 -17.704  10.439
  163    HA   ASN  21           HA       ASN  21 -22.223 -15.285  10.871
  164   1HB   ASN  21          2HB       ASN  21 -22.112 -15.833  13.235
  165   2HB   ASN  21          1HB       ASN  21 -22.512 -17.287  12.328
  166   1HD2  ASN  21          1HD2      ASN  21 -21.242 -17.133  14.976
  167   2HD2  ASN  21          2HD2      ASN  21 -19.738 -17.900  14.836
  168    H    GLY  22           H        GLY  22 -18.872 -16.228  10.876
  169   1HA   GLY  22          1HA       GLY  22 -18.138 -13.387  11.175
  170   2HA   GLY  22          2HA       GLY  22 -17.050 -14.687  10.698
  171    H    ASP  23           H        ASP  23 -17.614 -16.455  12.887
  172    HA   ASP  23           HA       ASP  23 -16.900 -14.858  15.283
  173   1HB   ASP  23          2HB       ASP  23 -17.204 -16.950  16.547
  174   2HB   ASP  23          1HB       ASP  23 -18.624 -16.595  15.568
  175    H    GLY  24           H        GLY  24 -15.243 -15.983  12.755
  176   1HA   GLY  24          1HA       GLY  24 -12.776 -16.267  14.365
  177   2HA   GLY  24          2HA       GLY  24 -12.843 -15.957  12.633
  178    H    LYS  25           H        LYS  25 -15.008 -18.428  13.457
  179    HA   LYS  25           HA       LYS  25 -12.993 -20.455  12.600
  180   1HB   LYS  25          2HB       LYS  25 -13.920 -22.061  14.158
  181   2HB   LYS  25          1HB       LYS  25 -13.523 -20.597  15.058
  182   1HG   LYS  25          2HG       LYS  25 -15.816 -19.900  15.092
  183   2HG   LYS  25          1HG       LYS  25 -16.277 -21.146  13.931
  184   1HD   LYS  25          2HD       LYS  25 -15.445 -22.848  15.660
  185   2HD   LYS  25          1HD       LYS  25 -15.414 -21.507  16.807
  186   1HE   LYS  25          2HE       LYS  25 -17.570 -22.911  16.728
  187   2HE   LYS  25          1HE       LYS  25 -17.758 -21.160  16.631
  188   1HZ   LYS  25          1HZ       LYS  25 -17.497 -22.801  14.192
  189   2HZ   LYS  25          3HZ       LYS  25 -19.002 -22.598  14.948
  190   3HZ   LYS  25          2HZ       LYS  25 -18.157 -21.245  14.363
  191    H    ILE  26           H        ILE  26 -13.721 -21.969  11.138
  192    HA   ILE  26           HA       ILE  26 -16.501 -21.570  10.111
  193    HB   ILE  26           HB       ILE  26 -14.281 -22.860   8.543
  194   1HG1  ILE  26          2HG1      ILE  26 -14.846 -19.891   8.802
  195   2HG1  ILE  26          1HG1      ILE  26 -13.375 -20.718   9.316
  196   1HG2  ILE  26          2HG2      ILE  26 -16.749 -22.854   7.853
  197   2HG2  ILE  26          1HG2      ILE  26 -16.574 -21.113   7.628
  198   3HG2  ILE  26          3HG2      ILE  26 -15.608 -22.229   6.663
  199   1HD1  ILE  26          2HD1      ILE  26 -14.029 -21.348   6.555
  200   2HD1  ILE  26          1HD1      ILE  26 -13.866 -19.608   6.790
  201   3HD1  ILE  26          3HD1      ILE  26 -12.537 -20.684   7.221
  202    H    SER  27           H        SER  27 -17.842 -23.313  10.112
  203    HA   SER  27           HA       SER  27 -16.710 -25.908  11.049
  204   1HB   SER  27          2HB       SER  27 -18.786 -26.369  12.043
  205   2HB   SER  27          1HB       SER  27 -18.637 -24.628  12.283
  206    HG   SER  27           HG       SER  27 -20.198 -24.290  10.914
  207    H    ALA  28           H        ALA  28 -17.876 -27.868  10.077
  208    HA   ALA  28           HA       ALA  28 -17.584 -27.959   7.296
  209   1HB   ALA  28          1HB       ALA  28 -19.687 -29.581   8.738
  210   2HB   ALA  28          2HB       ALA  28 -17.966 -29.910   8.937
  211   3HB   ALA  28          3HB       ALA  28 -18.714 -30.053   7.346
  212    H    ALA  29           H        ALA  29 -20.544 -27.321   9.162
  213    HA   ALA  29           HA       ALA  29 -22.316 -27.044   6.979
  214   1HB   ALA  29          3HB       ALA  29 -22.715 -26.948   9.591
  215   2HB   ALA  29          2HB       ALA  29 -22.551 -25.211   9.339
  216   3HB   ALA  29          1HB       ALA  29 -23.813 -26.108   8.495
  217    H    GLU  30           H        GLU  30 -20.126 -24.673   8.464
  218    HA   GLU  30           HA       GLU  30 -21.017 -22.516   6.741
  219   1HB   GLU  30          2HB       GLU  30 -18.524 -22.831   8.437
  220   2HB   GLU  30          1HB       GLU  30 -18.978 -21.343   7.606
  221   1HG   GLU  30          2HG       GLU  30 -21.124 -21.326   8.861
  222   2HG   GLU  30          1HG       GLU  30 -20.615 -22.777   9.723
  223    H    LEU  31           H        LEU  31 -18.012 -24.462   6.831
  224    HA   LEU  31           HA       LEU  31 -16.977 -23.432   4.377
  225   1HB   LEU  31          2HB       LEU  31 -15.555 -24.680   5.927
  226   2HB   LEU  31          1HB       LEU  31 -16.539 -26.126   5.706
  227    HG   LEU  31           HG       LEU  31 -15.948 -26.142   3.297
  228   1HD1  LEU  31          2HD1      LEU  31 -14.881 -23.517   4.033
  229   2HD1  LEU  31          1HD1      LEU  31 -13.717 -24.495   3.139
  230   3HD1  LEU  31          3HD1      LEU  31 -15.300 -24.149   2.441
  231   1HD2  LEU  31          3HD2      LEU  31 -13.733 -26.129   5.350
  232   2HD2  LEU  31          2HD2      LEU  31 -14.550 -27.517   4.631
  233   3HD2  LEU  31          1HD2      LEU  31 -13.429 -26.557   3.666
  234    H    GLY  32           H        GLY  32 -19.004 -26.263   5.084
  235   1HA   GLY  32          1HA       GLY  32 -20.329 -27.574   3.661
  236   2HA   GLY  32          2HA       GLY  32 -19.127 -27.257   2.412
  237    H    GLU  33           H        GLU  33 -21.209 -24.968   4.176
  238    HA   GLU  33           HA       GLU  33 -23.132 -24.570   2.142
  239   1HB   GLU  33          2HB       GLU  33 -22.148 -22.998   4.472
  240   2HB   GLU  33          1HB       GLU  33 -23.079 -22.128   3.255
  241   1HG   GLU  33          2HG       GLU  33 -24.864 -23.872   3.443
  242   2HG   GLU  33          1HG       GLU  33 -23.949 -24.617   4.754
  243    H    ALA  34           H        ALA  34 -20.017 -22.925   2.676
  244    HA   ALA  34           HA       ALA  34 -20.351 -21.175   0.391
  245   1HB   ALA  34          1HB       ALA  34 -18.709 -20.242   1.675
  246   2HB   ALA  34          3HB       ALA  34 -18.230 -21.797   2.356
  247   3HB   ALA  34          2HB       ALA  34 -17.643 -21.313   0.765
  248    H    LEU  35           H        LEU  35 -18.780 -24.284   0.979
  249    HA   LEU  35           HA       LEU  35 -17.510 -24.582  -1.539
  250   1HB   LEU  35          2HB       LEU  35 -18.419 -26.411   0.622
  251   2HB   LEU  35          1HB       LEU  35 -18.131 -27.141  -0.957
  252    HG   LEU  35           HG       LEU  35 -16.086 -25.234   0.106
  253   1HD1  LEU  35          3HD1      LEU  35 -16.849 -27.017   1.889
  254   2HD1  LEU  35          2HD1      LEU  35 -15.941 -28.135   0.870
  255   3HD1  LEU  35          1HD1      LEU  35 -15.130 -26.750   1.600
  256   1HD2  LEU  35          1HD2      LEU  35 -16.245 -27.585  -1.745
  257   2HD2  LEU  35          3HD2      LEU  35 -15.482 -26.015  -1.996
  258   3HD2  LEU  35          2HD2      LEU  35 -14.701 -27.221  -0.973
  259    H    LYS  36           H        LYS  36 -20.873 -25.113  -0.562
  260    HA   LYS  36           HA       LYS  36 -21.875 -26.643  -2.640
  261   1HB   LYS  36          2HB       LYS  36 -22.934 -24.488  -0.938
  262   2HB   LYS  36          1HB       LYS  36 -23.774 -24.654  -2.479
  263   1HG   LYS  36          2HG       LYS  36 -24.064 -27.080  -2.039
  264   2HG   LYS  36          1HG       LYS  36 -23.272 -26.877  -0.476
  265   1HD   LYS  36          2HD       LYS  36 -25.142 -24.949  -0.259
  266   2HD   LYS  36          1HD       LYS  36 -25.996 -26.045  -1.345
  267   1HE   LYS  36          2HE       LYS  36 -25.541 -27.914   0.246
  268   2HE   LYS  36          1HE       LYS  36 -24.795 -26.757   1.349
  269   1HZ   LYS  36          1HZ       LYS  36 -27.343 -25.847   0.493
  270   2HZ   LYS  36          3HZ       LYS  36 -27.469 -27.395   1.175
  271   3HZ   LYS  36          2HZ       LYS  36 -26.777 -26.127   2.070
  272    H    THR  37           H        THR  37 -20.574 -23.407  -2.824
  273    HA   THR  37           HA       THR  37 -21.676 -22.462  -5.221
  274    HB   THR  37           HB       THR  37 -19.998 -21.289  -3.695
  275    HG1  THR  37           HG1      THR  37 -20.621 -20.828  -6.052
  276   1HG2  THR  37          3HG2      THR  37 -18.110 -23.002  -5.330
  277   2HG2  THR  37          2HG2      THR  37 -17.602 -21.595  -4.397
  278   3HG2  THR  37          1HG2      THR  37 -18.290 -22.995  -3.575
  279    H    LEU  38           H        LEU  38 -19.434 -25.070  -4.691
  280    HA   LEU  38           HA       LEU  38 -18.355 -25.256  -7.338
  281   1HB   LEU  38          2HB       LEU  38 -18.824 -27.369  -5.217
  282   2HB   LEU  38          1HB       LEU  38 -17.940 -27.665  -6.713
  283    HG   LEU  38           HG       LEU  38 -17.010 -25.251  -5.366
  284   1HD1  LEU  38          3HD1      LEU  38 -17.589 -27.558  -3.713
  285   2HD1  LEU  38          2HD1      LEU  38 -15.853 -27.254  -3.758
  286   3HD1  LEU  38          1HD1      LEU  38 -16.957 -25.982  -3.235
  287   1HD2  LEU  38          1HD2      LEU  38 -15.875 -27.792  -6.500
  288   2HD2  LEU  38          3HD2      LEU  38 -15.583 -26.125  -6.996
  289   3HD2  LEU  38          2HD2      LEU  38 -14.851 -26.747  -5.517
  290    H    GLY  39           H        GLY  39 -21.361 -26.379  -5.897
  291   1HA   GLY  39          1HA       GLY  39 -22.619 -26.645  -8.478
  292   2HA   GLY  39          2HA       GLY  39 -23.326 -27.136  -6.939
  293    H    SER  40           H        SER  40 -20.458 -28.655  -6.891
  294    HA   SER  40           HA       SER  40 -21.660 -31.187  -7.792
  295   1HB   SER  40          2HB       SER  40 -19.780 -29.698  -9.419
  296   2HB   SER  40          1HB       SER  40 -19.100 -31.258  -8.955
  297    HG   SER  40           HG       SER  40 -20.910 -32.267  -9.789
  298    H    ILE  41           H        ILE  41 -21.110 -30.608  -5.209
  299    HA   ILE  41           HA       ILE  41 -18.729 -32.316  -4.685
  300    HB   ILE  41           HB       ILE  41 -18.301 -29.771  -4.366
  301   1HG1  ILE  41          2HG1      ILE  41 -17.827 -31.501  -1.934
  302   2HG1  ILE  41          1HG1      ILE  41 -16.965 -31.760  -3.451
  303   1HG2  ILE  41          1HG2      ILE  41 -20.590 -29.707  -3.027
  304   2HG2  ILE  41          3HG2      ILE  41 -19.560 -30.191  -1.679
  305   3HG2  ILE  41          2HG2      ILE  41 -19.239 -28.683  -2.539
  306   1HD1  ILE  41          3HD1      ILE  41 -16.605 -29.099  -3.194
  307   2HD1  ILE  41          2HD1      ILE  41 -16.730 -29.534  -1.490
  308   3HD1  ILE  41          1HD1      ILE  41 -15.491 -30.278  -2.501
  309    H    THR  42           H        THR  42 -18.785 -33.061  -2.310
  310    HA   THR  42           HA       THR  42 -21.628 -33.455  -1.463
  311    HB   THR  42           HB       THR  42 -21.335 -35.705  -1.363
  312    HG1  THR  42           HG1      THR  42 -18.662 -35.627  -0.579
  313   1HG2  THR  42          1HG2      THR  42 -20.217 -35.150  -3.540
  314   2HG2  THR  42          3HG2      THR  42 -18.668 -35.174  -2.697
  315   3HG2  THR  42          2HG2      THR  42 -19.633 -36.647  -2.813
  316    HA   PRO  43           HA       PRO  43 -20.442 -32.002   2.544
  317   1HB   PRO  43          2HB       PRO  43 -21.694 -33.721   4.220
  318   2HB   PRO  43          1HB       PRO  43 -22.557 -32.483   3.301
  319   1HG   PRO  43          2HG       PRO  43 -22.224 -35.402   2.703
  320   2HG   PRO  43          1HG       PRO  43 -23.678 -34.404   2.587
  321   1HD   PRO  43          1HD       PRO  43 -22.216 -35.035   0.410
  322   2HD   PRO  43          2HD       PRO  43 -23.037 -33.480   0.558
  323    H    ASP  44           H        ASP  44 -20.093 -35.465   1.943
  324    HA   ASP  44           HA       ASP  44 -18.315 -36.030   4.106
  325   1HB   ASP  44          2HB       ASP  44 -18.668 -37.357   1.405
  326   2HB   ASP  44          1HB       ASP  44 -17.656 -38.011   2.693
  327    H    GLU  45           H        GLU  45 -17.793 -34.492   0.993
  328    HA   GLU  45           HA       GLU  45 -14.886 -34.868   1.124
  329   1HB   GLU  45          2HB       GLU  45 -16.685 -33.228  -0.683
  330   2HB   GLU  45          1HB       GLU  45 -14.928 -33.255  -0.832
  331   1HG   GLU  45          2HG       GLU  45 -15.047 -35.750  -1.069
  332   2HG   GLU  45          1HG       GLU  45 -16.806 -35.624  -1.081
  333    H    VAL  46           H        VAL  46 -17.284 -32.377   1.796
  334    HA   VAL  46           HA       VAL  46 -15.387 -30.285   2.379
  335    HB   VAL  46           HB       VAL  46 -18.265 -30.701   3.231
  336   1HG1  VAL  46          2HG1      VAL  46 -16.251 -28.728   4.065
  337   2HG1  VAL  46          1HG1      VAL  46 -17.724 -28.000   3.423
  338   3HG1  VAL  46          3HG1      VAL  46 -17.813 -29.113   4.789
  339   1HG2  VAL  46          1HG2      VAL  46 -16.927 -29.720   0.849
  340   2HG2  VAL  46          3HG2      VAL  46 -18.641 -30.045   1.107
  341   3HG2  VAL  46          2HG2      VAL  46 -17.966 -28.477   1.547
  342    H    LYS  47           H        LYS  47 -16.943 -32.809   4.288
  343    HA   LYS  47           HA       LYS  47 -15.993 -31.883   6.849
  344   1HB   LYS  47          2HB       LYS  47 -17.822 -33.465   6.790
  345   2HB   LYS  47          1HB       LYS  47 -16.853 -34.623   5.879
  346   1HG   LYS  47          2HG       LYS  47 -15.310 -34.849   7.782
  347   2HG   LYS  47          1HG       LYS  47 -16.244 -33.662   8.692
  348   1HD   LYS  47          2HD       LYS  47 -17.049 -35.751   9.467
  349   2HD   LYS  47          1HD       LYS  47 -18.260 -35.230   8.296
  350   1HE   LYS  47          2HE       LYS  47 -17.529 -36.752   6.671
  351   2HE   LYS  47          1HE       LYS  47 -15.932 -36.913   7.402
  352   1HZ   LYS  47          2HZ       LYS  47 -16.980 -38.030   9.295
  353   2HZ   LYS  47          1HZ       LYS  47 -18.487 -37.939   8.516
  354   3HZ   LYS  47          3HZ       LYS  47 -17.239 -38.869   7.841
  355    H    HIS  48           H        HIS  48 -14.722 -34.102   4.405
  356    HA   HIS  48           HA       HIS  48 -12.449 -34.986   5.917
  357   1HB   HIS  48          2HB       HIS  48 -13.226 -36.145   3.877
  358   2HB   HIS  48          1HB       HIS  48 -12.780 -34.739   2.910
  359    HD1  HIS  48           HD1      HIS  48 -10.782 -35.591   1.628
  360    HD2  HIS  48           HD2      HIS  48 -10.496 -36.412   5.705
  361    HE1  HIS  48           HE1      HIS  48  -8.459 -36.525   2.010
  362    H    MET  49           H        MET  49 -12.966 -32.244   3.705
  363    HA   MET  49           HA       MET  49 -10.279 -31.342   3.577
  364   1HB   MET  49          2HB       MET  49 -12.957 -29.990   3.350
  365   2HB   MET  49          1HB       MET  49 -11.480 -29.032   3.338
  366   1HG   MET  49          2HG       MET  49 -10.670 -30.725   1.531
  367   2HG   MET  49          1HG       MET  49 -12.379 -31.132   1.375
  368   1HE   MET  49          3HE       MET  49 -12.097 -30.655  -0.978
  369   2HE   MET  49          2HE       MET  49 -13.678 -29.977  -0.599
  370   3HE   MET  49          1HE       MET  49 -12.581 -29.095  -1.659
  371    H    MET  50           H        MET  50 -12.864 -30.633   5.899
  372    HA   MET  50           HA       MET  50 -11.402 -28.785   7.500
  373   1HB   MET  50          2HB       MET  50 -13.718 -30.638   8.040
  374   2HB   MET  50          1HB       MET  50 -13.027 -29.651   9.325
  375   1HG   MET  50          2HG       MET  50 -13.314 -27.658   7.734
  376   2HG   MET  50          1HG       MET  50 -14.326 -28.724   6.759
  377   1HE   MET  50          2HE       MET  50 -13.516 -27.056   9.874
  378   2HE   MET  50          1HE       MET  50 -15.005 -26.828  10.787
  379   3HE   MET  50          3HE       MET  50 -14.115 -28.352  10.906
  380    H    ALA  51           H        ALA  51 -11.832 -32.302   7.812
  381    HA   ALA  51           HA       ALA  51 -10.238 -32.668  10.130
  382   1HB   ALA  51          3HB       ALA  51 -11.314 -34.634   9.602
  383   2HB   ALA  51          1HB       ALA  51  -9.766 -34.976   8.829
  384   3HB   ALA  51          2HB       ALA  51 -11.123 -34.392   7.865
  385    H    GLU  52           H        GLU  52  -9.362 -31.880   6.884
  386    HA   GLU  52           HA       GLU  52  -6.523 -32.623   7.361
  387   1HB   GLU  52          2HB       GLU  52  -8.121 -31.841   4.936
  388   2HB   GLU  52          1HB       GLU  52  -6.365 -31.681   4.918
  389   1HG   GLU  52          2HG       GLU  52  -6.261 -34.101   5.709
  390   2HG   GLU  52          1HG       GLU  52  -7.989 -34.196   5.367
  391    H    ILE  53           H        ILE  53  -8.611 -29.829   6.831
  392    HA   ILE  53           HA       ILE  53  -6.380 -27.938   6.909
  393    HB   ILE  53           HB       ILE  53  -9.375 -27.509   7.063
  394   1HG1  ILE  53          2HG1      ILE  53  -7.459 -27.223   4.735
  395   2HG1  ILE  53          1HG1      ILE  53  -8.539 -28.594   4.972
  396   1HG2  ILE  53          3HG2      ILE  53  -7.979 -25.660   7.995
  397   2HG2  ILE  53          2HG2      ILE  53  -7.143 -25.554   6.445
  398   3HG2  ILE  53          1HG2      ILE  53  -8.865 -25.187   6.546
  399   1HD1  ILE  53          2HD1      ILE  53 -10.214 -26.401   5.265
  400   2HD1  ILE  53          1HD1      ILE  53  -9.136 -25.919   3.954
  401   3HD1  ILE  53          3HD1      ILE  53 -10.076 -27.406   3.823
  402    H    ASP  54           H        ASP  54  -8.779 -29.227   9.140
  403    HA   ASP  54           HA       ASP  54  -8.484 -27.358  11.257
  404   1HB   ASP  54          2HB       ASP  54 -10.129 -29.379  10.894
  405   2HB   ASP  54          1HB       ASP  54  -8.890 -30.296  11.740
  406    H    THR  55           H        THR  55  -6.376 -26.816  11.791
  407    HA   THR  55           HA       THR  55  -4.212 -28.713  11.882
  408    HB   THR  55           HB       THR  55  -2.969 -26.866  12.998
  409    HG1  THR  55           HG1      THR  55  -4.010 -25.156  13.722
  410   1HG2  THR  55          2HG2      THR  55  -4.438 -26.657  10.450
  411   2HG2  THR  55          1HG2      THR  55  -3.839 -25.121  11.077
  412   3HG2  THR  55          3HG2      THR  55  -2.718 -26.449  10.779
  413    H    ASP  56           H        ASP  56  -6.144 -27.182  14.461
  414    HA   ASP  56           HA       ASP  56  -4.805 -28.866  16.472
  415   1HB   ASP  56          2HB       ASP  56  -5.906 -27.567  18.103
  416   2HB   ASP  56          1HB       ASP  56  -5.591 -26.419  16.803
  417    H    GLY  57           H        GLY  57  -7.963 -28.612  14.912
  418   1HA   GLY  57          1HA       GLY  57  -8.522 -31.383  15.841
  419   2HA   GLY  57          2HA       GLY  57  -9.285 -30.606  14.458
  420    H    ASP  58           H        ASP  58  -9.796 -28.096  16.054
  421    HA   ASP  58           HA       ASP  58 -11.570 -28.974  18.218
  422   1HB   ASP  58          2HB       ASP  58 -12.055 -26.643  18.556
  423   2HB   ASP  58          1HB       ASP  58 -10.330 -26.760  18.222
  424    H    GLY  59           H        GLY  59 -11.816 -29.009  14.906
  425   1HA   GLY  59          1HA       GLY  59 -14.781 -29.065  15.091
  426   2HA   GLY  59          2HA       GLY  59 -13.825 -29.829  13.823
  427    H    PHE  60           H        PHE  60 -12.558 -26.783  14.419
  428    HA   PHE  60           HA       PHE  60 -14.069 -25.695  12.091
  429   1HB   PHE  60          2HB       PHE  60 -13.263 -24.035  14.486
  430   2HB   PHE  60          1HB       PHE  60 -14.270 -23.543  13.125
  431    HD1  PHE  60           HD1      PHE  60 -16.535 -24.531  12.819
  432    HD2  PHE  60           HD2      PHE  60 -14.167 -25.295  16.316
  433    HE1  PHE  60           HE1      PHE  60 -18.552 -25.335  14.009
  434    HE2  PHE  60           HE2      PHE  60 -16.183 -26.098  17.509
  435    HZ   PHE  60           HZ       PHE  60 -18.380 -26.120  16.357
  436    H    ILE  61           H        ILE  61 -12.951 -24.051  10.887
  437    HA   ILE  61           HA       ILE  61  -9.993 -24.237  11.137
  438    HB   ILE  61           HB       ILE  61 -11.619 -23.378   8.730
  439   1HG1  ILE  61          2HG1      ILE  61 -12.165 -25.700   9.249
  440   2HG1  ILE  61          1HG1      ILE  61 -11.101 -25.655   7.844
  441   1HG2  ILE  61          3HG2      ILE  61  -9.251 -22.615   8.855
  442   2HG2  ILE  61          2HG2      ILE  61  -8.742 -24.296   9.010
  443   3HG2  ILE  61          1HG2      ILE  61  -9.522 -23.744   7.528
  444   1HD1  ILE  61          2HD1      ILE  61  -9.157 -26.014   9.422
  445   2HD1  ILE  61          1HD1      ILE  61 -10.335 -26.292  10.705
  446   3HD1  ILE  61          3HD1      ILE  61 -10.273 -27.379   9.315
  447    H    SER  62           H        SER  62  -8.935 -22.341  11.649
  448    HA   SER  62           HA       SER  62 -10.577 -19.871  11.802
  449   1HB   SER  62          2HB       SER  62  -7.814 -20.388  12.944
  450   2HB   SER  62          1HB       SER  62  -8.877 -19.030  13.315
  451    HG   SER  62           HG       SER  62  -8.773 -21.146  14.678
  452    H    PHE  63           H        PHE  63  -9.321 -17.820  11.189
  453    HA   PHE  63           HA       PHE  63  -8.535 -17.937   8.478
  454   1HB   PHE  63          2HB       PHE  63  -9.162 -15.827   9.641
  455   2HB   PHE  63          1HB       PHE  63  -7.640 -15.892  10.533
  456    HD1  PHE  63           HD1      PHE  63  -8.705 -16.428   6.977
  457    HD2  PHE  63           HD2      PHE  63  -5.997 -14.479   9.679
  458    HE1  PHE  63           HE1      PHE  63  -7.537 -15.388   5.054
  459    HE2  PHE  63           HE2      PHE  63  -4.825 -13.442   7.757
  460    HZ   PHE  63           HZ       PHE  63  -5.600 -13.894   5.442
  461    H    GLN  64           H        GLN  64  -6.564 -17.937  11.428
  462    HA   GLN  64           HA       GLN  64  -4.012 -17.981  10.196
  463   1HB   GLN  64          2HB       GLN  64  -4.513 -17.702  12.661
  464   2HB   GLN  64          1HB       GLN  64  -4.800 -19.440  12.733
  465   1HG   GLN  64          2HG       GLN  64  -2.229 -18.259  11.657
  466   2HG   GLN  64          1HG       GLN  64  -2.441 -18.675  13.357
  467   1HE2  GLN  64          1HE2      GLN  64  -0.883 -19.927  10.884
  468   2HE2  GLN  64          2HE2      GLN  64  -1.227 -21.582  11.045
  469    H    GLU  65           H        GLU  65  -6.141 -20.689  11.170
  470    HA   GLU  65           HA       GLU  65  -4.421 -22.778  10.270
  471   1HB   GLU  65          2HB       GLU  65  -7.410 -22.584  10.647
  472   2HB   GLU  65          1HB       GLU  65  -6.637 -24.065  10.096
  473   1HG   GLU  65          2HG       GLU  65  -5.207 -24.061  12.120
  474   2HG   GLU  65          1HG       GLU  65  -6.020 -22.599  12.677
  475    H    PHE  66           H        PHE  66  -7.099 -21.076   8.660
  476    HA   PHE  66           HA       PHE  66  -6.973 -22.487   6.192
  477   1HB   PHE  66          2HB       PHE  66  -8.821 -20.947   6.843
  478   2HB   PHE  66          1HB       PHE  66  -7.724 -19.582   6.634
  479    HD1  PHE  66           HD1      PHE  66  -6.951 -18.907   4.415
  480    HD2  PHE  66           HD2      PHE  66  -9.629 -22.227   4.923
  481    HE1  PHE  66           HE1      PHE  66  -7.446 -18.880   1.985
  482    HE2  PHE  66           HE2      PHE  66 -10.124 -22.200   2.493
  483    HZ   PHE  66           HZ       PHE  66  -9.033 -20.526   1.024
  484    H    THR  67           H        THR  67  -5.192 -19.675   7.384
  485    HA   THR  67           HA       THR  67  -3.870 -19.058   4.910
  486    HB   THR  67           HB       THR  67  -3.161 -18.524   7.805
  487    HG1  THR  67           HG1      THR  67  -3.572 -16.332   6.847
  488   1HG2  THR  67          2HG2      THR  67  -1.716 -17.700   5.275
  489   2HG2  THR  67          1HG2      THR  67  -1.474 -16.913   6.835
  490   3HG2  THR  67          3HG2      THR  67  -1.058 -18.615   6.632
  491    H    ASP  68           H        ASP  68  -2.872 -21.013   7.731
  492    HA   ASP  68           HA       ASP  68  -0.337 -21.800   6.718
  493   1HB   ASP  68          2HB       ASP  68  -1.230 -22.168   9.070
  494   2HB   ASP  68          1HB       ASP  68  -2.149 -23.527   8.421
  495    H    PHE  69           H        PHE  69  -3.560 -23.222   6.281
  496    HA   PHE  69           HA       PHE  69  -2.560 -25.440   4.689
  497   1HB   PHE  69          2HB       PHE  69  -4.577 -26.076   5.574
  498   2HB   PHE  69          1HB       PHE  69  -5.187 -24.425   5.627
  499    HD1  PHE  69           HD1      PHE  69  -5.857 -23.320   3.429
  500    HD2  PHE  69           HD2      PHE  69  -5.226 -27.542   3.843
  501    HE1  PHE  69           HE1      PHE  69  -7.153 -23.716   1.349
  502    HE2  PHE  69           HE2      PHE  69  -6.517 -27.944   1.768
  503    HZ   PHE  69           HZ       PHE  69  -7.485 -26.031   0.517
  504    H    GLY  70           H        GLY  70  -3.933 -22.247   4.050
  505   1HA   GLY  70          1HA       GLY  70  -3.973 -20.978   2.075
  506   2HA   GLY  70          2HA       GLY  70  -4.283 -22.500   1.240
  507    H    ARG  71           H        ARG  71  -1.409 -21.914   3.187
  508    HA   ARG  71           HA       ARG  71   0.296 -21.161   0.975
  509   1HB   ARG  71          2HB       ARG  71   0.957 -22.298   3.708
  510   2HB   ARG  71          1HB       ARG  71   2.149 -21.657   2.577
  511   1HG   ARG  71          2HG       ARG  71   0.961 -19.474   2.601
  512   2HG   ARG  71          1HG       ARG  71  -0.171 -20.121   3.787
  513   1HD   ARG  71          2HD       ARG  71   2.831 -19.884   4.163
  514   2HD   ARG  71          1HD       ARG  71   1.620 -18.827   4.891
  515    HE   ARG  71           HE       ARG  71   1.238 -21.668   5.494
  516   1HH1  ARG  71          1HH1      ARG  71   0.736 -18.982   7.069
  517   2HH1  ARG  71          2HH1      ARG  71   1.787 -19.250   8.419
  518   1HH2  ARG  71          1HH2      ARG  71   3.459 -21.898   6.931
  519   2HH2  ARG  71          2HH2      ARG  71   3.329 -20.901   8.341
  520    H    ALA  72           H        ALA  72  -0.679 -24.207   2.424
  521    HA   ALA  72           HA       ALA  72   1.335 -25.820   1.113
  522   1HB   ALA  72          3HB       ALA  72   0.484 -27.294   2.587
  523   2HB   ALA  72          1HB       ALA  72  -0.960 -27.407   1.580
  524   3HB   ALA  72          2HB       ALA  72  -0.894 -26.239   2.899
  525    H    ASN  73           H        ASN  73  -1.637 -24.377   0.088
  526    HA   ASN  73           HA       ASN  73  -1.254 -25.566  -2.591
  527   1HB   ASN  73          2HB       ASN  73  -4.037 -25.609  -1.471
  528   2HB   ASN  73          1HB       ASN  73  -3.336 -26.594  -2.754
  529   1HD2  ASN  73          1HD2      ASN  73  -4.185 -26.609   0.545
  530   2HD2  ASN  73          2HD2      ASN  73  -3.307 -27.983   1.014
  531    H    ARG  74           H        ARG  74  -0.668 -23.006  -2.111
  532    HA   ARG  74           HA       ARG  74  -2.689 -21.058  -2.080
  533   1HB   ARG  74          2HB       ARG  74  -0.100 -21.044  -3.664
  534   2HB   ARG  74          1HB       ARG  74  -1.099 -19.623  -3.356
  535   1HG   ARG  74          2HG       ARG  74  -0.779 -19.873  -0.949
  536   2HG   ARG  74          1HG       ARG  74   0.120 -21.370  -1.196
  537   1HD   ARG  74          2HD       ARG  74   1.810 -20.091  -2.515
  538   2HD   ARG  74          1HD       ARG  74   0.936 -18.605  -2.142
  539    HE   ARG  74           HE       ARG  74   1.376 -19.430   0.345
  540   1HH1  ARG  74          1HH1      ARG  74   3.410 -18.789  -2.297
  541   2HH1  ARG  74          2HH1      ARG  74   4.881 -19.143  -1.453
  542   1HH2  ARG  74          1HH2      ARG  74   3.279 -20.284   1.402
  543   2HH2  ARG  74          2HH2      ARG  74   4.806 -19.989   0.641
  544    H    GLY  75           H        GLY  75  -1.393 -22.897  -4.811
  545   1HA   GLY  75          1HA       GLY  75  -2.315 -23.349  -6.905
  546   2HA   GLY  75          2HA       GLY  75  -2.843 -21.667  -6.898
  547    H    LEU  76           H        LEU  76  -3.938 -23.692  -4.317
  548    HA   LEU  76           HA       LEU  76  -6.394 -24.546  -5.653
  549   1HB   LEU  76          2HB       LEU  76  -5.466 -24.627  -2.773
  550   2HB   LEU  76          1HB       LEU  76  -7.055 -25.199  -3.278
  551    HG   LEU  76           HG       LEU  76  -4.376 -26.224  -4.263
  552   1HD1  LEU  76          3HD1      LEU  76  -5.710 -26.858  -1.953
  553   2HD1  LEU  76          2HD1      LEU  76  -6.380 -28.041  -3.078
  554   3HD1  LEU  76          1HD1      LEU  76  -4.638 -27.963  -2.814
  555   1HD2  LEU  76          1HD2      LEU  76  -7.059 -26.326  -5.409
  556   2HD2  LEU  76          3HD2      LEU  76  -5.518 -26.798  -6.126
  557   3HD2  LEU  76          2HD2      LEU  76  -6.405 -27.937  -5.112
  558    H    LEU  77           H        LEU  77  -5.508 -22.100  -3.240
  559    HA   LEU  77           HA       LEU  77  -8.131 -21.087  -2.796
  560   1HB   LEU  77          2HB       LEU  77  -5.500 -19.584  -2.696
  561   2HB   LEU  77          1HB       LEU  77  -7.012 -19.072  -1.945
  562    HG   LEU  77           HG       LEU  77  -5.315 -21.480  -1.251
  563   1HD1  LEU  77          3HD1      LEU  77  -6.079 -18.890   0.033
  564   2HD1  LEU  77          2HD1      LEU  77  -5.857 -20.295   1.076
  565   3HD1  LEU  77          1HD1      LEU  77  -4.533 -19.737   0.053
  566   1HD2  LEU  77          1HD2      LEU  77  -8.199 -20.862  -0.616
  567   2HD2  LEU  77          3HD2      LEU  77  -7.500 -22.378  -1.183
  568   3HD2  LEU  77          2HD2      LEU  77  -7.218 -21.842   0.474
  569    H    LYS  78           H        LYS  78  -5.729 -20.350  -5.290
  570    HA   LYS  78           HA       LYS  78  -7.003 -18.051  -6.381
  571   1HB   LYS  78          2HB       LYS  78  -5.397 -20.190  -7.816
  572   2HB   LYS  78          1HB       LYS  78  -5.754 -18.582  -8.444
  573   1HG   LYS  78          2HG       LYS  78  -4.653 -17.701  -6.278
  574   2HG   LYS  78          1HG       LYS  78  -4.011 -19.334  -6.097
  575   1HD   LYS  78          2HD       LYS  78  -3.618 -17.542  -8.514
  576   2HD   LYS  78          1HD       LYS  78  -2.403 -17.882  -7.282
  577   1HE   LYS  78          2HE       LYS  78  -3.596 -20.320  -8.374
  578   2HE   LYS  78          1HE       LYS  78  -2.806 -19.345  -9.613
  579   1HZ   LYS  78          2HZ       LYS  78  -1.426 -19.774  -7.061
  580   2HZ   LYS  78          1HZ       LYS  78  -1.453 -21.042  -8.191
  581   3HZ   LYS  78          3HZ       LYS  78  -0.779 -19.545  -8.615
  582    H    ASP  79           H        ASP  79  -7.744 -21.459  -6.627
  583    HA   ASP  79           HA       ASP  79  -9.502 -21.173  -8.931
  584   1HB   ASP  79          2HB       ASP  79  -8.420 -23.336  -8.326
  585   2HB   ASP  79          1HB       ASP  79  -9.393 -23.382  -6.855
  586    H    VAL  80           H        VAL  80  -9.891 -21.223  -5.417
  587    HA   VAL  80           HA       VAL  80 -12.801 -21.076  -5.558
  588    HB   VAL  80           HB       VAL  80 -11.025 -20.410  -3.197
  589   1HG1  VAL  80          2HG1      VAL  80 -13.673 -20.045  -3.422
  590   2HG1  VAL  80          1HG1      VAL  80 -13.679 -21.756  -2.995
  591   3HG1  VAL  80          3HG1      VAL  80 -12.930 -20.580  -1.915
  592   1HG2  VAL  80          3HG2      VAL  80 -11.791 -23.026  -4.439
  593   2HG2  VAL  80          2HG2      VAL  80 -10.283 -22.560  -3.652
  594   3HG2  VAL  80          1HG2      VAL  80 -11.709 -22.924  -2.680
  595    H    ALA  81           H        ALA  81 -10.132 -18.800  -5.312
  596    HA   ALA  81           HA       ALA  81 -11.636 -16.507  -4.509
  597   1HB   ALA  81          3HB       ALA  81  -9.391 -16.038  -4.384
  598   2HB   ALA  81          1HB       ALA  81  -9.695 -15.380  -5.992
  599   3HB   ALA  81          2HB       ALA  81  -9.005 -16.994  -5.815
  600    H    LYS  82           H        LYS  82 -11.649 -18.286  -7.430
  601    HA   LYS  82           HA       LYS  82 -12.681 -15.980  -8.993
  602   1HB   LYS  82          2HB       LYS  82 -12.064 -18.840  -9.801
  603   2HB   LYS  82          1HB       LYS  82 -12.637 -17.586 -10.901
  604   1HG   LYS  82          2HG       LYS  82 -10.609 -16.210 -10.034
  605   2HG   LYS  82          1HG       LYS  82  -9.998 -17.759  -9.453
  606   1HD   LYS  82          2HD       LYS  82 -10.278 -18.675 -11.770
  607   2HD   LYS  82          1HD       LYS  82 -10.728 -17.058 -12.312
  608   1HE   LYS  82          2HE       LYS  82  -8.538 -16.599 -12.572
  609   2HE   LYS  82          1HE       LYS  82  -8.347 -16.742 -10.824
  610   1HZ   LYS  82          2HZ       LYS  82  -8.370 -19.133 -12.555
  611   2HZ   LYS  82          1HZ       LYS  82  -6.942 -18.244 -12.314
  612   3HZ   LYS  82          3HZ       LYS  82  -7.729 -18.956 -10.991
  613    H    ILE  83           H        ILE  83 -13.680 -19.009  -7.528
  614    HA   ILE  83           HA       ILE  83 -16.231 -19.292  -8.738
  615    HB   ILE  83           HB       ILE  83 -15.409 -19.964  -5.897
  616   1HG1  ILE  83          2HG1      ILE  83 -15.305 -21.559  -8.474
  617   2HG1  ILE  83          1HG1      ILE  83 -13.927 -21.018  -7.518
  618   1HG2  ILE  83          2HG2      ILE  83 -17.809 -20.560  -7.584
  619   2HG2  ILE  83          1HG2      ILE  83 -17.238 -21.801  -6.470
  620   3HG2  ILE  83          3HG2      ILE  83 -17.713 -20.217  -5.857
  621   1HD1  ILE  83          3HD1      ILE  83 -15.406 -22.349  -5.632
  622   2HD1  ILE  83          2HD1      ILE  83 -15.741 -23.303  -7.078
  623   3HD1  ILE  83          1HD1      ILE  83 -14.077 -23.068  -6.542
  624    H    PHE  84           H        PHE  84 -15.170 -17.362  -5.970
  625    HA   PHE  84           HA       PHE  84 -17.908 -16.345  -5.541
  626   1HB   PHE  84          2HB       PHE  84 -15.269 -15.704  -4.189
  627   2HB   PHE  84          1HB       PHE  84 -16.823 -15.014  -3.718
  628    HD1  PHE  84           HD1      PHE  84 -14.859 -18.150  -3.963
  629    HD2  PHE  84           HD2      PHE  84 -18.460 -16.306  -2.516
  630    HE1  PHE  84           HE1      PHE  84 -15.345 -20.164  -2.599
  631    HE2  PHE  84           HE2      PHE  84 -18.944 -18.320  -1.153
  632    HZ   PHE  84           HZ       PHE  84 -17.386 -20.250  -1.194

  No H/Q in entry =         632
  Start of MODEL    2
    1    H1   ALA   1          1H        ALA   1   9.163 -13.815   5.446
    2    H2   ALA   1          3H        ALA   1   8.844 -15.201   6.371
    3    H3   ALA   1          2H        ALA   1  10.243 -15.127   5.410
    4    HA   ALA   1           HA       ALA   1   8.905 -16.408   4.089
    5   1HB   ALA   1          2HB       ALA   1   6.407 -14.988   4.074
    6   2HB   ALA   1          1HB       ALA   1   6.727 -16.636   4.611
    7   3HB   ALA   1          3HB       ALA   1   6.879 -15.293   5.745
    8    H    ASP   2           H        ASP   2   8.715 -16.052   1.865
    9    HA   ASP   2           HA       ASP   2   9.469 -13.389   0.926
   10   1HB   ASP   2          2HB       ASP   2   8.900 -16.014  -0.464
   11   2HB   ASP   2          1HB       ASP   2   9.259 -14.535  -1.355
   12    H    ASP   3           H        ASP   3   6.528 -15.172   1.333
   13    HA   ASP   3           HA       ASP   3   4.847 -14.094  -0.633
   14   1HB   ASP   3          2HB       ASP   3   3.007 -14.380   1.013
   15   2HB   ASP   3          1HB       ASP   3   4.080 -15.779   0.977
   16    H    HIS   4           H        HIS   4   2.991 -12.419   0.099
   17    HA   HIS   4           HA       HIS   4   4.293 -10.083   1.421
   18   1HB   HIS   4          2HB       HIS   4   2.966  -8.738  -0.420
   19   2HB   HIS   4          1HB       HIS   4   4.550  -9.409  -0.797
   20    HD1  HIS   4           HD1      HIS   4   4.124  -9.862  -3.277
   21    HD2  HIS   4           HD2      HIS   4   1.300 -11.657  -0.790
   22    HE1  HIS   4           HE1      HIS   4   2.765 -11.420  -4.742
   23    HA   PRO   5           HA       PRO   5   0.424  -9.452   3.492
   24   1HB   PRO   5          2HB       PRO   5   0.018  -6.782   3.281
   25   2HB   PRO   5          1HB       PRO   5   1.232  -7.487   4.353
   26   1HG   PRO   5          2HG       PRO   5   1.571  -6.315   1.612
   27   2HG   PRO   5          1HG       PRO   5   2.560  -6.063   3.056
   28   1HD   PRO   5          1HD       PRO   5   3.330  -7.761   1.123
   29   2HD   PRO   5          2HD       PRO   5   3.647  -8.106   2.823
   30    H    GLN   6           H        GLN   6   0.770  -8.352   0.211
   31    HA   GLN   6           HA       GLN   6  -1.904  -7.574  -0.355
   32   1HB   GLN   6          2HB       GLN   6   0.407  -8.602  -1.956
   33   2HB   GLN   6          1HB       GLN   6  -1.182  -8.551  -2.720
   34   1HG   GLN   6          2HG       GLN   6  -1.376  -6.193  -2.384
   35   2HG   GLN   6          1HG       GLN   6  -0.007  -6.169  -1.274
   36   1HE2  GLN   6          1HE2      GLN   6   2.101  -7.201  -2.432
   37   2HE2  GLN   6          2HE2      GLN   6   2.397  -6.610  -3.995
   38    H    ASP   7           H        ASP   7  -0.308 -10.742  -0.596
   39    HA   ASP   7           HA       ASP   7  -2.506 -12.218  -1.591
   40   1HB   ASP   7          2HB       ASP   7  -0.166 -12.957   0.159
   41   2HB   ASP   7          1HB       ASP   7  -1.393 -14.151  -0.264
   42    H    LYS   8           H        LYS   8  -1.511 -11.797   1.808
   43    HA   LYS   8           HA       LYS   8  -3.517 -13.152   3.127
   44   1HB   LYS   8          2HB       LYS   8  -2.129 -10.561   3.733
   45   2HB   LYS   8          1HB       LYS   8  -3.420 -11.127   4.793
   46   1HG   LYS   8          2HG       LYS   8  -2.197 -13.352   4.895
   47   2HG   LYS   8          1HG       LYS   8  -0.845 -12.554   4.093
   48   1HD   LYS   8          2HD       LYS   8  -0.279 -12.262   6.338
   49   2HD   LYS   8          1HD       LYS   8  -1.148 -10.765   6.002
   50   1HE   LYS   8          2HE       LYS   8  -3.235 -11.830   6.866
   51   2HE   LYS   8          1HE       LYS   8  -2.294 -13.261   7.292
   52   1HZ   LYS   8          3HZ       LYS   8  -1.423 -10.624   8.252
   53   2HZ   LYS   8          2HZ       LYS   8  -2.706 -11.408   9.040
   54   3HZ   LYS   8          1HZ       LYS   8  -1.183 -12.153   8.943
   55    H    ALA   9           H        ALA   9  -3.802 -10.009   1.531
   56    HA   ALA   9           HA       ALA   9  -6.396  -9.328   2.468
   57   1HB   ALA   9          3HB       ALA   9  -4.575  -8.199   0.716
   58   2HB   ALA   9          1HB       ALA   9  -6.198  -7.581   1.030
   59   3HB   ALA   9          2HB       ALA   9  -5.910  -8.645  -0.347
   60    H    GLU  10           H        GLU  10  -5.383 -11.167  -0.398
   61    HA   GLU  10           HA       GLU  10  -8.072 -11.758  -1.257
   62   1HB   GLU  10          2HB       GLU  10  -5.605 -13.425  -1.811
   63   2HB   GLU  10          1HB       GLU  10  -7.065 -13.306  -2.794
   64   1HG   GLU  10          2HG       GLU  10  -6.537 -10.820  -3.037
   65   2HG   GLU  10          1HG       GLU  10  -4.958 -11.182  -2.338
   66    H    ARG  11           H        ARG  11  -5.731 -13.413   0.812
   67    HA   ARG  11           HA       ARG  11  -7.290 -15.807   1.165
   68   1HB   ARG  11          2HB       ARG  11  -5.086 -14.519   2.787
   69   2HB   ARG  11          1HB       ARG  11  -5.824 -16.055   3.240
   70   1HG   ARG  11          2HG       ARG  11  -5.257 -16.902   0.931
   71   2HG   ARG  11          1HG       ARG  11  -4.345 -15.419   0.671
   72   1HD   ARG  11          2HD       ARG  11  -3.797 -17.663   2.605
   73   2HD   ARG  11          1HD       ARG  11  -2.705 -16.923   1.436
   74    HE   ARG  11           HE       ARG  11  -3.676 -15.298   3.728
   75   1HH1  ARG  11          1HH1      ARG  11  -1.269 -15.748   1.441
   76   2HH1  ARG  11          2HH1      ARG  11   0.057 -15.473   2.521
   77   1HH2  ARG  11          1HH2      ARG  11  -1.923 -15.413   5.365
   78   2HH2  ARG  11          2HH2      ARG  11  -0.313 -15.283   4.741
   79    H    GLU  12           H        GLU  12  -7.059 -12.758   2.944
   80    HA   GLU  12           HA       GLU  12  -8.793 -13.540   5.101
   81   1HB   GLU  12          2HB       GLU  12  -7.704 -10.971   4.043
   82   2HB   GLU  12          1HB       GLU  12  -9.117 -10.882   5.092
   83   1HG   GLU  12          2HG       GLU  12  -7.753 -12.508   6.628
   84   2HG   GLU  12          1HG       GLU  12  -6.364 -11.924   5.712
   85    H    ARG  13           H        ARG  13  -9.359 -11.901   2.004
   86    HA   ARG  13           HA       ARG  13 -12.158 -11.432   2.444
   87   1HB   ARG  13          2HB       ARG  13 -10.618 -11.768  -0.147
   88   2HB   ARG  13          1HB       ARG  13 -12.263 -11.142  -0.023
   89   1HG   ARG  13          2HG       ARG  13 -11.527  -9.237   1.243
   90   2HG   ARG  13          1HG       ARG  13  -9.913  -9.917   1.442
   91   1HD   ARG  13          2HD       ARG  13  -9.529  -8.466  -0.329
   92   2HD   ARG  13          1HD       ARG  13  -9.958  -9.931  -1.213
   93    HE   ARG  13           HE       ARG  13 -11.660  -7.531  -0.908
   94   1HH1  ARG  13          1HH1      ARG  13 -10.817  -9.294  -3.376
   95   2HH1  ARG  13          2HH1      ARG  13 -12.363  -9.951  -3.796
   96   1HH2  ARG  13          1HH2      ARG  13 -13.862  -9.026  -0.808
   97   2HH2  ARG  13          2HH2      ARG  13 -14.088  -9.799  -2.342
   98    H    ILE  14           H        ILE  14 -10.364 -14.103   0.943
   99    HA   ILE  14           HA       ILE  14 -12.734 -15.570   0.175
  100    HB   ILE  14           HB       ILE  14  -9.932 -16.605   0.714
  101   1HG1  ILE  14          2HG1      ILE  14 -11.089 -15.944  -1.985
  102   2HG1  ILE  14          1HG1      ILE  14 -10.315 -14.691  -1.019
  103   1HG2  ILE  14          3HG2      ILE  14 -12.446 -17.790  -0.311
  104   2HG2  ILE  14          2HG2      ILE  14 -11.003 -18.151  -1.259
  105   3HG2  ILE  14          1HG2      ILE  14 -11.062 -18.574   0.452
  106   1HD1  ILE  14          3HD1      ILE  14  -8.682 -17.068  -1.007
  107   2HD1  ILE  14          2HD1      ILE  14  -9.052 -16.613  -2.670
  108   3HD1  ILE  14          1HD1      ILE  14  -8.275 -15.455  -1.592
  109    H    PHE  15           H        PHE  15 -10.511 -15.761   2.966
  110    HA   PHE  15           HA       PHE  15 -11.877 -17.925   4.251
  111   1HB   PHE  15          2HB       PHE  15  -9.611 -17.203   4.929
  112   2HB   PHE  15          1HB       PHE  15 -10.275 -15.676   5.521
  113    HD1  PHE  15           HD1      PHE  15 -10.143 -19.334   6.039
  114    HD2  PHE  15           HD2      PHE  15 -11.595 -15.593   7.571
  115    HE1  PHE  15           HE1      PHE  15 -10.733 -20.441   8.179
  116    HE2  PHE  15           HE2      PHE  15 -12.189 -16.702   9.712
  117    HZ   PHE  15           HZ       PHE  15 -11.760 -19.129  10.015
  118    H    LYS  16           H        LYS  16 -12.342 -14.426   4.298
  119    HA   LYS  16           HA       LYS  16 -14.279 -14.372   6.416
  120   1HB   LYS  16          2HB       LYS  16 -13.583 -12.536   4.138
  121   2HB   LYS  16          1HB       LYS  16 -15.027 -12.225   5.100
  122   1HG   LYS  16          2HG       LYS  16 -13.556 -12.379   7.162
  123   2HG   LYS  16          1HG       LYS  16 -12.165 -12.401   6.078
  124   1HD   LYS  16          2HD       LYS  16 -13.099 -10.250   5.061
  125   2HD   LYS  16          1HD       LYS  16 -14.211 -10.198   6.429
  126   1HE   LYS  16          2HE       LYS  16 -11.596 -10.717   7.452
  127   2HE   LYS  16          1HE       LYS  16 -11.477  -9.354   6.338
  128   1HZ   LYS  16          3HZ       LYS  16 -13.585  -8.552   7.570
  129   2HZ   LYS  16          2HZ       LYS  16 -13.074  -9.610   8.797
  130   3HZ   LYS  16          1HZ       LYS  16 -12.068  -8.335   8.296
  131    H    ARG  17           H        ARG  17 -14.476 -15.086   2.983
  132    HA   ARG  17           HA       ARG  17 -17.345 -14.920   2.767
  133   1HB   ARG  17          2HB       ARG  17 -15.235 -16.378   1.164
  134   2HB   ARG  17          1HB       ARG  17 -16.950 -16.437   0.750
  135   1HG   ARG  17          2HG       ARG  17 -16.927 -13.904   0.747
  136   2HG   ARG  17          1HG       ARG  17 -15.173 -13.990   0.885
  137   1HD   ARG  17          2HD       ARG  17 -15.271 -15.534  -1.181
  138   2HD   ARG  17          1HD       ARG  17 -16.920 -14.941  -1.384
  139    HE   ARG  17           HE       ARG  17 -15.861 -12.614  -1.447
  140   1HH1  ARG  17          1HH1      ARG  17 -13.079 -13.776  -0.889
  141   2HH1  ARG  17          2HH1      ARG  17 -12.385 -13.738  -2.476
  142   1HH2  ARG  17          1HH2      ARG  17 -15.428 -13.298  -4.082
  143   2HH2  ARG  17          2HH2      ARG  17 -13.716 -13.467  -4.284
  144    H    PHE  18           H        PHE  18 -15.083 -17.494   3.634
  145    HA   PHE  18           HA       PHE  18 -17.051 -19.598   3.706
  146   1HB   PHE  18          2HB       PHE  18 -14.317 -19.270   4.942
  147   2HB   PHE  18          1HB       PHE  18 -15.298 -20.710   5.220
  148    HD1  PHE  18           HD1      PHE  18 -16.083 -22.069   3.229
  149    HD2  PHE  18           HD2      PHE  18 -13.141 -18.957   2.901
  150    HE1  PHE  18           HE1      PHE  18 -15.361 -22.984   1.039
  151    HE2  PHE  18           HE2      PHE  18 -12.418 -19.872   0.712
  152    HZ   PHE  18           HZ       PHE  18 -13.528 -21.885  -0.219
  153    H    ASP  19           H        ASP  19 -15.576 -17.635   6.299
  154    HA   ASP  19           HA       ASP  19 -17.078 -18.712   8.442
  155   1HB   ASP  19          2HB       ASP  19 -15.137 -16.931   8.420
  156   2HB   ASP  19          1HB       ASP  19 -16.466 -15.769   8.355
  157    H    ALA  20           H        ALA  20 -19.268 -18.991   8.176
  158    HA   ALA  20           HA       ALA  20 -20.949 -17.164   6.729
  159   1HB   ALA  20          2HB       ALA  20 -21.237 -19.721   7.513
  160   2HB   ALA  20          1HB       ALA  20 -22.167 -18.929   8.785
  161   3HB   ALA  20          3HB       ALA  20 -22.609 -18.695   7.093
  162    H    ASN  21           H        ASN  21 -20.635 -17.744  10.277
  163    HA   ASN  21           HA       ASN  21 -22.336 -15.384  10.744
  164   1HB   ASN  21          2HB       ASN  21 -22.183 -15.954  13.108
  165   2HB   ASN  21          1HB       ASN  21 -22.562 -17.402  12.181
  166   1HD2  ASN  21          1HD2      ASN  21 -21.280 -17.299  14.813
  167   2HD2  ASN  21          2HD2      ASN  21 -19.754 -18.015  14.641
  168    H    GLY  22           H        GLY  22 -18.943 -16.253  10.871
  169   1HA   GLY  22          1HA       GLY  22 -18.314 -13.372  11.170
  170   2HA   GLY  22          2HA       GLY  22 -17.185 -14.617  10.642
  171    H    ASP  23           H        ASP  23 -17.763 -16.450  12.829
  172    HA   ASP  23           HA       ASP  23 -17.036 -14.904  15.245
  173   1HB   ASP  23          2HB       ASP  23 -17.271 -17.031  16.452
  174   2HB   ASP  23          1HB       ASP  23 -18.701 -16.718  15.472
  175    H    GLY  24           H        GLY  24 -15.374 -15.965  12.663
  176   1HA   GLY  24          1HA       GLY  24 -12.877 -16.159  14.239
  177   2HA   GLY  24          2HA       GLY  24 -12.981 -15.863  12.506
  178    H    LYS  25           H        LYS  25 -15.064 -18.385  13.298
  179    HA   LYS  25           HA       LYS  25 -12.988 -20.355  12.461
  180   1HB   LYS  25          2HB       LYS  25 -13.954 -22.002  14.008
  181   2HB   LYS  25          1HB       LYS  25 -13.419 -20.574  14.891
  182   1HG   LYS  25          2HG       LYS  25 -15.617 -19.798  15.206
  183   2HG   LYS  25          1HG       LYS  25 -16.256 -20.802  13.902
  184   1HD   LYS  25          2HD       LYS  25 -15.407 -22.793  15.393
  185   2HD   LYS  25          1HD       LYS  25 -15.458 -21.598  16.690
  186   1HE   LYS  25          2HE       LYS  25 -17.591 -22.976  16.340
  187   2HE   LYS  25          1HE       LYS  25 -17.795 -21.225  16.392
  188   1HZ   LYS  25          3HZ       LYS  25 -17.304 -22.521  13.806
  189   2HZ   LYS  25          2HZ       LYS  25 -18.857 -22.622  14.488
  190   3HZ   LYS  25          1HZ       LYS  25 -18.169 -21.105  14.155
  191    H    ILE  26           H        ILE  26 -13.685 -21.934  11.043
  192    HA   ILE  26           HA       ILE  26 -16.462 -21.599   9.989
  193    HB   ILE  26           HB       ILE  26 -14.203 -22.909   8.490
  194   1HG1  ILE  26          2HG1      ILE  26 -14.857 -19.949   8.607
  195   2HG1  ILE  26          1HG1      ILE  26 -13.377 -20.706   9.196
  196   1HG2  ILE  26          3HG2      ILE  26 -16.689 -21.383   7.650
  197   2HG2  ILE  26          2HG2      ILE  26 -15.533 -22.140   6.555
  198   3HG2  ILE  26          1HG2      ILE  26 -16.508 -23.137   7.634
  199   1HD1  ILE  26          3HD1      ILE  26 -14.039 -21.399   6.417
  200   2HD1  ILE  26          2HD1      ILE  26 -13.720 -19.682   6.663
  201   3HD1  ILE  26          1HD1      ILE  26 -12.503 -20.878   7.108
  202    H    SER  27           H        SER  27 -17.792 -23.342  10.050
  203    HA   SER  27           HA       SER  27 -16.672 -25.905  11.080
  204   1HB   SER  27          2HB       SER  27 -18.744 -26.319  12.083
  205   2HB   SER  27          1HB       SER  27 -18.624 -24.564  12.226
  206    HG   SER  27           HG       SER  27 -19.862 -24.393  10.330
  207    H    ALA  28           H        ALA  28 -17.820 -27.899  10.166
  208    HA   ALA  28           HA       ALA  28 -17.516 -28.093   7.395
  209   1HB   ALA  28          1HB       ALA  28 -19.071 -29.660   9.418
  210   2HB   ALA  28          2HB       ALA  28 -17.742 -30.182   8.381
  211   3HB   ALA  28          3HB       ALA  28 -19.361 -29.987   7.709
  212    H    ALA  29           H        ALA  29 -20.488 -27.386   9.223
  213    HA   ALA  29           HA       ALA  29 -22.242 -27.191   7.019
  214   1HB   ALA  29          3HB       ALA  29 -22.508 -26.847   9.715
  215   2HB   ALA  29          1HB       ALA  29 -23.751 -26.413   8.542
  216   3HB   ALA  29          2HB       ALA  29 -22.643 -25.182   9.148
  217    H    GLU  30           H        GLU  30 -20.074 -24.760   8.434
  218    HA   GLU  30           HA       GLU  30 -20.929 -22.683   6.597
  219   1HB   GLU  30          2HB       GLU  30 -18.467 -22.922   8.350
  220   2HB   GLU  30          1HB       GLU  30 -18.910 -21.473   7.448
  221   1HG   GLU  30          2HG       GLU  30 -21.068 -21.390   8.667
  222   2HG   GLU  30          1HG       GLU  30 -20.591 -22.816   9.588
  223    H    LEU  31           H        LEU  31 -17.918 -24.604   6.849
  224    HA   LEU  31           HA       LEU  31 -16.813 -23.703   4.387
  225   1HB   LEU  31          2HB       LEU  31 -15.641 -25.034   6.225
  226   2HB   LEU  31          1HB       LEU  31 -16.428 -26.467   5.566
  227    HG   LEU  31           HG       LEU  31 -14.837 -24.621   3.789
  228   1HD1  LEU  31          1HD1      LEU  31 -13.649 -25.716   5.950
  229   2HD1  LEU  31          3HD1      LEU  31 -13.559 -27.092   4.850
  230   3HD1  LEU  31          2HD1      LEU  31 -12.826 -25.552   4.398
  231   1HD2  LEU  31          3HD2      LEU  31 -15.803 -27.481   3.703
  232   2HD2  LEU  31          2HD2      LEU  31 -16.118 -26.184   2.549
  233   3HD2  LEU  31          1HD2      LEU  31 -14.515 -26.913   2.640
  234    H    GLY  32           H        GLY  32 -18.832 -26.536   5.140
  235   1HA   GLY  32          1HA       GLY  32 -20.122 -27.890   3.734
  236   2HA   GLY  32          2HA       GLY  32 -18.932 -27.558   2.477
  237    H    GLU  33           H        GLU  33 -21.069 -25.322   4.238
  238    HA   GLU  33           HA       GLU  33 -22.996 -24.962   2.200
  239   1HB   GLU  33          2HB       GLU  33 -22.048 -23.368   4.533
  240   2HB   GLU  33          1HB       GLU  33 -23.012 -22.528   3.322
  241   1HG   GLU  33          2HG       GLU  33 -24.689 -24.440   3.512
  242   2HG   GLU  33          1HG       GLU  33 -23.784 -24.973   4.930
  243    H    ALA  34           H        ALA  34 -19.901 -23.290   2.737
  244    HA   ALA  34           HA       ALA  34 -20.261 -21.524   0.462
  245   1HB   ALA  34          1HB       ALA  34 -18.662 -20.597   1.829
  246   2HB   ALA  34          3HB       ALA  34 -18.084 -22.168   2.385
  247   3HB   ALA  34          2HB       ALA  34 -17.578 -21.548   0.813
  248    H    LEU  35           H        LEU  35 -18.636 -24.605   1.056
  249    HA   LEU  35           HA       LEU  35 -17.352 -24.897  -1.453
  250   1HB   LEU  35          2HB       LEU  35 -18.197 -26.687   0.740
  251   2HB   LEU  35          1HB       LEU  35 -18.051 -27.467  -0.835
  252    HG   LEU  35           HG       LEU  35 -15.915 -25.825   0.560
  253   1HD1  LEU  35          1HD1      LEU  35 -16.173 -28.776  -0.090
  254   2HD1  LEU  35          3HD1      LEU  35 -14.691 -28.019   0.495
  255   3HD1  LEU  35          2HD1      LEU  35 -16.129 -28.048   1.515
  256   1HD2  LEU  35          1HD2      LEU  35 -16.167 -26.949  -2.216
  257   2HD2  LEU  35          3HD2      LEU  35 -15.527 -25.388  -1.702
  258   3HD2  LEU  35          2HD2      LEU  35 -14.578 -26.854  -1.458
  259    H    LYS  36           H        LYS  36 -20.712 -25.453  -0.495
  260    HA   LYS  36           HA       LYS  36 -21.704 -26.988  -2.571
  261   1HB   LYS  36          2HB       LYS  36 -22.785 -25.157  -0.694
  262   2HB   LYS  36          1HB       LYS  36 -23.436 -24.706  -2.270
  263   1HG   LYS  36          2HG       LYS  36 -24.303 -26.912  -2.639
  264   2HG   LYS  36          1HG       LYS  36 -23.420 -27.558  -1.255
  265   1HD   LYS  36          2HD       LYS  36 -25.135 -25.298  -0.535
  266   2HD   LYS  36          1HD       LYS  36 -26.045 -26.643  -1.220
  267   1HE   LYS  36          2HE       LYS  36 -24.022 -27.608   0.621
  268   2HE   LYS  36          1HE       LYS  36 -25.075 -26.435   1.412
  269   1HZ   LYS  36          1HZ       LYS  36 -26.712 -28.048  -0.127
  270   2HZ   LYS  36          3HZ       LYS  36 -25.636 -29.101   0.655
  271   3HZ   LYS  36          2HZ       LYS  36 -26.585 -28.026   1.567
  272    H    THR  37           H        THR  37 -20.455 -23.722  -2.765
  273    HA   THR  37           HA       THR  37 -21.549 -22.807  -5.169
  274    HB   THR  37           HB       THR  37 -19.855 -21.637  -3.639
  275    HG1  THR  37           HG1      THR  37 -19.768 -21.643  -6.449
  276   1HG2  THR  37          2HG2      THR  37 -18.204 -23.553  -3.799
  277   2HG2  THR  37          1HG2      THR  37 -17.863 -23.022  -5.446
  278   3HG2  THR  37          3HG2      THR  37 -17.517 -21.954  -4.087
  279    H    LEU  38           H        LEU  38 -19.307 -25.407  -4.625
  280    HA   LEU  38           HA       LEU  38 -18.214 -25.620  -7.258
  281   1HB   LEU  38          2HB       LEU  38 -18.724 -27.684  -5.103
  282   2HB   LEU  38          1HB       LEU  38 -17.905 -28.067  -6.618
  283    HG   LEU  38           HG       LEU  38 -17.023 -26.075  -4.510
  284   1HD1  LEU  38          2HD1      LEU  38 -16.268 -28.819  -5.315
  285   2HD1  LEU  38          1HD1      LEU  38 -14.912 -27.715  -5.087
  286   3HD1  LEU  38          3HD1      LEU  38 -16.049 -27.998  -3.769
  287   1HD2  LEU  38          2HD2      LEU  38 -16.149 -26.503  -7.363
  288   2HD2  LEU  38          1HD2      LEU  38 -16.475 -24.985  -6.525
  289   3HD2  LEU  38          3HD2      LEU  38 -15.012 -25.900  -6.157
  290    H    GLY  39           H        GLY  39 -21.252 -26.707  -5.850
  291   1HA   GLY  39          1HA       GLY  39 -22.491 -26.944  -8.444
  292   2HA   GLY  39          2HA       GLY  39 -23.216 -27.439  -6.914
  293    H    SER  40           H        SER  40 -20.371 -28.982  -6.830
  294    HA   SER  40           HA       SER  40 -21.566 -31.506  -7.739
  295   1HB   SER  40          2HB       SER  40 -19.563 -30.032  -9.305
  296   2HB   SER  40          1HB       SER  40 -19.101 -31.699  -8.962
  297    HG   SER  40           HG       SER  40 -20.491 -32.290 -10.392
  298    H    ILE  41           H        ILE  41 -20.987 -30.895  -5.163
  299    HA   ILE  41           HA       ILE  41 -18.600 -32.598  -4.642
  300    HB   ILE  41           HB       ILE  41 -18.221 -30.024  -4.355
  301   1HG1  ILE  41          2HG1      ILE  41 -17.596 -31.767  -1.966
  302   2HG1  ILE  41          1HG1      ILE  41 -16.792 -31.979  -3.522
  303   1HG2  ILE  41          2HG2      ILE  41 -20.443 -29.996  -2.931
  304   2HG2  ILE  41          1HG2      ILE  41 -19.372 -30.511  -1.626
  305   3HG2  ILE  41          3HG2      ILE  41 -19.080 -28.982  -2.456
  306   1HD1  ILE  41          2HD1      ILE  41 -16.887 -29.185  -2.582
  307   2HD1  ILE  41          1HD1      ILE  41 -15.942 -30.262  -1.553
  308   3HD1  ILE  41          3HD1      ILE  41 -15.541 -30.098  -3.263
  309    H    THR  42           H        THR  42 -18.634 -33.295  -2.235
  310    HA   THR  42           HA       THR  42 -21.470 -33.691  -1.363
  311    HB   THR  42           HB       THR  42 -21.197 -35.944  -1.274
  312    HG1  THR  42           HG1      THR  42 -19.754 -36.770   0.031
  313   1HG2  THR  42          3HG2      THR  42 -20.113 -35.403  -3.467
  314   2HG2  THR  42          2HG2      THR  42 -18.550 -35.425  -2.650
  315   3HG2  THR  42          1HG2      THR  42 -19.516 -36.898  -2.746
  316    HA   PRO  43           HA       PRO  43 -20.221 -32.348   2.669
  317   1HB   PRO  43          2HB       PRO  43 -21.372 -34.143   4.333
  318   2HB   PRO  43          1HB       PRO  43 -22.300 -32.917   3.464
  319   1HG   PRO  43          2HG       PRO  43 -21.889 -35.810   2.800
  320   2HG   PRO  43          1HG       PRO  43 -23.374 -34.855   2.734
  321   1HD   PRO  43          1HD       PRO  43 -21.931 -35.407   0.517
  322   2HD   PRO  43          2HD       PRO  43 -22.816 -33.893   0.703
  323    H    ASP  44           H        ASP  44 -19.783 -35.787   1.980
  324    HA   ASP  44           HA       ASP  44 -17.966 -36.380   4.086
  325   1HB   ASP  44          2HB       ASP  44 -18.154 -37.576   1.306
  326   2HB   ASP  44          1HB       ASP  44 -17.257 -38.282   2.649
  327    H    GLU  45           H        GLU  45 -17.465 -34.785   0.975
  328    HA   GLU  45           HA       GLU  45 -14.549 -34.967   1.198
  329   1HB   GLU  45          2HB       GLU  45 -16.298 -33.279  -0.624
  330   2HB   GLU  45          1HB       GLU  45 -14.556 -33.494  -0.787
  331   1HG   GLU  45          2HG       GLU  45 -15.010 -35.999  -0.933
  332   2HG   GLU  45          1HG       GLU  45 -16.717 -35.590  -1.095
  333    H    VAL  46           H        VAL  46 -17.115 -32.650   1.847
  334    HA   VAL  46           HA       VAL  46 -15.392 -30.426   2.454
  335    HB   VAL  46           HB       VAL  46 -18.221 -31.082   3.313
  336   1HG1  VAL  46          2HG1      VAL  46 -16.467 -29.233   4.496
  337   2HG1  VAL  46          1HG1      VAL  46 -17.476 -28.275   3.414
  338   3HG1  VAL  46          3HG1      VAL  46 -18.222 -29.272   4.663
  339   1HG2  VAL  46          2HG2      VAL  46 -17.093 -30.214   0.878
  340   2HG2  VAL  46          1HG2      VAL  46 -18.805 -30.240   1.308
  341   3HG2  VAL  46          3HG2      VAL  46 -17.846 -28.789   1.594
  342    H    LYS  47           H        LYS  47 -16.709 -33.095   4.341
  343    HA   LYS  47           HA       LYS  47 -15.802 -32.088   6.901
  344   1HB   LYS  47          2HB       LYS  47 -16.578 -34.851   5.936
  345   2HB   LYS  47          1HB       LYS  47 -16.096 -34.522   7.600
  346   1HG   LYS  47          2HG       LYS  47 -17.900 -32.803   7.741
  347   2HG   LYS  47          1HG       LYS  47 -18.416 -33.252   6.115
  348   1HD   LYS  47          2HD       LYS  47 -18.693 -35.621   6.955
  349   2HD   LYS  47          1HD       LYS  47 -18.396 -35.011   8.583
  350   1HE   LYS  47          2HE       LYS  47 -20.370 -33.714   8.582
  351   2HE   LYS  47          1HE       LYS  47 -20.519 -33.781   6.827
  352   1HZ   LYS  47          2HZ       LYS  47 -20.689 -36.193   8.537
  353   2HZ   LYS  47          1HZ       LYS  47 -22.054 -35.268   8.125
  354   3HZ   LYS  47          3HZ       LYS  47 -21.149 -36.028   6.909
  355    H    HIS  48           H        HIS  48 -14.439 -34.206   4.427
  356    HA   HIS  48           HA       HIS  48 -12.101 -34.963   5.928
  357   1HB   HIS  48          2HB       HIS  48 -12.862 -36.186   3.912
  358   2HB   HIS  48          1HB       HIS  48 -12.479 -34.777   2.924
  359    HD1  HIS  48           HD1      HIS  48 -10.466 -35.596   1.636
  360    HD2  HIS  48           HD2      HIS  48 -10.104 -36.283   5.732
  361    HE1  HIS  48           HE1      HIS  48  -8.102 -36.421   2.018
  362    H    MET  49           H        MET  49 -12.857 -32.254   3.763
  363    HA   MET  49           HA       MET  49 -10.218 -31.210   3.531
  364   1HB   MET  49          2HB       MET  49 -12.980 -30.050   3.335
  365   2HB   MET  49          1HB       MET  49 -11.590 -28.968   3.354
  366   1HG   MET  49          2HG       MET  49 -10.660 -30.658   1.538
  367   2HG   MET  49          1HG       MET  49 -12.373 -31.013   1.310
  368   1HE   MET  49          1HE       MET  49 -12.685 -30.588  -0.626
  369   2HE   MET  49          3HE       MET  49 -13.544 -29.084  -0.982
  370   3HE   MET  49          2HE       MET  49 -11.933 -29.358  -1.640
  371    H    MET  50           H        MET  50 -12.805 -30.528   5.872
  372    HA   MET  50           HA       MET  50 -11.334 -28.655   7.440
  373   1HB   MET  50          2HB       MET  50 -13.671 -30.472   7.985
  374   2HB   MET  50          1HB       MET  50 -12.963 -29.512   9.281
  375   1HG   MET  50          2HG       MET  50 -13.205 -27.498   7.705
  376   2HG   MET  50          1HG       MET  50 -14.240 -28.535   6.724
  377   1HE   MET  50          2HE       MET  50 -13.572 -26.558   9.711
  378   2HE   MET  50          1HE       MET  50 -14.973 -26.650  10.775
  379   3HE   MET  50          3HE       MET  50 -13.801 -27.975  10.733
  380    H    ALA  51           H        ALA  51 -11.785 -32.164   7.810
  381    HA   ALA  51           HA       ALA  51 -10.182 -32.495  10.129
  382   1HB   ALA  51          3HB       ALA  51 -11.122 -34.525   9.742
  383   2HB   ALA  51          1HB       ALA  51  -9.743 -34.806   8.678
  384   3HB   ALA  51          2HB       ALA  51 -11.267 -34.219   8.011
  385    H    GLU  52           H        GLU  52  -9.324 -31.718   6.893
  386    HA   GLU  52           HA       GLU  52  -6.491 -32.517   7.325
  387   1HB   GLU  52          2HB       GLU  52  -8.098 -31.666   4.924
  388   2HB   GLU  52          1HB       GLU  52  -6.336 -31.589   4.889
  389   1HG   GLU  52          2HG       GLU  52  -6.519 -34.054   5.823
  390   2HG   GLU  52          1HG       GLU  52  -8.128 -33.988   5.103
  391    H    ILE  53           H        ILE  53  -8.548 -29.697   6.846
  392    HA   ILE  53           HA       ILE  53  -6.298 -27.826   6.899
  393    HB   ILE  53           HB       ILE  53  -9.284 -27.358   7.108
  394   1HG1  ILE  53          2HG1      ILE  53  -7.432 -27.098   4.726
  395   2HG1  ILE  53          1HG1      ILE  53  -8.505 -28.468   5.001
  396   1HG2  ILE  53          3HG2      ILE  53  -7.664 -25.569   7.969
  397   2HG2  ILE  53          2HG2      ILE  53  -7.139 -25.395   6.293
  398   3HG2  ILE  53          1HG2      ILE  53  -8.814 -25.060   6.732
  399   1HD1  ILE  53          3HD1      ILE  53 -10.354 -26.621   5.237
  400   2HD1  ILE  53          2HD1      ILE  53  -9.206 -25.619   4.350
  401   3HD1  ILE  53          1HD1      ILE  53  -9.819 -27.108   3.630
  402    H    ASP  54           H        ASP  54  -8.685 -29.096   9.152
  403    HA   ASP  54           HA       ASP  54  -8.386 -27.242  11.264
  404   1HB   ASP  54          2HB       ASP  54  -9.979 -29.311  10.905
  405   2HB   ASP  54          1HB       ASP  54  -8.719 -30.181  11.768
  406    H    THR  55           H        THR  55  -6.284 -26.653  11.774
  407    HA   THR  55           HA       THR  55  -4.085 -28.516  11.877
  408    HB   THR  55           HB       THR  55  -2.853 -26.639  12.920
  409    HG1  THR  55           HG1      THR  55  -4.288 -25.639  14.184
  410   1HG2  THR  55          3HG2      THR  55  -4.640 -25.979  10.568
  411   2HG2  THR  55          2HG2      THR  55  -3.288 -24.965  11.073
  412   3HG2  THR  55          1HG2      THR  55  -2.995 -26.613  10.519
  413    H    ASP  56           H        ASP  56  -6.025 -26.950  14.427
  414    HA   ASP  56           HA       ASP  56  -4.668 -28.568  16.478
  415   1HB   ASP  56          2HB       ASP  56  -5.799 -27.254  18.076
  416   2HB   ASP  56          1HB       ASP  56  -5.505 -26.129  16.751
  417    H    GLY  57           H        GLY  57  -7.806 -28.427  14.876
  418   1HA   GLY  57          1HA       GLY  57  -8.320 -31.179  15.879
  419   2HA   GLY  57          2HA       GLY  57  -9.082 -30.457  14.465
  420    H    ASP  58           H        ASP  58  -9.663 -27.915  16.003
  421    HA   ASP  58           HA       ASP  58 -11.457 -28.793  18.152
  422   1HB   ASP  58          2HB       ASP  58 -11.974 -26.476  18.471
  423   2HB   ASP  58          1HB       ASP  58 -10.252 -26.546  18.115
  424    H    GLY  59           H        GLY  59 -11.637 -28.888  14.839
  425   1HA   GLY  59          1HA       GLY  59 -14.602 -29.028  14.967
  426   2HA   GLY  59          2HA       GLY  59 -13.597 -29.761  13.717
  427    H    PHE  60           H        PHE  60 -12.412 -26.693  14.301
  428    HA   PHE  60           HA       PHE  60 -13.935 -25.653  11.960
  429   1HB   PHE  60          2HB       PHE  60 -13.210 -23.959  14.356
  430   2HB   PHE  60          1HB       PHE  60 -14.222 -23.509  12.983
  431    HD1  PHE  60           HD1      PHE  60 -14.011 -25.663  15.993
  432    HD2  PHE  60           HD2      PHE  60 -16.518 -24.174  12.841
  433    HE1  PHE  60           HE1      PHE  60 -16.007 -26.550  17.163
  434    HE2  PHE  60           HE2      PHE  60 -18.512 -25.063  14.009
  435    HZ   PHE  60           HZ       PHE  60 -18.260 -26.251  16.171
  436    H    ILE  61           H        ILE  61 -12.853 -23.971  10.765
  437    HA   ILE  61           HA       ILE  61  -9.895 -24.107  11.035
  438    HB   ILE  61           HB       ILE  61 -11.522 -23.267   8.624
  439   1HG1  ILE  61          2HG1      ILE  61 -12.033 -25.598   9.144
  440   2HG1  ILE  61          1HG1      ILE  61 -10.969 -25.535   7.740
  441   1HG2  ILE  61          1HG2      ILE  61  -9.098 -22.524   8.881
  442   2HG2  ILE  61          3HG2      ILE  61  -8.658 -24.228   8.794
  443   3HG2  ILE  61          2HG2      ILE  61  -9.456 -23.453   7.426
  444   1HD1  ILE  61          2HD1      ILE  61  -9.019 -25.951   9.225
  445   2HD1  ILE  61          1HD1      ILE  61 -10.114 -26.070  10.602
  446   3HD1  ILE  61          3HD1      ILE  61 -10.197 -27.264   9.306
  447    H    SER  62           H        SER  62  -8.867 -22.217  11.579
  448    HA   SER  62           HA       SER  62 -10.520 -19.757  11.744
  449   1HB   SER  62          2HB       SER  62  -7.940 -19.280  12.798
  450   2HB   SER  62          1HB       SER  62  -9.432 -19.523  13.707
  451    HG   SER  62           HG       SER  62  -7.396 -21.328  13.083
  452    H    PHE  63           H        PHE  63  -9.291 -17.690  11.122
  453    HA   PHE  63           HA       PHE  63  -8.546 -17.785   8.401
  454   1HB   PHE  63          2HB       PHE  63  -9.152 -15.680   9.577
  455   2HB   PHE  63          1HB       PHE  63  -7.619 -15.750  10.453
  456    HD1  PHE  63           HD1      PHE  63  -8.720 -16.281   6.907
  457    HD2  PHE  63           HD2      PHE  63  -5.988 -14.331   9.584
  458    HE1  PHE  63           HE1      PHE  63  -7.568 -15.244   4.973
  459    HE2  PHE  63           HE2      PHE  63  -4.830 -13.298   7.651
  460    HZ   PHE  63           HZ       PHE  63  -5.625 -13.753   5.343
  461    H    GLN  64           H        GLN  64  -6.530 -17.826  11.318
  462    HA   GLN  64           HA       GLN  64  -3.994 -17.848  10.049
  463   1HB   GLN  64          2HB       GLN  64  -4.451 -17.614  12.524
  464   2HB   GLN  64          1HB       GLN  64  -4.759 -19.350  12.570
  465   1HG   GLN  64          2HG       GLN  64  -2.451 -19.016  13.195
  466   2HG   GLN  64          1HG       GLN  64  -2.458 -19.687  11.565
  467   1HE2  GLN  64          1HE2      GLN  64  -0.682 -18.673  10.563
  468   2HE2  GLN  64          2HE2      GLN  64  -0.444 -16.993  10.514
  469    H    GLU  65           H        GLU  65  -6.057 -20.592  11.079
  470    HA   GLU  65           HA       GLU  65  -4.381 -22.655  10.062
  471   1HB   GLU  65          2HB       GLU  65  -7.335 -22.445  10.607
  472   2HB   GLU  65          1HB       GLU  65  -6.654 -23.903   9.897
  473   1HG   GLU  65          2HG       GLU  65  -5.126 -24.145  11.800
  474   2HG   GLU  65          1HG       GLU  65  -5.738 -22.648  12.501
  475    H    PHE  66           H        PHE  66  -7.109 -20.919   8.584
  476    HA   PHE  66           HA       PHE  66  -7.043 -22.277   6.074
  477   1HB   PHE  66          2HB       PHE  66  -8.937 -20.870   6.743
  478   2HB   PHE  66          1HB       PHE  66  -7.901 -19.444   6.739
  479    HD1  PHE  66           HD1      PHE  66  -7.085 -18.476   4.643
  480    HD2  PHE  66           HD2      PHE  66  -9.647 -21.923   4.655
  481    HE1  PHE  66           HE1      PHE  66  -7.516 -18.164   2.220
  482    HE2  PHE  66           HE2      PHE  66 -10.078 -21.612   2.233
  483    HZ   PHE  66           HZ       PHE  66  -9.014 -19.731   1.016
  484    H    THR  67           H        THR  67  -5.220 -19.551   7.354
  485    HA   THR  67           HA       THR  67  -4.017 -18.795   4.836
  486    HB   THR  67           HB       THR  67  -3.275 -18.302   7.727
  487    HG1  THR  67           HG1      THR  67  -4.166 -16.388   7.350
  488   1HG2  THR  67          3HG2      THR  67  -1.839 -17.462   5.201
  489   2HG2  THR  67          2HG2      THR  67  -1.627 -16.636   6.745
  490   3HG2  THR  67          1HG2      THR  67  -1.172 -18.332   6.583
  491    H    ASP  68           H        ASP  68  -2.898 -20.776   7.591
  492    HA   ASP  68           HA       ASP  68  -0.376 -21.486   6.479
  493   1HB   ASP  68          2HB       ASP  68  -1.162 -21.887   8.861
  494   2HB   ASP  68          1HB       ASP  68  -2.078 -23.261   8.243
  495    H    PHE  69           H        PHE  69  -3.588 -22.945   6.128
  496    HA   PHE  69           HA       PHE  69  -2.573 -25.118   4.460
  497   1HB   PHE  69          2HB       PHE  69  -4.484 -25.870   5.489
  498   2HB   PHE  69          1HB       PHE  69  -5.189 -24.260   5.582
  499    HD1  PHE  69           HD1      PHE  69  -6.037 -23.199   3.411
  500    HD2  PHE  69           HD2      PHE  69  -5.170 -27.383   3.815
  501    HE1  PHE  69           HE1      PHE  69  -7.435 -23.680   1.416
  502    HE2  PHE  69           HE2      PHE  69  -6.561 -27.867   1.823
  503    HZ   PHE  69           HZ       PHE  69  -7.698 -26.017   0.622
  504    H    GLY  70           H        GLY  70  -4.205 -22.014   3.990
  505   1HA   GLY  70          1HA       GLY  70  -4.485 -20.719   2.054
  506   2HA   GLY  70          2HA       GLY  70  -4.678 -22.244   1.190
  507    H    ARG  71           H        ARG  71  -1.771 -21.626   3.014
  508    HA   ARG  71           HA       ARG  71  -0.259 -20.569   0.757
  509   1HB   ARG  71          2HB       ARG  71   0.530 -21.617   3.483
  510   2HB   ARG  71          1HB       ARG  71   1.720 -21.080   2.296
  511   1HG   ARG  71          2HG       ARG  71   0.472 -18.885   2.170
  512   2HG   ARG  71          1HG       ARG  71  -0.510 -19.436   3.527
  513   1HD   ARG  71          2HD       ARG  71   2.497 -19.038   3.504
  514   2HD   ARG  71          1HD       ARG  71   1.312 -18.086   4.399
  515    HE   ARG  71           HE       ARG  71   1.027 -20.806   5.182
  516   1HH1  ARG  71          1HH1      ARG  71   1.531 -18.279   6.892
  517   2HH1  ARG  71          2HH1      ARG  71   2.995 -18.735   7.697
  518   1HH2  ARG  71          1HH2      ARG  71   3.669 -21.369   5.545
  519   2HH2  ARG  71          2HH2      ARG  71   4.207 -20.485   6.934
  520    H    ALA  72           H        ALA  72  -0.765 -23.730   2.238
  521    HA   ALA  72           HA       ALA  72   1.269 -25.114   0.746
  522   1HB   ALA  72          1HB       ALA  72  -0.625 -27.033   1.227
  523   2HB   ALA  72          2HB       ALA  72  -1.026 -25.838   2.461
  524   3HB   ALA  72          3HB       ALA  72   0.595 -26.532   2.398
  525    H    ASN  73           H        ASN  73  -1.799 -23.837  -0.111
  526    HA   ASN  73           HA       ASN  73  -1.499 -24.971  -2.827
  527   1HB   ASN  73          2HB       ASN  73  -3.975 -25.549  -2.834
  528   2HB   ASN  73          1HB       ASN  73  -2.968 -26.604  -1.843
  529   1HD2  ASN  73          1HD2      ASN  73  -3.427 -26.705   0.391
  530   2HD2  ASN  73          2HD2      ASN  73  -4.590 -25.738   1.161
  531    H    ARG  74           H        ARG  74  -0.962 -22.393  -2.215
  532    HA   ARG  74           HA       ARG  74  -2.989 -20.482  -2.098
  533   1HB   ARG  74          2HB       ARG  74  -0.471 -20.403  -3.789
  534   2HB   ARG  74          1HB       ARG  74  -1.471 -19.000  -3.412
  535   1HG   ARG  74          2HG       ARG  74  -1.111 -19.521  -0.962
  536   2HG   ARG  74          1HG       ARG  74   0.064 -20.737  -1.460
  537   1HD   ARG  74          2HD       ARG  74   0.193 -17.784  -2.147
  538   2HD   ARG  74          1HD       ARG  74   1.171 -18.590  -0.922
  539    HE   ARG  74           HE       ARG  74   1.710 -20.049  -3.192
  540   1HH1  ARG  74          1HH1      ARG  74   0.954 -17.386  -4.541
  541   2HH1  ARG  74          2HH1      ARG  74   2.518 -16.666  -4.722
  542   1HH2  ARG  74          1HH2      ARG  74   4.065 -18.830  -2.497
  543   2HH2  ARG  74          2HH2      ARG  74   4.279 -17.484  -3.565
  544    H    GLY  75           H        GLY  75  -1.877 -22.355  -4.868
  545   1HA   GLY  75          1HA       GLY  75  -2.888 -22.763  -6.927
  546   2HA   GLY  75          2HA       GLY  75  -3.353 -21.063  -6.908
  547    H    LEU  76           H        LEU  76  -4.385 -23.131  -4.317
  548    HA   LEU  76           HA       LEU  76  -6.945 -23.840  -5.523
  549   1HB   LEU  76          2HB       LEU  76  -5.787 -24.076  -2.746
  550   2HB   LEU  76          1HB       LEU  76  -7.475 -24.467  -3.072
  551    HG   LEU  76           HG       LEU  76  -5.065 -25.717  -4.428
  552   1HD1  LEU  76          2HD1      LEU  76  -6.398 -26.294  -1.972
  553   2HD1  LEU  76          1HD1      LEU  76  -6.816 -27.568  -3.118
  554   3HD1  LEU  76          3HD1      LEU  76  -5.124 -27.226  -2.759
  555   1HD2  LEU  76          1HD2      LEU  76  -7.989 -25.740  -4.985
  556   2HD2  LEU  76          3HD2      LEU  76  -6.632 -25.928  -6.095
  557   3HD2  LEU  76          2HD2      LEU  76  -7.151 -27.288  -5.098
  558    H    LEU  77           H        LEU  77  -5.852 -21.518  -3.069
  559    HA   LEU  77           HA       LEU  77  -8.455 -20.413  -2.562
  560   1HB   LEU  77          2HB       LEU  77  -5.750 -19.079  -2.246
  561   2HB   LEU  77          1HB       LEU  77  -7.253 -18.592  -1.462
  562    HG   LEU  77           HG       LEU  77  -5.671 -21.136  -1.030
  563   1HD1  LEU  77          1HD1      LEU  77  -6.371 -18.696   0.557
  564   2HD1  LEU  77          3HD1      LEU  77  -6.186 -20.227   1.411
  565   3HD1  LEU  77          2HD1      LEU  77  -4.844 -19.574   0.471
  566   1HD2  LEU  77          3HD2      LEU  77  -8.562 -20.545  -0.608
  567   2HD2  LEU  77          2HD2      LEU  77  -7.765 -22.084  -0.936
  568   3HD2  LEU  77          1HD2      LEU  77  -7.724 -21.400   0.688
  569    H    LYS  78           H        LYS  78  -6.189 -19.972  -5.151
  570    HA   LYS  78           HA       LYS  78  -7.256 -17.375  -5.973
  571   1HB   LYS  78          2HB       LYS  78  -5.489 -19.373  -7.421
  572   2HB   LYS  78          1HB       LYS  78  -5.868 -17.752  -8.007
  573   1HG   LYS  78          2HG       LYS  78  -4.970 -16.920  -5.734
  574   2HG   LYS  78          1HG       LYS  78  -4.283 -18.536  -5.558
  575   1HD   LYS  78          2HD       LYS  78  -3.780 -16.686  -7.910
  576   2HD   LYS  78          1HD       LYS  78  -2.666 -16.931  -6.564
  577   1HE   LYS  78          2HE       LYS  78  -2.170 -19.119  -7.200
  578   2HE   LYS  78          1HE       LYS  78  -3.685 -19.314  -8.081
  579   1HZ   LYS  78          1HZ       LYS  78  -1.434 -17.560  -8.902
  580   2HZ   LYS  78          3HZ       LYS  78  -1.791 -19.076  -9.574
  581   3HZ   LYS  78          2HZ       LYS  78  -2.885 -17.788  -9.757
  582    H    ASP  79           H        ASP  79  -8.103 -20.686  -6.398
  583    HA   ASP  79           HA       ASP  79  -9.673 -20.191  -8.842
  584   1HB   ASP  79          2HB       ASP  79  -9.024 -22.574  -7.142
  585   2HB   ASP  79          1HB       ASP  79 -10.414 -22.644  -8.222
  586    H    VAL  80           H        VAL  80 -10.179 -20.717  -5.388
  587    HA   VAL  80           HA       VAL  80 -13.071 -20.820  -5.565
  588    HB   VAL  80           HB       VAL  80 -11.256 -20.163  -3.223
  589   1HG1  VAL  80          2HG1      VAL  80 -13.937 -19.641  -3.401
  590   2HG1  VAL  80          1HG1      VAL  80 -13.949 -21.289  -2.774
  591   3HG1  VAL  80          3HG1      VAL  80 -13.100 -20.018  -1.895
  592   1HG2  VAL  80          2HG2      VAL  80 -12.355 -22.694  -4.401
  593   2HG2  VAL  80          1HG2      VAL  80 -10.748 -22.373  -3.747
  594   3HG2  VAL  80          3HG2      VAL  80 -12.117 -22.594  -2.655
  595    H    ALA  81           H        ALA  81 -10.676 -18.286  -5.055
  596    HA   ALA  81           HA       ALA  81 -12.353 -16.168  -4.261
  597   1HB   ALA  81          1HB       ALA  81 -10.395 -15.313  -6.246
  598   2HB   ALA  81          2HB       ALA  81  -9.695 -16.420  -5.064
  599   3HB   ALA  81          3HB       ALA  81 -10.479 -14.936  -4.525
  600    H    LYS  82           H        LYS  82 -11.529 -17.191  -7.575
  601    HA   LYS  82           HA       LYS  82 -13.175 -15.275  -8.902
  602   1HB   LYS  82          2HB       LYS  82 -12.424 -18.067  -9.822
  603   2HB   LYS  82          1HB       LYS  82 -12.998 -16.757 -10.854
  604   1HG   LYS  82          2HG       LYS  82 -11.035 -15.395 -10.197
  605   2HG   LYS  82          1HG       LYS  82 -10.454 -16.729  -9.202
  606   1HD   LYS  82          2HD       LYS  82 -10.335 -18.171 -11.206
  607   2HD   LYS  82          1HD       LYS  82 -10.907 -16.831 -12.200
  608   1HE   LYS  82          2HE       LYS  82  -8.922 -15.624 -11.948
  609   2HE   LYS  82          1HE       LYS  82  -8.491 -16.454 -10.453
  610   1HZ   LYS  82          3HZ       LYS  82  -8.194 -18.497 -11.792
  611   2HZ   LYS  82          2HZ       LYS  82  -8.434 -17.575 -13.200
  612   3HZ   LYS  82          1HZ       LYS  82  -7.102 -17.263 -12.193
  613    H    ILE  83           H        ILE  83 -13.914 -18.345  -7.375
  614    HA   ILE  83           HA       ILE  83 -16.444 -18.840  -8.595
  615    HB   ILE  83           HB       ILE  83 -15.425 -19.491  -5.815
  616   1HG1  ILE  83          2HG1      ILE  83 -15.659 -21.098  -8.375
  617   2HG1  ILE  83          1HG1      ILE  83 -14.163 -20.560  -7.613
  618   1HG2  ILE  83          2HG2      ILE  83 -18.015 -20.060  -7.206
  619   2HG2  ILE  83          1HG2      ILE  83 -17.327 -21.311  -6.169
  620   3HG2  ILE  83          3HG2      ILE  83 -17.711 -19.724  -5.502
  621   1HD1  ILE  83          2HD1      ILE  83 -15.818 -21.981  -5.706
  622   2HD1  ILE  83          1HD1      ILE  83 -15.530 -22.975  -7.134
  623   3HD1  ILE  83          3HD1      ILE  83 -14.167 -22.330  -6.219
  624    H    PHE  84           H        PHE  84 -15.458 -16.702  -5.987
  625    HA   PHE  84           HA       PHE  84 -18.299 -15.833  -5.679
  626   1HB   PHE  84          2HB       PHE  84 -15.920 -15.406  -3.845
  627   2HB   PHE  84          1HB       PHE  84 -17.571 -14.873  -3.524
  628    HD1  PHE  84           HD1      PHE  84 -15.631 -17.964  -4.405
  629    HD2  PHE  84           HD2      PHE  84 -19.025 -16.293  -2.365
  630    HE1  PHE  84           HE1      PHE  84 -16.172 -20.198  -3.472
  631    HE2  PHE  84           HE2      PHE  84 -19.565 -18.526  -1.434
  632    HZ   PHE  84           HZ       PHE  84 -18.140 -20.479  -1.988

  No H/Q in entry =         632
  Start of MODEL    3
    1    H1   ALA   1          2H        ALA   1  10.183 -18.131   0.108
    2    H2   ALA   1          1H        ALA   1   9.860 -19.785   0.323
    3    H3   ALA   1          3H        ALA   1  10.001 -19.147  -1.242
    4    HA   ALA   1           HA       ALA   1   7.782 -19.044  -1.208
    5   1HB   ALA   1          3HB       ALA   1   7.616 -20.432   0.785
    6   2HB   ALA   1          2HB       ALA   1   8.042 -19.063   1.813
    7   3HB   ALA   1          1HB       ALA   1   6.505 -19.072   0.949
    8    H    ASP   2           H        ASP   2   7.174 -17.096  -2.011
    9    HA   ASP   2           HA       ASP   2   7.892 -14.631  -0.533
   10   1HB   ASP   2          2HB       ASP   2   8.316 -14.774  -2.984
   11   2HB   ASP   2          1HB       ASP   2   6.582 -14.957  -3.249
   12    H    ASP   3           H        ASP   3   6.421 -14.266   1.096
   13    HA   ASP   3           HA       ASP   3   3.531 -14.285   0.318
   14   1HB   ASP   3          2HB       ASP   3   4.048 -16.093   1.922
   15   2HB   ASP   3          1HB       ASP   3   4.730 -14.907   3.035
   16    H    HIS   4           H        HIS   4   2.775 -12.227   0.267
   17    HA   HIS   4           HA       HIS   4   4.019 -10.235   2.119
   18   1HB   HIS   4          2HB       HIS   4   2.614  -8.757   0.255
   19   2HB   HIS   4          1HB       HIS   4   4.342  -9.078   0.192
   20    HD1  HIS   4           HD1      HIS   4   1.095 -10.024  -1.393
   21    HD2  HIS   4           HD2      HIS   4   5.104 -11.132  -1.669
   22    HE1  HIS   4           HE1      HIS   4   1.309 -11.420  -3.495
   23    HA   PRO   5           HA       PRO   5   0.133  -9.395   4.075
   24   1HB   PRO   5          2HB       PRO   5  -0.161  -6.710   3.922
   25   2HB   PRO   5          1HB       PRO   5   1.009  -7.487   4.993
   26   1HG   PRO   5          2HG       PRO   5   1.433  -6.248   2.295
   27   2HG   PRO   5          1HG       PRO   5   2.417  -6.095   3.756
   28   1HD   PRO   5          1HD       PRO   5   3.109  -7.761   1.752
   29   2HD   PRO   5          2HD       PRO   5   3.437  -8.153   3.440
   30    H    GLN   6           H        GLN   6   0.578  -8.199   0.826
   31    HA   GLN   6           HA       GLN   6  -2.098  -7.358   0.285
   32   1HB   GLN   6          2HB       GLN   6   0.273  -8.162  -1.327
   33   2HB   GLN   6          1HB       GLN   6  -1.294  -8.231  -2.135
   34   1HG   GLN   6          2HG       GLN   6  -1.670  -5.934  -1.891
   35   2HG   GLN   6          1HG       GLN   6  -0.548  -5.795  -0.537
   36   1HE2  GLN   6          1HE2      GLN   6   1.832  -6.686  -1.352
   37   2HE2  GLN   6          2HE2      GLN   6   2.355  -5.952  -2.791
   38    H    ASP   7           H        ASP   7  -0.495 -10.511   0.041
   39    HA   ASP   7           HA       ASP   7  -2.682 -11.908  -1.156
   40   1HB   ASP   7          2HB       ASP   7  -0.478 -12.881   0.683
   41   2HB   ASP   7          1HB       ASP   7  -1.604 -13.949  -0.157
   42    H    LYS   8           H        LYS   8  -1.843 -11.278   2.231
   43    HA   LYS   8           HA       LYS   8  -3.775 -12.865   3.507
   44   1HB   LYS   8          2HB       LYS   8  -2.413 -10.291   4.166
   45   2HB   LYS   8          1HB       LYS   8  -3.805 -10.756   5.146
   46   1HG   LYS   8          2HG       LYS   8  -2.548 -13.110   5.144
   47   2HG   LYS   8          1HG       LYS   8  -1.140 -12.082   4.879
   48   1HD   LYS   8          2HD       LYS   8  -1.892 -10.700   6.860
   49   2HD   LYS   8          1HD       LYS   8  -3.112 -11.933   7.175
   50   1HE   LYS   8          2HE       LYS   8  -1.583 -13.221   8.210
   51   2HE   LYS   8          1HE       LYS   8  -0.570 -13.213   6.766
   52   1HZ   LYS   8          1HZ       LYS   8  -0.633 -11.024   8.769
   53   2HZ   LYS   8          3HZ       LYS   8   0.519 -12.269   8.758
   54   3HZ   LYS   8          2HZ       LYS   8   0.436 -11.180   7.457
   55    H    ALA   9           H        ALA   9  -4.135  -9.719   1.947
   56    HA   ALA   9           HA       ALA   9  -6.782  -9.141   2.811
   57   1HB   ALA   9          2HB       ALA   9  -5.011  -7.805   1.286
   58   2HB   ALA   9          3HB       ALA   9  -6.735  -7.434   1.265
   59   3HB   ALA   9          1HB       ALA   9  -6.037  -8.456   0.008
   60    H    GLU  10           H        GLU  10  -5.606 -10.921  -0.028
   61    HA   GLU  10           HA       GLU  10  -8.223 -11.577  -1.027
   62   1HB   GLU  10          2HB       GLU  10  -5.656 -13.148  -1.401
   63   2HB   GLU  10          1HB       GLU  10  -7.081 -13.192  -2.439
   64   1HG   GLU  10          2HG       GLU  10  -5.380 -10.731  -1.937
   65   2HG   GLU  10          1HG       GLU  10  -5.281 -11.746  -3.375
   66    H    ARG  11           H        ARG  11  -5.941 -13.268   1.092
   67    HA   ARG  11           HA       ARG  11  -7.512 -15.645   1.424
   68   1HB   ARG  11          2HB       ARG  11  -5.419 -14.333   3.173
   69   2HB   ARG  11          1HB       ARG  11  -6.140 -15.897   3.541
   70   1HG   ARG  11          2HG       ARG  11  -5.449 -16.550   1.129
   71   2HG   ARG  11          1HG       ARG  11  -4.406 -15.131   1.195
   72   1HD   ARG  11          2HD       ARG  11  -3.694 -16.198   3.526
   73   2HD   ARG  11          1HD       ARG  11  -4.243 -17.683   2.747
   74    HE   ARG  11           HE       ARG  11  -2.028 -15.957   1.742
   75   1HH1  ARG  11          1HH1      ARG  11  -3.604 -17.668  -0.259
   76   2HH1  ARG  11          2HH1      ARG  11  -2.604 -19.079  -0.336
   77   1HH2  ARG  11          1HH2      ARG  11  -0.828 -18.301   2.538
   78   2HH2  ARG  11          2HH2      ARG  11  -1.034 -19.438   1.248
   79    H    GLU  12           H        GLU  12  -7.373 -12.590   3.200
   80    HA   GLU  12           HA       GLU  12  -9.150 -13.332   5.310
   81   1HB   GLU  12          2HB       GLU  12  -8.312 -10.704   4.096
   82   2HB   GLU  12          1HB       GLU  12  -9.540 -10.763   5.356
   83   1HG   GLU  12          2HG       GLU  12  -7.837 -12.208   6.666
   84   2HG   GLU  12          1HG       GLU  12  -6.649 -11.599   5.516
   85    H    ARG  13           H        ARG  13  -9.708 -11.879   2.121
   86    HA   ARG  13           HA       ARG  13 -12.544 -11.529   2.494
   87   1HB   ARG  13          2HB       ARG  13 -10.942 -11.847  -0.063
   88   2HB   ARG  13          1HB       ARG  13 -12.608 -11.279   0.029
   89   1HG   ARG  13          2HG       ARG  13 -11.968  -9.308   1.226
   90   2HG   ARG  13          1HG       ARG  13 -10.344  -9.932   1.518
   91   1HD   ARG  13          2HD       ARG  13  -9.633  -9.047  -0.423
   92   2HD   ARG  13          1HD       ARG  13 -10.851  -9.965  -1.307
   93    HE   ARG  13           HE       ARG  13 -11.060  -7.152  -0.507
   94   1HH1  ARG  13          1HH1      ARG  13 -13.557  -8.599   0.400
   95   2HH1  ARG  13          2HH1      ARG  13 -14.576  -8.437  -0.991
   96   1HH2  ARG  13          1HH2      ARG  13 -11.982  -7.562  -3.120
   97   2HH2  ARG  13          2HH2      ARG  13 -13.685  -7.850  -2.984
   98    H    ILE  14           H        ILE  14 -10.543 -14.135   1.182
   99    HA   ILE  14           HA       ILE  14 -12.785 -15.763   0.344
  100    HB   ILE  14           HB       ILE  14  -9.960 -16.620   1.042
  101   1HG1  ILE  14          2HG1      ILE  14 -10.986 -16.084  -1.733
  102   2HG1  ILE  14          1HG1      ILE  14 -10.371 -14.757  -0.752
  103   1HG2  ILE  14          2HG2      ILE  14 -12.350 -17.986   0.041
  104   2HG2  ILE  14          1HG2      ILE  14 -10.952 -18.199  -1.013
  105   3HG2  ILE  14          3HG2      ILE  14 -10.857 -18.669   0.685
  106   1HD1  ILE  14          1HD1      ILE  14  -8.608 -17.071  -0.635
  107   2HD1  ILE  14          3HD1      ILE  14  -8.843 -16.521  -2.294
  108   3HD1  ILE  14          2HD1      ILE  14  -8.232 -15.404  -1.074
  109    H    PHE  15           H        PHE  15 -10.668 -15.746   3.231
  110    HA   PHE  15           HA       PHE  15 -12.007 -17.936   4.517
  111   1HB   PHE  15          2HB       PHE  15  -9.760 -17.163   5.207
  112   2HB   PHE  15          1HB       PHE  15 -10.458 -15.641   5.769
  113    HD1  PHE  15           HD1      PHE  15 -10.198 -19.271   6.369
  114    HD2  PHE  15           HD2      PHE  15 -11.857 -15.570   7.783
  115    HE1  PHE  15           HE1      PHE  15 -10.779 -20.355   8.522
  116    HE2  PHE  15           HE2      PHE  15 -12.440 -16.656   9.937
  117    HZ   PHE  15           HZ       PHE  15 -11.903 -19.052  10.306
  118    H    LYS  16           H        LYS  16 -12.534 -14.443   4.493
  119    HA   LYS  16           HA       LYS  16 -14.494 -14.397   6.593
  120   1HB   LYS  16          2HB       LYS  16 -13.802 -12.572   4.303
  121   2HB   LYS  16          1HB       LYS  16 -15.260 -12.274   5.250
  122   1HG   LYS  16          2HG       LYS  16 -13.806 -12.387   7.326
  123   2HG   LYS  16          1HG       LYS  16 -12.405 -12.398   6.254
  124   1HD   LYS  16          2HD       LYS  16 -13.374 -10.271   5.207
  125   2HD   LYS  16          1HD       LYS  16 -14.478 -10.221   6.582
  126   1HE   LYS  16          2HE       LYS  16 -12.805  -9.713   8.082
  127   2HE   LYS  16          1HE       LYS  16 -11.581 -10.603   7.176
  128   1HZ   LYS  16          3HZ       LYS  16 -12.167  -8.682   5.442
  129   2HZ   LYS  16          2HZ       LYS  16 -12.465  -7.851   6.893
  130   3HZ   LYS  16          1HZ       LYS  16 -10.939  -8.540   6.604
  131    H    ARG  17           H        ARG  17 -14.640 -15.158   3.169
  132    HA   ARG  17           HA       ARG  17 -17.520 -15.046   2.949
  133   1HB   ARG  17          2HB       ARG  17 -15.409 -16.485   1.317
  134   2HB   ARG  17          1HB       ARG  17 -17.121 -16.466   0.893
  135   1HG   ARG  17          2HG       ARG  17 -16.033 -13.802   1.490
  136   2HG   ARG  17          1HG       ARG  17 -15.273 -14.575   0.099
  137   1HD   ARG  17          2HD       ARG  17 -17.490 -14.984  -0.895
  138   2HD   ARG  17          1HD       ARG  17 -18.262 -14.239   0.504
  139    HE   ARG  17           HE       ARG  17 -16.325 -12.572  -0.989
  140   1HH1  ARG  17          1HH1      ARG  17 -19.054 -12.438   0.844
  141   2HH1  ARG  17          2HH1      ARG  17 -19.968 -11.416  -0.214
  142   1HH2  ARG  17          1HH2      ARG  17 -17.721 -11.684  -2.842
  143   2HH2  ARG  17          2HH2      ARG  17 -19.212 -10.989  -2.301
  144    H    PHE  18           H        PHE  18 -15.186 -17.570   3.773
  145    HA   PHE  18           HA       PHE  18 -17.089 -19.730   3.824
  146   1HB   PHE  18          2HB       PHE  18 -14.384 -19.330   5.104
  147   2HB   PHE  18          1HB       PHE  18 -15.321 -20.805   5.338
  148    HD1  PHE  18           HD1      PHE  18 -16.172 -22.013   3.201
  149    HD2  PHE  18           HD2      PHE  18 -13.033 -19.080   3.198
  150    HE1  PHE  18           HE1      PHE  18 -15.379 -22.864   1.011
  151    HE2  PHE  18           HE2      PHE  18 -12.241 -19.930   1.006
  152    HZ   PHE  18           HZ       PHE  18 -13.414 -21.822  -0.087
  153    H    ASP  19           H        ASP  19 -15.739 -17.677   6.409
  154    HA   ASP  19           HA       ASP  19 -17.227 -18.818   8.546
  155   1HB   ASP  19          2HB       ASP  19 -15.314 -17.015   8.557
  156   2HB   ASP  19          1HB       ASP  19 -16.649 -15.866   8.453
  157    H    ALA  20           H        ALA  20 -19.423 -19.130   8.235
  158    HA   ALA  20           HA       ALA  20 -21.095 -17.319   6.765
  159   1HB   ALA  20          3HB       ALA  20 -21.645 -19.612   8.642
  160   2HB   ALA  20          1HB       ALA  20 -21.848 -19.554   6.892
  161   3HB   ALA  20          2HB       ALA  20 -22.954 -18.664   7.939
  162    H    ASN  21           H        ASN  21 -20.862 -17.903  10.320
  163    HA   ASN  21           HA       ASN  21 -22.580 -15.554  10.754
  164   1HB   ASN  21          2HB       ASN  21 -22.492 -16.121  13.108
  165   2HB   ASN  21          1HB       ASN  21 -22.783 -17.592  12.186
  166   1HD2  ASN  21          1HD2      ASN  21 -21.559 -17.315  14.870
  167   2HD2  ASN  21          2HD2      ASN  21 -20.022 -18.020  14.760
  168    H    GLY  22           H        GLY  22 -19.183 -16.387  10.936
  169   1HA   GLY  22          1HA       GLY  22 -18.588 -13.498  11.215
  170   2HA   GLY  22          2HA       GLY  22 -17.440 -14.736  10.717
  171    H    ASP  23           H        ASP  23 -17.957 -16.557  12.894
  172    HA   ASP  23           HA       ASP  23 -17.293 -14.964  15.306
  173   1HB   ASP  23          2HB       ASP  23 -17.490 -17.101  16.533
  174   2HB   ASP  23          1HB       ASP  23 -18.940 -16.762  15.594
  175    H    GLY  24           H        GLY  24 -15.587 -15.966  12.766
  176   1HA   GLY  24          1HA       GLY  24 -13.110 -16.161  14.364
  177   2HA   GLY  24          2HA       GLY  24 -13.198 -15.875  12.628
  178    H    LYS  25           H        LYS  25 -15.270 -18.409  13.436
  179    HA   LYS  25           HA       LYS  25 -13.169 -20.373  12.641
  180   1HB   LYS  25          2HB       LYS  25 -14.083 -22.005  14.183
  181   2HB   LYS  25          1HB       LYS  25 -13.741 -20.529  15.084
  182   1HG   LYS  25          2HG       LYS  25 -16.032 -19.920  15.160
  183   2HG   LYS  25          1HG       LYS  25 -16.464 -21.073  13.895
  184   1HD   LYS  25          2HD       LYS  25 -15.529 -22.855  15.584
  185   2HD   LYS  25          1HD       LYS  25 -15.804 -21.589  16.783
  186   1HE   LYS  25          2HE       LYS  25 -18.136 -21.546  15.284
  187   2HE   LYS  25          1HE       LYS  25 -17.746 -23.264  15.364
  188   1HZ   LYS  25          3HZ       LYS  25 -17.486 -23.003  17.787
  189   2HZ   LYS  25          2HZ       LYS  25 -18.017 -21.395  17.654
  190   3HZ   LYS  25          1HZ       LYS  25 -19.062 -22.673  17.254
  191    H    ILE  26           H        ILE  26 -13.808 -21.921  11.172
  192    HA   ILE  26           HA       ILE  26 -16.579 -21.626  10.083
  193    HB   ILE  26           HB       ILE  26 -14.308 -22.862   8.554
  194   1HG1  ILE  26          2HG1      ILE  26 -14.904 -19.898   8.799
  195   2HG1  ILE  26          1HG1      ILE  26 -13.448 -20.708   9.378
  196   1HG2  ILE  26          2HG2      ILE  26 -16.716 -22.919   7.776
  197   2HG2  ILE  26          1HG2      ILE  26 -16.655 -21.160   7.671
  198   3HG2  ILE  26          3HG2      ILE  26 -15.604 -22.142   6.650
  199   1HD1  ILE  26          3HD1      ILE  26 -14.033 -21.323   6.581
  200   2HD1  ILE  26          2HD1      ILE  26 -13.792 -19.597   6.853
  201   3HD1  ILE  26          1HD1      ILE  26 -12.535 -20.746   7.310
  202    H    SER  27           H        SER  27 -17.856 -23.410  10.093
  203    HA   SER  27           HA       SER  27 -16.650 -25.959  11.062
  204   1HB   SER  27          2HB       SER  27 -18.725 -26.484  12.033
  205   2HB   SER  27          1HB       SER  27 -18.620 -24.738  12.274
  206    HG   SER  27           HG       SER  27 -20.038 -24.406  10.676
  207    H    ALA  28           H        ALA  28 -17.797 -27.961  10.130
  208    HA   ALA  28           HA       ALA  28 -17.452 -28.112   7.356
  209   1HB   ALA  28          3HB       ALA  28 -19.560 -29.904   7.995
  210   2HB   ALA  28          2HB       ALA  28 -17.841 -30.275   7.862
  211   3HB   ALA  28          1HB       ALA  28 -18.523 -29.810   9.419
  212    H    ALA  29           H        ALA  29 -20.458 -27.497   9.155
  213    HA   ALA  29           HA       ALA  29 -22.188 -27.291   6.932
  214   1HB   ALA  29          1HB       ALA  29 -23.123 -27.312   9.155
  215   2HB   ALA  29          3HB       ALA  29 -22.229 -25.858   9.598
  216   3HB   ALA  29          2HB       ALA  29 -23.545 -25.762   8.427
  217    H    GLU  30           H        GLU  30 -20.074 -24.858   8.417
  218    HA   GLU  30           HA       GLU  30 -20.956 -22.762   6.607
  219   1HB   GLU  30          2HB       GLU  30 -18.516 -22.961   8.397
  220   2HB   GLU  30          1HB       GLU  30 -19.002 -21.507   7.525
  221   1HG   GLU  30          2HG       GLU  30 -21.175 -21.533   8.722
  222   2HG   GLU  30          1HG       GLU  30 -20.656 -22.963   9.614
  223    H    LEU  31           H        LEU  31 -17.903 -24.614   6.897
  224    HA   LEU  31           HA       LEU  31 -16.758 -23.648   4.484
  225   1HB   LEU  31          2HB       LEU  31 -15.692 -25.035   6.398
  226   2HB   LEU  31          1HB       LEU  31 -16.334 -26.440   5.553
  227    HG   LEU  31           HG       LEU  31 -14.631 -24.361   4.164
  228   1HD1  LEU  31          1HD1      LEU  31 -13.560 -25.595   6.207
  229   2HD1  LEU  31          3HD1      LEU  31 -13.572 -27.004   5.145
  230   3HD1  LEU  31          2HD1      LEU  31 -12.678 -25.555   4.681
  231   1HD2  LEU  31          1HD2      LEU  31 -16.065 -26.724   3.370
  232   2HD2  LEU  31          3HD2      LEU  31 -15.127 -25.618   2.368
  233   3HD2  LEU  31          2HD2      LEU  31 -14.338 -26.992   3.139
  234    H    GLY  32           H        GLY  32 -18.696 -26.562   5.134
  235   1HA   GLY  32          1HA       GLY  32 -19.921 -27.923   3.677
  236   2HA   GLY  32          2HA       GLY  32 -18.714 -27.536   2.454
  237    H    GLU  33           H        GLU  33 -20.926 -25.354   4.184
  238    HA   GLU  33           HA       GLU  33 -22.831 -25.050   2.108
  239   1HB   GLU  33          2HB       GLU  33 -21.971 -23.413   4.455
  240   2HB   GLU  33          1HB       GLU  33 -23.017 -22.662   3.252
  241   1HG   GLU  33          2HG       GLU  33 -23.801 -25.388   4.122
  242   2HG   GLU  33          1HG       GLU  33 -23.967 -24.118   5.333
  243    H    ALA  34           H        ALA  34 -19.812 -23.268   2.731
  244    HA   ALA  34           HA       ALA  34 -20.206 -21.441   0.523
  245   1HB   ALA  34          2HB       ALA  34 -18.659 -20.622   2.067
  246   2HB   ALA  34          3HB       ALA  34 -17.590 -21.267   0.821
  247   3HB   ALA  34          1HB       ALA  34 -17.897 -22.198   2.288
  248    H    LEU  35           H        LEU  35 -18.528 -24.523   0.946
  249    HA   LEU  35           HA       LEU  35 -17.259 -24.624  -1.592
  250   1HB   LEU  35          2HB       LEU  35 -18.144 -26.671   0.410
  251   2HB   LEU  35          1HB       LEU  35 -17.609 -27.209  -1.180
  252    HG   LEU  35           HG       LEU  35 -16.036 -25.502   0.769
  253   1HD1  LEU  35          2HD1      LEU  35 -15.983 -28.379  -0.074
  254   2HD1  LEU  35          1HD1      LEU  35 -14.464 -27.591   0.351
  255   3HD1  LEU  35          3HD1      LEU  35 -15.769 -27.684   1.531
  256   1HD2  LEU  35          1HD2      LEU  35 -15.615 -26.225  -2.114
  257   2HD2  LEU  35          3HD2      LEU  35 -15.336 -24.686  -1.303
  258   3HD2  LEU  35          2HD2      LEU  35 -14.218 -26.028  -1.058
  259    H    LYS  36           H        LYS  36 -20.592 -25.307  -0.634
  260    HA   LYS  36           HA       LYS  36 -21.559 -26.834  -2.720
  261   1HB   LYS  36          2HB       LYS  36 -22.673 -25.056  -0.823
  262   2HB   LYS  36          1HB       LYS  36 -23.313 -24.564  -2.391
  263   1HG   LYS  36          2HG       LYS  36 -24.110 -26.810  -2.838
  264   2HG   LYS  36          1HG       LYS  36 -23.319 -27.424  -1.387
  265   1HD   LYS  36          2HD       LYS  36 -25.111 -25.159  -0.857
  266   2HD   LYS  36          1HD       LYS  36 -25.943 -26.563  -1.526
  267   1HE   LYS  36          2HE       LYS  36 -23.947 -27.002   0.663
  268   2HE   LYS  36          1HE       LYS  36 -25.529 -26.349   1.090
  269   1HZ   LYS  36          2HZ       LYS  36 -25.185 -28.770  -0.584
  270   2HZ   LYS  36          1HZ       LYS  36 -25.340 -28.833   1.107
  271   3HZ   LYS  36          3HZ       LYS  36 -26.605 -28.212   0.164
  272    H    THR  37           H        THR  37 -20.320 -23.572  -2.906
  273    HA   THR  37           HA       THR  37 -21.446 -22.671  -5.315
  274    HB   THR  37           HB       THR  37 -19.809 -21.455  -3.753
  275    HG1  THR  37           HG1      THR  37 -19.735 -20.092  -5.331
  276   1HG2  THR  37          3HG2      THR  37 -18.050 -23.193  -3.808
  277   2HG2  THR  37          2HG2      THR  37 -17.815 -22.891  -5.529
  278   3HG2  THR  37          1HG2      THR  37 -17.433 -21.634  -4.353
  279    H    LEU  38           H        LEU  38 -19.131 -25.207  -4.757
  280    HA   LEU  38           HA       LEU  38 -17.988 -25.362  -7.374
  281   1HB   LEU  38          2HB       LEU  38 -18.485 -27.474  -5.262
  282   2HB   LEU  38          1HB       LEU  38 -17.618 -27.802  -6.762
  283    HG   LEU  38           HG       LEU  38 -16.727 -25.415  -5.237
  284   1HD1  LEU  38          3HD1      LEU  38 -16.451 -28.251  -4.238
  285   2HD1  LEU  38          2HD1      LEU  38 -15.282 -27.001  -3.813
  286   3HD1  LEU  38          1HD1      LEU  38 -16.974 -26.824  -3.342
  287   1HD2  LEU  38          2HD2      LEU  38 -15.804 -27.005  -7.347
  288   2HD2  LEU  38          1HD2      LEU  38 -14.893 -25.746  -6.511
  289   3HD2  LEU  38          3HD2      LEU  38 -14.759 -27.426  -5.989
  290    H    GLY  39           H        GLY  39 -21.030 -26.515  -6.038
  291   1HA   GLY  39          1HA       GLY  39 -22.214 -26.770  -8.652
  292   2HA   GLY  39          2HA       GLY  39 -22.951 -27.296  -7.140
  293    H    SER  40           H        SER  40 -20.079 -28.778  -7.009
  294    HA   SER  40           HA       SER  40 -21.201 -31.316  -7.975
  295   1HB   SER  40          2HB       SER  40 -19.215 -29.780  -9.490
  296   2HB   SER  40          1HB       SER  40 -18.686 -31.423  -9.129
  297    HG   SER  40           HG       SER  40 -20.348 -32.233 -10.232
  298    H    ILE  41           H        ILE  41 -20.781 -30.898  -5.398
  299    HA   ILE  41           HA       ILE  41 -18.349 -32.500  -4.827
  300    HB   ILE  41           HB       ILE  41 -17.964 -29.949  -4.507
  301   1HG1  ILE  41          2HG1      ILE  41 -17.498 -31.567  -2.011
  302   2HG1  ILE  41          1HG1      ILE  41 -16.676 -31.985  -3.515
  303   1HG2  ILE  41          3HG2      ILE  41 -20.299 -30.085  -3.101
  304   2HG2  ILE  41          2HG2      ILE  41 -19.120 -30.244  -1.798
  305   3HG2  ILE  41          1HG2      ILE  41 -19.081 -28.833  -2.858
  306   1HD1  ILE  41          3HD1      ILE  41 -16.651 -29.174  -2.402
  307   2HD1  ILE  41          2HD1      ILE  41 -15.443 -30.374  -1.936
  308   3HD1  ILE  41          1HD1      ILE  41 -15.585 -29.872  -3.621
  309    H    THR  42           H        THR  42 -18.438 -33.125  -2.365
  310    HA   THR  42           HA       THR  42 -21.288 -33.602  -1.598
  311    HB   THR  42           HB       THR  42 -20.968 -35.847  -1.503
  312    HG1  THR  42           HG1      THR  42 -18.326 -35.643  -0.588
  313   1HG2  THR  42          1HG2      THR  42 -19.820 -35.352  -3.644
  314   2HG2  THR  42          3HG2      THR  42 -18.291 -35.216  -2.775
  315   3HG2  THR  42          2HG2      THR  42 -19.130 -36.766  -2.847
  316    HA   PRO  43           HA       PRO  43 -20.186 -32.182   2.449
  317   1HB   PRO  43          2HB       PRO  43 -21.400 -33.954   4.093
  318   2HB   PRO  43          1HB       PRO  43 -22.294 -32.741   3.173
  319   1HG   PRO  43          2HG       PRO  43 -21.863 -35.643   2.567
  320   2HG   PRO  43          1HG       PRO  43 -23.341 -34.686   2.427
  321   1HD   PRO  43          1HD       PRO  43 -21.809 -35.275   0.279
  322   2HD   PRO  43          2HD       PRO  43 -22.703 -33.760   0.404
  323    H    ASP  44           H        ASP  44 -19.724 -35.629   1.821
  324    HA   ASP  44           HA       ASP  44 -17.956 -36.154   4.005
  325   1HB   ASP  44          2HB       ASP  44 -18.195 -37.490   1.296
  326   2HB   ASP  44          1HB       ASP  44 -17.254 -38.129   2.643
  327    H    GLU  45           H        GLU  45 -17.430 -34.588   0.906
  328    HA   GLU  45           HA       GLU  45 -14.521 -34.924   1.047
  329   1HB   GLU  45          2HB       GLU  45 -16.327 -33.251  -0.725
  330   2HB   GLU  45          1HB       GLU  45 -14.570 -33.276  -0.875
  331   1HG   GLU  45          2HG       GLU  45 -14.741 -35.802  -1.107
  332   2HG   GLU  45          1HG       GLU  45 -16.487 -35.592  -1.241
  333    H    VAL  46           H        VAL  46 -16.944 -32.478   1.778
  334    HA   VAL  46           HA       VAL  46 -15.090 -30.362   2.386
  335    HB   VAL  46           HB       VAL  46 -17.939 -30.880   3.272
  336   1HG1  VAL  46          3HG1      VAL  46 -15.989 -29.011   4.300
  337   2HG1  VAL  46          2HG1      VAL  46 -17.291 -28.137   3.496
  338   3HG1  VAL  46          1HG1      VAL  46 -17.661 -29.254   4.810
  339   1HG2  VAL  46          2HG2      VAL  46 -16.819 -30.038   0.840
  340   2HG2  VAL  46          1HG2      VAL  46 -18.513 -29.914   1.317
  341   3HG2  VAL  46          3HG2      VAL  46 -17.415 -28.563   1.601
  342    H    LYS  47           H        LYS  47 -16.519 -32.980   4.254
  343    HA   LYS  47           HA       LYS  47 -15.619 -32.093   6.835
  344   1HB   LYS  47          2HB       LYS  47 -16.318 -34.827   5.741
  345   2HB   LYS  47          1HB       LYS  47 -15.847 -34.572   7.421
  346   1HG   LYS  47          2HG       LYS  47 -17.691 -32.882   7.620
  347   2HG   LYS  47          1HG       LYS  47 -18.207 -33.317   5.990
  348   1HD   LYS  47          2HD       LYS  47 -18.457 -35.686   6.750
  349   2HD   LYS  47          1HD       LYS  47 -18.062 -35.168   8.389
  350   1HE   LYS  47          2HE       LYS  47 -20.237 -33.702   6.956
  351   2HE   LYS  47          1HE       LYS  47 -20.595 -35.325   7.547
  352   1HZ   LYS  47          1HZ       LYS  47 -19.250 -33.426   9.335
  353   2HZ   LYS  47          3HZ       LYS  47 -20.919 -33.259   9.076
  354   3HZ   LYS  47          2HZ       LYS  47 -20.300 -34.708   9.711
  355    H    HIS  48           H        HIS  48 -14.158 -34.118   4.327
  356    HA   HIS  48           HA       HIS  48 -11.837 -34.847   5.866
  357   1HB   HIS  48          2HB       HIS  48 -12.515 -36.050   3.811
  358   2HB   HIS  48          1HB       HIS  48 -12.147 -34.614   2.857
  359    HD1  HIS  48           HD1      HIS  48 -10.132 -35.542   1.586
  360    HD2  HIS  48           HD2      HIS  48  -9.747 -35.917   5.719
  361    HE1  HIS  48           HE1      HIS  48  -7.741 -36.257   2.021
  362    H    MET  49           H        MET  49 -12.598 -32.108   3.738
  363    HA   MET  49           HA       MET  49  -9.968 -31.018   3.601
  364   1HB   MET  49          2HB       MET  49 -12.741 -29.933   3.290
  365   2HB   MET  49          1HB       MET  49 -11.405 -28.794   3.439
  366   1HG   MET  49          2HG       MET  49 -10.321 -30.467   1.636
  367   2HG   MET  49          1HG       MET  49 -12.023 -30.718   1.250
  368   1HE   MET  49          1HE       MET  49 -11.852 -30.019  -0.958
  369   2HE   MET  49          3HE       MET  49 -13.291 -29.140  -0.422
  370   3HE   MET  49          2HE       MET  49 -12.113 -28.353  -1.470
  371    H    MET  50           H        MET  50 -12.633 -30.449   5.880
  372    HA   MET  50           HA       MET  50 -11.258 -28.556   7.510
  373   1HB   MET  50          2HB       MET  50 -13.552 -30.449   7.980
  374   2HB   MET  50          1HB       MET  50 -12.909 -29.469   9.294
  375   1HG   MET  50          2HG       MET  50 -13.167 -27.469   7.687
  376   2HG   MET  50          1HG       MET  50 -14.179 -28.542   6.719
  377   1HE   MET  50          2HE       MET  50 -13.323 -26.971   9.866
  378   2HE   MET  50          1HE       MET  50 -14.819 -26.632  10.733
  379   3HE   MET  50          3HE       MET  50 -14.035 -28.209  10.897
  380    H    ALA  51           H        ALA  51 -11.614 -32.087   7.821
  381    HA   ALA  51           HA       ALA  51 -10.052 -32.384  10.178
  382   1HB   ALA  51          1HB       ALA  51 -11.437 -34.104   8.579
  383   2HB   ALA  51          3HB       ALA  51  -9.780 -34.516   8.138
  384   3HB   ALA  51          2HB       ALA  51 -10.298 -34.628   9.820
  385    H    GLU  52           H        GLU  52  -9.149 -31.578   6.959
  386    HA   GLU  52           HA       GLU  52  -6.308 -32.306   7.457
  387   1HB   GLU  52          2HB       GLU  52  -7.894 -31.544   5.018
  388   2HB   GLU  52          1HB       GLU  52  -6.140 -31.362   5.014
  389   1HG   GLU  52          2HG       GLU  52  -6.150 -33.817   5.938
  390   2HG   GLU  52          1HG       GLU  52  -7.780 -33.870   5.267
  391    H    ILE  53           H        ILE  53  -8.417 -29.533   6.907
  392    HA   ILE  53           HA       ILE  53  -6.204 -27.620   7.016
  393    HB   ILE  53           HB       ILE  53  -9.206 -27.227   7.112
  394   1HG1  ILE  53          2HG1      ILE  53  -7.234 -26.912   4.835
  395   2HG1  ILE  53          1HG1      ILE  53  -8.329 -28.278   5.032
  396   1HG2  ILE  53          1HG2      ILE  53  -7.672 -25.399   8.069
  397   2HG2  ILE  53          3HG2      ILE  53  -7.099 -25.180   6.416
  398   3HG2  ILE  53          2HG2      ILE  53  -8.799 -24.911   6.803
  399   1HD1  ILE  53          3HD1      ILE  53  -9.462 -25.506   5.083
  400   2HD1  ILE  53          2HD1      ILE  53  -9.028 -26.218   3.528
  401   3HD1  ILE  53          1HD1      ILE  53 -10.215 -27.014   4.563
  402    H    ASP  54           H        ASP  54  -8.627 -28.932   9.208
  403    HA   ASP  54           HA       ASP  54  -8.397 -27.064  11.326
  404   1HB   ASP  54          2HB       ASP  54  -9.991 -29.117  10.950
  405   2HB   ASP  54          1HB       ASP  54  -8.740 -30.012  11.801
  406    H    THR  55           H        THR  55  -6.314 -26.470  11.892
  407    HA   THR  55           HA       THR  55  -4.096 -28.295  12.005
  408    HB   THR  55           HB       THR  55  -2.937 -26.429  13.174
  409    HG1  THR  55           HG1      THR  55  -4.218 -25.214  14.294
  410   1HG2  THR  55          3HG2      THR  55  -4.634 -25.618  10.797
  411   2HG2  THR  55          2HG2      THR  55  -3.168 -24.794  11.332
  412   3HG2  THR  55          1HG2      THR  55  -3.078 -26.447  10.722
  413    H    ASP  56           H        ASP  56  -6.125 -26.875  14.575
  414    HA   ASP  56           HA       ASP  56  -4.778 -28.565  16.577
  415   1HB   ASP  56          2HB       ASP  56  -5.952 -27.336  18.215
  416   2HB   ASP  56          1HB       ASP  56  -5.635 -26.149  16.952
  417    H    GLY  57           H        GLY  57  -7.917 -28.342  14.978
  418   1HA   GLY  57          1HA       GLY  57  -8.426 -31.150  15.828
  419   2HA   GLY  57          2HA       GLY  57  -9.172 -30.363  14.442
  420    H    ASP  58           H        ASP  58  -9.762 -27.893  16.090
  421    HA   ASP  58           HA       ASP  58 -11.567 -28.847  18.187
  422   1HB   ASP  58          2HB       ASP  58 -12.122 -26.534  18.547
  423   2HB   ASP  58          1HB       ASP  58 -10.387 -26.604  18.256
  424    H    GLY  59           H        GLY  59 -11.733 -28.879  14.881
  425   1HA   GLY  59          1HA       GLY  59 -14.697 -29.026  14.988
  426   2HA   GLY  59          2HA       GLY  59 -13.682 -29.728  13.729
  427    H    PHE  60           H        PHE  60 -12.492 -26.685  14.371
  428    HA   PHE  60           HA       PHE  60 -14.001 -25.593  12.049
  429   1HB   PHE  60          2HB       PHE  60 -13.318 -23.935  14.478
  430   2HB   PHE  60          1HB       PHE  60 -14.346 -23.488  13.116
  431    HD1  PHE  60           HD1      PHE  60 -16.580 -24.471  12.840
  432    HD2  PHE  60           HD2      PHE  60 -14.119 -25.413  16.229
  433    HE1  PHE  60           HE1      PHE  60 -18.547 -25.421  14.005
  434    HE2  PHE  60           HE2      PHE  60 -16.087 -26.360  17.396
  435    HZ   PHE  60           HZ       PHE  60 -18.305 -26.367  16.286
  436    H    ILE  61           H        ILE  61 -12.921 -23.865  10.915
  437    HA   ILE  61           HA       ILE  61  -9.966 -23.967  11.232
  438    HB   ILE  61           HB       ILE  61 -11.525 -23.120   8.784
  439   1HG1  ILE  61          2HG1      ILE  61 -12.089 -25.454   9.351
  440   2HG1  ILE  61          1HG1      ILE  61 -11.078 -25.387   7.908
  441   1HG2  ILE  61          2HG2      ILE  61  -9.088 -22.447   9.110
  442   2HG2  ILE  61          1HG2      ILE  61  -8.695 -24.164   9.033
  443   3HG2  ILE  61          3HG2      ILE  61  -9.432 -23.364   7.645
  444   1HD1  ILE  61          3HD1      ILE  61  -9.076 -25.810   9.357
  445   2HD1  ILE  61          2HD1      ILE  61 -10.163 -26.014  10.732
  446   3HD1  ILE  61          1HD1      ILE  61 -10.236 -27.141   9.375
  447    H    SER  62           H        SER  62  -8.975 -22.052  11.776
  448    HA   SER  62           HA       SER  62 -10.673 -19.625  11.933
  449   1HB   SER  62          2HB       SER  62  -7.878 -20.057  13.032
  450   2HB   SER  62          1HB       SER  62  -8.983 -18.741  13.431
  451    HG   SER  62           HG       SER  62  -8.852 -21.258  14.429
  452    H    PHE  63           H        PHE  63  -9.462 -17.535  11.319
  453    HA   PHE  63           HA       PHE  63  -8.727 -17.623   8.591
  454   1HB   PHE  63          2HB       PHE  63  -9.375 -15.526   9.755
  455   2HB   PHE  63          1HB       PHE  63  -7.845 -15.562  10.637
  456    HD1  PHE  63           HD1      PHE  63  -8.891 -16.166   7.088
  457    HD2  PHE  63           HD2      PHE  63  -6.269 -14.077   9.769
  458    HE1  PHE  63           HE1      PHE  63  -7.751 -15.117   5.155
  459    HE2  PHE  63           HE2      PHE  63  -5.127 -13.027   7.835
  460    HZ   PHE  63           HZ       PHE  63  -5.873 -13.547   5.525
  461    H    GLN  64           H        GLN  64  -6.705 -17.627  11.503
  462    HA   GLN  64           HA       GLN  64  -4.178 -17.596  10.200
  463   1HB   GLN  64          2HB       GLN  64  -4.613 -17.298  12.671
  464   2HB   GLN  64          1HB       GLN  64  -4.874 -19.038  12.774
  465   1HG   GLN  64          2HG       GLN  64  -2.570 -18.637  13.360
  466   2HG   GLN  64          1HG       GLN  64  -2.575 -19.339  11.743
  467   1HE2  GLN  64          1HE2      GLN  64  -1.393 -18.188  10.206
  468   2HE2  GLN  64          2HE2      GLN  64  -0.965 -16.550  10.333
  469    H    GLU  65           H        GLU  65  -6.228 -20.339  11.238
  470    HA   GLU  65           HA       GLU  65  -4.479 -22.404  10.338
  471   1HB   GLU  65          2HB       GLU  65  -7.453 -22.244  10.793
  472   2HB   GLU  65          1HB       GLU  65  -6.713 -23.708  10.163
  473   1HG   GLU  65          2HG       GLU  65  -5.222 -23.809  12.127
  474   2HG   GLU  65          1HG       GLU  65  -5.953 -22.334  12.758
  475    H    PHE  66           H        PHE  66  -7.208 -20.773   8.741
  476    HA   PHE  66           HA       PHE  66  -7.063 -22.199   6.278
  477   1HB   PHE  66          2HB       PHE  66  -8.939 -20.678   6.997
  478   2HB   PHE  66          1HB       PHE  66  -7.888 -19.306   6.649
  479    HD1  PHE  66           HD1      PHE  66  -7.164 -18.825   4.336
  480    HD2  PHE  66           HD2      PHE  66  -9.901 -22.015   5.223
  481    HE1  PHE  66           HE1      PHE  66  -7.788 -18.955   1.939
  482    HE2  PHE  66           HE2      PHE  66 -10.525 -22.146   2.826
  483    HZ   PHE  66           HZ       PHE  66  -9.468 -20.616   1.184
  484    H    THR  67           H        THR  67  -5.431 -19.260   7.392
  485    HA   THR  67           HA       THR  67  -4.131 -18.651   4.911
  486    HB   THR  67           HB       THR  67  -3.419 -18.015   7.786
  487    HG1  THR  67           HG1      THR  67  -4.856 -16.832   5.722
  488   1HG2  THR  67          1HG2      THR  67  -1.380 -18.051   6.382
  489   2HG2  THR  67          3HG2      THR  67  -2.158 -16.954   5.240
  490   3HG2  THR  67          2HG2      THR  67  -1.794 -16.411   6.878
  491    H    ASP  68           H        ASP  68  -3.039 -20.477   7.780
  492    HA   ASP  68           HA       ASP  68  -0.458 -21.146   6.810
  493   1HB   ASP  68          2HB       ASP  68  -2.308 -22.723   8.622
  494   2HB   ASP  68          1HB       ASP  68  -0.595 -23.075   8.389
  495    H    PHE  69           H        PHE  69  -3.598 -22.703   6.295
  496    HA   PHE  69           HA       PHE  69  -2.447 -24.904   4.772
  497   1HB   PHE  69          2HB       PHE  69  -4.443 -25.622   5.653
  498   2HB   PHE  69          1HB       PHE  69  -5.148 -24.009   5.634
  499    HD1  PHE  69           HD1      PHE  69  -5.796 -23.017   3.364
  500    HD2  PHE  69           HD2      PHE  69  -4.998 -27.187   3.983
  501    HE1  PHE  69           HE1      PHE  69  -7.023 -23.561   1.275
  502    HE2  PHE  69           HE2      PHE  69  -6.219 -27.734   1.898
  503    HZ   PHE  69           HZ       PHE  69  -7.236 -25.923   0.542
  504    H    GLY  70           H        GLY  70  -3.932 -21.778   4.073
  505   1HA   GLY  70          1HA       GLY  70  -3.978 -20.529   2.086
  506   2HA   GLY  70          2HA       GLY  70  -4.263 -22.067   1.269
  507    H    ARG  71           H        ARG  71  -1.403 -21.485   3.214
  508    HA   ARG  71           HA       ARG  71   0.309 -20.693   1.013
  509   1HB   ARG  71          2HB       ARG  71   1.004 -21.889   3.714
  510   2HB   ARG  71          1HB       ARG  71   2.155 -21.146   2.603
  511   1HG   ARG  71          2HG       ARG  71   0.917 -19.016   2.745
  512   2HG   ARG  71          1HG       ARG  71  -0.238 -19.757   3.851
  513   1HD   ARG  71          2HD       ARG  71   2.737 -19.422   4.345
  514   2HD   ARG  71          1HD       ARG  71   1.450 -18.493   5.113
  515    HE   ARG  71           HE       ARG  71   0.964 -21.266   5.577
  516   1HH1  ARG  71          1HH1      ARG  71   3.896 -21.273   6.071
  517   2HH1  ARG  71          2HH1      ARG  71   3.997 -20.814   7.738
  518   1HH2  ARG  71          1HH2      ARG  71   0.763 -19.572   7.869
  519   2HH2  ARG  71          2HH2      ARG  71   2.224 -19.850   8.756
  520    H    ALA  72           H        ALA  72  -0.710 -23.745   2.396
  521    HA   ALA  72           HA       ALA  72   1.312 -25.370   1.119
  522   1HB   ALA  72          3HB       ALA  72   0.371 -26.864   2.518
  523   2HB   ALA  72          1HB       ALA  72  -1.045 -26.904   1.468
  524   3HB   ALA  72          2HB       ALA  72  -0.982 -25.774   2.820
  525    H    ASN  73           H        ASN  73  -1.604 -23.853   0.039
  526    HA   ASN  73           HA       ASN  73  -1.134 -24.907  -2.675
  527   1HB   ASN  73          2HB       ASN  73  -3.942 -25.100  -1.629
  528   2HB   ASN  73          1HB       ASN  73  -3.187 -25.976  -2.961
  529   1HD2  ASN  73          1HD2      ASN  73  -4.132 -26.266   0.287
  530   2HD2  ASN  73          2HD2      ASN  73  -3.206 -27.628   0.693
  531    H    ARG  74           H        ARG  74  -0.632 -22.376  -2.070
  532    HA   ARG  74           HA       ARG  74  -2.650 -20.453  -1.935
  533   1HB   ARG  74          2HB       ARG  74  -1.117 -18.932  -3.110
  534   2HB   ARG  74          1HB       ARG  74  -0.220 -19.919  -1.954
  535   1HG   ARG  74          2HG       ARG  74   0.239 -21.525  -3.883
  536   2HG   ARG  74          1HG       ARG  74  -0.389 -20.273  -4.954
  537   1HD   ARG  74          2HD       ARG  74   1.970 -19.927  -4.902
  538   2HD   ARG  74          1HD       ARG  74   1.296 -18.692  -3.838
  539    HE   ARG  74           HE       ARG  74   2.035 -21.154  -2.444
  540   1HH1  ARG  74          1HH1      ARG  74   3.307 -18.328  -3.926
  541   2HH1  ARG  74          2HH1      ARG  74   4.499 -18.053  -2.700
  542   1HH2  ARG  74          1HH2      ARG  74   3.462 -20.706  -0.723
  543   2HH2  ARG  74          2HH2      ARG  74   4.586 -19.399  -0.886
  544    H    GLY  75           H        GLY  75  -1.515 -22.281  -4.729
  545   1HA   GLY  75          1HA       GLY  75  -2.503 -22.642  -6.808
  546   2HA   GLY  75          2HA       GLY  75  -2.986 -20.947  -6.750
  547    H    LEU  76           H        LEU  76  -3.969 -23.282  -4.326
  548    HA   LEU  76           HA       LEU  76  -6.519 -23.939  -5.506
  549   1HB   LEU  76          2HB       LEU  76  -5.395 -24.148  -2.713
  550   2HB   LEU  76          1HB       LEU  76  -7.067 -24.585  -3.067
  551    HG   LEU  76           HG       LEU  76  -4.617 -25.755  -4.422
  552   1HD1  LEU  76          1HD1      LEU  76  -5.772 -26.340  -1.916
  553   2HD1  LEU  76          3HD1      LEU  76  -6.327 -27.612  -3.006
  554   3HD1  LEU  76          2HD1      LEU  76  -4.600 -27.319  -2.799
  555   1HD2  LEU  76          2HD2      LEU  76  -7.381 -25.635  -5.192
  556   2HD2  LEU  76          1HD2      LEU  76  -6.048 -26.444  -6.017
  557   3HD2  LEU  76          3HD2      LEU  76  -6.977 -27.303  -4.789
  558    H    LEU  77           H        LEU  77  -5.520 -21.605  -3.018
  559    HA   LEU  77           HA       LEU  77  -8.131 -20.558  -2.513
  560   1HB   LEU  77          2HB       LEU  77  -5.404 -19.264  -2.239
  561   2HB   LEU  77          1HB       LEU  77  -6.899 -18.582  -1.599
  562    HG   LEU  77           HG       LEU  77  -5.577 -21.194  -0.822
  563   1HD1  LEU  77          3HD1      LEU  77  -6.129 -18.551   0.500
  564   2HD1  LEU  77          2HD1      LEU  77  -6.003 -20.010   1.483
  565   3HD1  LEU  77          1HD1      LEU  77  -4.641 -19.497   0.488
  566   1HD2  LEU  77          3HD2      LEU  77  -8.360 -20.148  -0.250
  567   2HD2  LEU  77          2HD2      LEU  77  -7.916 -21.696  -0.967
  568   3HD2  LEU  77          1HD2      LEU  77  -7.586 -21.387   0.737
  569    H    LYS  78           H        LYS  78  -5.896 -20.049  -5.134
  570    HA   LYS  78           HA       LYS  78  -7.114 -17.535  -5.996
  571   1HB   LYS  78          2HB       LYS  78  -5.194 -19.448  -7.353
  572   2HB   LYS  78          1HB       LYS  78  -5.723 -17.920  -8.058
  573   1HG   LYS  78          2HG       LYS  78  -4.920 -16.838  -5.859
  574   2HG   LYS  78          1HG       LYS  78  -4.089 -18.364  -5.556
  575   1HD   LYS  78          2HD       LYS  78  -3.745 -16.709  -8.073
  576   2HD   LYS  78          1HD       LYS  78  -2.645 -16.657  -6.696
  577   1HE   LYS  78          2HE       LYS  78  -1.821 -18.782  -7.100
  578   2HE   LYS  78          1HE       LYS  78  -3.315 -19.329  -7.863
  579   1HZ   LYS  78          3HZ       LYS  78  -2.652 -17.529  -9.616
  580   2HZ   LYS  78          2HZ       LYS  78  -1.090 -17.802  -9.006
  581   3HZ   LYS  78          1HZ       LYS  78  -1.980 -19.085  -9.677
  582    H    ASP  79           H        ASP  79  -7.790 -20.891  -6.360
  583    HA   ASP  79           HA       ASP  79  -9.300 -20.585  -8.857
  584   1HB   ASP  79          2HB       ASP  79  -8.582 -22.798  -7.016
  585   2HB   ASP  79          1HB       ASP  79 -10.113 -22.978  -7.874
  586    H    VAL  80           H        VAL  80  -9.949 -20.687  -5.400
  587    HA   VAL  80           HA       VAL  80 -12.863 -20.687  -5.815
  588    HB   VAL  80           HB       VAL  80 -11.322 -20.208  -3.249
  589   1HG1  VAL  80          1HG1      VAL  80 -13.984 -19.883  -3.765
  590   2HG1  VAL  80          3HG1      VAL  80 -13.941 -21.579  -3.283
  591   3HG1  VAL  80          2HG1      VAL  80 -13.335 -20.335  -2.189
  592   1HG2  VAL  80          2HG2      VAL  80 -12.277 -22.793  -4.517
  593   2HG2  VAL  80          1HG2      VAL  80 -10.605 -22.335  -4.196
  594   3HG2  VAL  80          3HG2      VAL  80 -11.705 -22.652  -2.854
  595    H    ALA  81           H        ALA  81 -10.276 -18.409  -5.237
  596    HA   ALA  81           HA       ALA  81 -11.850 -16.195  -4.339
  597   1HB   ALA  81          2HB       ALA  81  -9.825 -15.215  -4.262
  598   2HB   ALA  81          3HB       ALA  81  -9.664 -15.328  -6.014
  599   3HB   ALA  81          1HB       ALA  81  -9.140 -16.667  -4.993
  600    H    LYS  82           H        LYS  82 -11.664 -17.745  -7.394
  601    HA   LYS  82           HA       LYS  82 -12.651 -15.351  -8.839
  602   1HB   LYS  82          2HB       LYS  82 -12.138 -18.151  -9.884
  603   2HB   LYS  82          1HB       LYS  82 -12.419 -16.703 -10.851
  604   1HG   LYS  82          2HG       LYS  82 -10.372 -15.700  -9.703
  605   2HG   LYS  82          1HG       LYS  82 -10.042 -17.317  -9.080
  606   1HD   LYS  82          2HD       LYS  82  -9.962 -18.201 -11.373
  607   2HD   LYS  82          1HD       LYS  82 -10.340 -16.602 -12.014
  608   1HE   LYS  82          2HE       LYS  82  -8.172 -16.000 -11.905
  609   2HE   LYS  82          1HE       LYS  82  -8.110 -16.415 -10.192
  610   1HZ   LYS  82          2HZ       LYS  82  -7.802 -18.749 -10.844
  611   2HZ   LYS  82          1HZ       LYS  82  -7.747 -18.277 -12.476
  612   3HZ   LYS  82          3HZ       LYS  82  -6.545 -17.751 -11.401
  613    H    ILE  83           H        ILE  83 -13.736 -18.483  -7.656
  614    HA   ILE  83           HA       ILE  83 -16.219 -18.647  -9.015
  615    HB   ILE  83           HB       ILE  83 -15.521 -19.545  -6.204
  616   1HG1  ILE  83          2HG1      ILE  83 -15.301 -20.834  -8.929
  617   2HG1  ILE  83          1HG1      ILE  83 -14.030 -20.608  -7.729
  618   1HG2  ILE  83          1HG2      ILE  83 -18.011 -19.340  -6.945
  619   2HG2  ILE  83          3HG2      ILE  83 -17.652 -20.725  -7.976
  620   3HG2  ILE  83          2HG2      ILE  83 -17.472 -20.858  -6.227
  621   1HD1  ILE  83          2HD1      ILE  83 -15.217 -22.164  -6.202
  622   2HD1  ILE  83          1HD1      ILE  83 -16.451 -22.415  -7.438
  623   3HD1  ILE  83          3HD1      ILE  83 -14.794 -22.944  -7.727
  624    H    PHE  84           H        PHE  84 -15.275 -16.865  -6.121
  625    HA   PHE  84           HA       PHE  84 -18.043 -15.852  -5.802
  626   1HB   PHE  84          2HB       PHE  84 -15.542 -15.415  -4.142
  627   2HB   PHE  84          1HB       PHE  84 -17.139 -14.781  -3.745
  628    HD1  PHE  84           HD1      PHE  84 -15.096 -17.843  -4.086
  629    HD2  PHE  84           HD2      PHE  84 -18.907 -16.228  -2.934
  630    HE1  PHE  84           HE1      PHE  84 -15.688 -20.000  -3.013
  631    HE2  PHE  84           HE2      PHE  84 -19.498 -18.385  -1.862
  632    HZ   PHE  84           HZ       PHE  84 -17.888 -20.272  -1.902

  No H/Q in entry =         632
  Start of MODEL    4
    1    H1   ALA   1          1H        ALA   1   9.814 -17.571  -1.151
    2    H2   ALA   1          3H        ALA   1   8.358 -18.435  -1.043
    3    H3   ALA   1          2H        ALA   1   9.596 -18.982  -2.072
    4    HA   ALA   1           HA       ALA   1   9.215 -17.384  -3.650
    5   1HB   ALA   1          2HB       ALA   1   6.414 -17.260  -2.719
    6   2HB   ALA   1          3HB       ALA   1   7.084 -18.888  -2.821
    7   3HB   ALA   1          1HB       ALA   1   7.066 -17.850  -4.247
    8    H    ASP   2           H        ASP   2   6.884 -15.557  -3.557
    9    HA   ASP   2           HA       ASP   2   8.093 -13.443  -1.818
   10   1HB   ASP   2          2HB       ASP   2   8.288 -12.992  -4.251
   11   2HB   ASP   2          1HB       ASP   2   6.535 -13.109  -4.400
   12    H    ASP   3           H        ASP   3   6.694 -14.136  -0.047
   13    HA   ASP   3           HA       ASP   3   3.780 -13.889  -0.457
   14   1HB   ASP   3          2HB       ASP   3   4.822 -15.666   1.019
   15   2HB   ASP   3          1HB       ASP   3   5.274 -14.376   2.134
   16    H    HIS   4           H        HIS   4   2.804 -11.936  -0.253
   17    HA   HIS   4           HA       HIS   4   4.121  -9.897   1.500
   18   1HB   HIS   4          2HB       HIS   4   2.380  -8.525  -0.211
   19   2HB   HIS   4          1HB       HIS   4   4.135  -8.575  -0.332
   20    HD1  HIS   4           HD1      HIS   4   1.027 -10.196  -1.728
   21    HD2  HIS   4           HD2      HIS   4   5.135 -10.165  -2.440
   22    HE1  HIS   4           HE1      HIS   4   1.383 -11.399  -3.929
   23    HA   PRO   5           HA       PRO   5   0.390  -9.434   3.841
   24   1HB   PRO   5          2HB       PRO   5  -0.058  -6.767   3.890
   25   2HB   PRO   5          1HB       PRO   5   1.248  -7.536   4.798
   26   1HG   PRO   5          2HG       PRO   5   1.349  -6.110   2.163
   27   2HG   PRO   5          1HG       PRO   5   2.460  -5.994   3.532
   28   1HD   PRO   5          1HD       PRO   5   3.030  -7.488   1.358
   29   2HD   PRO   5          2HD       PRO   5   3.555  -7.958   2.976
   30    H    GLN   6           H        GLN   6   0.470  -8.019   0.651
   31    HA   GLN   6           HA       GLN   6  -2.271  -7.286   0.392
   32   1HB   GLN   6          2HB       GLN   6  -0.062  -8.001  -1.499
   33   2HB   GLN   6          1HB       GLN   6  -1.710  -7.933  -2.123
   34   1HG   GLN   6          2HG       GLN   6  -1.954  -5.648  -1.554
   35   2HG   GLN   6          1HG       GLN   6  -0.572  -5.688  -0.458
   36   1HE2  GLN   6          1HE2      GLN   6   1.611  -6.210  -1.612
   37   2HE2  GLN   6          2HE2      GLN   6   1.840  -5.534  -3.151
   38    H    ASP   7           H        ASP   7  -0.578 -10.359  -0.088
   39    HA   ASP   7           HA       ASP   7  -2.713 -11.835  -1.231
   40   1HB   ASP   7          2HB       ASP   7  -0.497 -12.721   0.635
   41   2HB   ASP   7          1HB       ASP   7  -1.580 -13.835  -0.198
   42    H    LYS   8           H        LYS   8  -1.865 -11.330   2.186
   43    HA   LYS   8           HA       LYS   8  -3.812 -12.903   3.418
   44   1HB   LYS   8          2HB       LYS   8  -2.585 -10.256   4.150
   45   2HB   LYS   8          1HB       LYS   8  -3.833 -10.970   5.171
   46   1HG   LYS   8          2HG       LYS   8  -2.453 -13.096   5.182
   47   2HG   LYS   8          1HG       LYS   8  -1.163 -12.176   4.410
   48   1HD   LYS   8          2HD       LYS   8  -0.606 -11.941   6.666
   49   2HD   LYS   8          1HD       LYS   8  -1.572 -10.490   6.392
   50   1HE   LYS   8          2HE       LYS   8  -3.589 -11.783   7.183
   51   2HE   LYS   8          1HE       LYS   8  -2.500 -13.098   7.628
   52   1HZ   LYS   8          3HZ       LYS   8  -2.046 -10.346   8.597
   53   2HZ   LYS   8          2HZ       LYS   8  -3.110 -11.395   9.407
   54   3HZ   LYS   8          1HZ       LYS   8  -1.470 -11.806   9.240
   55    H    ALA   9           H        ALA   9  -4.183  -9.732   1.911
   56    HA   ALA   9           HA       ALA   9  -6.824  -9.172   2.798
   57   1HB   ALA   9          2HB       ALA   9  -4.993  -8.107   0.863
   58   2HB   ALA   9          3HB       ALA   9  -6.412  -7.330   1.566
   59   3HB   ALA   9          1HB       ALA   9  -6.571  -8.294   0.097
   60    H    GLU  10           H        GLU  10  -5.663 -10.941  -0.052
   61    HA   GLU  10           HA       GLU  10  -8.298 -11.600  -1.017
   62   1HB   GLU  10          2HB       GLU  10  -5.728 -13.139  -1.482
   63   2HB   GLU  10          1HB       GLU  10  -7.173 -13.158  -2.494
   64   1HG   GLU  10          2HG       GLU  10  -6.850 -10.675  -2.843
   65   2HG   GLU  10          1HG       GLU  10  -5.295 -10.827  -2.024
   66    H    ARG  11           H        ARG  11  -5.972 -13.252   1.082
   67    HA   ARG  11           HA       ARG  11  -7.516 -15.665   1.375
   68   1HB   ARG  11          2HB       ARG  11  -5.350 -14.382   3.050
   69   2HB   ARG  11          1HB       ARG  11  -6.091 -15.924   3.480
   70   1HG   ARG  11          2HG       ARG  11  -5.488 -16.734   1.154
   71   2HG   ARG  11          1HG       ARG  11  -4.545 -15.260   0.960
   72   1HD   ARG  11          2HD       ARG  11  -4.145 -17.415   3.056
   73   2HD   ARG  11          1HD       ARG  11  -3.060 -17.025   1.720
   74    HE   ARG  11           HE       ARG  11  -3.575 -14.760   3.475
   75   1HH1  ARG  11          1HH1      ARG  11  -1.252 -16.680   2.044
   76   2HH1  ARG  11          2HH1      ARG  11  -0.084 -16.537   3.315
   77   1HH2  ARG  11          1HH2      ARG  11  -2.262 -14.951   5.498
   78   2HH2  ARG  11          2HH2      ARG  11  -0.655 -15.558   5.270
   79    H    GLU  12           H        GLU  12  -7.338 -12.639   3.198
   80    HA   GLU  12           HA       GLU  12  -9.097 -13.455   5.316
   81   1HB   GLU  12          2HB       GLU  12  -8.113 -10.826   4.256
   82   2HB   GLU  12          1HB       GLU  12  -9.439 -10.843   5.415
   83   1HG   GLU  12          2HG       GLU  12  -7.962 -12.358   6.859
   84   2HG   GLU  12          1HG       GLU  12  -6.638 -11.922   5.779
   85    H    ARG  13           H        ARG  13  -9.645 -11.799   2.221
   86    HA   ARG  13           HA       ARG  13 -12.454 -11.370   2.621
   87   1HB   ARG  13          2HB       ARG  13 -10.824 -11.652   0.080
   88   2HB   ARG  13          1HB       ARG  13 -12.512 -11.141   0.121
   89   1HG   ARG  13          2HG       ARG  13 -11.934  -9.213   1.499
   90   2HG   ARG  13          1HG       ARG  13 -10.258  -9.747   1.595
   91   1HD   ARG  13          2HD       ARG  13  -9.958  -8.380  -0.202
   92   2HD   ARG  13          1HD       ARG  13 -10.651  -9.720  -1.114
   93    HE   ARG  13           HE       ARG  13 -12.892  -8.364  -0.387
   94   1HH1  ARG  13          1HH1      ARG  13  -9.948  -7.602  -1.989
   95   2HH1  ARG  13          2HH1      ARG  13 -10.543  -6.128  -2.676
   96   1HH2  ARG  13          1HH2      ARG  13 -13.638  -6.346  -1.127
   97   2HH2  ARG  13          2HH2      ARG  13 -12.633  -5.416  -2.187
   98    H    ILE  14           H        ILE  14 -10.602 -14.022   1.167
   99    HA   ILE  14           HA       ILE  14 -12.934 -15.526   0.355
  100    HB   ILE  14           HB       ILE  14 -10.133 -16.526   0.954
  101   1HG1  ILE  14          2HG1      ILE  14 -11.212 -15.882  -1.778
  102   2HG1  ILE  14          1HG1      ILE  14 -10.518 -14.603  -0.785
  103   1HG2  ILE  14          1HG2      ILE  14 -12.439 -17.965   0.460
  104   2HG2  ILE  14          3HG2      ILE  14 -11.742 -17.799  -1.151
  105   3HG2  ILE  14          2HG2      ILE  14 -10.802 -18.539   0.144
  106   1HD1  ILE  14          1HD1      ILE  14  -8.847 -16.989  -0.769
  107   2HD1  ILE  14          3HD1      ILE  14  -9.105 -16.392  -2.409
  108   3HD1  ILE  14          2HD1      ILE  14  -8.417 -15.328  -1.182
  109    H    PHE  15           H        PHE  15 -10.737 -15.716   3.170
  110    HA   PHE  15           HA       PHE  15 -12.168 -17.860   4.441
  111   1HB   PHE  15          2HB       PHE  15  -9.848 -17.223   5.061
  112   2HB   PHE  15          1HB       PHE  15 -10.454 -15.700   5.717
  113    HD1  PHE  15           HD1      PHE  15 -11.930 -15.699   7.720
  114    HD2  PHE  15           HD2      PHE  15 -10.182 -19.321   6.210
  115    HE1  PHE  15           HE1      PHE  15 -12.482 -16.854   9.846
  116    HE2  PHE  15           HE2      PHE  15 -10.731 -20.474   8.336
  117    HZ   PHE  15           HZ       PHE  15 -11.885 -19.243  10.154
  118    H    LYS  16           H        LYS  16 -12.479 -14.349   4.498
  119    HA   LYS  16           HA       LYS  16 -14.340 -14.195   6.674
  120   1HB   LYS  16          2HB       LYS  16 -13.621 -12.410   4.368
  121   2HB   LYS  16          1HB       LYS  16 -15.034 -12.028   5.350
  122   1HG   LYS  16          2HG       LYS  16 -13.587 -12.152   7.389
  123   2HG   LYS  16          1HG       LYS  16 -12.190 -12.384   6.338
  124   1HD   LYS  16          2HD       LYS  16 -12.765 -10.218   5.204
  125   2HD   LYS  16          1HD       LYS  16 -14.032  -9.976   6.407
  126   1HE   LYS  16          2HE       LYS  16 -11.062 -10.261   6.959
  127   2HE   LYS  16          1HE       LYS  16 -12.013  -8.782   7.098
  128   1HZ   LYS  16          2HZ       LYS  16 -13.443 -10.169   8.695
  129   2HZ   LYS  16          1HZ       LYS  16 -12.095 -11.200   8.781
  130   3HZ   LYS  16          3HZ       LYS  16 -11.951  -9.577   9.251
  131    H    ARG  17           H        ARG  17 -14.721 -14.802   3.218
  132    HA   ARG  17           HA       ARG  17 -17.620 -14.608   3.287
  133   1HB   ARG  17          2HB       ARG  17 -17.566 -15.247   1.019
  134   2HB   ARG  17          1HB       ARG  17 -16.054 -14.374   1.240
  135   1HG   ARG  17          2HG       ARG  17 -14.946 -16.188   0.509
  136   2HG   ARG  17          1HG       ARG  17 -15.524 -17.078   1.909
  137   1HD   ARG  17          2HD       ARG  17 -17.357 -16.705  -0.432
  138   2HD   ARG  17          1HD       ARG  17 -16.088 -17.925  -0.526
  139    HE   ARG  17           HE       ARG  17 -17.119 -18.736   1.729
  140   1HH1  ARG  17          1HH1      ARG  17 -18.474 -19.913  -0.605
  141   2HH1  ARG  17          2HH1      ARG  17 -20.132 -19.477  -0.358
  142   1HH2  ARG  17          1HH2      ARG  17 -19.411 -16.997   1.955
  143   2HH2  ARG  17          2HH2      ARG  17 -20.663 -17.826   1.091
  144    H    PHE  18           H        PHE  18 -15.271 -17.092   3.931
  145    HA   PHE  18           HA       PHE  18 -17.115 -19.324   3.721
  146   1HB   PHE  18          2HB       PHE  18 -14.363 -18.926   4.858
  147   2HB   PHE  18          1HB       PHE  18 -15.260 -20.393   5.250
  148    HD1  PHE  18           HD1      PHE  18 -16.406 -21.591   3.180
  149    HD2  PHE  18           HD2      PHE  18 -13.081 -18.885   2.908
  150    HE1  PHE  18           HE1      PHE  18 -15.810 -22.547   0.971
  151    HE2  PHE  18           HE2      PHE  18 -12.485 -19.840   0.698
  152    HZ   PHE  18           HZ       PHE  18 -13.849 -21.671  -0.270
  153    H    ASP  19           H        ASP  19 -15.889 -17.328   6.390
  154    HA   ASP  19           HA       ASP  19 -17.281 -18.720   8.474
  155   1HB   ASP  19          2HB       ASP  19 -15.412 -16.875   8.606
  156   2HB   ASP  19          1HB       ASP  19 -16.776 -15.755   8.593
  157    H    ALA  20           H        ALA  20 -19.469 -19.065   8.152
  158    HA   ALA  20           HA       ALA  20 -21.216 -17.266   6.799
  159   1HB   ALA  20          1HB       ALA  20 -21.559 -19.660   8.555
  160   2HB   ALA  20          2HB       ALA  20 -22.080 -19.405   6.890
  161   3HB   ALA  20          3HB       ALA  20 -22.972 -18.661   8.216
  162    H    ASN  21           H        ASN  21 -20.858 -17.837  10.346
  163    HA   ASN  21           HA       ASN  21 -22.576 -15.479  10.800
  164   1HB   ASN  21          2HB       ASN  21 -22.471 -16.071  13.166
  165   2HB   ASN  21          1HB       ASN  21 -22.873 -17.496  12.213
  166   1HD2  ASN  21          1HD2      ASN  21 -21.622 -17.430  14.871
  167   2HD2  ASN  21          2HD2      ASN  21 -20.121 -18.202  14.719
  168    H    GLY  22           H        GLY  22 -19.203 -16.348  10.874
  169   1HA   GLY  22          1HA       GLY  22 -18.547 -13.495  11.258
  170   2HA   GLY  22          2HA       GLY  22 -17.419 -14.752  10.757
  171    H    ASP  23           H        ASP  23 -18.094 -16.583  12.921
  172    HA   ASP  23           HA       ASP  23 -17.434 -15.063  15.368
  173   1HB   ASP  23          2HB       ASP  23 -17.671 -17.218  16.540
  174   2HB   ASP  23          1HB       ASP  23 -19.086 -16.884  15.545
  175    H    GLY  24           H        GLY  24 -15.684 -16.062  12.828
  176   1HA   GLY  24          1HA       GLY  24 -13.234 -16.263  14.477
  177   2HA   GLY  24          2HA       GLY  24 -13.287 -15.930  12.747
  178    H    LYS  25           H        LYS  25 -15.368 -18.487  13.423
  179    HA   LYS  25           HA       LYS  25 -13.251 -20.421  12.605
  180   1HB   LYS  25          2HB       LYS  25 -14.181 -22.095  14.113
  181   2HB   LYS  25          1HB       LYS  25 -13.782 -20.648  15.037
  182   1HG   LYS  25          2HG       LYS  25 -16.073 -19.963  15.113
  183   2HG   LYS  25          1HG       LYS  25 -16.543 -21.174  13.918
  184   1HD   LYS  25          2HD       LYS  25 -15.662 -22.915  15.607
  185   2HD   LYS  25          1HD       LYS  25 -15.690 -21.602  16.785
  186   1HE   LYS  25          2HE       LYS  25 -17.798 -23.038  16.684
  187   2HE   LYS  25          1HE       LYS  25 -18.051 -21.300  16.528
  188   1HZ   LYS  25          1HZ       LYS  25 -17.578 -22.787  14.069
  189   2HZ   LYS  25          3HZ       LYS  25 -19.069 -23.048  14.835
  190   3HZ   LYS  25          2HZ       LYS  25 -18.621 -21.478  14.366
  191    H    ILE  26           H        ILE  26 -13.899 -21.980  11.134
  192    HA   ILE  26           HA       ILE  26 -16.660 -21.652  10.033
  193    HB   ILE  26           HB       ILE  26 -14.331 -22.865   8.550
  194   1HG1  ILE  26          2HG1      ILE  26 -15.108 -19.938   8.731
  195   2HG1  ILE  26          1HG1      ILE  26 -13.589 -20.652   9.275
  196   1HG2  ILE  26          3HG2      ILE  26 -17.051 -21.773   7.902
  197   2HG2  ILE  26          2HG2      ILE  26 -15.787 -21.712   6.673
  198   3HG2  ILE  26          1HG2      ILE  26 -16.289 -23.262   7.347
  199   1HD1  ILE  26          2HD1      ILE  26 -14.197 -21.336   6.501
  200   2HD1  ILE  26          1HD1      ILE  26 -14.086 -19.592   6.746
  201   3HD1  ILE  26          3HD1      ILE  26 -12.730 -20.632   7.184
  202    H    SER  27           H        SER  27 -17.960 -23.436   9.989
  203    HA   SER  27           HA       SER  27 -16.795 -25.992  10.988
  204   1HB   SER  27          2HB       SER  27 -18.883 -26.493  11.928
  205   2HB   SER  27          1HB       SER  27 -18.797 -24.744  12.142
  206    HG   SER  27           HG       SER  27 -20.716 -25.034  11.199
  207    H    ALA  28           H        ALA  28 -17.864 -27.988   9.989
  208    HA   ALA  28           HA       ALA  28 -17.490 -28.081   7.221
  209   1HB   ALA  28          3HB       ALA  28 -19.613 -29.891   7.856
  210   2HB   ALA  28          2HB       ALA  28 -17.905 -30.261   7.619
  211   3HB   ALA  28          1HB       ALA  28 -18.503 -29.847   9.226
  212    H    ALA  29           H        ALA  29 -20.518 -27.513   8.997
  213    HA   ALA  29           HA       ALA  29 -22.228 -27.288   6.758
  214   1HB   ALA  29          2HB       ALA  29 -22.882 -27.307   9.226
  215   2HB   ALA  29          1HB       ALA  29 -22.459 -25.596   9.252
  216   3HB   ALA  29          3HB       ALA  29 -23.762 -26.165   8.210
  217    H    GLU  30           H        GLU  30 -20.126 -24.873   8.287
  218    HA   GLU  30           HA       GLU  30 -21.034 -22.740   6.535
  219   1HB   GLU  30          2HB       GLU  30 -18.581 -22.965   8.302
  220   2HB   GLU  30          1HB       GLU  30 -19.079 -21.495   7.466
  221   1HG   GLU  30          2HG       GLU  30 -21.250 -21.565   8.670
  222   2HG   GLU  30          1HG       GLU  30 -20.709 -23.004   9.535
  223    H    LEU  31           H        LEU  31 -17.972 -24.587   6.746
  224    HA   LEU  31           HA       LEU  31 -16.886 -23.543   4.322
  225   1HB   LEU  31          2HB       LEU  31 -15.468 -24.730   5.912
  226   2HB   LEU  31          1HB       LEU  31 -16.411 -26.205   5.700
  227    HG   LEU  31           HG       LEU  31 -15.761 -26.263   3.310
  228   1HD1  LEU  31          1HD1      LEU  31 -14.331 -23.726   4.101
  229   2HD1  LEU  31          3HD1      LEU  31 -13.795 -24.685   2.722
  230   3HD1  LEU  31          2HD1      LEU  31 -15.418 -23.993   2.738
  231   1HD2  LEU  31          1HD2      LEU  31 -13.711 -26.237   5.495
  232   2HD2  LEU  31          3HD2      LEU  31 -14.296 -27.591   4.528
  233   3HD2  LEU  31          2HD2      LEU  31 -13.166 -26.432   3.829
  234    H    GLY  32           H        GLY  32 -18.846 -26.430   4.981
  235   1HA   GLY  32          1HA       GLY  32 -20.083 -27.791   3.526
  236   2HA   GLY  32          2HA       GLY  32 -18.850 -27.447   2.315
  237    H    GLU  33           H        GLU  33 -21.063 -25.215   3.990
  238    HA   GLU  33           HA       GLU  33 -22.916 -24.889   1.877
  239   1HB   GLU  33          2HB       GLU  33 -22.090 -23.273   4.242
  240   2HB   GLU  33          1HB       GLU  33 -23.029 -22.461   2.991
  241   1HG   GLU  33          2HG       GLU  33 -24.697 -24.346   3.128
  242   2HG   GLU  33          1HG       GLU  33 -23.802 -24.962   4.517
  243    H    ALA  34           H        ALA  34 -19.887 -23.135   2.545
  244    HA   ALA  34           HA       ALA  34 -20.194 -21.404   0.234
  245   1HB   ALA  34          1HB       ALA  34 -18.757 -20.510   1.868
  246   2HB   ALA  34          2HB       ALA  34 -17.626 -21.127   0.664
  247   3HB   ALA  34          3HB       ALA  34 -17.945 -22.054   2.130
  248    H    LEU  35           H        LEU  35 -18.477 -24.413   0.947
  249    HA   LEU  35           HA       LEU  35 -17.085 -24.681  -1.508
  250   1HB   LEU  35          2HB       LEU  35 -17.998 -26.526   0.640
  251   2HB   LEU  35          1HB       LEU  35 -17.602 -27.261  -0.913
  252    HG   LEU  35           HG       LEU  35 -15.753 -25.300   0.458
  253   1HD1  LEU  35          1HD1      LEU  35 -16.262 -27.355   1.874
  254   2HD1  LEU  35          3HD1      LEU  35 -15.555 -28.319   0.577
  255   3HD1  LEU  35          2HD1      LEU  35 -14.567 -27.141   1.440
  256   1HD2  LEU  35          1HD2      LEU  35 -15.589 -25.897  -2.038
  257   2HD2  LEU  35          3HD2      LEU  35 -14.126 -26.111  -1.076
  258   3HD2  LEU  35          2HD2      LEU  35 -15.113 -27.509  -1.504
  259    H    LYS  36           H        LYS  36 -20.452 -25.351  -0.663
  260    HA   LYS  36           HA       LYS  36 -21.298 -26.965  -2.747
  261   1HB   LYS  36          2HB       LYS  36 -22.519 -24.961  -1.040
  262   2HB   LYS  36          1HB       LYS  36 -23.231 -24.927  -2.652
  263   1HG   LYS  36          2HG       LYS  36 -23.667 -27.336  -2.538
  264   2HG   LYS  36          1HG       LYS  36 -22.881 -27.423  -0.961
  265   1HD   LYS  36          2HD       LYS  36 -24.746 -25.390  -0.634
  266   2HD   LYS  36          1HD       LYS  36 -25.596 -26.560  -1.644
  267   1HE   LYS  36          2HE       LYS  36 -24.195 -28.035   0.344
  268   2HE   LYS  36          1HE       LYS  36 -25.022 -26.712   1.166
  269   1HZ   LYS  36          2HZ       LYS  36 -26.594 -28.030  -0.863
  270   2HZ   LYS  36          1HZ       LYS  36 -26.182 -29.024   0.452
  271   3HZ   LYS  36          3HZ       LYS  36 -27.019 -27.573   0.717
  272    H    THR  37           H        THR  37 -20.149 -23.671  -2.943
  273    HA   THR  37           HA       THR  37 -21.184 -22.798  -5.384
  274    HB   THR  37           HB       THR  37 -19.553 -21.576  -3.842
  275    HG1  THR  37           HG1      THR  37 -20.155 -21.100  -6.165
  276   1HG2  THR  37          1HG2      THR  37 -17.885 -23.459  -3.836
  277   2HG2  THR  37          3HG2      THR  37 -17.502 -23.055  -5.508
  278   3HG2  THR  37          2HG2      THR  37 -17.186 -21.887  -4.225
  279    H    LEU  38           H        LEU  38 -18.944 -25.374  -4.749
  280    HA   LEU  38           HA       LEU  38 -17.723 -25.628  -7.307
  281   1HB   LEU  38          2HB       LEU  38 -18.396 -27.594  -5.125
  282   2HB   LEU  38          1HB       LEU  38 -17.699 -28.150  -6.646
  283    HG   LEU  38           HG       LEU  38 -16.439 -25.864  -5.146
  284   1HD1  LEU  38          1HD1      LEU  38 -16.221 -28.820  -4.578
  285   2HD1  LEU  38          3HD1      LEU  38 -14.892 -27.718  -4.215
  286   3HD1  LEU  38          2HD1      LEU  38 -16.458 -27.498  -3.434
  287   1HD2  LEU  38          3HD2      LEU  38 -15.872 -26.652  -7.559
  288   2HD2  LEU  38          2HD2      LEU  38 -14.538 -26.393  -6.434
  289   3HD2  LEU  38          1HD2      LEU  38 -15.107 -28.029  -6.765
  290    H    GLY  39           H        GLY  39 -20.888 -26.609  -6.119
  291   1HA   GLY  39          1HA       GLY  39 -21.904 -26.818  -8.832
  292   2HA   GLY  39          2HA       GLY  39 -22.817 -27.145  -7.360
  293    H    SER  40           H        SER  40 -20.028 -28.915  -7.101
  294    HA   SER  40           HA       SER  40 -21.454 -31.385  -7.813
  295   1HB   SER  40          2HB       SER  40 -19.438 -30.181  -9.551
  296   2HB   SER  40          1HB       SER  40 -19.014 -31.823  -9.068
  297    HG   SER  40           HG       SER  40 -21.204 -32.391  -9.690
  298    H    ILE  41           H        ILE  41 -20.860 -30.878  -5.293
  299    HA   ILE  41           HA       ILE  41 -18.502 -32.617  -4.770
  300    HB   ILE  41           HB       ILE  41 -18.026 -30.082  -4.460
  301   1HG1  ILE  41          2HG1      ILE  41 -17.570 -31.707  -1.967
  302   2HG1  ILE  41          1HG1      ILE  41 -16.800 -32.169  -3.484
  303   1HG2  ILE  41          1HG2      ILE  41 -20.332 -30.073  -3.055
  304   2HG2  ILE  41          3HG2      ILE  41 -19.196 -30.385  -1.742
  305   3HG2  ILE  41          2HG2      ILE  41 -19.020 -28.938  -2.736
  306   1HD1  ILE  41          1HD1      ILE  41 -16.632 -29.302  -2.664
  307   2HD1  ILE  41          3HD1      ILE  41 -15.637 -30.463  -1.784
  308   3HD1  ILE  41          2HD1      ILE  41 -15.458 -30.291  -3.532
  309    H    THR  42           H        THR  42 -18.556 -33.257  -2.326
  310    HA   THR  42           HA       THR  42 -21.402 -33.648  -1.495
  311    HB   THR  42           HB       THR  42 -21.129 -35.899  -1.379
  312    HG1  THR  42           HG1      THR  42 -19.460 -36.804  -0.245
  313   1HG2  THR  42          3HG2      THR  42 -19.991 -35.393  -3.551
  314   2HG2  THR  42          2HG2      THR  42 -18.448 -35.397  -2.695
  315   3HG2  THR  42          1HG2      THR  42 -19.407 -36.874  -2.790
  316    HA   PRO  43           HA       PRO  43 -20.195 -32.149   2.491
  317   1HB   PRO  43          2HB       PRO  43 -21.474 -33.824   4.190
  318   2HB   PRO  43          1HB       PRO  43 -22.316 -32.586   3.254
  319   1HG   PRO  43          2HG       PRO  43 -22.028 -35.518   2.694
  320   2HG   PRO  43          1HG       PRO  43 -23.467 -34.500   2.567
  321   1HD   PRO  43          1HD       PRO  43 -22.020 -35.179   0.396
  322   2HD   PRO  43          2HD       PRO  43 -22.813 -33.608   0.527
  323    H    ASP  44           H        ASP  44 -19.896 -35.625   1.933
  324    HA   ASP  44           HA       ASP  44 -18.136 -36.198   4.106
  325   1HB   ASP  44          2HB       ASP  44 -18.339 -37.552   1.399
  326   2HB   ASP  44          1HB       ASP  44 -17.562 -38.230   2.830
  327    H    GLU  45           H        GLU  45 -17.568 -34.719   0.968
  328    HA   GLU  45           HA       GLU  45 -14.667 -35.111   1.130
  329   1HB   GLU  45          2HB       GLU  45 -16.415 -33.435  -0.700
  330   2HB   GLU  45          1HB       GLU  45 -14.661 -33.548  -0.849
  331   1HG   GLU  45          2HG       GLU  45 -14.974 -36.082  -0.974
  332   2HG   GLU  45          1HG       GLU  45 -16.697 -35.763  -1.169
  333    H    VAL  46           H        VAL  46 -17.043 -32.592   1.768
  334    HA   VAL  46           HA       VAL  46 -15.128 -30.512   2.336
  335    HB   VAL  46           HB       VAL  46 -18.027 -30.904   3.110
  336   1HG1  VAL  46          1HG1      VAL  46 -16.031 -29.010   4.125
  337   2HG1  VAL  46          3HG1      VAL  46 -17.440 -28.214   3.424
  338   3HG1  VAL  46          2HG1      VAL  46 -17.644 -29.373   4.737
  339   1HG2  VAL  46          1HG2      VAL  46 -16.596 -29.868   0.815
  340   2HG2  VAL  46          3HG2      VAL  46 -18.329 -30.135   1.013
  341   3HG2  VAL  46          2HG2      VAL  46 -17.608 -28.611   1.529
  342    H    LYS  47           H        LYS  47 -16.728 -32.994   4.258
  343    HA   LYS  47           HA       LYS  47 -15.839 -32.059   6.826
  344   1HB   LYS  47          2HB       LYS  47 -16.614 -34.816   5.837
  345   2HB   LYS  47          1HB       LYS  47 -16.245 -34.461   7.524
  346   1HG   LYS  47          2HG       LYS  47 -18.031 -32.716   7.506
  347   2HG   LYS  47          1HG       LYS  47 -18.439 -33.191   5.857
  348   1HD   LYS  47          2HD       LYS  47 -18.867 -35.512   6.676
  349   2HD   LYS  47          1HD       LYS  47 -18.566 -34.955   8.323
  350   1HE   LYS  47          2HE       LYS  47 -20.566 -33.471   6.658
  351   2HE   LYS  47          1HE       LYS  47 -21.034 -35.025   7.349
  352   1HZ   LYS  47          3HZ       LYS  47 -20.312 -34.187   9.528
  353   2HZ   LYS  47          2HZ       LYS  47 -19.995 -32.670   8.831
  354   3HZ   LYS  47          1HZ       LYS  47 -21.582 -33.273   8.873
  355    H    HIS  48           H        HIS  48 -14.450 -34.272   4.437
  356    HA   HIS  48           HA       HIS  48 -12.194 -35.071   6.021
  357   1HB   HIS  48          2HB       HIS  48 -12.854 -36.311   4.009
  358   2HB   HIS  48          1HB       HIS  48 -12.503 -34.903   3.007
  359    HD1  HIS  48           HD1      HIS  48 -10.553 -35.982   1.718
  360    HD2  HIS  48           HD2      HIS  48 -10.012 -36.026   5.852
  361    HE1  HIS  48           HE1      HIS  48  -8.148 -36.668   2.119
  362    H    MET  49           H        MET  49 -12.701 -32.404   3.713
  363    HA   MET  49           HA       MET  49 -10.035 -31.435   3.666
  364   1HB   MET  49          2HB       MET  49 -12.736 -30.182   3.262
  365   2HB   MET  49          1HB       MET  49 -11.301 -29.162   3.317
  366   1HG   MET  49          2HG       MET  49 -10.329 -30.900   1.610
  367   2HG   MET  49          1HG       MET  49 -12.024 -31.304   1.336
  368   1HE   MET  49          1HE       MET  49 -12.134 -30.981  -0.714
  369   2HE   MET  49          3HE       MET  49 -13.349 -29.700  -0.811
  370   3HE   MET  49          2HE       MET  49 -11.846 -29.563  -1.718
  371    H    MET  50           H        MET  50 -12.729 -30.727   5.858
  372    HA   MET  50           HA       MET  50 -11.387 -28.780   7.449
  373   1HB   MET  50          2HB       MET  50 -13.719 -30.614   7.847
  374   2HB   MET  50          1HB       MET  50 -13.047 -29.792   9.254
  375   1HG   MET  50          2HG       MET  50 -13.199 -27.636   7.862
  376   2HG   MET  50          1HG       MET  50 -14.216 -28.560   6.755
  377   1HE   MET  50          2HE       MET  50 -13.536 -26.947   9.882
  378   2HE   MET  50          1HE       MET  50 -15.036 -26.825  10.799
  379   3HE   MET  50          3HE       MET  50 -14.045 -28.286  10.909
  380    H    ALA  51           H        ALA  51 -11.705 -32.297   7.858
  381    HA   ALA  51           HA       ALA  51 -10.186 -32.521  10.251
  382   1HB   ALA  51          1HB       ALA  51 -11.482 -34.291   8.564
  383   2HB   ALA  51          3HB       ALA  51  -9.786 -34.729   8.356
  384   3HB   ALA  51          2HB       ALA  51 -10.511 -34.748   9.963
  385    H    GLU  52           H        GLU  52  -9.228 -31.847   7.005
  386    HA   GLU  52           HA       GLU  52  -6.393 -32.527   7.567
  387   1HB   GLU  52          2HB       GLU  52  -7.926 -31.739   5.096
  388   2HB   GLU  52          1HB       GLU  52  -6.167 -31.633   5.129
  389   1HG   GLU  52          2HG       GLU  52  -7.521 -34.156   6.043
  390   2HG   GLU  52          1HG       GLU  52  -7.311 -33.855   4.318
  391    H    ILE  53           H        ILE  53  -8.509 -29.775   6.969
  392    HA   ILE  53           HA       ILE  53  -6.316 -27.840   7.081
  393    HB   ILE  53           HB       ILE  53  -9.322 -27.475   7.155
  394   1HG1  ILE  53          2HG1      ILE  53  -7.345 -27.164   4.882
  395   2HG1  ILE  53          1HG1      ILE  53  -8.417 -28.547   5.092
  396   1HG2  ILE  53          1HG2      ILE  53  -7.968 -25.598   8.119
  397   2HG2  ILE  53          3HG2      ILE  53  -7.137 -25.462   6.570
  398   3HG2  ILE  53          2HG2      ILE  53  -8.868 -25.147   6.671
  399   1HD1  ILE  53          2HD1      ILE  53  -9.747 -25.912   5.217
  400   2HD1  ILE  53          1HD1      ILE  53  -9.067 -26.328   3.643
  401   3HD1  ILE  53          3HD1      ILE  53 -10.251 -27.392   4.402
  402    H    ASP  54           H        ASP  54  -8.719 -29.180   9.268
  403    HA   ASP  54           HA       ASP  54  -8.532 -27.279  11.371
  404   1HB   ASP  54          2HB       ASP  54 -10.104 -29.355  10.988
  405   2HB   ASP  54          1HB       ASP  54  -8.864 -30.217  11.888
  406    H    THR  55           H        THR  55  -6.457 -26.669  11.951
  407    HA   THR  55           HA       THR  55  -4.235 -28.492  12.111
  408    HB   THR  55           HB       THR  55  -3.090 -26.597  13.255
  409    HG1  THR  55           HG1      THR  55  -4.431 -25.413  14.352
  410   1HG2  THR  55          3HG2      THR  55  -3.228 -26.695  10.788
  411   2HG2  THR  55          2HG2      THR  55  -4.751 -25.808  10.845
  412   3HG2  THR  55          1HG2      THR  55  -3.257 -25.030  11.367
  413    H    ASP  56           H        ASP  56  -6.305 -27.036  14.622
  414    HA   ASP  56           HA       ASP  56  -4.959 -28.660  16.681
  415   1HB   ASP  56          2HB       ASP  56  -6.154 -27.393  18.276
  416   2HB   ASP  56          1HB       ASP  56  -5.827 -26.240  16.984
  417    H    GLY  57           H        GLY  57  -8.110 -28.479  15.085
  418   1HA   GLY  57          1HA       GLY  57  -8.604 -31.271  15.996
  419   2HA   GLY  57          2HA       GLY  57  -9.349 -30.526  14.586
  420    H    ASP  58           H        ASP  58  -9.980 -28.020  16.122
  421    HA   ASP  58           HA       ASP  58 -11.786 -28.923  18.252
  422   1HB   ASP  58          2HB       ASP  58 -12.327 -26.600  18.565
  423   2HB   ASP  58          1HB       ASP  58 -10.592 -26.684  18.277
  424    H    GLY  59           H        GLY  59 -11.938 -28.970  14.932
  425   1HA   GLY  59          1HA       GLY  59 -14.904 -29.110  15.038
  426   2HA   GLY  59          2HA       GLY  59 -13.893 -29.839  13.792
  427    H    PHE  60           H        PHE  60 -12.695 -26.785  14.398
  428    HA   PHE  60           HA       PHE  60 -14.193 -25.720  12.051
  429   1HB   PHE  60          2HB       PHE  60 -13.491 -24.046  14.469
  430   2HB   PHE  60          1HB       PHE  60 -14.475 -23.579  13.083
  431    HD1  PHE  60           HD1      PHE  60 -16.722 -24.540  12.748
  432    HD2  PHE  60           HD2      PHE  60 -14.388 -25.416  16.244
  433    HE1  PHE  60           HE1      PHE  60 -18.747 -25.401  13.884
  434    HE2  PHE  60           HE2      PHE  60 -16.416 -26.273  17.383
  435    HZ   PHE  60           HZ       PHE  60 -18.598 -26.269  16.204
  436    H    ILE  61           H        ILE  61 -13.085 -24.051  10.871
  437    HA   ILE  61           HA       ILE  61 -10.132 -24.157  11.198
  438    HB   ILE  61           HB       ILE  61 -11.711 -23.356   8.743
  439   1HG1  ILE  61          2HG1      ILE  61 -12.240 -25.682   9.294
  440   2HG1  ILE  61          1HG1      ILE  61 -11.163 -25.635   7.898
  441   1HG2  ILE  61          3HG2      ILE  61  -9.341 -22.578   8.942
  442   2HG2  ILE  61          2HG2      ILE  61  -8.836 -24.261   9.087
  443   3HG2  ILE  61          1HG2      ILE  61  -9.588 -23.691   7.597
  444   1HD1  ILE  61          2HD1      ILE  61  -9.227 -25.982   9.461
  445   2HD1  ILE  61          1HD1      ILE  61 -10.385 -26.198  10.773
  446   3HD1  ILE  61          3HD1      ILE  61 -10.355 -27.340   9.428
  447    H    SER  62           H        SER  62  -9.141 -22.231  11.730
  448    HA   SER  62           HA       SER  62 -10.846 -19.799  11.802
  449   1HB   SER  62          2HB       SER  62  -8.449 -19.125  12.994
  450   2HB   SER  62          1HB       SER  62  -9.877 -19.699  13.856
  451    HG   SER  62           HG       SER  62  -7.518 -20.869  13.642
  452    H    PHE  63           H        PHE  63  -9.637 -17.725  11.199
  453    HA   PHE  63           HA       PHE  63  -8.781 -17.830   8.514
  454   1HB   PHE  63          2HB       PHE  63  -9.475 -15.731   9.649
  455   2HB   PHE  63          1HB       PHE  63  -7.980 -15.764  10.589
  456    HD1  PHE  63           HD1      PHE  63  -8.916 -16.331   7.000
  457    HD2  PHE  63           HD2      PHE  63  -6.349 -14.310   9.787
  458    HE1  PHE  63           HE1      PHE  63  -7.712 -15.263   5.115
  459    HE2  PHE  63           HE2      PHE  63  -5.142 -13.244   7.903
  460    HZ   PHE  63           HZ       PHE  63  -5.828 -13.719   5.564
  461    H    GLN  64           H        GLN  64  -6.883 -17.811  11.508
  462    HA   GLN  64           HA       GLN  64  -4.300 -17.793  10.334
  463   1HB   GLN  64          2HB       GLN  64  -4.847 -17.526  12.783
  464   2HB   GLN  64          1HB       GLN  64  -5.135 -19.264  12.851
  465   1HG   GLN  64          2HG       GLN  64  -2.861 -18.915  13.554
  466   2HG   GLN  64          1HG       GLN  64  -2.789 -19.576  11.921
  467   1HE2  GLN  64          1HE2      GLN  64  -1.216 -18.495  10.733
  468   2HE2  GLN  64          2HE2      GLN  64  -0.901 -16.829  10.815
  469    H    GLU  65           H        GLU  65  -6.385 -20.549  11.272
  470    HA   GLU  65           HA       GLU  65  -4.608 -22.595  10.386
  471   1HB   GLU  65          2HB       GLU  65  -7.603 -22.472  10.743
  472   2HB   GLU  65          1HB       GLU  65  -6.794 -23.934  10.191
  473   1HG   GLU  65          2HG       GLU  65  -5.386 -23.926  12.219
  474   2HG   GLU  65          1HG       GLU  65  -6.196 -22.461  12.774
  475    H    PHE  66           H        PHE  66  -7.315 -20.960   8.752
  476    HA   PHE  66           HA       PHE  66  -7.128 -22.355   6.280
  477   1HB   PHE  66          2HB       PHE  66  -9.007 -20.834   6.928
  478   2HB   PHE  66          1HB       PHE  66  -7.926 -19.459   6.702
  479    HD1  PHE  66           HD1      PHE  66  -7.052 -18.896   4.453
  480    HD2  PHE  66           HD2      PHE  66  -9.906 -22.052   5.044
  481    HE1  PHE  66           HE1      PHE  66  -7.549 -18.903   2.023
  482    HE2  PHE  66           HE2      PHE  66 -10.402 -22.059   2.614
  483    HZ   PHE  66           HZ       PHE  66  -9.224 -20.484   1.104
  484    H    THR  67           H        THR  67  -5.442 -19.487   7.488
  485    HA   THR  67           HA       THR  67  -4.067 -18.882   5.035
  486    HB   THR  67           HB       THR  67  -3.433 -18.267   7.934
  487    HG1  THR  67           HG1      THR  67  -4.510 -16.493   7.536
  488   1HG2  THR  67          2HG2      THR  67  -1.968 -17.577   5.394
  489   2HG2  THR  67          1HG2      THR  67  -1.896 -16.513   6.798
  490   3HG2  THR  67          3HG2      THR  67  -1.311 -18.173   6.918
  491    H    ASP  68           H        ASP  68  -3.124 -20.750   7.928
  492    HA   ASP  68           HA       ASP  68  -0.525 -21.475   7.044
  493   1HB   ASP  68          2HB       ASP  68  -2.491 -22.940   8.822
  494   2HB   ASP  68          1HB       ASP  68  -0.820 -23.453   8.589
  495    H    PHE  69           H        PHE  69  -3.681 -23.001   6.480
  496    HA   PHE  69           HA       PHE  69  -2.546 -25.201   4.960
  497   1HB   PHE  69          2HB       PHE  69  -4.581 -25.878   5.775
  498   2HB   PHE  69          1HB       PHE  69  -5.242 -24.246   5.761
  499    HD1  PHE  69           HD1      PHE  69  -5.819 -23.210   3.496
  500    HD2  PHE  69           HD2      PHE  69  -5.126 -27.404   4.066
  501    HE1  PHE  69           HE1      PHE  69  -7.010 -23.695   1.371
  502    HE2  PHE  69           HE2      PHE  69  -6.311 -27.893   1.947
  503    HZ   PHE  69           HZ       PHE  69  -7.258 -26.039   0.596
  504    H    GLY  70           H        GLY  70  -3.974 -22.054   4.231
  505   1HA   GLY  70          1HA       GLY  70  -3.954 -20.799   2.247
  506   2HA   GLY  70          2HA       GLY  70  -4.192 -22.335   1.411
  507    H    ARG  71           H        ARG  71  -1.429 -21.594   3.480
  508    HA   ARG  71           HA       ARG  71   0.370 -20.817   1.379
  509   1HB   ARG  71          2HB       ARG  71   0.906 -22.044   4.102
  510   2HB   ARG  71          1HB       ARG  71   2.155 -21.380   3.048
  511   1HG   ARG  71          2HG       ARG  71   0.954 -19.192   3.071
  512   2HG   ARG  71          1HG       ARG  71  -0.205 -19.870   4.213
  513   1HD   ARG  71          2HD       ARG  71   2.771 -19.474   4.635
  514   2HD   ARG  71          1HD       ARG  71   1.454 -18.674   5.495
  515    HE   ARG  71           HE       ARG  71   1.089 -21.430   5.910
  516   1HH1  ARG  71          1HH1      ARG  71   3.730 -19.255   6.249
  517   2HH1  ARG  71          2HH1      ARG  71   4.237 -19.892   7.776
  518   1HH2  ARG  71          1HH2      ARG  71   1.626 -22.162   8.000
  519   2HH2  ARG  71          2HH2      ARG  71   3.046 -21.537   8.768
  520    H    ALA  72           H        ALA  72  -0.592 -23.926   2.722
  521    HA   ALA  72           HA       ALA  72   1.456 -25.491   1.437
  522   1HB   ALA  72          1HB       ALA  72   0.500 -27.022   2.785
  523   2HB   ALA  72          2HB       ALA  72  -0.879 -27.071   1.687
  524   3HB   ALA  72          3HB       ALA  72  -0.884 -25.964   3.060
  525    H    ASN  73           H        ASN  73  -1.449 -23.989   0.316
  526    HA   ASN  73           HA       ASN  73  -0.898 -24.968  -2.409
  527   1HB   ASN  73          2HB       ASN  73  -3.726 -25.230  -1.426
  528   2HB   ASN  73          1HB       ASN  73  -2.938 -26.047  -2.776
  529   1HD2  ASN  73          1HD2      ASN  73  -3.917 -26.456   0.455
  530   2HD2  ASN  73          2HD2      ASN  73  -2.984 -27.825   0.822
  531    H    ARG  74           H        ARG  74  -0.442 -22.450  -1.737
  532    HA   ARG  74           HA       ARG  74  -2.499 -20.563  -1.596
  533   1HB   ARG  74          2HB       ARG  74   0.179 -20.481  -2.996
  534   2HB   ARG  74          1HB       ARG  74  -0.899 -19.084  -2.974
  535   1HG   ARG  74          2HG       ARG  74  -0.979 -19.414  -0.417
  536   2HG   ARG  74          1HG       ARG  74   0.416 -20.471  -0.634
  537   1HD   ARG  74          2HD       ARG  74   0.267 -17.599  -1.599
  538   2HD   ARG  74          1HD       ARG  74   1.067 -18.115  -0.115
  539    HE   ARG  74           HE       ARG  74   1.984 -18.754  -2.872
  540   1HH1  ARG  74          1HH1      ARG  74   2.249 -20.345  -0.018
  541   2HH1  ARG  74          2HH1      ARG  74   3.956 -20.134   0.187
  542   1HH2  ARG  74          1HH2      ARG  74   4.249 -17.817  -2.375
  543   2HH2  ARG  74          2HH2      ARG  74   5.088 -18.703  -1.147
  544    H    GLY  75           H        GLY  75  -1.277 -22.323  -4.392
  545   1HA   GLY  75          1HA       GLY  75  -2.187 -22.617  -6.520
  546   2HA   GLY  75          2HA       GLY  75  -2.693 -20.930  -6.423
  547    H    LEU  76           H        LEU  76  -3.703 -23.374  -4.116
  548    HA   LEU  76           HA       LEU  76  -6.207 -24.034  -5.374
  549   1HB   LEU  76          2HB       LEU  76  -5.245 -24.221  -2.512
  550   2HB   LEU  76          1HB       LEU  76  -6.838 -24.782  -3.019
  551    HG   LEU  76           HG       LEU  76  -4.184 -25.738  -4.140
  552   1HD1  LEU  76          1HD1      LEU  76  -5.484 -26.448  -1.769
  553   2HD1  LEU  76          3HD1      LEU  76  -5.952 -27.706  -2.912
  554   3HD1  LEU  76          2HD1      LEU  76  -4.245 -27.390  -2.599
  555   1HD2  LEU  76          3HD2      LEU  76  -7.000 -26.012  -5.001
  556   2HD2  LEU  76          2HD2      LEU  76  -5.515 -26.189  -5.936
  557   3HD2  LEU  76          1HD2      LEU  76  -6.094 -27.522  -4.938
  558    H    LEU  77           H        LEU  77  -5.326 -21.694  -2.849
  559    HA   LEU  77           HA       LEU  77  -7.974 -20.708  -2.410
  560   1HB   LEU  77          2HB       LEU  77  -5.328 -19.258  -2.096
  561   2HB   LEU  77          1HB       LEU  77  -6.863 -18.762  -1.385
  562    HG   LEU  77           HG       LEU  77  -5.242 -21.239  -0.764
  563   1HD1  LEU  77          2HD1      LEU  77  -6.056 -18.732   0.650
  564   2HD1  LEU  77          1HD1      LEU  77  -5.897 -20.207   1.603
  565   3HD1  LEU  77          3HD1      LEU  77  -4.518 -19.592   0.693
  566   1HD2  LEU  77          1HD2      LEU  77  -8.162 -20.683  -0.423
  567   2HD2  LEU  77          3HD2      LEU  77  -7.345 -22.209  -0.758
  568   3HD2  LEU  77          2HD2      LEU  77  -7.323 -21.536   0.872
  569    H    LYS  78           H        LYS  78  -5.531 -19.943  -4.826
  570    HA   LYS  78           HA       LYS  78  -6.708 -17.510  -5.779
  571   1HB   LYS  78          2HB       LYS  78  -5.029 -19.595  -7.206
  572   2HB   LYS  78          1HB       LYS  78  -5.431 -18.014  -7.875
  573   1HG   LYS  78          2HG       LYS  78  -4.375 -16.960  -5.858
  574   2HG   LYS  78          1HG       LYS  78  -3.862 -18.564  -5.339
  575   1HD   LYS  78          2HD       LYS  78  -2.136 -17.205  -6.652
  576   2HD   LYS  78          1HD       LYS  78  -2.449 -18.836  -7.245
  577   1HE   LYS  78          2HE       LYS  78  -3.884 -18.007  -8.992
  578   2HE   LYS  78          1HE       LYS  78  -3.866 -16.380  -8.314
  579   1HZ   LYS  78          2HZ       LYS  78  -1.415 -16.394  -8.683
  580   2HZ   LYS  78          1HZ       LYS  78  -1.603 -17.842  -9.551
  581   3HZ   LYS  78          3HZ       LYS  78  -2.340 -16.421 -10.108
  582    H    ASP  79           H        ASP  79  -7.469 -20.883  -6.266
  583    HA   ASP  79           HA       ASP  79  -9.144 -20.445  -8.607
  584   1HB   ASP  79          2HB       ASP  79  -8.115 -22.644  -8.153
  585   2HB   ASP  79          1HB       ASP  79  -9.055 -22.774  -6.666
  586    H    VAL  80           H        VAL  80  -9.645 -20.600  -5.119
  587    HA   VAL  80           HA       VAL  80 -12.559 -20.492  -5.366
  588    HB   VAL  80           HB       VAL  80 -10.844 -19.976  -2.921
  589   1HG1  VAL  80          2HG1      VAL  80 -13.426 -19.420  -3.124
  590   2HG1  VAL  80          1HG1      VAL  80 -13.598 -21.163  -2.918
  591   3HG1  VAL  80          3HG1      VAL  80 -12.794 -20.203  -1.675
  592   1HG2  VAL  80          3HG2      VAL  80 -11.785 -22.512  -4.240
  593   2HG2  VAL  80          2HG2      VAL  80 -10.201 -22.138  -3.560
  594   3HG2  VAL  80          1HG2      VAL  80 -11.569 -22.452  -2.491
  595    H    ALA  81           H        ALA  81  -9.917 -18.220  -4.903
  596    HA   ALA  81           HA       ALA  81 -11.473 -15.976  -4.052
  597   1HB   ALA  81          1HB       ALA  81  -9.510 -14.828  -4.185
  598   2HB   ALA  81          3HB       ALA  81  -8.808 -16.427  -4.426
  599   3HB   ALA  81          2HB       ALA  81  -9.172 -15.405  -5.817
  600    H    LYS  82           H        LYS  82 -11.211 -17.554  -7.111
  601    HA   LYS  82           HA       LYS  82 -12.182 -15.196  -8.603
  602   1HB   LYS  82          2HB       LYS  82 -11.655 -18.053  -9.481
  603   2HB   LYS  82          1HB       LYS  82 -12.118 -16.736 -10.558
  604   1HG   LYS  82          2HG       LYS  82 -10.080 -15.476  -9.689
  605   2HG   LYS  82          1HG       LYS  82  -9.583 -16.984  -8.922
  606   1HD   LYS  82          2HD       LYS  82  -9.786 -18.081 -11.205
  607   2HD   LYS  82          1HD       LYS  82  -9.983 -16.464 -11.878
  608   1HE   LYS  82          2HE       LYS  82  -7.666 -16.845 -12.069
  609   2HE   LYS  82          1HE       LYS  82  -7.797 -15.904 -10.583
  610   1HZ   LYS  82          3HZ       LYS  82  -8.016 -18.226  -9.497
  611   2HZ   LYS  82          2HZ       LYS  82  -7.275 -18.779 -10.923
  612   3HZ   LYS  82          1HZ       LYS  82  -6.481 -17.650  -9.931
  613    H    ILE  83           H        ILE  83 -13.374 -18.197  -7.237
  614    HA   ILE  83           HA       ILE  83 -15.899 -18.266  -8.591
  615    HB   ILE  83           HB       ILE  83 -15.168 -19.277  -5.826
  616   1HG1  ILE  83          2HG1      ILE  83 -14.998 -20.494  -8.590
  617   2HG1  ILE  83          1HG1      ILE  83 -13.704 -20.309  -7.407
  618   1HG2  ILE  83          3HG2      ILE  83 -17.613 -19.076  -6.259
  619   2HG2  ILE  83          2HG2      ILE  83 -17.418 -20.084  -7.694
  620   3HG2  ILE  83          1HG2      ILE  83 -17.098 -20.755  -6.094
  621   1HD1  ILE  83          3HD1      ILE  83 -14.972 -21.856  -5.881
  622   2HD1  ILE  83          2HD1      ILE  83 -16.116 -22.134  -7.194
  623   3HD1  ILE  83          1HD1      ILE  83 -14.432 -22.623  -7.376
  624    H    PHE  84           H        PHE  84 -14.773 -16.652  -5.670
  625    HA   PHE  84           HA       PHE  84 -17.463 -15.399  -5.361
  626   1HB   PHE  84          2HB       PHE  84 -15.142 -15.439  -3.412
  627   2HB   PHE  84          1HB       PHE  84 -16.784 -14.882  -3.082
  628    HD1  PHE  84           HD1      PHE  84 -18.654 -16.484  -2.936
  629    HD2  PHE  84           HD2      PHE  84 -14.614 -17.800  -3.573
  630    HE1  PHE  84           HE1      PHE  84 -19.318 -18.803  -2.359
  631    HE2  PHE  84           HE2      PHE  84 -15.279 -20.119  -2.993
  632    HZ   PHE  84           HZ       PHE  84 -17.631 -20.619  -2.386

  No H/Q in entry =         632
  Start of MODEL    5
    1    H1   ALA   1          1H        ALA   1  10.104 -14.800   4.314
    2    H2   ALA   1          3H        ALA   1   9.888 -16.315   5.045
    3    H3   ALA   1          2H        ALA   1  10.734 -16.196   3.577
    4    HA   ALA   1           HA       ALA   1   8.652 -16.976   2.941
    5   1HB   ALA   1          1HB       ALA   1   6.832 -15.065   3.992
    6   2HB   ALA   1          2HB       ALA   1   7.854 -15.589   5.330
    7   3HB   ALA   1          3HB       ALA   1   6.946 -16.778   4.395
    8    H    ASP   2           H        ASP   2   8.330 -16.308   0.878
    9    HA   ASP   2           HA       ASP   2   8.960 -13.537   0.137
   10   1HB   ASP   2          2HB       ASP   2   8.498 -14.361  -2.186
   11   2HB   ASP   2          1HB       ASP   2   9.714 -15.319  -1.341
   12    H    ASP   3           H        ASP   3   6.202 -15.185   1.174
   13    HA   ASP   3           HA       ASP   3   4.180 -14.001  -0.472
   14   1HB   ASP   3          2HB       ASP   3   4.020 -14.872   2.430
   15   2HB   ASP   3          1HB       ASP   3   2.642 -14.567   1.374
   16    H    HIS   4           H        HIS   4   2.939 -12.101  -0.131
   17    HA   HIS   4           HA       HIS   4   4.192 -10.141   1.752
   18   1HB   HIS   4          2HB       HIS   4   2.513  -8.892  -0.246
   19   2HB   HIS   4          1HB       HIS   4   4.223  -8.629   0.078
   20    HD1  HIS   4           HD1      HIS   4   1.987  -9.939  -2.444
   21    HD2  HIS   4           HD2      HIS   4   5.896 -10.763  -1.253
   22    HE1  HIS   4           HE1      HIS   4   3.062 -11.210  -4.350
   23    HA   PRO   5           HA       PRO   5   0.325  -9.459   3.807
   24   1HB   PRO   5          2HB       PRO   5  -0.080  -6.787   3.716
   25   2HB   PRO   5          1HB       PRO   5   1.150  -7.536   4.738
   26   1HG   PRO   5          2HG       PRO   5   1.449  -6.221   2.062
   27   2HG   PRO   5          1HG       PRO   5   2.472  -6.070   3.494
   28   1HD   PRO   5          1HD       PRO   5   3.148  -7.657   1.419
   29   2HD   PRO   5          2HD       PRO   5   3.566  -8.068   3.083
   30    H    GLN   6           H        GLN   6   0.619  -8.186   0.567
   31    HA   GLN   6           HA       GLN   6  -2.099  -7.430   0.130
   32   1HB   GLN   6          2HB       GLN   6   0.234  -8.139  -1.579
   33   2HB   GLN   6          1HB       GLN   6  -1.359  -8.237  -2.330
   34   1HG   GLN   6          2HG       GLN   6  -1.799  -5.952  -1.992
   35   2HG   GLN   6          1HG       GLN   6  -0.578  -5.810  -0.727
   36   1HE2  GLN   6          1HE2      GLN   6   1.774  -6.347  -1.598
   37   2HE2  GLN   6          2HE2      GLN   6   2.158  -5.699  -3.119
   38    H    ASP   7           H        ASP   7  -0.408 -10.521  -0.337
   39    HA   ASP   7           HA       ASP   7  -2.570 -11.972  -1.459
   40   1HB   ASP   7          2HB       ASP   7  -0.291 -12.867   0.321
   41   2HB   ASP   7          1HB       ASP   7  -1.425 -13.988  -0.434
   42    H    LYS   8           H        LYS   8  -1.719 -11.363   1.930
   43    HA   LYS   8           HA       LYS   8  -3.618 -13.013   3.190
   44   1HB   LYS   8          2HB       LYS   8  -2.343 -10.393   3.900
   45   2HB   LYS   8          1HB       LYS   8  -3.659 -11.001   4.906
   46   1HG   LYS   8          2HG       LYS   8  -2.293 -13.249   4.824
   47   2HG   LYS   8          1HG       LYS   8  -0.945 -12.189   4.413
   48   1HD   LYS   8          2HD       LYS   8  -1.546 -10.804   6.447
   49   2HD   LYS   8          1HD       LYS   8  -2.681 -12.078   6.892
   50   1HE   LYS   8          2HE       LYS   8  -1.005 -13.289   7.782
   51   2HE   LYS   8          1HE       LYS   8  -0.153 -13.275   6.238
   52   1HZ   LYS   8          3HZ       LYS   8  -0.090 -10.934   8.032
   53   2HZ   LYS   8          2HZ       LYS   8   0.988 -12.228   8.249
   54   3HZ   LYS   8          1HZ       LYS   8   0.990 -11.351   6.793
   55    H    ALA   9           H        ALA   9  -4.019  -9.858   1.671
   56    HA   ALA   9           HA       ALA   9  -6.658  -9.298   2.562
   57   1HB   ALA   9          1HB       ALA   9  -5.645  -8.635  -0.206
   58   2HB   ALA   9          3HB       ALA   9  -6.777  -7.717   0.786
   59   3HB   ALA   9          2HB       ALA   9  -5.070  -7.777   1.224
   60    H    GLU  10           H        GLU  10  -5.505 -11.073  -0.289
   61    HA   GLU  10           HA       GLU  10  -8.147 -11.740  -1.239
   62   1HB   GLU  10          2HB       GLU  10  -5.585 -13.283  -1.725
   63   2HB   GLU  10          1HB       GLU  10  -7.031 -13.276  -2.735
   64   1HG   GLU  10          2HG       GLU  10  -5.250 -10.881  -2.186
   65   2HG   GLU  10          1HG       GLU  10  -5.285 -11.810  -3.685
   66    H    ARG  11           H        ARG  11  -5.790 -13.372   0.833
   67    HA   ARG  11           HA       ARG  11  -7.302 -15.801   1.150
   68   1HB   ARG  11          2HB       ARG  11  -5.123 -14.482   2.775
   69   2HB   ARG  11          1HB       ARG  11  -5.845 -16.019   3.249
   70   1HG   ARG  11          2HG       ARG  11  -5.294 -16.850   0.907
   71   2HG   ARG  11          1HG       ARG  11  -4.329 -15.392   0.704
   72   1HD   ARG  11          2HD       ARG  11  -3.931 -17.627   2.700
   73   2HD   ARG  11          1HD       ARG  11  -2.809 -17.069   1.460
   74    HE   ARG  11           HE       ARG  11  -3.558 -15.118   3.543
   75   1HH1  ARG  11          1HH1      ARG  11  -1.678 -17.831   3.624
   76   2HH1  ARG  11          2HH1      ARG  11  -0.168 -17.026   3.886
   77   1HH2  ARG  11          1HH2      ARG  11  -1.447 -13.863   3.279
   78   2HH2  ARG  11          2HH2      ARG  11  -0.038 -14.779   3.693
   79    H    GLU  12           H        GLU  12  -7.155 -12.762   2.945
   80    HA   GLU  12           HA       GLU  12  -8.875 -13.599   5.095
   81   1HB   GLU  12          2HB       GLU  12  -7.813 -11.009   4.072
   82   2HB   GLU  12          1HB       GLU  12  -9.248 -10.940   5.093
   83   1HG   GLU  12          2HG       GLU  12  -7.869 -12.587   6.625
   84   2HG   GLU  12          1HG       GLU  12  -6.487 -11.907   5.767
   85    H    ARG  13           H        ARG  13  -9.456 -12.006   1.985
   86    HA   ARG  13           HA       ARG  13 -12.265 -11.560   2.416
   87   1HB   ARG  13          2HB       ARG  13 -10.652 -11.854  -0.135
   88   2HB   ARG  13          1HB       ARG  13 -12.346 -11.367  -0.093
   89   1HG   ARG  13          2HG       ARG  13 -11.856  -9.346   1.032
   90   2HG   ARG  13          1HG       ARG  13 -10.264  -9.912   1.535
   91   1HD   ARG  13          2HD       ARG  13  -9.306  -9.247  -0.405
   92   2HD   ARG  13          1HD       ARG  13 -10.609  -9.935  -1.374
   93    HE   ARG  13           HE       ARG  13 -11.899  -7.793  -0.637
   94   1HH1  ARG  13          1HH1      ARG  13  -8.697  -7.508   0.208
   95   2HH1  ARG  13          2HH1      ARG  13  -8.377  -6.087  -0.728
   96   1HH2  ARG  13          1HH2      ARG  13 -11.412  -6.187  -2.404
   97   2HH2  ARG  13          2HH2      ARG  13  -9.914  -5.340  -2.209
   98    H    ILE  14           H        ILE  14 -10.417 -14.218   0.974
   99    HA   ILE  14           HA       ILE  14 -12.748 -15.740   0.193
  100    HB   ILE  14           HB       ILE  14  -9.945 -16.732   0.796
  101   1HG1  ILE  14          2HG1      ILE  14 -10.996 -16.109  -1.948
  102   2HG1  ILE  14          1HG1      ILE  14 -10.340 -14.810  -0.955
  103   1HG2  ILE  14          2HG2      ILE  14 -12.411 -17.991  -0.106
  104   2HG2  ILE  14          1HG2      ILE  14 -11.118 -18.186  -1.291
  105   3HG2  ILE  14          3HG2      ILE  14 -10.885 -18.739   0.369
  106   1HD1  ILE  14          1HD1      ILE  14  -8.598 -17.108  -0.831
  107   2HD1  ILE  14          3HD1      ILE  14  -8.891 -16.672  -2.514
  108   3HD1  ILE  14          2HD1      ILE  14  -8.235 -15.477  -1.395
  109    H    PHE  15           H        PHE  15 -10.536 -15.878   2.995
  110    HA   PHE  15           HA       PHE  15 -11.893 -18.032   4.304
  111   1HB   PHE  15          2HB       PHE  15  -9.625 -17.301   4.957
  112   2HB   PHE  15          1HB       PHE  15 -10.284 -15.767   5.533
  113    HD1  PHE  15           HD1      PHE  15 -10.101 -19.409   6.116
  114    HD2  PHE  15           HD2      PHE  15 -11.620 -15.668   7.582
  115    HE1  PHE  15           HE1      PHE  15 -10.667 -20.486   8.276
  116    HE2  PHE  15           HE2      PHE  15 -12.184 -16.745   9.745
  117    HZ   PHE  15           HZ       PHE  15 -11.711 -19.158  10.091
  118    H    LYS  16           H        LYS  16 -12.377 -14.537   4.307
  119    HA   LYS  16           HA       LYS  16 -14.295 -14.478   6.448
  120   1HB   LYS  16          2HB       LYS  16 -13.607 -12.639   4.170
  121   2HB   LYS  16          1HB       LYS  16 -15.045 -12.326   5.142
  122   1HG   LYS  16          2HG       LYS  16 -13.655 -12.351   7.190
  123   2HG   LYS  16          1HG       LYS  16 -12.219 -12.638   6.206
  124   1HD   LYS  16          2HD       LYS  16 -12.752 -10.501   4.966
  125   2HD   LYS  16          1HD       LYS  16 -14.014 -10.196   6.160
  126   1HE   LYS  16          2HE       LYS  16 -11.552 -10.901   7.496
  127   2HE   LYS  16          1HE       LYS  16 -11.266  -9.567   6.378
  128   1HZ   LYS  16          3HZ       LYS  16 -13.615  -8.895   7.524
  129   2HZ   LYS  16          2HZ       LYS  16 -12.790  -9.624   8.818
  130   3HZ   LYS  16          1HZ       LYS  16 -12.098  -8.306   8.001
  131    H    ARG  17           H        ARG  17 -14.517 -15.199   3.018
  132    HA   ARG  17           HA       ARG  17 -17.391 -15.023   2.832
  133   1HB   ARG  17          2HB       ARG  17 -15.285 -16.442   1.193
  134   2HB   ARG  17          1HB       ARG  17 -17.002 -16.556   0.808
  135   1HG   ARG  17          2HG       ARG  17 -17.004 -13.980   0.875
  136   2HG   ARG  17          1HG       ARG  17 -15.246 -14.098   0.818
  137   1HD   ARG  17          2HD       ARG  17 -15.490 -15.534  -1.240
  138   2HD   ARG  17          1HD       ARG  17 -17.215 -15.173  -1.219
  139    HE   ARG  17           HE       ARG  17 -16.121 -12.670  -1.183
  140   1HH1  ARG  17          1HH1      ARG  17 -13.805 -14.400  -2.444
  141   2HH1  ARG  17          2HH1      ARG  17 -14.053 -14.022  -4.116
  142   1HH2  ARG  17          1HH2      ARG  17 -17.196 -12.646  -3.612
  143   2HH2  ARG  17          2HH2      ARG  17 -15.972 -13.029  -4.777
  144    H    PHE  18           H        PHE  18 -15.125 -17.622   3.625
  145    HA   PHE  18           HA       PHE  18 -17.100 -19.715   3.707
  146   1HB   PHE  18          2HB       PHE  18 -14.372 -19.420   4.977
  147   2HB   PHE  18          1HB       PHE  18 -15.353 -20.873   5.161
  148    HD1  PHE  18           HD1      PHE  18 -16.151 -22.075   3.046
  149    HD2  PHE  18           HD2      PHE  18 -13.094 -19.058   3.021
  150    HE1  PHE  18           HE1      PHE  18 -15.379 -22.876   0.829
  151    HE2  PHE  18           HE2      PHE  18 -12.322 -19.858   0.804
  152    HZ   PHE  18           HZ       PHE  18 -13.465 -21.768  -0.292
  153    H    ASP  19           H        ASP  19 -15.636 -17.722   6.279
  154    HA   ASP  19           HA       ASP  19 -17.108 -18.813   8.443
  155   1HB   ASP  19          2HB       ASP  19 -15.182 -17.028   8.414
  156   2HB   ASP  19          1HB       ASP  19 -16.505 -15.865   8.307
  157    H    ALA  20           H        ALA  20 -19.303 -19.115   8.180
  158    HA   ALA  20           HA       ALA  20 -21.003 -17.340   6.708
  159   1HB   ALA  20          1HB       ALA  20 -21.241 -19.876   7.714
  160   2HB   ALA  20          3HB       ALA  20 -22.293 -18.965   8.796
  161   3HB   ALA  20          2HB       ALA  20 -22.577 -18.932   7.055
  162    H    ASN  21           H        ASN  21 -20.692 -17.808  10.273
  163    HA   ASN  21           HA       ASN  21 -22.383 -15.428  10.661
  164   1HB   ASN  21          2HB       ASN  21 -22.256 -15.929  13.036
  165   2HB   ASN  21          1HB       ASN  21 -22.619 -17.407  12.152
  166   1HD2  ASN  21          1HD2      ASN  21 -21.346 -17.163  14.798
  167   2HD2  ASN  21          2HD2      ASN  21 -19.828 -17.905  14.670
  168    H    GLY  22           H        GLY  22 -18.993 -16.291  10.802
  169   1HA   GLY  22          1HA       GLY  22 -18.365 -13.407  11.034
  170   2HA   GLY  22          2HA       GLY  22 -17.234 -14.667  10.551
  171    H    ASP  23           H        ASP  23 -17.768 -16.444  12.761
  172    HA   ASP  23           HA       ASP  23 -17.072 -14.824  15.145
  173   1HB   ASP  23          2HB       ASP  23 -17.309 -16.924  16.413
  174   2HB   ASP  23          1HB       ASP  23 -18.746 -16.606  15.445
  175    H    GLY  24           H        GLY  24 -15.397 -15.918  12.611
  176   1HA   GLY  24          1HA       GLY  24 -12.913 -16.109  14.204
  177   2HA   GLY  24          2HA       GLY  24 -13.004 -15.843  12.464
  178    H    LYS  25           H        LYS  25 -15.098 -18.347  13.328
  179    HA   LYS  25           HA       LYS  25 -13.026 -20.339  12.525
  180   1HB   LYS  25          2HB       LYS  25 -13.939 -21.944  14.106
  181   2HB   LYS  25          1HB       LYS  25 -13.533 -20.467  14.976
  182   1HG   LYS  25          2HG       LYS  25 -15.810 -19.792  15.088
  183   2HG   LYS  25          1HG       LYS  25 -16.303 -20.985  13.885
  184   1HD   LYS  25          2HD       LYS  25 -15.377 -22.734  15.585
  185   2HD   LYS  25          1HD       LYS  25 -15.502 -21.421  16.758
  186   1HE   LYS  25          2HE       LYS  25 -17.892 -21.693  15.079
  187   2HE   LYS  25          1HE       LYS  25 -17.561 -23.127  16.050
  188   1HZ   LYS  25          1HZ       LYS  25 -17.210 -20.661  17.483
  189   2HZ   LYS  25          3HZ       LYS  25 -18.798 -20.892  16.936
  190   3HZ   LYS  25          2HZ       LYS  25 -18.064 -22.062  17.925
  191    H    ILE  26           H        ILE  26 -13.708 -21.908  11.100
  192    HA   ILE  26           HA       ILE  26 -16.487 -21.596  10.042
  193    HB   ILE  26           HB       ILE  26 -14.215 -22.862   8.530
  194   1HG1  ILE  26          2HG1      ILE  26 -14.874 -19.909   8.729
  195   2HG1  ILE  26          1HG1      ILE  26 -13.376 -20.682   9.247
  196   1HG2  ILE  26          3HG2      ILE  26 -16.599 -23.029   7.744
  197   2HG2  ILE  26          2HG2      ILE  26 -16.632 -21.269   7.629
  198   3HG2  ILE  26          1HG2      ILE  26 -15.537 -22.199   6.607
  199   1HD1  ILE  26          1HD1      ILE  26 -14.099 -21.301   6.473
  200   2HD1  ILE  26          3HD1      ILE  26 -13.823 -19.582   6.751
  201   3HD1  ILE  26          2HD1      ILE  26 -12.560 -20.751   7.134
  202    H    SER  27           H        SER  27 -17.791 -23.364  10.096
  203    HA   SER  27           HA       SER  27 -16.613 -25.906  11.107
  204   1HB   SER  27          2HB       SER  27 -18.686 -26.383  12.089
  205   2HB   SER  27          1HB       SER  27 -18.599 -24.629  12.258
  206    HG   SER  27           HG       SER  27 -20.357 -26.120  10.878
  207    H    ALA  28           H        ALA  28 -17.715 -27.919  10.176
  208    HA   ALA  28           HA       ALA  28 -17.374 -28.081   7.403
  209   1HB   ALA  28          2HB       ALA  28 -19.472 -29.723   8.822
  210   2HB   ALA  28          1HB       ALA  28 -18.406 -30.210   7.503
  211   3HB   ALA  28          3HB       ALA  28 -17.753 -29.983   9.126
  212    H    ALA  29           H        ALA  29 -20.376 -27.455   9.208
  213    HA   ALA  29           HA       ALA  29 -22.111 -27.293   6.977
  214   1HB   ALA  29          1HB       ALA  29 -22.470 -27.059   9.647
  215   2HB   ALA  29          2HB       ALA  29 -23.672 -26.524   8.472
  216   3HB   ALA  29          3HB       ALA  29 -22.558 -25.359   9.188
  217    H    GLU  30           H        GLU  30 -20.004 -24.837   8.439
  218    HA   GLU  30           HA       GLU  30 -20.927 -22.739   6.657
  219   1HB   GLU  30          2HB       GLU  30 -18.453 -22.951   8.397
  220   2HB   GLU  30          1HB       GLU  30 -18.931 -21.495   7.525
  221   1HG   GLU  30          2HG       GLU  30 -21.096 -21.502   8.749
  222   2HG   GLU  30          1HG       GLU  30 -20.561 -22.916   9.655
  223    H    LEU  31           H        LEU  31 -17.871 -24.598   6.847
  224    HA   LEU  31           HA       LEU  31 -16.811 -23.609   4.392
  225   1HB   LEU  31          2HB       LEU  31 -15.662 -24.978   6.279
  226   2HB   LEU  31          1HB       LEU  31 -16.302 -26.391   5.447
  227    HG   LEU  31           HG       LEU  31 -14.457 -24.284   4.276
  228   1HD1  LEU  31          1HD1      LEU  31 -14.099 -27.219   4.954
  229   2HD1  LEU  31          3HD1      LEU  31 -12.932 -26.265   4.038
  230   3HD1  LEU  31          2HD1      LEU  31 -13.285 -25.852   5.716
  231   1HD2  LEU  31          2HD2      LEU  31 -16.052 -26.509   3.046
  232   2HD2  LEU  31          1HD2      LEU  31 -15.733 -24.890   2.424
  233   3HD2  LEU  31          3HD2      LEU  31 -14.469 -26.118   2.376
  234    H    GLY  32           H        GLY  32 -18.762 -26.488   5.139
  235   1HA   GLY  32          1HA       GLY  32 -20.005 -27.887   3.727
  236   2HA   GLY  32          2HA       GLY  32 -18.822 -27.519   2.474
  237    H    GLU  33           H        GLU  33 -21.025 -25.335   4.227
  238    HA   GLU  33           HA       GLU  33 -22.948 -25.049   2.164
  239   1HB   GLU  33          2HB       GLU  33 -22.076 -23.355   4.481
  240   2HB   GLU  33          1HB       GLU  33 -23.207 -22.693   3.304
  241   1HG   GLU  33          2HG       GLU  33 -23.773 -25.436   4.317
  242   2HG   GLU  33          1HG       GLU  33 -24.030 -24.101   5.441
  243    H    ALA  34           H        ALA  34 -19.933 -23.256   2.769
  244    HA   ALA  34           HA       ALA  34 -20.356 -21.437   0.553
  245   1HB   ALA  34          1HB       ALA  34 -18.823 -20.576   2.087
  246   2HB   ALA  34          2HB       ALA  34 -17.738 -21.232   0.862
  247   3HB   ALA  34          3HB       ALA  34 -18.049 -22.141   2.340
  248    H    LEU  35           H        LEU  35 -18.621 -24.479   1.017
  249    HA   LEU  35           HA       LEU  35 -17.349 -24.608  -1.520
  250   1HB   LEU  35          2HB       LEU  35 -18.102 -26.543   0.600
  251   2HB   LEU  35          1HB       LEU  35 -17.827 -27.222  -1.004
  252    HG   LEU  35           HG       LEU  35 -15.903 -25.477   0.562
  253   1HD1  LEU  35          2HD1      LEU  35 -16.174 -28.407   0.041
  254   2HD1  LEU  35          1HD1      LEU  35 -14.547 -27.728   0.072
  255   3HD1  LEU  35          3HD1      LEU  35 -15.594 -27.573   1.484
  256   1HD2  LEU  35          2HD2      LEU  35 -15.963 -26.442  -2.278
  257   2HD2  LEU  35          1HD2      LEU  35 -15.436 -24.884  -1.640
  258   3HD2  LEU  35          3HD2      LEU  35 -14.409 -26.306  -1.455
  259    H    LYS  36           H        LYS  36 -20.666 -25.316  -0.549
  260    HA   LYS  36           HA       LYS  36 -21.617 -26.894  -2.608
  261   1HB   LYS  36          2HB       LYS  36 -22.744 -24.990  -0.783
  262   2HB   LYS  36          1HB       LYS  36 -23.478 -24.754  -2.369
  263   1HG   LYS  36          2HG       LYS  36 -24.130 -27.072  -2.492
  264   2HG   LYS  36          1HG       LYS  36 -23.200 -27.465  -1.046
  265   1HD   LYS  36          2HD       LYS  36 -24.851 -25.404  -0.195
  266   2HD   LYS  36          1HD       LYS  36 -25.890 -26.331  -1.277
  267   1HE   LYS  36          2HE       LYS  36 -24.348 -28.135   0.360
  268   2HE   LYS  36          1HE       LYS  36 -25.182 -26.970   1.389
  269   1HZ   LYS  36          3HZ       LYS  36 -27.222 -27.477   0.064
  270   2HZ   LYS  36          2HZ       LYS  36 -26.371 -28.764  -0.648
  271   3HZ   LYS  36          1HZ       LYS  36 -26.662 -28.757   1.025
  272    H    THR  37           H        THR  37 -20.428 -23.620  -2.863
  273    HA   THR  37           HA       THR  37 -21.604 -22.742  -5.243
  274    HB   THR  37           HB       THR  37 -19.891 -21.535  -3.764
  275    HG1  THR  37           HG1      THR  37 -19.712 -21.549  -6.588
  276   1HG2  THR  37          1HG2      THR  37 -18.037 -23.165  -5.519
  277   2HG2  THR  37          3HG2      THR  37 -17.527 -21.760  -4.585
  278   3HG2  THR  37          2HG2      THR  37 -18.129 -23.196  -3.759
  279    H    LEU  38           H        LEU  38 -19.373 -25.344  -4.740
  280    HA   LEU  38           HA       LEU  38 -18.268 -25.561  -7.360
  281   1HB   LEU  38          2HB       LEU  38 -18.900 -27.673  -5.283
  282   2HB   LEU  38          1HB       LEU  38 -18.017 -28.010  -6.772
  283    HG   LEU  38           HG       LEU  38 -17.208 -26.125  -4.542
  284   1HD1  LEU  38          1HD1      LEU  38 -16.679 -28.860  -5.100
  285   2HD1  LEU  38          3HD1      LEU  38 -15.197 -27.970  -5.450
  286   3HD1  LEU  38          2HD1      LEU  38 -15.940 -27.853  -3.855
  287   1HD2  LEU  38          2HD2      LEU  38 -16.295 -26.367  -7.390
  288   2HD2  LEU  38          1HD2      LEU  38 -16.502 -24.919  -6.406
  289   3HD2  LEU  38          3HD2      LEU  38 -15.112 -25.972  -6.143
  290    H    GLY  39           H        GLY  39 -21.360 -26.581  -6.019
  291   1HA   GLY  39          1HA       GLY  39 -22.505 -26.789  -8.684
  292   2HA   GLY  39          2HA       GLY  39 -23.345 -27.127  -7.170
  293    H    SER  40           H        SER  40 -20.529 -28.861  -7.051
  294    HA   SER  40           HA       SER  40 -21.948 -31.353  -7.696
  295   1HB   SER  40          2HB       SER  40 -21.150 -31.091  -9.873
  296   2HB   SER  40          1HB       SER  40 -19.686 -30.261  -9.341
  297    HG   SER  40           HG       SER  40 -20.237 -32.963  -9.530
  298    H    ILE  41           H        ILE  41 -21.390 -31.061  -5.228
  299    HA   ILE  41           HA       ILE  41 -18.975 -32.693  -4.750
  300    HB   ILE  41           HB       ILE  41 -18.429 -30.162  -4.577
  301   1HG1  ILE  41          2HG1      ILE  41 -17.901 -31.808  -2.096
  302   2HG1  ILE  41          1HG1      ILE  41 -17.111 -32.139  -3.638
  303   1HG2  ILE  41          3HG2      ILE  41 -20.649 -29.979  -3.100
  304   2HG2  ILE  41          2HG2      ILE  41 -19.517 -30.358  -1.801
  305   3HG2  ILE  41          1HG2      ILE  41 -19.260 -28.932  -2.808
  306   1HD1  ILE  41          1HD1      ILE  41 -16.903 -29.344  -3.198
  307   2HD1  ILE  41          3HD1      ILE  41 -16.460 -30.129  -1.683
  308   3HD1  ILE  41          2HD1      ILE  41 -15.603 -30.535  -3.170
  309    H    THR  42           H        THR  42 -18.924 -33.367  -2.359
  310    HA   THR  42           HA       THR  42 -21.734 -33.656  -1.365
  311    HB   THR  42           HB       THR  42 -21.421 -35.891  -1.213
  312    HG1  THR  42           HG1      THR  42 -19.401 -36.632  -0.135
  313   1HG2  THR  42          3HG2      THR  42 -20.078 -35.430  -3.306
  314   2HG2  THR  42          2HG2      THR  42 -18.628 -35.473  -2.302
  315   3HG2  THR  42          1HG2      THR  42 -19.634 -36.914  -2.462
  316    HA   PRO  43           HA       PRO  43 -20.426 -31.918   2.494
  317   1HB   PRO  43          2HB       PRO  43 -21.692 -33.463   4.317
  318   2HB   PRO  43          1HB       PRO  43 -22.543 -32.289   3.310
  319   1HG   PRO  43          2HG       PRO  43 -22.297 -35.254   2.973
  320   2HG   PRO  43          1HG       PRO  43 -23.717 -34.226   2.761
  321   1HD   PRO  43          1HD       PRO  43 -22.246 -35.120   0.666
  322   2HD   PRO  43          2HD       PRO  43 -23.079 -33.564   0.641
  323    H    ASP  44           H        ASP  44 -20.123 -35.407   2.079
  324    HA   ASP  44           HA       ASP  44 -18.355 -35.876   4.289
  325   1HB   ASP  44          2HB       ASP  44 -18.689 -37.377   1.675
  326   2HB   ASP  44          1HB       ASP  44 -17.786 -37.975   3.068
  327    H    GLU  45           H        GLU  45 -17.826 -34.524   1.103
  328    HA   GLU  45           HA       GLU  45 -14.945 -35.028   1.145
  329   1HB   GLU  45          2HB       GLU  45 -16.692 -33.250  -0.584
  330   2HB   GLU  45          1HB       GLU  45 -14.954 -33.438  -0.812
  331   1HG   GLU  45          2HG       GLU  45 -15.376 -35.950  -0.958
  332   2HG   GLU  45          1HG       GLU  45 -17.095 -35.564  -1.055
  333    H    VAL  46           H        VAL  46 -17.167 -32.431   1.969
  334    HA   VAL  46           HA       VAL  46 -15.137 -30.439   2.441
  335    HB   VAL  46           HB       VAL  46 -17.983 -30.725   3.432
  336   1HG1  VAL  46          2HG1      VAL  46 -15.854 -28.990   4.357
  337   2HG1  VAL  46          1HG1      VAL  46 -17.146 -28.042   3.622
  338   3HG1  VAL  46          3HG1      VAL  46 -17.506 -29.136   4.958
  339   1HG2  VAL  46          1HG2      VAL  46 -16.881 -29.974   0.958
  340   2HG2  VAL  46          3HG2      VAL  46 -18.544 -29.726   1.489
  341   3HG2  VAL  46          2HG2      VAL  46 -17.343 -28.459   1.733
  342    H    LYS  47           H        LYS  47 -16.682 -32.911   4.406
  343    HA   LYS  47           HA       LYS  47 -15.676 -32.079   6.952
  344   1HB   LYS  47          2HB       LYS  47 -16.355 -34.850   5.920
  345   2HB   LYS  47          1HB       LYS  47 -16.023 -34.473   7.611
  346   1HG   LYS  47          2HG       LYS  47 -17.894 -32.810   7.555
  347   2HG   LYS  47          1HG       LYS  47 -18.265 -33.337   5.912
  348   1HD   LYS  47          2HD       LYS  47 -18.499 -35.688   6.826
  349   2HD   LYS  47          1HD       LYS  47 -18.379 -34.997   8.444
  350   1HE   LYS  47          2HE       LYS  47 -20.299 -33.434   7.723
  351   2HE   LYS  47          1HE       LYS  47 -20.525 -34.540   6.368
  352   1HZ   LYS  47          1HZ       LYS  47 -20.290 -35.754   9.000
  353   2HZ   LYS  47          3HZ       LYS  47 -21.706 -34.864   8.716
  354   3HZ   LYS  47          2HZ       LYS  47 -21.302 -36.164   7.699
  355    H    HIS  48           H        HIS  48 -14.327 -34.156   4.422
  356    HA   HIS  48           HA       HIS  48 -11.987 -34.950   5.883
  357   1HB   HIS  48          2HB       HIS  48 -12.702 -36.127   3.851
  358   2HB   HIS  48          1HB       HIS  48 -12.421 -34.673   2.894
  359    HD1  HIS  48           HD1      HIS  48 -10.440 -35.429   1.502
  360    HD2  HIS  48           HD2      HIS  48  -9.858 -36.077   5.579
  361    HE1  HIS  48           HE1      HIS  48  -8.023 -36.137   1.777
  362    H    MET  49           H        MET  49 -12.684 -32.193   3.747
  363    HA   MET  49           HA       MET  49 -10.046 -31.152   3.604
  364   1HB   MET  49          2HB       MET  49 -12.795 -29.970   3.377
  365   2HB   MET  49          1HB       MET  49 -11.399 -28.900   3.443
  366   1HG   MET  49          2HG       MET  49 -10.439 -30.544   1.612
  367   2HG   MET  49          1HG       MET  49 -12.142 -30.920   1.354
  368   1HE   MET  49          1HE       MET  49 -12.372 -30.275  -0.842
  369   2HE   MET  49          3HE       MET  49 -13.738 -29.443  -0.088
  370   3HE   MET  49          2HE       MET  49 -12.793 -28.639  -1.340
  371    H    MET  50           H        MET  50 -12.658 -30.569   5.939
  372    HA   MET  50           HA       MET  50 -11.238 -28.699   7.558
  373   1HB   MET  50          2HB       MET  50 -13.518 -30.600   8.074
  374   2HB   MET  50          1HB       MET  50 -12.846 -29.617   9.370
  375   1HG   MET  50          2HG       MET  50 -13.159 -27.619   7.767
  376   2HG   MET  50          1HG       MET  50 -14.194 -28.698   6.832
  377   1HE   MET  50          2HE       MET  50 -13.197 -27.227   9.955
  378   2HE   MET  50          1HE       MET  50 -14.662 -26.705  10.782
  379   3HE   MET  50          3HE       MET  50 -14.017 -28.327  11.061
  380    H    ALA  51           H        ALA  51 -11.618 -32.229   7.855
  381    HA   ALA  51           HA       ALA  51 -10.010 -32.574  10.164
  382   1HB   ALA  51          1HB       ALA  51 -11.414 -34.258   8.528
  383   2HB   ALA  51          3HB       ALA  51  -9.755 -34.673   8.097
  384   3HB   ALA  51          2HB       ALA  51 -10.289 -34.804   9.772
  385    H    GLU  52           H        GLU  52  -9.142 -31.718   6.941
  386    HA   GLU  52           HA       GLU  52  -6.294 -32.447   7.418
  387   1HB   GLU  52          2HB       GLU  52  -7.891 -31.700   4.979
  388   2HB   GLU  52          1HB       GLU  52  -6.135 -31.536   4.968
  389   1HG   GLU  52          2HG       GLU  52  -6.114 -33.971   5.868
  390   2HG   GLU  52          1HG       GLU  52  -7.788 -34.036   5.315
  391    H    ILE  53           H        ILE  53  -8.418 -29.687   6.858
  392    HA   ILE  53           HA       ILE  53  -6.210 -27.767   6.924
  393    HB   ILE  53           HB       ILE  53  -9.209 -27.368   7.044
  394   1HG1  ILE  53          2HG1      ILE  53  -7.276 -27.116   4.726
  395   2HG1  ILE  53          1HG1      ILE  53  -8.360 -28.481   4.978
  396   1HG2  ILE  53          2HG2      ILE  53  -7.737 -25.509   7.942
  397   2HG2  ILE  53          1HG2      ILE  53  -7.047 -25.378   6.324
  398   3HG2  ILE  53          3HG2      ILE  53  -8.762 -25.057   6.579
  399   1HD1  ILE  53          2HD1      ILE  53  -9.489 -25.702   4.961
  400   2HD1  ILE  53          1HD1      ILE  53  -9.105 -26.484   3.427
  401   3HD1  ILE  53          3HD1      ILE  53 -10.266 -27.226   4.527
  402    H    ASP  54           H        ASP  54  -8.624 -29.036   9.154
  403    HA   ASP  54           HA       ASP  54  -8.376 -27.130  11.237
  404   1HB   ASP  54          2HB       ASP  54  -9.971 -29.194  10.892
  405   2HB   ASP  54          1HB       ASP  54  -8.726 -30.064  11.775
  406    H    THR  55           H        THR  55  -6.279 -26.533  11.773
  407    HA   THR  55           HA       THR  55  -4.056 -28.335  11.891
  408    HB   THR  55           HB       THR  55  -2.923 -26.483  13.113
  409    HG1  THR  55           HG1      THR  55  -4.141 -25.159  14.156
  410   1HG2  THR  55          1HG2      THR  55  -4.477 -26.040  10.590
  411   2HG2  THR  55          3HG2      THR  55  -3.568 -24.694  11.278
  412   3HG2  THR  55          2HG2      THR  55  -2.733 -26.179  10.819
  413    H    ASP  56           H        ASP  56  -6.124 -27.004  14.473
  414    HA   ASP  56           HA       ASP  56  -4.765 -28.735  16.441
  415   1HB   ASP  56          2HB       ASP  56  -5.918 -27.528  18.110
  416   2HB   ASP  56          1HB       ASP  56  -5.589 -26.319  16.871
  417    H    GLY  57           H        GLY  57  -7.963 -28.402  14.950
  418   1HA   GLY  57          1HA       GLY  57  -8.481 -31.237  15.711
  419   2HA   GLY  57          2HA       GLY  57  -9.244 -30.404  14.360
  420    H    ASP  58           H        ASP  58  -9.775 -27.969  16.026
  421    HA   ASP  58           HA       ASP  58 -11.532 -28.902  18.179
  422   1HB   ASP  58          2HB       ASP  58 -12.034 -26.574  18.551
  423   2HB   ASP  58          1HB       ASP  58 -10.306 -26.684  18.224
  424    H    GLY  59           H        GLY  59 -11.797 -28.892  14.873
  425   1HA   GLY  59          1HA       GLY  59 -14.761 -28.939  15.071
  426   2HA   GLY  59          2HA       GLY  59 -13.813 -29.695  13.791
  427    H    PHE  60           H        PHE  60 -12.492 -26.684  14.376
  428    HA   PHE  60           HA       PHE  60 -14.004 -25.570  12.071
  429   1HB   PHE  60          2HB       PHE  60 -13.246 -23.909  14.474
  430   2HB   PHE  60          1HB       PHE  60 -14.263 -23.441  13.110
  431    HD1  PHE  60           HD1      PHE  60 -16.521 -24.375  12.836
  432    HD2  PHE  60           HD2      PHE  60 -14.102 -25.299  16.259
  433    HE1  PHE  60           HE1      PHE  60 -18.520 -25.232  14.018
  434    HE2  PHE  60           HE2      PHE  60 -16.101 -26.156  17.443
  435    HZ   PHE  60           HZ       PHE  60 -18.314 -26.125  16.323
  436    H    ILE  61           H        ILE  61 -12.900 -23.925  10.886
  437    HA   ILE  61           HA       ILE  61  -9.941 -24.050  11.172
  438    HB   ILE  61           HB       ILE  61 -11.509 -23.236   8.716
  439   1HG1  ILE  61          2HG1      ILE  61 -12.127 -25.542   9.351
  440   2HG1  ILE  61          1HG1      ILE  61 -11.139 -25.532   7.889
  441   1HG2  ILE  61          1HG2      ILE  61  -9.074 -22.600   8.965
  442   2HG2  ILE  61          3HG2      ILE  61  -8.696 -24.322   9.012
  443   3HG2  ILE  61          2HG2      ILE  61  -9.422 -23.617   7.567
  444   1HD1  ILE  61          3HD1      ILE  61  -9.123 -25.873   9.442
  445   2HD1  ILE  61          2HD1      ILE  61 -10.299 -26.248  10.703
  446   3HD1  ILE  61          1HD1      ILE  61 -10.211 -27.250   9.252
  447    H    SER  62           H        SER  62  -8.930 -22.120  11.644
  448    HA   SER  62           HA       SER  62 -10.625 -19.685  11.737
  449   1HB   SER  62          2HB       SER  62  -7.829 -19.992  12.851
  450   2HB   SER  62          1HB       SER  62  -9.051 -18.800  13.296
  451    HG   SER  62           HG       SER  62  -9.352 -21.593  13.650
  452    H    PHE  63           H        PHE  63  -9.388 -17.621  11.101
  453    HA   PHE  63           HA       PHE  63  -8.625 -17.763   8.385
  454   1HB   PHE  63          2HB       PHE  63  -9.256 -15.639   9.506
  455   2HB   PHE  63          1HB       PHE  63  -7.743 -15.686  10.415
  456    HD1  PHE  63           HD1      PHE  63  -8.724 -16.338   6.858
  457    HD2  PHE  63           HD2      PHE  63  -6.143 -14.219   9.556
  458    HE1  PHE  63           HE1      PHE  63  -7.541 -15.329   4.931
  459    HE2  PHE  63           HE2      PHE  63  -4.953 -13.213   7.627
  460    HZ   PHE  63           HZ       PHE  63  -5.659 -13.766   5.312
  461    H    GLN  64           H        GLN  64  -6.634 -17.741  11.319
  462    HA   GLN  64           HA       GLN  64  -4.091 -17.768  10.053
  463   1HB   GLN  64          2HB       GLN  64  -4.546 -17.442  12.514
  464   2HB   GLN  64          1HB       GLN  64  -4.851 -19.174  12.630
  465   1HG   GLN  64          2HG       GLN  64  -2.539 -18.782  13.246
  466   2HG   GLN  64          1HG       GLN  64  -2.554 -19.569  11.669
  467   1HE2  GLN  64          1HE2      GLN  64  -1.016 -18.611  10.336
  468   2HE2  GLN  64          2HE2      GLN  64  -0.674 -16.950  10.272
  469    H    GLU  65           H        GLU  65  -6.150 -20.490  11.147
  470    HA   GLU  65           HA       GLU  65  -4.432 -22.571  10.254
  471   1HB   GLU  65          2HB       GLU  65  -7.423 -22.410  10.642
  472   2HB   GLU  65          1HB       GLU  65  -6.624 -23.894  10.142
  473   1HG   GLU  65          2HG       GLU  65  -5.199 -23.808  12.160
  474   2HG   GLU  65          1HG       GLU  65  -6.008 -22.326  12.664
  475    H    PHE  66           H        PHE  66  -7.149 -20.938   8.632
  476    HA   PHE  66           HA       PHE  66  -6.961 -22.398   6.179
  477   1HB   PHE  66          2HB       PHE  66  -8.919 -21.012   6.769
  478   2HB   PHE  66          1HB       PHE  66  -7.926 -19.560   6.654
  479    HD1  PHE  66           HD1      PHE  66  -7.028 -18.815   4.468
  480    HD2  PHE  66           HD2      PHE  66  -9.670 -22.186   4.796
  481    HE1  PHE  66           HE1      PHE  66  -7.449 -18.724   2.025
  482    HE2  PHE  66           HE2      PHE  66 -10.090 -22.095   2.353
  483    HZ   PHE  66           HZ       PHE  66  -8.980 -20.363   0.969
  484    H    THR  67           H        THR  67  -5.261 -19.577   7.416
  485    HA   THR  67           HA       THR  67  -4.045 -18.809   4.918
  486    HB   THR  67           HB       THR  67  -3.157 -18.351   7.784
  487    HG1  THR  67           HG1      THR  67  -4.218 -16.451   7.565
  488   1HG2  THR  67          1HG2      THR  67  -1.611 -18.085   5.514
  489   2HG2  THR  67          3HG2      THR  67  -2.286 -16.467   5.709
  490   3HG2  THR  67          2HG2      THR  67  -1.363 -17.203   7.020
  491    H    ASP  68           H        ASP  68  -2.858 -20.752   7.678
  492    HA   ASP  68           HA       ASP  68  -0.328 -21.399   6.559
  493   1HB   ASP  68          2HB       ASP  68  -2.051 -23.100   8.387
  494   2HB   ASP  68          1HB       ASP  68  -0.316 -23.287   8.133
  495    H    PHE  69           H        PHE  69  -3.510 -22.891   6.151
  496    HA   PHE  69           HA       PHE  69  -2.466 -25.082   4.534
  497   1HB   PHE  69          2HB       PHE  69  -4.428 -25.786   5.504
  498   2HB   PHE  69          1HB       PHE  69  -5.110 -24.165   5.541
  499    HD1  PHE  69           HD1      PHE  69  -5.842 -23.128   3.314
  500    HD2  PHE  69           HD2      PHE  69  -5.087 -27.318   3.840
  501    HE1  PHE  69           HE1      PHE  69  -7.173 -23.623   1.275
  502    HE2  PHE  69           HE2      PHE  69  -6.410 -27.817   1.805
  503    HZ   PHE  69           HZ       PHE  69  -7.457 -25.970   0.522
  504    H    GLY  70           H        GLY  70  -3.995 -21.944   3.984
  505   1HA   GLY  70          1HA       GLY  70  -4.141 -20.644   2.036
  506   2HA   GLY  70          2HA       GLY  70  -4.418 -22.163   1.183
  507    H    ARG  71           H        ARG  71  -1.513 -21.596   3.056
  508    HA   ARG  71           HA       ARG  71   0.112 -20.685   0.837
  509   1HB   ARG  71          2HB       ARG  71   0.865 -21.935   3.496
  510   2HB   ARG  71          1HB       ARG  71   2.023 -21.246   2.359
  511   1HG   ARG  71          2HG       ARG  71   0.781 -19.075   2.489
  512   2HG   ARG  71          1HG       ARG  71  -0.250 -19.782   3.733
  513   1HD   ARG  71          2HD       ARG  71   2.762 -19.457   3.896
  514   2HD   ARG  71          1HD       ARG  71   1.569 -18.495   4.769
  515    HE   ARG  71           HE       ARG  71   1.162 -21.279   5.335
  516   1HH1  ARG  71          1HH1      ARG  71   3.897 -19.289   5.556
  517   2HH1  ARG  71          2HH1      ARG  71   4.168 -19.576   7.242
  518   1HH2  ARG  71          1HH2      ARG  71   1.235 -21.374   7.679
  519   2HH2  ARG  71          2HH2      ARG  71   2.659 -20.755   8.445
  520    H    ALA  72           H        ALA  72  -0.721 -23.816   2.200
  521    HA   ALA  72           HA       ALA  72   1.240 -25.354   0.759
  522   1HB   ALA  72          3HB       ALA  72   0.378 -26.901   2.153
  523   2HB   ALA  72          1HB       ALA  72  -1.060 -26.953   1.132
  524   3HB   ALA  72          2HB       ALA  72  -1.000 -25.859   2.514
  525    H    ASN  73           H        ASN  73  -1.732 -23.843  -0.149
  526    HA   ASN  73           HA       ASN  73  -1.390 -24.881  -2.902
  527   1HB   ASN  73          2HB       ASN  73  -4.133 -24.882  -1.639
  528   2HB   ASN  73          1HB       ASN  73  -3.607 -25.680  -3.122
  529   1HD2  ASN  73          1HD2      ASN  73  -4.080 -26.129   0.250
  530   2HD2  ASN  73          2HD2      ASN  73  -3.298 -27.628   0.392
  531    H    ARG  74           H        ARG  74  -0.646 -22.420  -2.398
  532    HA   ARG  74           HA       ARG  74  -2.502 -20.331  -2.160
  533   1HB   ARG  74          2HB       ARG  74   0.042 -20.514  -3.793
  534   2HB   ARG  74          1HB       ARG  74  -0.871 -19.016  -3.611
  535   1HG   ARG  74          2HG       ARG  74  -0.703 -19.366  -1.092
  536   2HG   ARG  74          1HG       ARG  74   0.460 -20.646  -1.437
  537   1HD   ARG  74          2HD       ARG  74   0.702 -17.731  -2.240
  538   2HD   ARG  74          1HD       ARG  74   1.658 -18.560  -1.011
  539    HE   ARG  74           HE       ARG  74   2.104 -20.052  -3.298
  540   1HH1  ARG  74          1HH1      ARG  74   1.666 -17.649  -4.937
  541   2HH1  ARG  74          2HH1      ARG  74   3.223 -16.889  -4.946
  542   1HH2  ARG  74          1HH2      ARG  74   4.404 -18.679  -2.221
  543   2HH2  ARG  74          2HH2      ARG  74   4.773 -17.472  -3.406
  544    H    GLY  75           H        GLY  75  -1.639 -22.254  -4.987
  545   1HA   GLY  75          1HA       GLY  75  -2.681 -22.462  -7.064
  546   2HA   GLY  75          2HA       GLY  75  -3.097 -20.753  -6.927
  547    H    LEU  76           H        LEU  76  -4.090 -23.069  -4.501
  548    HA   LEU  76           HA       LEU  76  -6.682 -23.659  -5.617
  549   1HB   LEU  76          2HB       LEU  76  -5.474 -23.898  -2.867
  550   2HB   LEU  76          1HB       LEU  76  -7.184 -24.235  -3.134
  551    HG   LEU  76           HG       LEU  76  -4.870 -25.573  -4.569
  552   1HD1  LEU  76          1HD1      LEU  76  -6.065 -26.078  -2.041
  553   2HD1  LEU  76          3HD1      LEU  76  -6.639 -27.335  -3.138
  554   3HD1  LEU  76          2HD1      LEU  76  -4.909 -27.091  -2.905
  555   1HD2  LEU  76          2HD2      LEU  76  -7.708 -25.327  -5.169
  556   2HD2  LEU  76          1HD2      LEU  76  -6.417 -26.019  -6.152
  557   3HD2  LEU  76          3HD2      LEU  76  -7.239 -27.013  -4.950
  558    H    LEU  77           H        LEU  77  -5.573 -21.320  -3.181
  559    HA   LEU  77           HA       LEU  77  -8.194 -20.204  -2.731
  560   1HB   LEU  77          2HB       LEU  77  -5.647 -18.659  -2.311
  561   2HB   LEU  77          1HB       LEU  77  -7.123 -18.643  -1.346
  562    HG   LEU  77           HG       LEU  77  -5.012 -20.805  -1.481
  563   1HD1  LEU  77          3HD1      LEU  77  -5.805 -18.700   0.382
  564   2HD1  LEU  77          2HD1      LEU  77  -5.774 -20.288   1.147
  565   3HD1  LEU  77          1HD1      LEU  77  -4.330 -19.666   0.348
  566   1HD2  LEU  77          2HD2      LEU  77  -7.838 -20.924  -0.397
  567   2HD2  LEU  77          1HD2      LEU  77  -7.106 -21.987  -1.598
  568   3HD2  LEU  77          3HD2      LEU  77  -6.574 -22.058   0.081
  569    H    LYS  78           H        LYS  78  -5.837 -19.784  -5.228
  570    HA   LYS  78           HA       LYS  78  -6.766 -17.127  -6.017
  571   1HB   LYS  78          2HB       LYS  78  -4.992 -19.175  -7.373
  572   2HB   LYS  78          1HB       LYS  78  -5.363 -17.597  -8.068
  573   1HG   LYS  78          2HG       LYS  78  -4.533 -16.605  -5.849
  574   2HG   LYS  78          1HG       LYS  78  -3.875 -18.204  -5.507
  575   1HD   LYS  78          2HD       LYS  78  -3.243 -16.560  -7.978
  576   2HD   LYS  78          1HD       LYS  78  -2.194 -16.706  -6.568
  577   1HE   LYS  78          2HE       LYS  78  -1.808 -19.013  -6.956
  578   2HE   LYS  78          1HE       LYS  78  -3.178 -19.141  -8.060
  579   1HZ   LYS  78          1HZ       LYS  78  -1.158 -17.208  -8.813
  580   2HZ   LYS  78          3HZ       LYS  78  -0.646 -18.825  -8.848
  581   3HZ   LYS  78          2HZ       LYS  78  -1.991 -18.342  -9.766
  582    H    ASP  79           H        ASP  79  -7.575 -20.450  -6.745
  583    HA   ASP  79           HA       ASP  79  -9.215 -19.651  -9.072
  584   1HB   ASP  79          2HB       ASP  79  -7.928 -21.757  -9.174
  585   2HB   ASP  79          1HB       ASP  79  -8.815 -22.359  -7.773
  586    H    VAL  80           H        VAL  80  -9.645 -21.005  -5.815
  587    HA   VAL  80           HA       VAL  80 -12.471 -21.267  -5.895
  588    HB   VAL  80           HB       VAL  80 -10.767 -22.041  -4.093
  589   1HG1  VAL  80          1HG1      VAL  80  -9.863 -19.802  -3.598
  590   2HG1  VAL  80          3HG1      VAL  80 -11.459 -19.279  -3.055
  591   3HG1  VAL  80          2HG1      VAL  80 -10.586 -20.524  -2.159
  592   1HG2  VAL  80          2HG2      VAL  80 -13.573 -21.121  -3.801
  593   2HG2  VAL  80          1HG2      VAL  80 -12.880 -22.720  -3.529
  594   3HG2  VAL  80          3HG2      VAL  80 -12.710 -21.464  -2.302
  595    H    ALA  81           H        ALA  81 -10.421 -18.568  -4.893
  596    HA   ALA  81           HA       ALA  81 -12.338 -16.746  -4.005
  597   1HB   ALA  81          2HB       ALA  81 -10.497 -15.336  -5.700
  598   2HB   ALA  81          3HB       ALA  81  -9.632 -16.622  -4.859
  599   3HB   ALA  81          1HB       ALA  81 -10.528 -15.414  -3.937
  600    H    LYS  82           H        LYS  82 -11.498 -17.547  -7.353
  601    HA   LYS  82           HA       LYS  82 -13.171 -15.518  -8.539
  602   1HB   LYS  82          2HB       LYS  82 -12.298 -18.162  -9.742
  603   2HB   LYS  82          1HB       LYS  82 -12.830 -16.728 -10.621
  604   1HG   LYS  82          2HG       LYS  82 -10.906 -15.466  -9.690
  605   2HG   LYS  82          1HG       LYS  82 -10.367 -16.925  -8.859
  606   1HD   LYS  82          2HD       LYS  82 -10.186 -18.078 -11.058
  607   2HD   LYS  82          1HD       LYS  82 -10.650 -16.578 -11.860
  608   1HE   LYS  82          2HE       LYS  82  -8.405 -16.392  -9.920
  609   2HE   LYS  82          1HE       LYS  82  -8.072 -17.264 -11.415
  610   1HZ   LYS  82          1HZ       LYS  82  -9.455 -14.681 -11.554
  611   2HZ   LYS  82          3HZ       LYS  82  -7.780 -14.694 -11.293
  612   3HZ   LYS  82          2HZ       LYS  82  -8.425 -15.418 -12.688
  613    H    ILE  83           H        ILE  83 -13.773 -18.687  -7.228
  614    HA   ILE  83           HA       ILE  83 -16.229 -19.254  -8.583
  615    HB   ILE  83           HB       ILE  83 -15.471 -20.054  -5.761
  616   1HG1  ILE  83          2HG1      ILE  83 -14.716 -21.243  -8.444
  617   2HG1  ILE  83          1HG1      ILE  83 -13.625 -20.631  -7.203
  618   1HG2  ILE  83          3HG2      ILE  83 -17.360 -21.150  -7.854
  619   2HG2  ILE  83          2HG2      ILE  83 -16.827 -22.103  -6.470
  620   3HG2  ILE  83          1HG2      ILE  83 -17.747 -20.621  -6.218
  621   1HD1  ILE  83          2HD1      ILE  83 -15.224 -22.525  -5.886
  622   2HD1  ILE  83          1HD1      ILE  83 -14.835 -23.262  -7.441
  623   3HD1  ILE  83          3HD1      ILE  83 -13.540 -22.726  -6.369
  624    H    PHE  84           H        PHE  84 -15.556 -17.615  -5.500
  625    HA   PHE  84           HA       PHE  84 -18.397 -16.961  -5.140
  626   1HB   PHE  84          2HB       PHE  84 -15.923 -16.123  -3.597
  627   2HB   PHE  84          1HB       PHE  84 -17.578 -15.727  -3.129
  628    HD1  PHE  84           HD1      PHE  84 -15.218 -18.540  -3.735
  629    HD2  PHE  84           HD2      PHE  84 -18.978 -17.329  -2.049
  630    HE1  PHE  84           HE1      PHE  84 -15.433 -20.749  -2.629
  631    HE2  PHE  84           HE2      PHE  84 -19.195 -19.538  -0.944
  632    HZ   PHE  84           HZ       PHE  84 -17.421 -21.249  -1.234

  No H/Q in entry =         632
  Start of MODEL    6
    1    H1   ALA   1          3H        ALA   1   9.959 -13.507   0.373
    2    H2   ALA   1          2H        ALA   1  11.255 -14.601   0.276
    3    H3   ALA   1          1H        ALA   1  10.965 -13.510  -0.993
    4    HA   ALA   1           HA       ALA   1  10.190 -15.668  -1.650
    5   1HB   ALA   1          2HB       ALA   1   9.693 -16.932   0.203
    6   2HB   ALA   1          3HB       ALA   1   8.063 -16.351  -0.140
    7   3HB   ALA   1          1HB       ALA   1   9.040 -15.556   1.094
    8    H    ASP   2           H        ASP   2   7.686 -16.085  -2.261
    9    HA   ASP   2           HA       ASP   2   6.755 -13.492  -3.315
   10   1HB   ASP   2          2HB       ASP   2   5.179 -14.859  -4.630
   11   2HB   ASP   2          1HB       ASP   2   6.827 -15.462  -4.804
   12    H    ASP   3           H        ASP   3   6.398 -14.847  -0.421
   13    HA   ASP   3           HA       ASP   3   3.462 -14.559  -0.192
   14   1HB   ASP   3          2HB       ASP   3   4.796 -16.396   0.976
   15   2HB   ASP   3          1HB       ASP   3   5.430 -15.134   2.033
   16    H    HIS   4           H        HIS   4   2.746 -12.487   0.003
   17    HA   HIS   4           HA       HIS   4   4.291 -10.661   1.802
   18   1HB   HIS   4          2HB       HIS   4   2.630  -9.188  -0.040
   19   2HB   HIS   4          1HB       HIS   4   4.375  -9.102   0.176
   20    HD1  HIS   4           HD1      HIS   4   1.726 -10.667  -1.953
   21    HD2  HIS   4           HD2      HIS   4   5.882 -10.731  -1.639
   22    HE1  HIS   4           HE1      HIS   4   2.586 -11.794  -4.052
   23    HA   PRO   5           HA       PRO   5   0.582  -9.821   4.076
   24   1HB   PRO   5          2HB       PRO   5   0.350  -7.126   4.111
   25   2HB   PRO   5          1HB       PRO   5   1.574  -7.996   5.039
   26   1HG   PRO   5          2HG       PRO   5   1.831  -6.598   2.402
   27   2HG   PRO   5          1HG       PRO   5   2.926  -6.562   3.788
   28   1HD   PRO   5          1HD       PRO   5   3.414  -8.108   1.634
   29   2HD   PRO   5          2HD       PRO   5   3.864  -8.615   3.263
   30    H    GLN   6           H        GLN   6   0.796  -8.422   0.877
   31    HA   GLN   6           HA       GLN   6  -1.898  -7.502   0.624
   32   1HB   GLN   6          2HB       GLN   6   0.258  -8.333  -1.292
   33   2HB   GLN   6          1HB       GLN   6  -1.377  -8.076  -1.897
   34   1HG   GLN   6          2HG       GLN   6  -1.390  -5.804  -1.235
   35   2HG   GLN   6          1HG       GLN   6  -0.015  -6.026  -0.153
   36   1HE2  GLN   6          1HE2      GLN   6   2.106  -6.686  -1.330
   37   2HE2  GLN   6          2HE2      GLN   6   2.393  -5.987  -2.850
   38    H    ASP   7           H        ASP   7  -0.388 -10.661   0.120
   39    HA   ASP   7           HA       ASP   7  -2.620 -11.968  -1.072
   40   1HB   ASP   7          2HB       ASP   7  -0.410 -13.033   0.707
   41   2HB   ASP   7          1HB       ASP   7  -1.582 -14.064  -0.114
   42    H    LYS   8           H        LYS   8  -1.726 -11.491   2.327
   43    HA   LYS   8           HA       LYS   8  -3.703 -13.048   3.567
   44   1HB   LYS   8          2HB       LYS   8  -2.266 -10.532   4.304
   45   2HB   LYS   8          1HB       LYS   8  -3.646 -11.019   5.289
   46   1HG   LYS   8          2HG       LYS   8  -2.460 -13.383   5.201
   47   2HG   LYS   8          1HG       LYS   8  -1.025 -12.411   4.873
   48   1HD   LYS   8          2HD       LYS   8  -1.622 -11.027   6.911
   49   2HD   LYS   8          1HD       LYS   8  -2.855 -12.233   7.281
   50   1HE   LYS   8          2HE       LYS   8  -1.322 -13.721   8.038
   51   2HE   LYS   8          1HE       LYS   8  -0.233 -13.409   6.686
   52   1HZ   LYS   8          3HZ       LYS   8  -0.238 -11.121   8.244
   53   2HZ   LYS   8          2HZ       LYS   8  -0.106 -12.422   9.329
   54   3HZ   LYS   8          1HZ       LYS   8   1.020 -12.245   8.069
   55    H    ALA   9           H        ALA   9  -3.968  -9.836   2.118
   56    HA   ALA   9           HA       ALA   9  -6.581  -9.191   3.022
   57   1HB   ALA   9          1HB       ALA   9  -5.248  -8.529   0.378
   58   2HB   ALA   9          3HB       ALA   9  -6.712  -7.758   0.986
   59   3HB   ALA   9          2HB       ALA   9  -5.185  -7.552   1.844
   60    H    GLU  10           H        GLU  10  -5.502 -10.963   0.143
   61    HA   GLU  10           HA       GLU  10  -8.161 -11.535  -0.813
   62   1HB   GLU  10          2HB       GLU  10  -5.663 -13.183  -1.296
   63   2HB   GLU  10          1HB       GLU  10  -7.098 -13.095  -2.317
   64   1HG   GLU  10          2HG       GLU  10  -6.634 -10.647  -2.647
   65   2HG   GLU  10          1HG       GLU  10  -5.121 -10.862  -1.767
   66    H    ARG  11           H        ARG  11  -5.885 -13.248   1.283
   67    HA   ARG  11           HA       ARG  11  -7.442 -15.645   1.573
   68   1HB   ARG  11          2HB       ARG  11  -5.363 -14.343   3.346
   69   2HB   ARG  11          1HB       ARG  11  -6.080 -15.914   3.695
   70   1HG   ARG  11          2HG       ARG  11  -5.371 -16.538   1.279
   71   2HG   ARG  11          1HG       ARG  11  -4.330 -15.118   1.371
   72   1HD   ARG  11          2HD       ARG  11  -3.550 -16.153   3.642
   73   2HD   ARG  11          1HD       ARG  11  -4.224 -17.649   2.994
   74    HE   ARG  11           HE       ARG  11  -1.912 -16.167   1.860
   75   1HH1  ARG  11          1HH1      ARG  11  -4.360 -18.460   1.239
   76   2HH1  ARG  11          2HH1      ARG  11  -3.312 -19.584   0.439
   77   1HH2  ARG  11          1HH2      ARG  11  -0.432 -17.767   1.090
   78   2HH2  ARG  11          2HH2      ARG  11  -1.088 -19.191   0.355
   79    H    GLU  12           H        GLU  12  -7.318 -12.611   3.382
   80    HA   GLU  12           HA       GLU  12  -9.128 -13.390   5.463
   81   1HB   GLU  12          2HB       GLU  12  -8.155 -10.776   4.354
   82   2HB   GLU  12          1HB       GLU  12  -9.513 -10.779   5.476
   83   1HG   GLU  12          2HG       GLU  12  -8.074 -12.203   7.024
   84   2HG   GLU  12          1HG       GLU  12  -6.720 -11.845   5.951
   85    H    ARG  13           H        ARG  13  -9.608 -11.873   2.293
   86    HA   ARG  13           HA       ARG  13 -12.441 -11.469   2.600
   87   1HB   ARG  13          2HB       ARG  13 -10.791 -11.832   0.080
   88   2HB   ARG  13          1HB       ARG  13 -12.443 -11.215   0.137
   89   1HG   ARG  13          2HG       ARG  13 -11.768  -9.267   1.347
   90   2HG   ARG  13          1HG       ARG  13 -10.174  -9.939   1.679
   91   1HD   ARG  13          2HD       ARG  13  -9.809  -8.426  -0.110
   92   2HD   ARG  13          1HD       ARG  13  -9.874 -10.010  -0.884
   93    HE   ARG  13           HE       ARG  13 -12.508  -8.970  -0.879
   94   1HH1  ARG  13          1HH1      ARG  13  -9.425  -8.687  -2.371
   95   2HH1  ARG  13          2HH1      ARG  13 -10.004  -7.747  -3.706
   96   1HH2  ARG  13          1HH2      ARG  13 -13.259  -7.580  -2.521
   97   2HH2  ARG  13          2HH2      ARG  13 -12.174  -7.121  -3.791
   98    H    ILE  14           H        ILE  14 -10.483 -14.110   1.278
   99    HA   ILE  14           HA       ILE  14 -12.748 -15.686   0.415
  100    HB   ILE  14           HB       ILE  14  -9.959 -16.627   1.150
  101   1HG1  ILE  14          2HG1      ILE  14 -10.877 -16.044  -1.647
  102   2HG1  ILE  14          1HG1      ILE  14 -10.317 -14.717  -0.632
  103   1HG2  ILE  14          1HG2      ILE  14 -12.249 -17.800  -0.435
  104   2HG2  ILE  14          3HG2      ILE  14 -10.590 -18.359  -0.647
  105   3HG2  ILE  14          2HG2      ILE  14 -11.381 -18.519   0.920
  106   1HD1  ILE  14          1HD1      ILE  14  -8.489 -16.901  -0.339
  107   2HD1  ILE  14          3HD1      ILE  14  -8.742 -16.621  -2.062
  108   3HD1  ILE  14          2HD1      ILE  14  -8.181 -15.307  -1.027
  109    H    PHE  15           H        PHE  15 -10.679 -15.711   3.326
  110    HA   PHE  15           HA       PHE  15 -12.038 -17.890   4.599
  111   1HB   PHE  15          2HB       PHE  15  -9.818 -17.077   5.340
  112   2HB   PHE  15          1HB       PHE  15 -10.556 -15.568   5.881
  113    HD1  PHE  15           HD1      PHE  15 -12.043 -15.531   7.842
  114    HD2  PHE  15           HD2      PHE  15 -10.215 -19.180   6.506
  115    HE1  PHE  15           HE1      PHE  15 -12.662 -16.626   9.982
  116    HE2  PHE  15           HE2      PHE  15 -10.831 -20.274   8.644
  117    HZ   PHE  15           HZ       PHE  15 -12.058 -19.000  10.382
  118    H    LYS  16           H        LYS  16 -12.601 -14.406   4.530
  119    HA   LYS  16           HA       LYS  16 -14.624 -14.359   6.571
  120   1HB   LYS  16          2HB       LYS  16 -13.885 -12.546   4.285
  121   2HB   LYS  16          1HB       LYS  16 -15.361 -12.250   5.202
  122   1HG   LYS  16          2HG       LYS  16 -13.977 -12.301   7.305
  123   2HG   LYS  16          1HG       LYS  16 -12.536 -12.391   6.292
  124   1HD   LYS  16          2HD       LYS  16 -13.300 -10.270   5.159
  125   2HD   LYS  16          1HD       LYS  16 -14.580 -10.155   6.367
  126   1HE   LYS  16          2HE       LYS  16 -13.093  -9.712   8.097
  127   2HE   LYS  16          1HE       LYS  16 -11.755 -10.533   7.294
  128   1HZ   LYS  16          2HZ       LYS  16 -12.950  -7.946   6.454
  129   2HZ   LYS  16          1HZ       LYS  16 -11.469  -8.133   7.267
  130   3HZ   LYS  16          3HZ       LYS  16 -11.652  -8.734   5.692
  131    H    ARG  17           H        ARG  17 -14.655 -15.153   3.152
  132    HA   ARG  17           HA       ARG  17 -17.532 -15.064   2.849
  133   1HB   ARG  17          2HB       ARG  17 -15.318 -16.392   1.272
  134   2HB   ARG  17          1HB       ARG  17 -17.017 -16.541   0.821
  135   1HG   ARG  17          2HG       ARG  17 -17.092 -13.971   0.922
  136   2HG   ARG  17          1HG       ARG  17 -15.331 -14.037   0.947
  137   1HD   ARG  17          2HD       ARG  17 -15.477 -15.487  -1.142
  138   2HD   ARG  17          1HD       ARG  17 -17.187 -15.063  -1.212
  139    HE   ARG  17           HE       ARG  17 -16.446 -12.668  -1.417
  140   1HH1  ARG  17          1HH1      ARG  17 -13.621 -14.290  -0.933
  141   2HH1  ARG  17          2HH1      ARG  17 -12.833 -13.773  -2.387
  142   1HH2  ARG  17          1HH2      ARG  17 -15.703 -12.401  -3.768
  143   2HH2  ARG  17          2HH2      ARG  17 -14.012 -12.704  -3.992
  144    H    PHE  18           H        PHE  18 -15.197 -17.528   3.809
  145    HA   PHE  18           HA       PHE  18 -17.109 -19.708   3.783
  146   1HB   PHE  18          2HB       PHE  18 -14.366 -19.328   4.974
  147   2HB   PHE  18          1HB       PHE  18 -15.312 -20.777   5.313
  148    HD1  PHE  18           HD1      PHE  18 -16.272 -22.066   3.277
  149    HD2  PHE  18           HD2      PHE  18 -13.114 -19.168   2.989
  150    HE1  PHE  18           HE1      PHE  18 -15.598 -23.017   1.087
  151    HE2  PHE  18           HE2      PHE  18 -12.441 -20.120   0.800
  152    HZ   PHE  18           HZ       PHE  18 -13.683 -22.044  -0.151
  153    H    ASP  19           H        ASP  19 -15.732 -17.681   6.376
  154    HA   ASP  19           HA       ASP  19 -17.205 -18.848   8.515
  155   1HB   ASP  19          2HB       ASP  19 -15.279 -17.070   8.553
  156   2HB   ASP  19          1HB       ASP  19 -16.593 -15.898   8.434
  157    H    ALA  20           H        ALA  20 -19.402 -19.147   8.209
  158    HA   ALA  20           HA       ALA  20 -21.078 -17.349   6.748
  159   1HB   ALA  20          2HB       ALA  20 -21.440 -19.845   7.385
  160   2HB   ALA  20          1HB       ALA  20 -22.118 -19.199   8.879
  161   3HB   ALA  20          3HB       ALA  20 -22.843 -18.777   7.327
  162    H    ASN  21           H        ASN  21 -20.823 -17.846  10.315
  163    HA   ASN  21           HA       ASN  21 -22.501 -15.451  10.683
  164   1HB   ASN  21          2HB       ASN  21 -22.437 -15.973  13.058
  165   2HB   ASN  21          1HB       ASN  21 -22.805 -17.437  12.152
  166   1HD2  ASN  21          1HD2      ASN  21 -21.593 -17.243  14.828
  167   2HD2  ASN  21          2HD2      ASN  21 -20.084 -18.006  14.728
  168    H    GLY  22           H        GLY  22 -19.138 -16.332  10.773
  169   1HA   GLY  22          1HA       GLY  22 -18.458 -13.478  11.073
  170   2HA   GLY  22          2HA       GLY  22 -17.336 -14.764  10.637
  171    H    ASP  23           H        ASP  23 -17.944 -16.521  12.826
  172    HA   ASP  23           HA       ASP  23 -17.330 -14.901  15.232
  173   1HB   ASP  23          2HB       ASP  23 -17.605 -17.006  16.489
  174   2HB   ASP  23          1HB       ASP  23 -19.013 -16.677  15.483
  175    H    GLY  24           H        GLY  24 -15.569 -15.993  12.759
  176   1HA   GLY  24          1HA       GLY  24 -13.146 -16.209  14.445
  177   2HA   GLY  24          2HA       GLY  24 -13.167 -15.905  12.710
  178    H    LYS  25           H        LYS  25 -15.301 -18.416  13.456
  179    HA   LYS  25           HA       LYS  25 -13.216 -20.403  12.679
  180   1HB   LYS  25          2HB       LYS  25 -14.146 -22.023  14.213
  181   2HB   LYS  25          1HB       LYS  25 -13.836 -20.546  15.121
  182   1HG   LYS  25          2HG       LYS  25 -16.142 -19.940  15.102
  183   2HG   LYS  25          1HG       LYS  25 -16.525 -21.152  13.878
  184   1HD   LYS  25          2HD       LYS  25 -15.626 -22.859  15.637
  185   2HD   LYS  25          1HD       LYS  25 -15.876 -21.551  16.793
  186   1HE   LYS  25          2HE       LYS  25 -18.245 -21.358  15.860
  187   2HE   LYS  25          1HE       LYS  25 -17.941 -22.881  15.026
  188   1HZ   LYS  25          2HZ       LYS  25 -17.112 -23.400  17.542
  189   2HZ   LYS  25          1HZ       LYS  25 -18.447 -22.385  17.814
  190   3HZ   LYS  25          3HZ       LYS  25 -18.637 -23.810  16.915
  191    H    ILE  26           H        ILE  26 -13.862 -21.939  11.199
  192    HA   ILE  26           HA       ILE  26 -16.614 -21.601  10.079
  193    HB   ILE  26           HB       ILE  26 -14.293 -22.820   8.592
  194   1HG1  ILE  26          2HG1      ILE  26 -15.013 -19.882   8.816
  195   2HG1  ILE  26          1HG1      ILE  26 -13.508 -20.634   9.347
  196   1HG2  ILE  26          2HG2      ILE  26 -16.669 -23.014   7.767
  197   2HG2  ILE  26          1HG2      ILE  26 -16.713 -21.254   7.652
  198   3HG2  ILE  26          3HG2      ILE  26 -15.590 -22.175   6.652
  199   1HD1  ILE  26          2HD1      ILE  26 -14.063 -21.317   6.588
  200   2HD1  ILE  26          1HD1      ILE  26 -14.060 -19.566   6.800
  201   3HD1  ILE  26          3HD1      ILE  26 -12.648 -20.513   7.267
  202    H    SER  27           H        SER  27 -17.910 -23.381  10.033
  203    HA   SER  27           HA       SER  27 -16.742 -25.945  11.009
  204   1HB   SER  27          2HB       SER  27 -18.836 -26.455  11.949
  205   2HB   SER  27          1HB       SER  27 -18.714 -24.715  12.207
  206    HG   SER  27           HG       SER  27 -20.535 -26.064  10.816
  207    H    ALA  28           H        ALA  28 -17.872 -27.929  10.028
  208    HA   ALA  28           HA       ALA  28 -17.501 -28.030   7.255
  209   1HB   ALA  28          3HB       ALA  28 -18.972 -29.700   9.230
  210   2HB   ALA  28          1HB       ALA  28 -17.731 -30.168   8.066
  211   3HB   ALA  28          2HB       ALA  28 -19.397 -29.935   7.535
  212    H    ALA  29           H        ALA  29 -20.521 -27.437   9.038
  213    HA   ALA  29           HA       ALA  29 -22.229 -27.194   6.800
  214   1HB   ALA  29          2HB       ALA  29 -22.429 -26.780   9.581
  215   2HB   ALA  29          3HB       ALA  29 -23.746 -26.749   8.407
  216   3HB   ALA  29          1HB       ALA  29 -22.911 -25.256   8.836
  217    H    GLU  30           H        GLU  30 -20.084 -24.813   8.316
  218    HA   GLU  30           HA       GLU  30 -20.994 -22.665   6.575
  219   1HB   GLU  30          2HB       GLU  30 -18.539 -22.899   8.340
  220   2HB   GLU  30          1HB       GLU  30 -19.045 -21.425   7.515
  221   1HG   GLU  30          2HG       GLU  30 -21.213 -21.517   8.727
  222   2HG   GLU  30          1HG       GLU  30 -20.655 -22.953   9.586
  223    H    LEU  31           H        LEU  31 -17.946 -24.530   6.786
  224    HA   LEU  31           HA       LEU  31 -16.866 -23.481   4.353
  225   1HB   LEU  31          2HB       LEU  31 -15.399 -24.619   5.903
  226   2HB   LEU  31          1HB       LEU  31 -16.360 -26.093   5.807
  227    HG   LEU  31           HG       LEU  31 -15.770 -26.360   3.447
  228   1HD1  LEU  31          1HD1      LEU  31 -14.509 -23.663   3.893
  229   2HD1  LEU  31          3HD1      LEU  31 -13.893 -24.735   2.635
  230   3HD1  LEU  31          2HD1      LEU  31 -15.568 -24.188   2.584
  231   1HD2  LEU  31          2HD2      LEU  31 -14.099 -26.782   5.564
  232   2HD2  LEU  31          1HD2      LEU  31 -13.733 -27.275   3.910
  233   3HD2  LEU  31          3HD2      LEU  31 -13.087 -25.760   4.543
  234    H    GLY  32           H        GLY  32 -18.828 -26.351   5.048
  235   1HA   GLY  32          1HA       GLY  32 -20.029 -27.759   3.604
  236   2HA   GLY  32          2HA       GLY  32 -18.821 -27.386   2.377
  237    H    GLU  33           H        GLU  33 -21.071 -25.216   4.091
  238    HA   GLU  33           HA       GLU  33 -22.942 -24.920   1.986
  239   1HB   GLU  33          2HB       GLU  33 -22.121 -23.240   4.328
  240   2HB   GLU  33          1HB       GLU  33 -23.203 -22.553   3.119
  241   1HG   GLU  33          2HG       GLU  33 -23.772 -25.278   4.251
  242   2HG   GLU  33          1HG       GLU  33 -24.223 -23.839   5.165
  243    H    ALA  34           H        ALA  34 -19.941 -23.133   2.664
  244    HA   ALA  34           HA       ALA  34 -20.295 -21.337   0.410
  245   1HB   ALA  34          1HB       ALA  34 -18.859 -20.731   2.327
  246   2HB   ALA  34          2HB       ALA  34 -17.928 -20.737   0.829
  247   3HB   ALA  34          3HB       ALA  34 -17.791 -22.085   1.958
  248    H    LEU  35           H        LEU  35 -18.548 -24.355   0.996
  249    HA   LEU  35           HA       LEU  35 -17.191 -24.512  -1.496
  250   1HB   LEU  35          2HB       LEU  35 -18.037 -26.462   0.599
  251   2HB   LEU  35          1HB       LEU  35 -17.561 -27.107  -0.971
  252    HG   LEU  35           HG       LEU  35 -15.903 -25.266   0.779
  253   1HD1  LEU  35          3HD1      LEU  35 -15.974 -28.211   0.278
  254   2HD1  LEU  35          2HD1      LEU  35 -14.396 -27.450   0.472
  255   3HD1  LEU  35          1HD1      LEU  35 -15.593 -27.335   1.761
  256   1HD2  LEU  35          1HD2      LEU  35 -15.704 -26.130  -2.057
  257   2HD2  LEU  35          3HD2      LEU  35 -15.100 -24.666  -1.282
  258   3HD2  LEU  35          2HD2      LEU  35 -14.210 -26.179  -1.122
  259    H    LYS  36           H        LYS  36 -20.524 -25.264  -0.599
  260    HA   LYS  36           HA       LYS  36 -21.371 -26.882  -2.684
  261   1HB   LYS  36          2HB       LYS  36 -22.607 -24.921  -0.933
  262   2HB   LYS  36          1HB       LYS  36 -23.354 -24.899  -2.531
  263   1HG   LYS  36          2HG       LYS  36 -23.746 -27.305  -2.424
  264   2HG   LYS  36          1HG       LYS  36 -22.888 -27.406  -0.887
  265   1HD   LYS  36          2HD       LYS  36 -24.828 -25.397  -0.529
  266   2HD   LYS  36          1HD       LYS  36 -25.653 -26.699  -1.387
  267   1HE   LYS  36          2HE       LYS  36 -24.840 -28.318   0.295
  268   2HE   LYS  36          1HE       LYS  36 -24.029 -27.010   1.157
  269   1HZ   LYS  36          2HZ       LYS  36 -26.937 -27.019   0.587
  270   2HZ   LYS  36          1HZ       LYS  36 -26.272 -27.634   2.025
  271   3HZ   LYS  36          3HZ       LYS  36 -26.088 -25.992   1.642
  272    H    THR  37           H        THR  37 -20.271 -23.578  -2.876
  273    HA   THR  37           HA       THR  37 -21.394 -22.722  -5.301
  274    HB   THR  37           HB       THR  37 -19.814 -21.435  -3.759
  275    HG1  THR  37           HG1      THR  37 -20.479 -20.848  -5.966
  276   1HG2  THR  37          1HG2      THR  37 -17.793 -23.015  -5.370
  277   2HG2  THR  37          3HG2      THR  37 -17.398 -21.594  -4.405
  278   3HG2  THR  37          2HG2      THR  37 -18.008 -23.050  -3.620
  279    H    LEU  38           H        LEU  38 -19.055 -25.216  -4.705
  280    HA   LEU  38           HA       LEU  38 -17.823 -25.375  -7.264
  281   1HB   LEU  38          2HB       LEU  38 -18.435 -27.445  -5.152
  282   2HB   LEU  38          1HB       LEU  38 -17.631 -27.879  -6.661
  283    HG   LEU  38           HG       LEU  38 -16.571 -25.529  -5.148
  284   1HD1  LEU  38          2HD1      LEU  38 -16.935 -27.271  -3.412
  285   2HD1  LEU  38          1HD1      LEU  38 -16.006 -28.411  -4.385
  286   3HD1  LEU  38          3HD1      LEU  38 -15.220 -26.985  -3.707
  287   1HD2  LEU  38          3HD2      LEU  38 -15.737 -26.428  -7.400
  288   2HD2  LEU  38          2HD2      LEU  38 -14.513 -26.197  -6.151
  289   3HD2  LEU  38          1HD2      LEU  38 -15.124 -27.814  -6.499
  290    H    GLY  39           H        GLY  39 -20.944 -26.509  -6.096
  291   1HA   GLY  39          1HA       GLY  39 -21.954 -26.718  -8.809
  292   2HA   GLY  39          2HA       GLY  39 -22.843 -27.129  -7.344
  293    H    SER  40           H        SER  40 -19.984 -28.753  -7.098
  294    HA   SER  40           HA       SER  40 -21.256 -31.277  -7.910
  295   1HB   SER  40          2HB       SER  40 -20.300 -30.860 -10.014
  296   2HB   SER  40          1HB       SER  40 -18.877 -30.087  -9.317
  297    HG   SER  40           HG       SER  40 -18.153 -32.068  -8.626
  298    H    ILE  41           H        ILE  41 -20.883 -30.983  -5.391
  299    HA   ILE  41           HA       ILE  41 -18.458 -32.562  -4.770
  300    HB   ILE  41           HB       ILE  41 -18.015 -30.030  -4.467
  301   1HG1  ILE  41          2HG1      ILE  41 -17.663 -31.543  -1.898
  302   2HG1  ILE  41          1HG1      ILE  41 -16.863 -32.122  -3.359
  303   1HG2  ILE  41          2HG2      ILE  41 -20.390 -30.012  -3.182
  304   2HG2  ILE  41          1HG2      ILE  41 -19.321 -30.288  -1.806
  305   3HG2  ILE  41          3HG2      ILE  41 -19.104 -28.860  -2.820
  306   1HD1  ILE  41          1HD1      ILE  41 -16.658 -29.224  -2.566
  307   2HD1  ILE  41          3HD1      ILE  41 -15.602 -30.425  -1.821
  308   3HD1  ILE  41          2HD1      ILE  41 -15.563 -30.178  -3.567
  309    H    THR  42           H        THR  42 -18.584 -33.120  -2.276
  310    HA   THR  42           HA       THR  42 -21.451 -33.580  -1.561
  311    HB   THR  42           HB       THR  42 -21.134 -35.823  -1.388
  312    HG1  THR  42           HG1      THR  42 -19.789 -36.543   0.059
  313   1HG2  THR  42          2HG2      THR  42 -19.957 -35.342  -3.536
  314   2HG2  THR  42          1HG2      THR  42 -18.435 -35.267  -2.645
  315   3HG2  THR  42          3HG2      THR  42 -19.337 -36.781  -2.726
  316    HA   PRO  43           HA       PRO  43 -20.433 -32.028   2.459
  317   1HB   PRO  43          2HB       PRO  43 -21.723 -33.723   4.126
  318   2HB   PRO  43          1HB       PRO  43 -22.569 -32.525   3.143
  319   1HG   PRO  43          2HG       PRO  43 -22.172 -35.453   2.642
  320   2HG   PRO  43          1HG       PRO  43 -23.631 -34.479   2.434
  321   1HD   PRO  43          1HD       PRO  43 -22.058 -35.158   0.345
  322   2HD   PRO  43          2HD       PRO  43 -22.924 -33.622   0.400
  323    H    ASP  44           H        ASP  44 -20.009 -35.498   1.953
  324    HA   ASP  44           HA       ASP  44 -18.297 -35.958   4.204
  325   1HB   ASP  44          2HB       ASP  44 -18.537 -37.425   1.562
  326   2HB   ASP  44          1HB       ASP  44 -17.633 -38.020   2.955
  327    H    GLU  45           H        GLU  45 -17.703 -34.519   1.065
  328    HA   GLU  45           HA       GLU  45 -14.808 -34.946   1.226
  329   1HB   GLU  45          2HB       GLU  45 -16.573 -33.303  -0.611
  330   2HB   GLU  45          1HB       GLU  45 -14.814 -33.324  -0.737
  331   1HG   GLU  45          2HG       GLU  45 -14.968 -35.855  -0.905
  332   2HG   GLU  45          1HG       GLU  45 -16.713 -35.660  -1.063
  333    H    VAL  46           H        VAL  46 -17.139 -32.353   1.786
  334    HA   VAL  46           HA       VAL  46 -15.205 -30.319   2.389
  335    HB   VAL  46           HB       VAL  46 -18.092 -30.668   3.242
  336   1HG1  VAL  46          3HG1      VAL  46 -16.536 -29.189   4.732
  337   2HG1  VAL  46          2HG1      VAL  46 -16.559 -28.077   3.364
  338   3HG1  VAL  46          1HG1      VAL  46 -18.065 -28.509   4.175
  339   1HG2  VAL  46          2HG2      VAL  46 -16.827 -29.894   0.814
  340   2HG2  VAL  46          1HG2      VAL  46 -18.550 -29.863   1.191
  341   3HG2  VAL  46          3HG2      VAL  46 -17.552 -28.445   1.510
  342    H    LYS  47           H        LYS  47 -16.798 -32.810   4.295
  343    HA   LYS  47           HA       LYS  47 -15.865 -31.900   6.865
  344   1HB   LYS  47          2HB       LYS  47 -16.699 -34.647   5.887
  345   2HB   LYS  47          1HB       LYS  47 -16.339 -34.275   7.573
  346   1HG   LYS  47          2HG       LYS  47 -18.091 -32.483   7.492
  347   2HG   LYS  47          1HG       LYS  47 -18.504 -33.014   5.862
  348   1HD   LYS  47          2HD       LYS  47 -18.894 -35.327   6.823
  349   2HD   LYS  47          1HD       LYS  47 -18.721 -34.614   8.426
  350   1HE   LYS  47          2HE       LYS  47 -20.531 -32.935   7.675
  351   2HE   LYS  47          1HE       LYS  47 -20.841 -34.055   6.348
  352   1HZ   LYS  47          3HZ       LYS  47 -21.082 -35.820   8.078
  353   2HZ   LYS  47          2HZ       LYS  47 -21.045 -34.596   9.256
  354   3HZ   LYS  47          1HZ       LYS  47 -22.292 -34.633   8.105
  355    H    HIS  48           H        HIS  48 -14.564 -34.118   4.432
  356    HA   HIS  48           HA       HIS  48 -12.301 -34.979   5.978
  357   1HB   HIS  48          2HB       HIS  48 -13.018 -36.200   3.976
  358   2HB   HIS  48          1HB       HIS  48 -12.663 -34.796   2.971
  359    HD1  HIS  48           HD1      HIS  48 -10.646 -35.562   1.663
  360    HD2  HIS  48           HD2      HIS  48 -10.250 -36.305   5.746
  361    HE1  HIS  48           HE1      HIS  48  -8.273 -36.375   2.016
  362    H    MET  49           H        MET  49 -12.796 -32.296   3.684
  363    HA   MET  49           HA       MET  49 -10.107 -31.383   3.608
  364   1HB   MET  49          2HB       MET  49 -12.782 -30.060   3.229
  365   2HB   MET  49          1HB       MET  49 -11.309 -29.095   3.226
  366   1HG   MET  49          2HG       MET  49 -10.433 -30.863   1.524
  367   2HG   MET  49          1HG       MET  49 -12.135 -31.280   1.325
  368   1HE   MET  49          2HE       MET  49 -12.403 -31.027  -0.666
  369   2HE   MET  49          1HE       MET  49 -13.371 -29.615  -1.083
  370   3HE   MET  49          3HE       MET  49 -11.752 -29.815  -1.765
  371    H    MET  50           H        MET  50 -12.784 -30.583   5.796
  372    HA   MET  50           HA       MET  50 -11.377 -28.665   7.368
  373   1HB   MET  50          2HB       MET  50 -13.788 -30.385   7.753
  374   2HB   MET  50          1HB       MET  50 -13.074 -29.641   9.183
  375   1HG   MET  50          2HG       MET  50 -13.112 -27.439   7.879
  376   2HG   MET  50          1HG       MET  50 -14.146 -28.265   6.713
  377   1HE   MET  50          3HE       MET  50 -13.491 -26.741   9.883
  378   2HE   MET  50          2HE       MET  50 -14.992 -26.640  10.797
  379   3HE   MET  50          1HE       MET  50 -14.025 -28.112  10.863
  380    H    ALA  51           H        ALA  51 -11.806 -32.167   7.800
  381    HA   ALA  51           HA       ALA  51 -10.312 -32.430  10.200
  382   1HB   ALA  51          1HB       ALA  51 -11.251 -34.464   9.771
  383   2HB   ALA  51          2HB       ALA  51  -9.755 -34.768   8.889
  384   3HB   ALA  51          3HB       ALA  51 -11.193 -34.227   8.024
  385    H    GLU  52           H        GLU  52  -9.312 -31.799   6.951
  386    HA   GLU  52           HA       GLU  52  -6.490 -32.492   7.548
  387   1HB   GLU  52          2HB       GLU  52  -8.001 -31.718   5.063
  388   2HB   GLU  52          1HB       GLU  52  -6.243 -31.580   5.107
  389   1HG   GLU  52          2HG       GLU  52  -6.254 -34.009   5.968
  390   2HG   GLU  52          1HG       GLU  52  -7.935 -34.061   5.439
  391    H    ILE  53           H        ILE  53  -8.575 -29.719   6.943
  392    HA   ILE  53           HA       ILE  53  -6.374 -27.799   7.060
  393    HB   ILE  53           HB       ILE  53  -9.378 -27.420   7.188
  394   1HG1  ILE  53          2HG1      ILE  53  -7.449 -27.083   4.878
  395   2HG1  ILE  53          1HG1      ILE  53  -8.502 -28.477   5.098
  396   1HG2  ILE  53          2HG2      ILE  53  -7.126 -25.451   6.701
  397   2HG2  ILE  53          1HG2      ILE  53  -8.847 -25.080   6.597
  398   3HG2  ILE  53          3HG2      ILE  53  -8.134 -25.532   8.145
  399   1HD1  ILE  53          3HD1      ILE  53 -10.379 -26.627   5.304
  400   2HD1  ILE  53          2HD1      ILE  53  -9.220 -25.653   4.400
  401   3HD1  ILE  53          1HD1      ILE  53  -9.827 -27.162   3.717
  402    H    ASP  54           H        ASP  54  -8.743 -29.172   9.256
  403    HA   ASP  54           HA       ASP  54  -8.539 -27.309  11.391
  404   1HB   ASP  54          2HB       ASP  54 -10.097 -29.400  10.967
  405   2HB   ASP  54          1HB       ASP  54  -8.851 -30.255  11.864
  406    H    THR  55           H        THR  55  -6.437 -26.710  11.938
  407    HA   THR  55           HA       THR  55  -4.244 -28.580  12.070
  408    HB   THR  55           HB       THR  55  -3.031 -26.702  13.162
  409    HG1  THR  55           HG1      THR  55  -4.217 -24.750  13.395
  410   1HG2  THR  55          2HG2      THR  55  -4.720 -25.926  10.769
  411   2HG2  THR  55          1HG2      THR  55  -3.226 -25.130  11.266
  412   3HG2  THR  55          3HG2      THR  55  -3.192 -26.804  10.711
  413    H    ASP  56           H        ASP  56  -6.232 -27.028  14.587
  414    HA   ASP  56           HA       ASP  56  -4.901 -28.655  16.652
  415   1HB   ASP  56          2HB       ASP  56  -6.810 -27.531  18.090
  416   2HB   ASP  56          1HB       ASP  56  -5.417 -26.586  17.570
  417    H    GLY  57           H        GLY  57  -7.917 -28.640  14.853
  418   1HA   GLY  57          1HA       GLY  57  -8.447 -31.357  15.895
  419   2HA   GLY  57          2HA       GLY  57  -9.219 -30.627  14.491
  420    H    ASP  58           H        ASP  58  -9.800 -28.112  16.053
  421    HA   ASP  58           HA       ASP  58 -11.591 -29.025  18.192
  422   1HB   ASP  58          2HB       ASP  58 -11.984 -26.730  18.655
  423   2HB   ASP  58          1HB       ASP  58 -10.290 -26.806  18.173
  424    H    GLY  59           H        GLY  59 -11.811 -29.004  14.880
  425   1HA   GLY  59          1HA       GLY  59 -14.777 -29.066  15.048
  426   2HA   GLY  59          2HA       GLY  59 -13.812 -29.799  13.769
  427    H    PHE  60           H        PHE  60 -12.622 -26.717  14.454
  428    HA   PHE  60           HA       PHE  60 -14.120 -25.642  12.108
  429   1HB   PHE  60          2HB       PHE  60 -13.413 -23.995  14.543
  430   2HB   PHE  60          1HB       PHE  60 -14.402 -23.509  13.166
  431    HD1  PHE  60           HD1      PHE  60 -16.635 -24.542  12.796
  432    HD2  PHE  60           HD2      PHE  60 -14.319 -25.324  16.326
  433    HE1  PHE  60           HE1      PHE  60 -18.656 -25.423  13.927
  434    HE2  PHE  60           HE2      PHE  60 -16.340 -26.202  17.457
  435    HZ   PHE  60           HZ       PHE  60 -18.511 -26.255  16.259
  436    H    ILE  61           H        ILE  61 -13.010 -23.971  10.917
  437    HA   ILE  61           HA       ILE  61 -10.062 -24.107  11.253
  438    HB   ILE  61           HB       ILE  61 -11.610 -23.201   8.817
  439   1HG1  ILE  61          2HG1      ILE  61 -12.232 -25.511   9.279
  440   2HG1  ILE  61          1HG1      ILE  61 -11.112 -25.483   7.919
  441   1HG2  ILE  61          2HG2      ILE  61  -8.755 -24.142   9.235
  442   2HG2  ILE  61          1HG2      ILE  61  -9.462 -23.689   7.683
  443   3HG2  ILE  61          3HG2      ILE  61  -9.261 -22.477   8.947
  444   1HD1  ILE  61          2HD1      ILE  61  -9.246 -25.890   9.604
  445   2HD1  ILE  61          1HD1      ILE  61 -10.505 -26.201  10.797
  446   3HD1  ILE  61          3HD1      ILE  61 -10.363 -27.237   9.377
  447    H    SER  62           H        SER  62  -9.062 -22.245  11.893
  448    HA   SER  62           HA       SER  62 -10.690 -19.783  12.098
  449   1HB   SER  62          2HB       SER  62  -8.282 -19.116  13.176
  450   2HB   SER  62          1HB       SER  62  -9.579 -19.874  14.099
  451    HG   SER  62           HG       SER  62  -8.552 -21.734  14.070
  452    H    PHE  63           H        PHE  63  -9.523 -17.706  11.454
  453    HA   PHE  63           HA       PHE  63  -8.838 -17.760   8.718
  454   1HB   PHE  63          2HB       PHE  63  -9.459 -15.677   9.900
  455   2HB   PHE  63          1HB       PHE  63  -7.937 -15.735  10.792
  456    HD1  PHE  63           HD1      PHE  63  -8.932 -16.285   7.219
  457    HD2  PHE  63           HD2      PHE  63  -6.374 -14.211   9.975
  458    HE1  PHE  63           HE1      PHE  63  -7.777 -15.188   5.320
  459    HE2  PHE  63           HE2      PHE  63  -5.213 -13.119   8.076
  460    HZ   PHE  63           HZ       PHE  63  -5.920 -13.605   5.747
  461    H    GLN  64           H        GLN  64  -6.769 -17.853  11.590
  462    HA   GLN  64           HA       GLN  64  -4.261 -17.801  10.238
  463   1HB   GLN  64          2HB       GLN  64  -4.638 -17.547  12.720
  464   2HB   GLN  64          1HB       GLN  64  -4.930 -19.285  12.797
  465   1HG   GLN  64          2HG       GLN  64  -2.612 -18.964  13.342
  466   2HG   GLN  64          1HG       GLN  64  -2.653 -19.594  11.695
  467   1HE2  GLN  64          1HE2      GLN  64  -1.307 -18.453  10.303
  468   2HE2  GLN  64          2HE2      GLN  64  -0.917 -16.807  10.447
  469    H    GLU  65           H        GLU  65  -6.252 -20.563  11.348
  470    HA   GLU  65           HA       GLU  65  -4.586 -22.630  10.346
  471   1HB   GLU  65          2HB       GLU  65  -7.483 -22.373  11.018
  472   2HB   GLU  65          1HB       GLU  65  -6.986 -23.773  10.077
  473   1HG   GLU  65          2HG       GLU  65  -5.370 -24.405  11.788
  474   2HG   GLU  65          1HG       GLU  65  -5.723 -22.941  12.704
  475    H    PHE  66           H        PHE  66  -7.314 -20.929   8.817
  476    HA   PHE  66           HA       PHE  66  -7.211 -22.313   6.327
  477   1HB   PHE  66          2HB       PHE  66  -9.080 -20.825   7.075
  478   2HB   PHE  66          1HB       PHE  66  -8.031 -19.435   6.803
  479    HD1  PHE  66           HD1      PHE  66  -9.859 -22.208   5.183
  480    HD2  PHE  66           HD2      PHE  66  -7.456 -18.701   4.567
  481    HE1  PHE  66           HE1      PHE  66 -10.461 -22.218   2.777
  482    HE2  PHE  66           HE2      PHE  66  -8.059 -18.711   2.162
  483    HZ   PHE  66           HZ       PHE  66  -9.561 -20.469   1.267
  484    H    THR  67           H        THR  67  -5.552 -19.404   7.477
  485    HA   THR  67           HA       THR  67  -4.275 -18.760   4.991
  486    HB   THR  67           HB       THR  67  -3.574 -18.154   7.873
  487    HG1  THR  67           HG1      THR  67  -4.128 -16.006   6.936
  488   1HG2  THR  67          3HG2      THR  67  -1.507 -18.214   6.521
  489   2HG2  THR  67          2HG2      THR  67  -2.244 -17.114   5.355
  490   3HG2  THR  67          1HG2      THR  67  -1.912 -16.565   6.998
  491    H    ASP  68           H        ASP  68  -3.165 -20.636   7.824
  492    HA   ASP  68           HA       ASP  68  -0.594 -21.291   6.802
  493   1HB   ASP  68          2HB       ASP  68  -2.391 -22.914   8.630
  494   2HB   ASP  68          1HB       ASP  68  -0.667 -23.195   8.391
  495    H    PHE  69           H        PHE  69  -3.752 -22.823   6.338
  496    HA   PHE  69           HA       PHE  69  -2.640 -25.025   4.781
  497   1HB   PHE  69          2HB       PHE  69  -4.616 -25.752   5.696
  498   2HB   PHE  69          1HB       PHE  69  -5.316 -24.136   5.719
  499    HD1  PHE  69           HD1      PHE  69  -6.032 -23.112   3.488
  500    HD2  PHE  69           HD2      PHE  69  -5.207 -27.291   4.008
  501    HE1  PHE  69           HE1      PHE  69  -7.311 -23.620   1.422
  502    HE2  PHE  69           HE2      PHE  69  -6.479 -27.802   1.945
  503    HZ   PHE  69           HZ       PHE  69  -7.535 -25.968   0.649
  504    H    GLY  70           H        GLY  70  -4.198 -21.919   4.128
  505   1HA   GLY  70          1HA       GLY  70  -4.344 -20.677   2.141
  506   2HA   GLY  70          2HA       GLY  70  -4.518 -22.225   1.314
  507    H    ARG  71           H        ARG  71  -1.710 -21.498   3.283
  508    HA   ARG  71           HA       ARG  71  -0.056 -20.571   1.085
  509   1HB   ARG  71          2HB       ARG  71   0.628 -21.627   3.842
  510   2HB   ARG  71          1HB       ARG  71   1.826 -20.996   2.712
  511   1HG   ARG  71          2HG       ARG  71   0.541 -18.850   2.624
  512   2HG   ARG  71          1HG       ARG  71  -0.543 -19.488   3.861
  513   1HD   ARG  71          2HD       ARG  71   2.421 -18.924   4.116
  514   2HD   ARG  71          1HD       ARG  71   1.101 -18.169   5.010
  515    HE   ARG  71           HE       ARG  71   0.919 -20.906   5.577
  516   1HH1  ARG  71          1HH1      ARG  71   2.876 -18.151   6.171
  517   2HH1  ARG  71          2HH1      ARG  71   3.788 -18.896   7.441
  518   1HH2  ARG  71          1HH2      ARG  71   2.246 -21.983   7.095
  519   2HH2  ARG  71          2HH2      ARG  71   3.430 -21.066   7.964
  520    H    ALA  72           H        ALA  72  -0.721 -23.686   2.590
  521    HA   ALA  72           HA       ALA  72   1.373 -25.150   1.266
  522   1HB   ALA  72          3HB       ALA  72  -0.547 -27.033   1.652
  523   2HB   ALA  72          2HB       ALA  72   0.530 -26.474   2.931
  524   3HB   ALA  72          1HB       ALA  72  -1.092 -25.796   2.787
  525    H    ASN  73           H        ASN  73  -1.602 -23.823   0.170
  526    HA   ASN  73           HA       ASN  73  -1.136 -25.012  -2.496
  527   1HB   ASN  73          2HB       ASN  73  -3.945 -25.066  -1.435
  528   2HB   ASN  73          1HB       ASN  73  -3.220 -26.037  -2.716
  529   1HD2  ASN  73          1HD2      ASN  73  -4.121 -26.079   0.571
  530   2HD2  ASN  73          2HD2      ASN  73  -3.250 -27.457   1.041
  531    H    ARG  74           H        ARG  74  -0.567 -22.458  -2.017
  532    HA   ARG  74           HA       ARG  74  -2.570 -20.500  -2.015
  533   1HB   ARG  74          2HB       ARG  74  -0.966 -19.073  -3.264
  534   2HB   ARG  74          1HB       ARG  74  -0.180 -19.934  -1.941
  535   1HG   ARG  74          2HG       ARG  74   0.525 -21.696  -3.578
  536   2HG   ARG  74          1HG       ARG  74  -0.147 -20.704  -4.874
  537   1HD   ARG  74          2HD       ARG  74   2.181 -20.071  -3.053
  538   2HD   ARG  74          1HD       ARG  74   2.165 -20.148  -4.815
  539    HE   ARG  74           HE       ARG  74   0.683 -18.080  -4.710
  540   1HH1  ARG  74          1HH1      ARG  74   1.181 -18.714  -1.547
  541   2HH1  ARG  74          2HH1      ARG  74   2.014 -17.247  -1.155
  542   1HH2  ARG  74          1HH2      ARG  74   2.442 -16.295  -4.461
  543   2HH2  ARG  74          2HH2      ARG  74   2.729 -15.879  -2.804
  544    H    GLY  75           H        GLY  75  -1.303 -22.388  -4.723
  545   1HA   GLY  75          1HA       GLY  75  -2.250 -22.858  -6.802
  546   2HA   GLY  75          2HA       GLY  75  -2.682 -21.148  -6.842
  547    H    LEU  76           H        LEU  76  -3.892 -23.026  -4.213
  548    HA   LEU  76           HA       LEU  76  -6.399 -23.769  -5.529
  549   1HB   LEU  76          2HB       LEU  76  -5.472 -23.860  -2.649
  550   2HB   LEU  76          1HB       LEU  76  -7.078 -24.381  -3.159
  551    HG   LEU  76           HG       LEU  76  -4.438 -25.504  -4.149
  552   1HD1  LEU  76          1HD1      LEU  76  -5.735 -26.046  -1.792
  553   2HD1  LEU  76          3HD1      LEU  76  -6.448 -27.245  -2.871
  554   3HD1  LEU  76          2HD1      LEU  76  -4.700 -27.191  -2.645
  555   1HD2  LEU  76          1HD2      LEU  76  -7.297 -25.865  -4.995
  556   2HD2  LEU  76          3HD2      LEU  76  -5.845 -25.753  -5.992
  557   3HD2  LEU  76          2HD2      LEU  76  -6.190 -27.235  -5.100
  558    H    LEU  77           H        LEU  77  -5.351 -21.341  -3.164
  559    HA   LEU  77           HA       LEU  77  -7.900 -20.185  -2.676
  560   1HB   LEU  77          2HB       LEU  77  -5.085 -19.105  -2.538
  561   2HB   LEU  77          1HB       LEU  77  -6.477 -18.099  -2.144
  562    HG   LEU  77           HG       LEU  77  -5.321 -19.372  -0.208
  563   1HD1  LEU  77          1HD1      LEU  77  -8.222 -19.144  -0.843
  564   2HD1  LEU  77          3HD1      LEU  77  -7.785 -20.118   0.561
  565   3HD1  LEU  77          2HD1      LEU  77  -7.300 -18.425   0.478
  566   1HD2  LEU  77          2HD2      LEU  77  -6.901 -21.622  -1.484
  567   2HD2  LEU  77          1HD2      LEU  77  -5.147 -21.550  -1.320
  568   3HD2  LEU  77          3HD2      LEU  77  -6.162 -21.682   0.116
  569    H    LYS  78           H        LYS  78  -5.457 -19.471  -5.149
  570    HA   LYS  78           HA       LYS  78  -6.782 -17.199  -6.268
  571   1HB   LYS  78          2HB       LYS  78  -4.988 -19.228  -7.635
  572   2HB   LYS  78          1HB       LYS  78  -5.398 -17.632  -8.266
  573   1HG   LYS  78          2HG       LYS  78  -4.280 -16.537  -6.435
  574   2HG   LYS  78          1HG       LYS  78  -4.069 -18.064  -5.578
  575   1HD   LYS  78          2HD       LYS  78  -1.973 -17.404  -6.687
  576   2HD   LYS  78          1HD       LYS  78  -2.615 -18.879  -7.411
  577   1HE   LYS  78          2HE       LYS  78  -2.507 -17.828  -9.405
  578   2HE   LYS  78          1HE       LYS  78  -3.827 -16.799  -8.846
  579   1HZ   LYS  78          3HZ       LYS  78  -1.300 -15.992  -7.787
  580   2HZ   LYS  78          2HZ       LYS  78  -1.304 -15.981  -9.486
  581   3HZ   LYS  78          1HZ       LYS  78  -2.459 -15.080  -8.625
  582    H    ASP  79           H        ASP  79  -7.075 -20.665  -6.899
  583    HA   ASP  79           HA       ASP  79  -8.905 -20.342  -9.125
  584   1HB   ASP  79          2HB       ASP  79  -7.863 -22.596  -7.489
  585   2HB   ASP  79          1HB       ASP  79  -9.410 -22.855  -8.297
  586    H    VAL  80           H        VAL  80  -9.341 -21.265  -5.709
  587    HA   VAL  80           HA       VAL  80 -12.203 -21.391  -5.839
  588    HB   VAL  80           HB       VAL  80 -10.601 -22.292  -4.021
  589   1HG1  VAL  80          3HG1      VAL  80  -9.513 -20.092  -3.590
  590   2HG1  VAL  80          2HG1      VAL  80 -11.044 -19.494  -2.950
  591   3HG1  VAL  80          1HG1      VAL  80 -10.197 -20.808  -2.132
  592   1HG2  VAL  80          2HG2      VAL  80 -13.309 -21.138  -3.787
  593   2HG2  VAL  80          1HG2      VAL  80 -12.742 -22.761  -3.391
  594   3HG2  VAL  80          3HG2      VAL  80 -12.497 -21.438  -2.250
  595    H    ALA  81           H        ALA  81  -9.953 -18.839  -4.897
  596    HA   ALA  81           HA       ALA  81 -11.737 -16.888  -3.983
  597   1HB   ALA  81          3HB       ALA  81  -9.430 -16.367  -3.850
  598   2HB   ALA  81          2HB       ALA  81  -9.182 -16.660  -5.571
  599   3HB   ALA  81          1HB       ALA  81 -10.067 -15.231  -5.038
  600    H    LYS  82           H        LYS  82 -10.940 -17.715  -7.341
  601    HA   LYS  82           HA       LYS  82 -12.455 -15.586  -8.530
  602   1HB   LYS  82          2HB       LYS  82 -11.645 -18.303  -9.604
  603   2HB   LYS  82          1HB       LYS  82 -12.376 -17.032 -10.583
  604   1HG   LYS  82          2HG       LYS  82 -10.493 -15.510  -9.828
  605   2HG   LYS  82          1HG       LYS  82  -9.725 -16.932  -9.121
  606   1HD   LYS  82          2HD       LYS  82  -9.864 -18.030 -11.391
  607   2HD   LYS  82          1HD       LYS  82 -10.407 -16.482 -12.039
  608   1HE   LYS  82          2HE       LYS  82  -7.942 -16.442 -10.368
  609   2HE   LYS  82          1HE       LYS  82  -7.806 -17.184 -11.963
  610   1HZ   LYS  82          2HZ       LYS  82  -9.255 -14.910 -12.389
  611   2HZ   LYS  82          1HZ       LYS  82  -8.075 -14.429 -11.264
  612   3HZ   LYS  82          3HZ       LYS  82  -7.607 -15.127 -12.736
  613    H    ILE  83           H        ILE  83 -13.339 -18.692  -7.210
  614    HA   ILE  83           HA       ILE  83 -15.849 -19.025  -8.532
  615    HB   ILE  83           HB       ILE  83 -15.155 -19.867  -5.708
  616   1HG1  ILE  83          2HG1      ILE  83 -14.494 -21.099  -8.391
  617   2HG1  ILE  83          1HG1      ILE  83 -13.380 -20.672  -7.095
  618   1HG2  ILE  83          2HG2      ILE  83 -17.112 -20.884  -7.787
  619   2HG2  ILE  83          1HG2      ILE  83 -16.729 -21.744  -6.296
  620   3HG2  ILE  83          3HG2      ILE  83 -17.503 -20.160  -6.228
  621   1HD1  ILE  83          3HD1      ILE  83 -14.798 -22.353  -5.673
  622   2HD1  ILE  83          2HD1      ILE  83 -15.318 -22.969  -7.242
  623   3HD1  ILE  83          1HD1      ILE  83 -13.608 -22.987  -6.809
  624    H    PHE  84           H        PHE  84 -14.995 -17.428  -5.476
  625    HA   PHE  84           HA       PHE  84 -17.765 -16.467  -5.150
  626   1HB   PHE  84          2HB       PHE  84 -15.261 -15.962  -3.511
  627   2HB   PHE  84          1HB       PHE  84 -16.882 -15.421  -3.074
  628    HD1  PHE  84           HD1      PHE  84 -14.728 -18.390  -3.606
  629    HD2  PHE  84           HD2      PHE  84 -18.528 -16.955  -2.210
  630    HE1  PHE  84           HE1      PHE  84 -15.191 -20.605  -2.590
  631    HE2  PHE  84           HE2      PHE  84 -18.992 -19.170  -1.194
  632    HZ   PHE  84           HZ       PHE  84 -17.323 -20.995  -1.385

  No H/Q in entry =         632
  Start of MODEL    7
    1    H1   ALA   1          3H        ALA   1  10.793 -15.770  -0.620
    2    H2   ALA   1          2H        ALA   1  11.941 -15.037   0.397
    3    H3   ALA   1          1H        ALA   1  11.262 -16.536   0.819
    4    HA   ALA   1           HA       ALA   1   9.333 -15.646   1.560
    5   1HB   ALA   1          1HB       ALA   1  11.657 -13.968   2.052
    6   2HB   ALA   1          2HB       ALA   1  10.360 -14.425   3.155
    7   3HB   ALA   1          3HB       ALA   1  10.167 -13.026   2.099
    8    H    ASP   2           H        ASP   2   8.633 -15.655  -0.937
    9    HA   ASP   2           HA       ASP   2   8.261 -12.968  -2.053
   10   1HB   ASP   2          2HB       ASP   2   7.309 -15.713  -2.907
   11   2HB   ASP   2          1HB       ASP   2   6.910 -14.237  -3.785
   12    H    ASP   3           H        ASP   3   6.686 -14.831   0.277
   13    HA   ASP   3           HA       ASP   3   3.942 -14.177  -0.297
   14   1HB   ASP   3          2HB       ASP   3   5.349 -14.888   2.291
   15   2HB   ASP   3          1HB       ASP   3   3.602 -14.700   2.149
   16    H    HIS   4           H        HIS   4   3.078 -12.164  -0.259
   17    HA   HIS   4           HA       HIS   4   4.370 -10.120   1.501
   18   1HB   HIS   4          2HB       HIS   4   2.779  -8.675  -0.194
   19   2HB   HIS   4          1HB       HIS   4   4.481  -9.007  -0.487
   20    HD1  HIS   4           HD1      HIS   4   1.229 -10.943  -1.046
   21    HD2  HIS   4           HD2      HIS   4   4.796 -10.054  -3.009
   22    HE1  HIS   4           HE1      HIS   4   1.102 -12.075  -3.308
   23    HA   PRO   5           HA       PRO   5   0.652  -9.506   3.829
   24   1HB   PRO   5          2HB       PRO   5   0.204  -6.838   3.732
   25   2HB   PRO   5          1HB       PRO   5   1.503  -7.560   4.687
   26   1HG   PRO   5          2HG       PRO   5   1.622  -6.297   1.969
   27   2HG   PRO   5          1HG       PRO   5   2.718  -6.083   3.339
   28   1HD   PRO   5          1HD       PRO   5   3.343  -7.709   1.292
   29   2HD   PRO   5          2HD       PRO   5   3.806  -8.100   2.948
   30    H    GLN   6           H        GLN   6   0.723  -8.274   0.565
   31    HA   GLN   6           HA       GLN   6  -2.046  -7.594   0.296
   32   1HB   GLN   6          2HB       GLN   6   0.205  -8.237  -1.554
   33   2HB   GLN   6          1HB       GLN   6  -1.432  -8.352  -2.204
   34   1HG   GLN   6          2HG       GLN   6  -1.864  -6.083  -1.883
   35   2HG   GLN   6          1HG       GLN   6  -0.652  -5.929  -0.611
   36   1HE2  GLN   6          1HE2      GLN   6   1.714  -6.419  -1.486
   37   2HE2  GLN   6          2HE2      GLN   6   2.088  -5.742  -2.997
   38    H    ASP   7           H        ASP   7  -0.270 -10.629   0.015
   39    HA   ASP   7           HA       ASP   7  -2.321 -12.217  -1.144
   40   1HB   ASP   7          2HB       ASP   7  -0.024 -12.836   0.704
   41   2HB   ASP   7          1HB       ASP   7  -1.163 -14.098   0.232
   42    H    LYS   8           H        LYS   8  -1.610 -11.519   2.268
   43    HA   LYS   8           HA       LYS   8  -3.566 -13.095   3.499
   44   1HB   LYS   8          2HB       LYS   8  -2.288 -10.475   4.155
   45   2HB   LYS   8          1HB       LYS   8  -3.695 -10.963   5.099
   46   1HG   LYS   8          2HG       LYS   8  -2.395 -13.278   5.196
   47   2HG   LYS   8          1HG       LYS   8  -0.995 -12.243   4.915
   48   1HD   LYS   8          2HD       LYS   8  -1.845 -10.797   6.840
   49   2HD   LYS   8          1HD       LYS   8  -2.976 -12.101   7.197
   50   1HE   LYS   8          2HE       LYS   8  -0.774 -12.168   8.484
   51   2HE   LYS   8          1HE       LYS   8  -1.198 -13.648   7.623
   52   1HZ   LYS   8          1HZ       LYS   8   0.391 -11.621   6.225
   53   2HZ   LYS   8          3HZ       LYS   8   1.163 -12.586   7.387
   54   3HZ   LYS   8          2HZ       LYS   8   0.399 -13.312   6.054
   55    H    ALA   9           H        ALA   9  -3.935  -9.975   1.879
   56    HA   ALA   9           HA       ALA   9  -6.606  -9.407   2.624
   57   1HB   ALA   9          2HB       ALA   9  -4.753  -8.287   0.883
   58   2HB   ALA   9          3HB       ALA   9  -6.404  -7.715   1.127
   59   3HB   ALA   9          1HB       ALA   9  -6.042  -8.828  -0.192
   60    H    GLU  10           H        GLU  10  -5.337 -11.356  -0.050
   61    HA   GLU  10           HA       GLU  10  -7.901 -12.112  -1.100
   62   1HB   GLU  10          2HB       GLU  10  -5.336 -13.719  -1.229
   63   2HB   GLU  10          1HB       GLU  10  -6.702 -13.807  -2.342
   64   1HG   GLU  10          2HG       GLU  10  -6.287 -11.341  -2.843
   65   2HG   GLU  10          1HG       GLU  10  -4.771 -11.508  -1.957
   66    H    ARG  11           H        ARG  11  -5.693 -13.688   1.199
   67    HA   ARG  11           HA       ARG  11  -7.302 -16.003   1.662
   68   1HB   ARG  11          2HB       ARG  11  -5.281 -14.564   3.397
   69   2HB   ARG  11          1HB       ARG  11  -6.026 -16.094   3.853
   70   1HG   ARG  11          2HG       ARG  11  -5.166 -17.117   1.766
   71   2HG   ARG  11          1HG       ARG  11  -4.395 -15.588   1.346
   72   1HD   ARG  11          2HD       ARG  11  -3.320 -15.818   3.746
   73   2HD   ARG  11          1HD       ARG  11  -3.697 -17.527   3.529
   74    HE   ARG  11           HE       ARG  11  -2.314 -17.401   1.417
   75   1HH1  ARG  11          1HH1      ARG  11  -2.253 -14.281   2.267
   76   2HH1  ARG  11          2HH1      ARG  11  -0.549 -14.146   2.547
   77   1HH2  ARG  11          1HH2      ARG  11   0.002 -17.569   2.477
   78   2HH2  ARG  11          2HH2      ARG  11   0.728 -16.008   2.665
   79    H    GLU  12           H        GLU  12  -7.200 -12.826   3.217
   80    HA   GLU  12           HA       GLU  12  -9.088 -13.419   5.289
   81   1HB   GLU  12          2HB       GLU  12  -7.901 -10.971   4.098
   82   2HB   GLU  12          1HB       GLU  12  -9.442 -10.760   4.929
   83   1HG   GLU  12          2HG       GLU  12  -8.315 -12.206   6.808
   84   2HG   GLU  12          1HG       GLU  12  -6.811 -11.711   6.033
   85    H    ARG  13           H        ARG  13  -9.470 -12.045   2.034
   86    HA   ARG  13           HA       ARG  13 -12.305 -11.645   2.244
   87   1HB   ARG  13          2HB       ARG  13 -10.509 -12.069  -0.161
   88   2HB   ARG  13          1HB       ARG  13 -12.218 -11.647  -0.280
   89   1HG   ARG  13          2HG       ARG  13 -11.880  -9.540   0.770
   90   2HG   ARG  13          1HG       ARG  13 -10.278  -9.999   1.350
   91   1HD   ARG  13          2HD       ARG  13  -9.303  -9.369  -0.588
   92   2HD   ARG  13          1HD       ARG  13 -10.497 -10.242  -1.549
   93    HE   ARG  13           HE       ARG  13 -11.964  -8.106  -0.885
   94   1HH1  ARG  13          1HH1      ARG  13 -10.378  -8.194  -3.483
   95   2HH1  ARG  13          2HH1      ARG  13  -9.540  -6.680  -3.416
   96   1HH2  ARG  13          1HH2      ARG  13 -10.135  -6.199  -0.034
   97   2HH2  ARG  13          2HH2      ARG  13  -9.402  -5.550  -1.463
   98    H    ILE  14           H        ILE  14 -10.330 -14.351   1.084
   99    HA   ILE  14           HA       ILE  14 -12.581 -15.965   0.267
  100    HB   ILE  14           HB       ILE  14  -9.807 -16.870   1.096
  101   1HG1  ILE  14          2HG1      ILE  14 -10.704 -16.418  -1.736
  102   2HG1  ILE  14          1HG1      ILE  14 -10.113 -15.060  -0.782
  103   1HG2  ILE  14          2HG2      ILE  14 -12.009 -18.127  -0.564
  104   2HG2  ILE  14          1HG2      ILE  14 -10.360 -18.746  -0.500
  105   3HG2  ILE  14          3HG2      ILE  14 -11.350 -18.727   0.958
  106   1HD1  ILE  14          3HD1      ILE  14  -8.456 -17.510  -0.642
  107   2HD1  ILE  14          2HD1      ILE  14  -8.493 -16.721  -2.218
  108   3HD1  ILE  14          1HD1      ILE  14  -7.962 -15.823  -0.795
  109    H    PHE  15           H        PHE  15 -10.591 -15.834   3.229
  110    HA   PHE  15           HA       PHE  15 -12.005 -17.957   4.555
  111   1HB   PHE  15          2HB       PHE  15  -9.772 -17.166   5.294
  112   2HB   PHE  15          1HB       PHE  15 -10.491 -15.631   5.791
  113    HD1  PHE  15           HD1      PHE  15 -12.024 -15.529   7.717
  114    HD2  PHE  15           HD2      PHE  15 -10.205 -19.227   6.512
  115    HE1  PHE  15           HE1      PHE  15 -12.697 -16.562   9.871
  116    HE2  PHE  15           HE2      PHE  15 -10.873 -20.261   8.664
  117    HZ   PHE  15           HZ       PHE  15 -12.123 -18.933  10.344
  118    H    LYS  16           H        LYS  16 -12.483 -14.464   4.360
  119    HA   LYS  16           HA       LYS  16 -14.500 -14.275   6.384
  120   1HB   LYS  16          2HB       LYS  16 -13.774 -12.607   3.984
  121   2HB   LYS  16          1HB       LYS  16 -15.219 -12.232   4.923
  122   1HG   LYS  16          2HG       LYS  16 -12.540 -12.630   6.257
  123   2HG   LYS  16          1HG       LYS  16 -13.015 -11.062   5.607
  124   1HD   LYS  16          2HD       LYS  16 -14.886 -10.906   7.073
  125   2HD   LYS  16          1HD       LYS  16 -14.785 -12.613   7.502
  126   1HE   LYS  16          2HE       LYS  16 -12.879 -12.291   8.843
  127   2HE   LYS  16          1HE       LYS  16 -12.481 -10.757   8.069
  128   1HZ   LYS  16          1HZ       LYS  16 -14.697  -9.971   9.018
  129   2HZ   LYS  16          3HZ       LYS  16 -14.617 -11.333  10.025
  130   3HZ   LYS  16          2HZ       LYS  16 -13.398 -10.152  10.100
  131    H    ARG  17           H        ARG  17 -14.603 -15.206   2.989
  132    HA   ARG  17           HA       ARG  17 -17.486 -15.124   2.761
  133   1HB   ARG  17          2HB       ARG  17 -15.357 -16.592   1.183
  134   2HB   ARG  17          1HB       ARG  17 -17.068 -16.613   0.758
  135   1HG   ARG  17          2HG       ARG  17 -17.019 -14.111   0.663
  136   2HG   ARG  17          1HG       ARG  17 -15.280 -14.171   0.940
  137   1HD   ARG  17          2HD       ARG  17 -15.029 -15.576  -1.098
  138   2HD   ARG  17          1HD       ARG  17 -16.761 -15.418  -1.394
  139    HE   ARG  17           HE       ARG  17 -16.322 -12.920  -1.579
  140   1HH1  ARG  17          1HH1      ARG  17 -14.353 -15.379  -2.825
  141   2HH1  ARG  17          2HH1      ARG  17 -13.136 -14.313  -3.443
  142   1HH2  ARG  17          1HH2      ARG  17 -14.524 -11.472  -2.020
  143   2HH2  ARG  17          2HH2      ARG  17 -13.232 -12.103  -2.987
  144    H    PHE  18           H        PHE  18 -15.123 -17.586   3.675
  145    HA   PHE  18           HA       PHE  18 -16.998 -19.768   3.792
  146   1HB   PHE  18          2HB       PHE  18 -14.257 -19.275   4.925
  147   2HB   PHE  18          1HB       PHE  18 -15.173 -20.705   5.405
  148    HD1  PHE  18           HD1      PHE  18 -16.139 -22.185   3.514
  149    HD2  PHE  18           HD2      PHE  18 -13.066 -19.249   2.898
  150    HE1  PHE  18           HE1      PHE  18 -15.492 -23.306   1.399
  151    HE2  PHE  18           HE2      PHE  18 -12.419 -20.370   0.782
  152    HZ   PHE  18           HZ       PHE  18 -13.633 -22.398   0.033
  153    H    ASP  19           H        ASP  19 -15.698 -17.587   6.298
  154    HA   ASP  19           HA       ASP  19 -17.180 -18.736   8.459
  155   1HB   ASP  19          2HB       ASP  19 -15.239 -16.961   8.469
  156   2HB   ASP  19          1HB       ASP  19 -16.560 -15.793   8.366
  157    H    ALA  20           H        ALA  20 -19.373 -19.015   8.152
  158    HA   ALA  20           HA       ALA  20 -21.020 -17.188   6.673
  159   1HB   ALA  20          2HB       ALA  20 -21.381 -19.711   7.305
  160   2HB   ALA  20          1HB       ALA  20 -22.147 -19.041   8.745
  161   3HB   ALA  20          3HB       ALA  20 -22.775 -18.642   7.147
  162    H    ASN  21           H        ASN  21 -20.781 -17.757  10.229
  163    HA   ASN  21           HA       ASN  21 -22.477 -15.389  10.655
  164   1HB   ASN  21          2HB       ASN  21 -22.385 -15.945  13.015
  165   2HB   ASN  21          1HB       ASN  21 -22.710 -17.412  12.098
  166   1HD2  ASN  21          1HD2      ASN  21 -21.494 -17.216  14.766
  167   2HD2  ASN  21          2HD2      ASN  21 -19.959 -17.922  14.650
  168    H    GLY  22           H        GLY  22 -19.088 -16.257  10.840
  169   1HA   GLY  22          1HA       GLY  22 -18.464 -13.374  11.120
  170   2HA   GLY  22          2HA       GLY  22 -17.327 -14.622  10.621
  171    H    ASP  23           H        ASP  23 -17.904 -16.437  12.809
  172    HA   ASP  23           HA       ASP  23 -17.217 -14.858  15.219
  173   1HB   ASP  23          2HB       ASP  23 -17.460 -16.980  16.448
  174   2HB   ASP  23          1HB       ASP  23 -18.889 -16.646  15.475
  175    H    GLY  24           H        GLY  24 -15.520 -15.953  12.680
  176   1HA   GLY  24          1HA       GLY  24 -13.052 -16.147  14.301
  177   2HA   GLY  24          2HA       GLY  24 -13.122 -15.867  12.564
  178    H    LYS  25           H        LYS  25 -15.232 -18.370  13.357
  179    HA   LYS  25           HA       LYS  25 -13.158 -20.361  12.570
  180   1HB   LYS  25          2HB       LYS  25 -14.093 -21.983  14.123
  181   2HB   LYS  25          1HB       LYS  25 -13.683 -20.518  15.014
  182   1HG   LYS  25          2HG       LYS  25 -15.952 -19.840  15.148
  183   2HG   LYS  25          1HG       LYS  25 -16.450 -20.979  13.895
  184   1HD   LYS  25          2HD       LYS  25 -15.534 -22.793  15.550
  185   2HD   LYS  25          1HD       LYS  25 -15.715 -21.523  16.761
  186   1HE   LYS  25          2HE       LYS  25 -18.010 -21.966  14.910
  187   2HE   LYS  25          1HE       LYS  25 -17.723 -23.196  16.141
  188   1HZ   LYS  25          3HZ       LYS  25 -17.575 -20.452  17.059
  189   2HZ   LYS  25          2HZ       LYS  25 -19.118 -20.965  16.566
  190   3HZ   LYS  25          1HZ       LYS  25 -18.291 -21.804  17.790
  191    H    ILE  26           H        ILE  26 -13.838 -21.934  11.146
  192    HA   ILE  26           HA       ILE  26 -16.601 -21.595  10.053
  193    HB   ILE  26           HB       ILE  26 -14.338 -22.895   8.559
  194   1HG1  ILE  26          2HG1      ILE  26 -14.926 -19.926   8.746
  195   2HG1  ILE  26          1HG1      ILE  26 -13.463 -20.733   9.314
  196   1HG2  ILE  26          2HG2      ILE  26 -16.722 -22.989   7.754
  197   2HG2  ILE  26          1HG2      ILE  26 -16.699 -21.229   7.643
  198   3HG2  ILE  26          3HG2      ILE  26 -15.624 -22.191   6.629
  199   1HD1  ILE  26          2HD1      ILE  26 -13.957 -21.486   6.585
  200   2HD1  ILE  26          1HD1      ILE  26 -13.988 -19.727   6.714
  201   3HD1  ILE  26          3HD1      ILE  26 -12.570 -20.625   7.253
  202    H    SER  27           H        SER  27 -17.918 -23.347  10.077
  203    HA   SER  27           HA       SER  27 -16.781 -25.915  11.080
  204   1HB   SER  27          2HB       SER  27 -18.862 -26.370  12.064
  205   2HB   SER  27          1HB       SER  27 -18.734 -24.622  12.263
  206    HG   SER  27           HG       SER  27 -20.530 -24.563  11.203
  207    H    ALA  28           H        ALA  28 -17.963 -27.899  10.152
  208    HA   ALA  28           HA       ALA  28 -17.631 -28.061   7.377
  209   1HB   ALA  28          1HB       ALA  28 -19.762 -29.818   8.006
  210   2HB   ALA  28          3HB       ALA  28 -18.046 -30.215   7.905
  211   3HB   ALA  28          2HB       ALA  28 -18.750 -29.733   9.448
  212    H    ALA  29           H        ALA  29 -20.623 -27.385   9.193
  213    HA   ALA  29           HA       ALA  29 -22.358 -27.153   6.983
  214   1HB   ALA  29          1HB       ALA  29 -22.380 -26.394   9.784
  215   2HB   ALA  29          2HB       ALA  29 -23.733 -26.834   8.743
  216   3HB   ALA  29          3HB       ALA  29 -23.166 -25.165   8.792
  217    H    GLU  30           H        GLU  30 -20.192 -24.743   8.432
  218    HA   GLU  30           HA       GLU  30 -21.034 -22.647   6.607
  219   1HB   GLU  30          2HB       GLU  30 -18.587 -22.894   8.380
  220   2HB   GLU  30          1HB       GLU  30 -19.035 -21.437   7.494
  221   1HG   GLU  30          2HG       GLU  30 -21.204 -21.392   8.699
  222   2HG   GLU  30          1HG       GLU  30 -20.714 -22.821   9.609
  223    H    LEU  31           H        LEU  31 -18.031 -24.572   6.884
  224    HA   LEU  31           HA       LEU  31 -16.882 -23.649   4.451
  225   1HB   LEU  31          2HB       LEU  31 -15.757 -25.008   6.304
  226   2HB   LEU  31          1HB       LEU  31 -16.531 -26.429   5.604
  227    HG   LEU  31           HG       LEU  31 -14.886 -24.559   3.901
  228   1HD1  LEU  31          3HD1      LEU  31 -13.844 -25.890   6.100
  229   2HD1  LEU  31          2HD1      LEU  31 -13.550 -27.018   4.777
  230   3HD1  LEU  31          1HD1      LEU  31 -12.923 -25.372   4.688
  231   1HD2  LEU  31          3HD2      LEU  31 -16.408 -26.940   3.495
  232   2HD2  LEU  31          2HD2      LEU  31 -15.452 -26.049   2.311
  233   3HD2  LEU  31          1HD2      LEU  31 -14.708 -27.341   3.252
  234    H    GLY  32           H        GLY  32 -18.932 -26.468   5.139
  235   1HA   GLY  32          1HA       GLY  32 -20.202 -27.810   3.698
  236   2HA   GLY  32          2HA       GLY  32 -18.991 -27.471   2.464
  237    H    GLU  33           H        GLU  33 -21.151 -25.245   4.209
  238    HA   GLU  33           HA       GLU  33 -23.041 -24.856   2.143
  239   1HB   GLU  33          2HB       GLU  33 -22.137 -23.315   4.519
  240   2HB   GLU  33          1HB       GLU  33 -23.020 -22.414   3.287
  241   1HG   GLU  33          2HG       GLU  33 -24.756 -24.297   3.366
  242   2HG   GLU  33          1HG       GLU  33 -23.944 -24.841   4.835
  243    H    ALA  34           H        ALA  34 -19.952 -23.190   2.745
  244    HA   ALA  34           HA       ALA  34 -20.272 -21.430   0.457
  245   1HB   ALA  34          1HB       ALA  34 -18.787 -20.673   2.176
  246   2HB   ALA  34          2HB       ALA  34 -17.757 -21.096   0.808
  247   3HB   ALA  34          3HB       ALA  34 -17.902 -22.199   2.176
  248    H    LEU  35           H        LEU  35 -18.645 -24.499   1.100
  249    HA   LEU  35           HA       LEU  35 -17.309 -24.781  -1.388
  250   1HB   LEU  35          2HB       LEU  35 -18.094 -26.533   0.834
  251   2HB   LEU  35          1HB       LEU  35 -18.036 -27.360  -0.722
  252    HG   LEU  35           HG       LEU  35 -15.812 -25.693   0.496
  253   1HD1  LEU  35          3HD1      LEU  35 -16.133 -27.929   1.529
  254   2HD1  LEU  35          2HD1      LEU  35 -16.007 -28.669  -0.068
  255   3HD1  LEU  35          1HD1      LEU  35 -14.618 -27.834   0.630
  256   1HD2  LEU  35          3HD2      LEU  35 -16.292 -26.823  -2.219
  257   2HD2  LEU  35          2HD2      LEU  35 -15.389 -25.385  -1.743
  258   3HD2  LEU  35          1HD2      LEU  35 -14.661 -26.981  -1.566
  259    H    LYS  36           H        LYS  36 -20.677 -25.377  -0.481
  260    HA   LYS  36           HA       LYS  36 -21.605 -26.943  -2.568
  261   1HB   LYS  36          2HB       LYS  36 -22.745 -25.030  -0.759
  262   2HB   LYS  36          1HB       LYS  36 -23.431 -24.764  -2.362
  263   1HG   LYS  36          2HG       LYS  36 -23.982 -27.172  -2.519
  264   2HG   LYS  36          1HG       LYS  36 -23.313 -27.425  -0.906
  265   1HD   LYS  36          2HD       LYS  36 -25.112 -25.272  -0.646
  266   2HD   LYS  36          1HD       LYS  36 -25.939 -26.458  -1.656
  267   1HE   LYS  36          2HE       LYS  36 -24.817 -28.069   0.256
  268   2HE   LYS  36          1HE       LYS  36 -25.167 -26.616   1.192
  269   1HZ   LYS  36          3HZ       LYS  36 -27.212 -27.686  -0.626
  270   2HZ   LYS  36          2HZ       LYS  36 -26.977 -28.427   0.885
  271   3HZ   LYS  36          1HZ       LYS  36 -27.405 -26.785   0.797
  272    H    THR  37           H        THR  37 -20.356 -23.688  -2.759
  273    HA   THR  37           HA       THR  37 -21.432 -22.802  -5.197
  274    HB   THR  37           HB       THR  37 -19.837 -21.561  -3.630
  275    HG1  THR  37           HG1      THR  37 -20.462 -20.943  -5.837
  276   1HG2  THR  37          1HG2      THR  37 -18.118 -23.374  -3.607
  277   2HG2  THR  37          3HG2      THR  37 -17.764 -23.011  -5.296
  278   3HG2  THR  37          2HG2      THR  37 -17.454 -21.802  -4.050
  279    H    LEU  38           H        LEU  38 -19.114 -25.326  -4.572
  280    HA   LEU  38           HA       LEU  38 -17.921 -25.507  -7.159
  281   1HB   LEU  38          2HB       LEU  38 -18.501 -27.643  -5.086
  282   2HB   LEU  38          1HB       LEU  38 -17.536 -27.923  -6.535
  283    HG   LEU  38           HG       LEU  38 -16.938 -26.028  -4.251
  284   1HD1  LEU  38          2HD1      LEU  38 -15.865 -28.605  -5.287
  285   2HD1  LEU  38          1HD1      LEU  38 -14.683 -27.433  -4.706
  286   3HD1  LEU  38          3HD1      LEU  38 -15.955 -28.010  -3.629
  287   1HD2  LEU  38          3HD2      LEU  38 -15.709 -26.216  -7.013
  288   2HD2  LEU  38          2HD2      LEU  38 -16.415 -24.793  -6.244
  289   3HD2  LEU  38          1HD2      LEU  38 -14.891 -25.454  -5.648
  290    H    GLY  39           H        GLY  39 -21.001 -26.638  -5.894
  291   1HA   GLY  39          1HA       GLY  39 -22.159 -26.857  -8.508
  292   2HA   GLY  39          2HA       GLY  39 -22.889 -27.460  -7.021
  293    H    SER  40           H        SER  40 -20.040 -28.914  -6.862
  294    HA   SER  40           HA       SER  40 -21.079 -31.415  -7.995
  295   1HB   SER  40          2HB       SER  40 -19.050 -29.783  -9.354
  296   2HB   SER  40          1HB       SER  40 -18.536 -31.447  -9.071
  297    HG   SER  40           HG       SER  40 -20.977 -30.648 -10.275
  298    H    ILE  41           H        ILE  41 -20.671 -30.922  -5.360
  299    HA   ILE  41           HA       ILE  41 -18.300 -32.620  -4.779
  300    HB   ILE  41           HB       ILE  41 -17.848 -30.100  -4.409
  301   1HG1  ILE  41          2HG1      ILE  41 -17.511 -31.577  -1.836
  302   2HG1  ILE  41          1HG1      ILE  41 -16.786 -32.277  -3.282
  303   1HG2  ILE  41          3HG2      ILE  41 -20.242 -30.130  -3.132
  304   2HG2  ILE  41          2HG2      ILE  41 -19.159 -30.386  -1.763
  305   3HG2  ILE  41          1HG2      ILE  41 -18.975 -28.954  -2.779
  306   1HD1  ILE  41          1HD1      ILE  41 -16.373 -29.403  -2.410
  307   2HD1  ILE  41          3HD1      ILE  41 -15.257 -30.714  -2.025
  308   3HD1  ILE  41          2HD1      ILE  41 -15.528 -30.251  -3.706
  309    H    THR  42           H        THR  42 -18.442 -33.231  -2.307
  310    HA   THR  42           HA       THR  42 -21.311 -33.693  -1.600
  311    HB   THR  42           HB       THR  42 -21.027 -35.946  -1.481
  312    HG1  THR  42           HG1      THR  42 -18.864 -36.727  -0.665
  313   1HG2  THR  42          2HG2      THR  42 -19.922 -35.419  -3.652
  314   2HG2  THR  42          1HG2      THR  42 -18.369 -35.376  -2.818
  315   3HG2  THR  42          3HG2      THR  42 -19.281 -36.883  -2.906
  316    HA   PRO  43           HA       PRO  43 -20.270 -32.356   2.488
  317   1HB   PRO  43          2HB       PRO  43 -21.464 -34.177   4.093
  318   2HB   PRO  43          1HB       PRO  43 -22.372 -32.959   3.193
  319   1HG   PRO  43          2HG       PRO  43 -21.890 -35.842   2.530
  320   2HG   PRO  43          1HG       PRO  43 -23.385 -34.909   2.407
  321   1HD   PRO  43          1HD       PRO  43 -21.845 -35.423   0.249
  322   2HD   PRO  43          2HD       PRO  43 -22.755 -33.920   0.408
  323    H    ASP  44           H        ASP  44 -19.769 -35.789   1.822
  324    HA   ASP  44           HA       ASP  44 -18.009 -36.351   3.986
  325   1HB   ASP  44          2HB       ASP  44 -18.078 -37.570   1.209
  326   2HB   ASP  44          1HB       ASP  44 -17.258 -38.265   2.607
  327    H    GLU  45           H        GLU  45 -17.443 -34.751   0.888
  328    HA   GLU  45           HA       GLU  45 -14.534 -34.918   1.170
  329   1HB   GLU  45          2HB       GLU  45 -16.306 -33.280  -0.673
  330   2HB   GLU  45          1HB       GLU  45 -14.546 -33.339  -0.772
  331   1HG   GLU  45          2HG       GLU  45 -14.761 -35.865  -0.997
  332   2HG   GLU  45          1HG       GLU  45 -16.496 -35.616  -1.193
  333    H    VAL  46           H        VAL  46 -17.112 -32.576   1.713
  334    HA   VAL  46           HA       VAL  46 -15.435 -30.366   2.413
  335    HB   VAL  46           HB       VAL  46 -18.269 -31.090   3.184
  336   1HG1  VAL  46          2HG1      VAL  46 -16.532 -29.221   4.458
  337   2HG1  VAL  46          1HG1      VAL  46 -17.695 -28.299   3.509
  338   3HG1  VAL  46          3HG1      VAL  46 -18.261 -29.446   4.723
  339   1HG2  VAL  46          3HG2      VAL  46 -17.097 -30.074   0.842
  340   2HG2  VAL  46          2HG2      VAL  46 -18.816 -30.094   1.237
  341   3HG2  VAL  46          1HG2      VAL  46 -17.837 -28.680   1.627
  342    H    LYS  47           H        LYS  47 -16.753 -33.063   4.263
  343    HA   LYS  47           HA       LYS  47 -15.865 -32.078   6.836
  344   1HB   LYS  47          2HB       LYS  47 -16.550 -34.876   5.883
  345   2HB   LYS  47          1HB       LYS  47 -16.208 -34.463   7.562
  346   1HG   LYS  47          2HG       LYS  47 -18.064 -32.782   7.471
  347   2HG   LYS  47          1HG       LYS  47 -18.449 -33.350   5.847
  348   1HD   LYS  47          2HD       LYS  47 -18.824 -35.629   6.743
  349   2HD   LYS  47          1HD       LYS  47 -18.466 -35.041   8.367
  350   1HE   LYS  47          2HE       LYS  47 -20.681 -33.940   6.612
  351   2HE   LYS  47          1HE       LYS  47 -20.926 -35.157   7.865
  352   1HZ   LYS  47          2HZ       LYS  47 -19.445 -33.056   8.963
  353   2HZ   LYS  47          1HZ       LYS  47 -20.777 -32.378   8.156
  354   3HZ   LYS  47          3HZ       LYS  47 -21.022 -33.549   9.358
  355    H    HIS  48           H        HIS  48 -14.466 -34.150   4.344
  356    HA   HIS  48           HA       HIS  48 -12.141 -34.921   5.854
  357   1HB   HIS  48          2HB       HIS  48 -12.777 -36.165   3.859
  358   2HB   HIS  48          1HB       HIS  48 -12.598 -34.721   2.863
  359    HD1  HIS  48           HD1      HIS  48 -10.833 -37.661   3.442
  360    HD2  HIS  48           HD2      HIS  48  -9.678 -33.656   3.536
  361    HE1  HIS  48           HE1      HIS  48  -8.315 -37.634   3.165
  362    H    MET  49           H        MET  49 -12.869 -32.184   3.705
  363    HA   MET  49           HA       MET  49 -10.224 -31.134   3.554
  364   1HB   MET  49          2HB       MET  49 -12.981 -30.008   3.245
  365   2HB   MET  49          1HB       MET  49 -11.627 -28.889   3.381
  366   1HG   MET  49          2HG       MET  49 -10.577 -30.594   1.585
  367   2HG   MET  49          1HG       MET  49 -12.285 -30.816   1.207
  368   1HE   MET  49          2HE       MET  49 -12.744 -30.196  -0.582
  369   2HE   MET  49          1HE       MET  49 -13.362 -28.568  -0.845
  370   3HE   MET  49          3HE       MET  49 -11.839 -29.071  -1.592
  371    H    MET  50           H        MET  50 -12.874 -30.486   5.830
  372    HA   MET  50           HA       MET  50 -11.465 -28.604   7.442
  373   1HB   MET  50          2HB       MET  50 -13.797 -30.444   7.899
  374   2HB   MET  50          1HB       MET  50 -13.110 -29.546   9.250
  375   1HG   MET  50          2HG       MET  50 -13.313 -27.467   7.741
  376   2HG   MET  50          1HG       MET  50 -14.361 -28.459   6.727
  377   1HE   MET  50          1HE       MET  50 -13.625 -26.623   9.748
  378   2HE   MET  50          3HE       MET  50 -15.060 -26.617  10.783
  379   3HE   MET  50          2HE       MET  50 -13.965 -27.998  10.795
  380    H    ALA  51           H        ALA  51 -11.857 -32.123   7.773
  381    HA   ALA  51           HA       ALA  51 -10.301 -32.440  10.129
  382   1HB   ALA  51          1HB       ALA  51 -11.635 -34.133   8.351
  383   2HB   ALA  51          3HB       ALA  51  -9.946 -34.631   8.239
  384   3HB   ALA  51          2HB       ALA  51 -10.763 -34.627   9.802
  385    H    GLU  52           H        GLU  52  -9.366 -31.683   6.897
  386    HA   GLU  52           HA       GLU  52  -6.544 -32.456   7.424
  387   1HB   GLU  52          2HB       GLU  52  -8.086 -31.650   4.969
  388   2HB   GLU  52          1HB       GLU  52  -6.328 -31.527   4.984
  389   1HG   GLU  52          2HG       GLU  52  -6.430 -33.979   5.910
  390   2HG   GLU  52          1HG       GLU  52  -8.054 -33.979   5.219
  391    H    ILE  53           H        ILE  53  -8.599 -29.648   6.880
  392    HA   ILE  53           HA       ILE  53  -6.357 -27.772   6.989
  393    HB   ILE  53           HB       ILE  53  -9.349 -27.321   7.114
  394   1HG1  ILE  53          2HG1      ILE  53  -7.404 -27.045   4.808
  395   2HG1  ILE  53          1HG1      ILE  53  -8.511 -28.399   5.025
  396   1HG2  ILE  53          1HG2      ILE  53  -7.022 -25.427   6.686
  397   2HG2  ILE  53          3HG2      ILE  53  -8.719 -24.993   6.468
  398   3HG2  ILE  53          2HG2      ILE  53  -8.122 -25.447   8.065
  399   1HD1  ILE  53          2HD1      ILE  53  -9.661 -25.646   5.123
  400   2HD1  ILE  53          1HD1      ILE  53  -9.180 -26.276   3.546
  401   3HD1  ILE  53          3HD1      ILE  53 -10.373 -27.141   4.515
  402    H    ASP  54           H        ASP  54  -8.787 -29.060   9.192
  403    HA   ASP  54           HA       ASP  54  -8.515 -27.208  11.318
  404   1HB   ASP  54          2HB       ASP  54 -10.124 -29.257  10.931
  405   2HB   ASP  54          1HB       ASP  54  -8.879 -30.151  11.792
  406    H    THR  55           H        THR  55  -6.412 -26.639  11.869
  407    HA   THR  55           HA       THR  55  -4.224 -28.507  11.964
  408    HB   THR  55           HB       THR  55  -3.026 -26.657  13.140
  409    HG1  THR  55           HG1      THR  55  -4.160 -24.767  13.523
  410   1HG2  THR  55          2HG2      THR  55  -4.638 -26.028  10.662
  411   2HG2  THR  55          1HG2      THR  55  -3.369 -24.964  11.268
  412   3HG2  THR  55          3HG2      THR  55  -2.974 -26.603  10.751
  413    H    ASP  56           H        ASP  56  -6.225 -27.050  14.531
  414    HA   ASP  56           HA       ASP  56  -4.884 -28.744  16.538
  415   1HB   ASP  56          2HB       ASP  56  -6.021 -27.482  18.175
  416   2HB   ASP  56          1HB       ASP  56  -5.703 -26.309  16.899
  417    H    GLY  57           H        GLY  57  -8.017 -28.495  14.934
  418   1HA   GLY  57          1HA       GLY  57  -8.570 -31.281  15.815
  419   2HA   GLY  57          2HA       GLY  57  -9.313 -30.493  14.428
  420    H    ASP  58           H        ASP  58  -9.853 -28.003  16.069
  421    HA   ASP  58           HA       ASP  58 -11.669 -28.926  18.174
  422   1HB   ASP  58          2HB       ASP  58 -12.173 -26.609  18.551
  423   2HB   ASP  58          1HB       ASP  58 -10.444 -26.701  18.235
  424    H    GLY  59           H        GLY  59 -11.850 -28.950  14.869
  425   1HA   GLY  59          1HA       GLY  59 -14.816 -29.030  14.992
  426   2HA   GLY  59          2HA       GLY  59 -13.825 -29.764  13.732
  427    H    PHE  60           H        PHE  60 -12.608 -26.710  14.388
  428    HA   PHE  60           HA       PHE  60 -14.090 -25.621  12.044
  429   1HB   PHE  60          2HB       PHE  60 -13.361 -23.958  14.460
  430   2HB   PHE  60          1HB       PHE  60 -14.374 -23.493  13.093
  431    HD1  PHE  60           HD1      PHE  60 -16.642 -24.372  12.840
  432    HD2  PHE  60           HD2      PHE  60 -14.201 -25.428  16.208
  433    HE1  PHE  60           HE1      PHE  60 -18.640 -25.245  14.014
  434    HE2  PHE  60           HE2      PHE  60 -16.198 -26.301  17.384
  435    HZ   PHE  60           HZ       PHE  60 -18.421 -26.212  16.288
  436    H    ILE  61           H        ILE  61 -12.978 -23.926  10.891
  437    HA   ILE  61           HA       ILE  61 -10.025 -24.079  11.207
  438    HB   ILE  61           HB       ILE  61 -11.577 -23.185   8.768
  439   1HG1  ILE  61          2HG1      ILE  61 -12.194 -25.502   9.261
  440   2HG1  ILE  61          1HG1      ILE  61 -11.110 -25.463   7.871
  441   1HG2  ILE  61          2HG2      ILE  61  -8.719 -24.095   9.217
  442   2HG2  ILE  61          1HG2      ILE  61  -9.419 -23.720   7.642
  443   3HG2  ILE  61          3HG2      ILE  61  -9.246 -22.451   8.855
  444   1HD1  ILE  61          3HD1      ILE  61  -9.201 -25.842   9.543
  445   2HD1  ILE  61          2HD1      ILE  61 -10.453 -26.228  10.723
  446   3HD1  ILE  61          1HD1      ILE  61 -10.280 -27.210   9.267
  447    H    SER  62           H        SER  62  -9.035 -22.194  11.830
  448    HA   SER  62           HA       SER  62 -10.692 -19.752  12.019
  449   1HB   SER  62          2HB       SER  62  -7.878 -20.206  13.051
  450   2HB   SER  62          1HB       SER  62  -8.983 -18.908  13.507
  451    HG   SER  62           HG       SER  62  -9.085 -20.484  15.070
  452    H    PHE  63           H        PHE  63  -9.454 -17.665  11.447
  453    HA   PHE  63           HA       PHE  63  -8.797 -17.683   8.697
  454   1HB   PHE  63          2HB       PHE  63  -9.416 -15.622   9.920
  455   2HB   PHE  63          1HB       PHE  63  -7.887 -15.691  10.800
  456    HD1  PHE  63           HD1      PHE  63  -8.878 -16.220   7.227
  457    HD2  PHE  63           HD2      PHE  63  -6.366 -14.112   9.997
  458    HE1  PHE  63           HE1      PHE  63  -7.746 -15.089   5.340
  459    HE2  PHE  63           HE2      PHE  63  -5.227 -12.985   8.105
  460    HZ   PHE  63           HZ       PHE  63  -5.925 -13.470   5.773
  461    H    GLN  64           H        GLN  64  -6.697 -17.776  11.550
  462    HA   GLN  64           HA       GLN  64  -4.211 -17.730  10.153
  463   1HB   GLN  64          2HB       GLN  64  -4.560 -17.431  12.639
  464   2HB   GLN  64          1HB       GLN  64  -4.818 -19.172  12.748
  465   1HG   GLN  64          2HG       GLN  64  -2.491 -18.752  13.255
  466   2HG   GLN  64          1HG       GLN  64  -2.559 -19.484  11.652
  467   1HE2  GLN  64          1HE2      GLN  64  -0.940 -18.461  10.444
  468   2HE2  GLN  64          2HE2      GLN  64  -0.716 -16.780  10.358
  469    H    GLU  65           H        GLU  65  -6.267 -20.440  11.236
  470    HA   GLU  65           HA       GLU  65  -4.570 -22.542  10.324
  471   1HB   GLU  65          2HB       GLU  65  -7.493 -22.281  10.921
  472   2HB   GLU  65          1HB       GLU  65  -6.918 -23.735  10.116
  473   1HG   GLU  65          2HG       GLU  65  -5.311 -24.124  11.938
  474   2HG   GLU  65          1HG       GLU  65  -5.853 -22.650  12.740
  475    H    PHE  66           H        PHE  66  -7.303 -20.887   8.748
  476    HA   PHE  66           HA       PHE  66  -7.171 -22.351   6.300
  477   1HB   PHE  66          2HB       PHE  66  -9.082 -20.895   6.986
  478   2HB   PHE  66          1HB       PHE  66  -8.067 -19.482   6.697
  479    HD1  PHE  66           HD1      PHE  66  -7.245 -18.974   4.402
  480    HD2  PHE  66           HD2      PHE  66 -10.040 -22.145   5.164
  481    HE1  PHE  66           HE1      PHE  66  -7.814 -19.051   1.989
  482    HE2  PHE  66           HE2      PHE  66 -10.609 -22.224   2.752
  483    HZ   PHE  66           HZ       PHE  66  -9.496 -20.677   1.164
  484    H    THR  67           H        THR  67  -5.482 -19.467   7.432
  485    HA   THR  67           HA       THR  67  -4.265 -18.822   4.900
  486    HB   THR  67           HB       THR  67  -3.440 -18.185   7.750
  487    HG1  THR  67           HG1      THR  67  -5.032 -16.857   7.484
  488   1HG2  THR  67          2HG2      THR  67  -2.300 -17.363   5.079
  489   2HG2  THR  67          1HG2      THR  67  -2.132 -16.333   6.501
  490   3HG2  THR  67          3HG2      THR  67  -1.446 -17.957   6.504
  491    H    ASP  68           H        ASP  68  -3.108 -20.643   7.751
  492    HA   ASP  68           HA       ASP  68  -0.542 -21.292   6.723
  493   1HB   ASP  68          2HB       ASP  68  -2.331 -22.887   8.581
  494   2HB   ASP  68          1HB       ASP  68  -0.618 -23.208   8.315
  495    H    PHE  69           H        PHE  69  -3.696 -22.824   6.255
  496    HA   PHE  69           HA       PHE  69  -2.598 -25.055   4.742
  497   1HB   PHE  69          2HB       PHE  69  -4.611 -25.724   5.620
  498   2HB   PHE  69          1HB       PHE  69  -5.275 -24.093   5.601
  499    HD1  PHE  69           HD1      PHE  69  -5.898 -23.086   3.329
  500    HD2  PHE  69           HD2      PHE  69  -5.209 -27.274   3.952
  501    HE1  PHE  69           HE1      PHE  69  -7.138 -23.600   1.239
  502    HE2  PHE  69           HE2      PHE  69  -6.441 -27.793   1.868
  503    HZ   PHE  69           HZ       PHE  69  -7.410 -25.956   0.508
  504    H    GLY  70           H        GLY  70  -4.038 -21.911   4.024
  505   1HA   GLY  70          1HA       GLY  70  -4.053 -20.668   2.032
  506   2HA   GLY  70          2HA       GLY  70  -4.350 -22.206   1.218
  507    H    ARG  71           H        ARG  71  -1.502 -21.630   3.188
  508    HA   ARG  71           HA       ARG  71   0.246 -20.860   1.022
  509   1HB   ARG  71          2HB       ARG  71   0.886 -22.136   3.702
  510   2HB   ARG  71          1HB       ARG  71   2.071 -21.412   2.614
  511   1HG   ARG  71          2HG       ARG  71   0.882 -19.243   2.784
  512   2HG   ARG  71          1HG       ARG  71  -0.270 -19.973   3.902
  513   1HD   ARG  71          2HD       ARG  71   2.724 -19.741   4.343
  514   2HD   ARG  71          1HD       ARG  71   1.488 -18.762   5.134
  515    HE   ARG  71           HE       ARG  71   1.180 -21.661   5.500
  516   1HH1  ARG  71          1HH1      ARG  71   0.508 -19.084   7.218
  517   2HH1  ARG  71          2HH1      ARG  71   1.493 -19.417   8.604
  518   1HH2  ARG  71          1HH2      ARG  71   3.305 -21.927   7.043
  519   2HH2  ARG  71          2HH2      ARG  71   3.076 -21.026   8.504
  520    H    ALA  72           H        ALA  72  -0.835 -23.916   2.358
  521    HA   ALA  72           HA       ALA  72   1.136 -25.570   1.047
  522   1HB   ALA  72          3HB       ALA  72   0.141 -27.128   2.334
  523   2HB   ALA  72          1HB       ALA  72  -1.345 -26.971   1.395
  524   3HB   ALA  72          2HB       ALA  72  -1.079 -25.942   2.804
  525    H    ASN  73           H        ASN  73  -1.748 -23.969   0.002
  526    HA   ASN  73           HA       ASN  73  -1.309 -24.992  -2.732
  527   1HB   ASN  73          2HB       ASN  73  -4.119 -25.085  -1.673
  528   2HB   ASN  73          1HB       ASN  73  -3.415 -25.957  -3.035
  529   1HD2  ASN  73          1HD2      ASN  73  -4.273 -26.238   0.261
  530   2HD2  ASN  73          2HD2      ASN  73  -3.430 -27.671   0.604
  531    H    ARG  74           H        ARG  74  -0.690 -22.502  -2.121
  532    HA   ARG  74           HA       ARG  74  -2.619 -20.489  -1.936
  533   1HB   ARG  74          2HB       ARG  74  -1.015 -19.064  -3.235
  534   2HB   ARG  74          1HB       ARG  74  -0.240 -19.958  -1.927
  535   1HG   ARG  74          2HG       ARG  74   0.312 -21.756  -3.642
  536   2HG   ARG  74          1HG       ARG  74  -0.218 -20.619  -4.882
  537   1HD   ARG  74          2HD       ARG  74   2.090 -20.205  -4.771
  538   2HD   ARG  74          1HD       ARG  74   1.430 -18.962  -3.707
  539    HE   ARG  74           HE       ARG  74   2.097 -20.378  -1.786
  540   1HH1  ARG  74          1HH1      ARG  74   2.342 -22.815  -3.758
  541   2HH1  ARG  74          2HH1      ARG  74   4.054 -23.063  -3.690
  542   1HH2  ARG  74          1HH2      ARG  74   4.706 -20.005  -2.190
  543   2HH2  ARG  74          2HH2      ARG  74   5.393 -21.473  -2.802
  544    H    GLY  75           H        GLY  75  -1.624 -22.362  -4.746
  545   1HA   GLY  75          1HA       GLY  75  -2.623 -22.620  -6.836
  546   2HA   GLY  75          2HA       GLY  75  -3.040 -20.910  -6.738
  547    H    LEU  76           H        LEU  76  -4.091 -23.262  -4.355
  548    HA   LEU  76           HA       LEU  76  -6.665 -23.811  -5.525
  549   1HB   LEU  76          2HB       LEU  76  -5.548 -24.075  -2.733
  550   2HB   LEU  76          1HB       LEU  76  -7.230 -24.464  -3.095
  551    HG   LEU  76           HG       LEU  76  -4.797 -25.694  -4.429
  552   1HD1  LEU  76          2HD1      LEU  76  -6.107 -26.289  -1.978
  553   2HD1  LEU  76          1HD1      LEU  76  -6.569 -27.547  -3.125
  554   3HD1  LEU  76          3HD1      LEU  76  -4.865 -27.239  -2.793
  555   1HD2  LEU  76          1HD2      LEU  76  -7.593 -25.520  -5.196
  556   2HD2  LEU  76          3HD2      LEU  76  -6.234 -26.193  -6.095
  557   3HD2  LEU  76          2HD2      LEU  76  -7.115 -27.198  -4.943
  558    H    LEU  77           H        LEU  77  -5.584 -21.523  -3.026
  559    HA   LEU  77           HA       LEU  77  -8.173 -20.395  -2.531
  560   1HB   LEU  77          2HB       LEU  77  -5.492 -19.007  -2.253
  561   2HB   LEU  77          1HB       LEU  77  -6.987 -18.603  -1.410
  562    HG   LEU  77           HG       LEU  77  -5.294 -21.092  -1.090
  563   1HD1  LEU  77          3HD1      LEU  77  -5.933 -18.663   0.513
  564   2HD1  LEU  77          2HD1      LEU  77  -5.805 -20.187   1.393
  565   3HD1  LEU  77          1HD1      LEU  77  -4.441 -19.601   0.440
  566   1HD2  LEU  77          3HD2      LEU  77  -8.133 -20.521  -0.221
  567   2HD2  LEU  77          2HD2      LEU  77  -7.529 -21.919  -1.110
  568   3HD2  LEU  77          1HD2      LEU  77  -7.124 -21.715   0.596
  569    H    LYS  78           H        LYS  78  -5.946 -20.021  -5.148
  570    HA   LYS  78           HA       LYS  78  -6.941 -17.400  -5.983
  571   1HB   LYS  78          2HB       LYS  78  -5.262 -19.481  -7.418
  572   2HB   LYS  78          1HB       LYS  78  -5.627 -17.881  -8.062
  573   1HG   LYS  78          2HG       LYS  78  -4.679 -17.011  -5.793
  574   2HG   LYS  78          1HG       LYS  78  -3.952 -18.613  -5.668
  575   1HD   LYS  78          2HD       LYS  78  -3.602 -16.723  -8.017
  576   2HD   LYS  78          1HD       LYS  78  -2.415 -16.974  -6.736
  577   1HE   LYS  78          2HE       LYS  78  -3.361 -19.480  -7.933
  578   2HE   LYS  78          1HE       LYS  78  -2.557 -18.422  -9.093
  579   1HZ   LYS  78          3HZ       LYS  78  -0.742 -18.196  -7.409
  580   2HZ   LYS  78          2HZ       LYS  78  -1.483 -19.444  -6.526
  581   3HZ   LYS  78          1HZ       LYS  78  -0.893 -19.741  -8.091
  582    H    ASP  79           H        ASP  79  -7.892 -20.701  -6.404
  583    HA   ASP  79           HA       ASP  79  -9.519 -20.126  -8.792
  584   1HB   ASP  79          2HB       ASP  79  -8.837 -22.549  -7.177
  585   2HB   ASP  79          1HB       ASP  79 -10.315 -22.578  -8.139
  586    H    VAL  80           H        VAL  80  -9.973 -20.828  -5.353
  587    HA   VAL  80           HA       VAL  80 -12.865 -20.757  -5.467
  588    HB   VAL  80           HB       VAL  80 -11.230 -21.752  -3.661
  589   1HG1  VAL  80          1HG1      VAL  80 -11.662 -18.931  -2.644
  590   2HG1  VAL  80          3HG1      VAL  80 -11.003 -20.262  -1.691
  591   3HG1  VAL  80          2HG1      VAL  80 -10.115 -19.653  -3.087
  592   1HG2  VAL  80          1HG2      VAL  80 -13.867 -20.375  -3.135
  593   2HG2  VAL  80          3HG2      VAL  80 -13.580 -22.086  -3.450
  594   3HG2  VAL  80          2HG2      VAL  80 -13.072 -21.375  -1.919
  595    H    ALA  81           H        ALA  81 -10.338 -18.417  -4.737
  596    HA   ALA  81           HA       ALA  81 -11.990 -16.288  -3.821
  597   1HB   ALA  81          1HB       ALA  81  -9.413 -16.453  -3.840
  598   2HB   ALA  81          3HB       ALA  81  -9.517 -15.864  -5.498
  599   3HB   ALA  81          2HB       ALA  81 -10.124 -14.874  -4.171
  600    H    LYS  82           H        LYS  82 -11.743 -17.698  -6.929
  601    HA   LYS  82           HA       LYS  82 -12.793 -15.255  -8.260
  602   1HB   LYS  82          2HB       LYS  82 -11.955 -17.940  -9.401
  603   2HB   LYS  82          1HB       LYS  82 -12.489 -16.555 -10.353
  604   1HG   LYS  82          2HG       LYS  82 -10.611 -15.245  -9.163
  605   2HG   LYS  82          1HG       LYS  82  -9.992 -16.823  -8.675
  606   1HD   LYS  82          2HD       LYS  82  -9.961 -17.511 -11.073
  607   2HD   LYS  82          1HD       LYS  82 -10.474 -15.884 -11.518
  608   1HE   LYS  82          2HE       LYS  82  -8.119 -15.821 -11.741
  609   2HE   LYS  82          1HE       LYS  82  -8.417 -15.081 -10.169
  610   1HZ   LYS  82          3HZ       LYS  82  -7.912 -17.980 -10.444
  611   2HZ   LYS  82          2HZ       LYS  82  -6.637 -16.867 -10.302
  612   3HZ   LYS  82          1HZ       LYS  82  -7.783 -17.012  -9.057
  613    H    ILE  83           H        ILE  83 -13.705 -18.487  -7.250
  614    HA   ILE  83           HA       ILE  83 -16.100 -18.818  -8.714
  615    HB   ILE  83           HB       ILE  83 -15.418 -19.658  -5.882
  616   1HG1  ILE  83          2HG1      ILE  83 -15.179 -20.950  -8.603
  617   2HG1  ILE  83          1HG1      ILE  83 -13.912 -20.694  -7.405
  618   1HG2  ILE  83          3HG2      ILE  83 -17.662 -20.571  -7.709
  619   2HG2  ILE  83          2HG2      ILE  83 -17.267 -21.280  -6.143
  620   3HG2  ILE  83          1HG2      ILE  83 -17.856 -19.621  -6.236
  621   1HD1  ILE  83          3HD1      ILE  83 -15.708 -22.183  -5.970
  622   2HD1  ILE  83          2HD1      ILE  83 -15.923 -22.850  -7.589
  623   3HD1  ILE  83          1HD1      ILE  83 -14.328 -22.859  -6.836
  624    H    PHE  84           H        PHE  84 -15.379 -16.818  -5.924
  625    HA   PHE  84           HA       PHE  84 -18.245 -16.059  -5.690
  626   1HB   PHE  84          2HB       PHE  84 -15.845 -15.385  -3.961
  627   2HB   PHE  84          1HB       PHE  84 -17.496 -14.852  -3.641
  628    HD1  PHE  84           HD1      PHE  84 -15.227 -17.762  -3.778
  629    HD2  PHE  84           HD2      PHE  84 -19.199 -16.403  -2.868
  630    HE1  PHE  84           HE1      PHE  84 -15.707 -19.919  -2.654
  631    HE2  PHE  84           HE2      PHE  84 -19.679 -18.561  -1.743
  632    HZ   PHE  84           HZ       PHE  84 -17.933 -20.319  -1.636

  No H/Q in entry =         632
  Start of MODEL    8
    1    H1   ALA   1          1H        ALA   1  10.845 -16.309  -0.923
    2    H2   ALA   1          3H        ALA   1  10.952 -17.440   0.337
    3    H3   ALA   1          2H        ALA   1   9.667 -17.523  -0.772
    4    HA   ALA   1           HA       ALA   1   8.700 -16.560   1.092
    5   1HB   ALA   1          3HB       ALA   1  10.648 -14.367   1.422
    6   2HB   ALA   1          2HB       ALA   1   9.857 -15.364   2.644
    7   3HB   ALA   1          1HB       ALA   1  11.283 -15.968   1.801
    8    H    ASP   2           H        ASP   2   8.319 -16.145  -1.640
    9    HA   ASP   2           HA       ASP   2   8.311 -13.268  -2.193
   10   1HB   ASP   2          2HB       ASP   2   7.125 -15.627  -3.684
   11   2HB   ASP   2          1HB       ASP   2   7.101 -13.966  -4.275
   12    H    ASP   3           H        ASP   3   6.526 -14.993  -0.118
   13    HA   ASP   3           HA       ASP   3   3.828 -14.231  -0.867
   14   1HB   ASP   3          2HB       ASP   3   5.024 -15.128   1.770
   15   2HB   ASP   3          1HB       ASP   3   3.301 -14.862   1.511
   16    H    HIS   4           H        HIS   4   2.904 -12.252  -0.601
   17    HA   HIS   4           HA       HIS   4   4.313 -10.302   1.173
   18   1HB   HIS   4          2HB       HIS   4   2.668  -8.753  -0.348
   19   2HB   HIS   4          1HB       HIS   4   4.332  -9.124  -0.784
   20    HD1  HIS   4           HD1      HIS   4   0.784  -9.945  -1.656
   21    HD2  HIS   4           HD2      HIS   4   4.611 -11.038  -2.888
   22    HE1  HIS   4           HE1      HIS   4   0.500 -11.214  -3.829
   23    HA   PRO   5           HA       PRO   5   0.732  -9.770   3.726
   24   1HB   PRO   5          2HB       PRO   5   0.367  -7.089   3.823
   25   2HB   PRO   5          1HB       PRO   5   1.691  -7.908   4.657
   26   1HG   PRO   5          2HG       PRO   5   1.708  -6.468   2.027
   27   2HG   PRO   5          1HG       PRO   5   2.882  -6.385   3.346
   28   1HD   PRO   5          1HD       PRO   5   3.332  -7.884   1.154
   29   2HD   PRO   5          2HD       PRO   5   3.886  -8.392   2.750
   30    H    GLN   6           H        GLN   6   0.685  -8.323   0.549
   31    HA   GLN   6           HA       GLN   6  -2.054  -7.528   0.449
   32   1HB   GLN   6          2HB       GLN   6   0.049  -8.226  -1.559
   33   2HB   GLN   6          1HB       GLN   6  -1.626  -8.162  -2.106
   34   1HG   GLN   6          2HG       GLN   6  -1.860  -5.880  -1.389
   35   2HG   GLN   6          1HG       GLN   6  -0.320  -5.930  -0.532
   36   1HE2  GLN   6          1HE2      GLN   6   1.560  -6.758  -2.197
   37   2HE2  GLN   6          2HE2      GLN   6   1.572  -5.925  -3.675
   38    H    ASP   7           H        ASP   7  -0.441 -10.613  -0.203
   39    HA   ASP   7           HA       ASP   7  -2.631 -12.050  -1.257
   40   1HB   ASP   7          2HB       ASP   7  -0.317 -12.928   0.480
   41   2HB   ASP   7          1HB       ASP   7  -1.489 -14.068  -0.179
   42    H    LYS   8           H        LYS   8  -1.678 -11.583   2.139
   43    HA   LYS   8           HA       LYS   8  -3.621 -13.140   3.408
   44   1HB   LYS   8          2HB       LYS   8  -2.195 -10.614   4.113
   45   2HB   LYS   8          1HB       LYS   8  -3.578 -11.075   5.106
   46   1HG   LYS   8          2HG       LYS   8  -2.381 -13.454   5.027
   47   2HG   LYS   8          1HG       LYS   8  -0.953 -12.459   4.744
   48   1HD   LYS   8          2HD       LYS   8  -1.749 -11.071   6.773
   49   2HD   LYS   8          1HD       LYS   8  -2.815 -12.433   7.122
   50   1HE   LYS   8          2HE       LYS   8  -0.453 -12.394   8.222
   51   2HE   LYS   8          1HE       LYS   8  -1.018 -13.901   7.503
   52   1HZ   LYS   8          1HZ       LYS   8   0.484 -11.976   5.865
   53   2HZ   LYS   8          3HZ       LYS   8   1.321 -13.005   6.922
   54   3HZ   LYS   8          2HZ       LYS   8   0.349 -13.660   5.692
   55    H    ALA   9           H        ALA   9  -3.958  -9.939   1.954
   56    HA   ALA   9           HA       ALA   9  -6.564  -9.321   2.891
   57   1HB   ALA   9          2HB       ALA   9  -4.744  -8.221   1.037
   58   2HB   ALA   9          3HB       ALA   9  -6.262  -7.508   1.581
   59   3HB   ALA   9          1HB       ALA   9  -6.230  -8.511   0.132
   60    H    GLU  10           H        GLU  10  -5.513 -11.103   0.008
   61    HA   GLU  10           HA       GLU  10  -8.176 -11.702  -0.912
   62   1HB   GLU  10          2HB       GLU  10  -5.671 -13.335  -1.405
   63   2HB   GLU  10          1HB       GLU  10  -7.117 -13.271  -2.412
   64   1HG   GLU  10          2HG       GLU  10  -6.679 -10.821  -2.768
   65   2HG   GLU  10          1HG       GLU  10  -5.153 -11.016  -1.905
   66    H    ARG  11           H        ARG  11  -5.885 -13.363   1.205
   67    HA   ARG  11           HA       ARG  11  -7.430 -15.770   1.514
   68   1HB   ARG  11          2HB       ARG  11  -5.367 -14.462   3.306
   69   2HB   ARG  11          1HB       ARG  11  -6.034 -16.070   3.580
   70   1HG   ARG  11          2HG       ARG  11  -5.308 -16.466   1.073
   71   2HG   ARG  11          1HG       ARG  11  -4.224 -15.112   1.385
   72   1HD   ARG  11          2HD       ARG  11  -3.610 -16.451   3.553
   73   2HD   ARG  11          1HD       ARG  11  -4.284 -17.826   2.678
   74    HE   ARG  11           HE       ARG  11  -1.872 -16.292   1.881
   75   1HH1  ARG  11          1HH1      ARG  11  -3.944 -17.499  -0.190
   76   2HH1  ARG  11          2HH1      ARG  11  -3.069 -18.920  -0.651
   77   1HH2  ARG  11          1HH2      ARG  11  -0.810 -18.702   1.970
   78   2HH2  ARG  11          2HH2      ARG  11  -1.293 -19.602   0.572
   79    H    GLU  12           H        GLU  12  -7.265 -12.739   3.326
   80    HA   GLU  12           HA       GLU  12  -9.064 -13.506   5.420
   81   1HB   GLU  12          2HB       GLU  12  -7.975 -10.943   4.357
   82   2HB   GLU  12          1HB       GLU  12  -9.428 -10.849   5.350
   83   1HG   GLU  12          2HG       GLU  12  -8.098 -12.441   6.960
   84   2HG   GLU  12          1HG       GLU  12  -6.687 -11.834   6.094
   85    H    ARG  13           H        ARG  13  -9.573 -11.892   2.296
   86    HA   ARG  13           HA       ARG  13 -12.388 -11.470   2.640
   87   1HB   ARG  13          2HB       ARG  13 -10.796 -11.855   0.087
   88   2HB   ARG  13          1HB       ARG  13 -12.433 -11.208   0.180
   89   1HG   ARG  13          2HG       ARG  13 -11.704  -9.270   1.363
   90   2HG   ARG  13          1HG       ARG  13 -10.123  -9.976   1.693
   91   1HD   ARG  13          2HD       ARG  13  -9.759  -8.458  -0.107
   92   2HD   ARG  13          1HD       ARG  13  -9.808 -10.053  -0.856
   93    HE   ARG  13           HE       ARG  13 -12.447  -8.986  -0.866
   94   1HH1  ARG  13          1HH1      ARG  13  -9.820  -7.162  -1.702
   95   2HH1  ARG  13          2HH1      ARG  13 -10.194  -7.032  -3.389
   96   1HH2  ARG  13          1HH2      ARG  13 -12.731  -9.392  -3.279
   97   2HH2  ARG  13          2HH2      ARG  13 -11.841  -8.295  -4.282
   98    H    ILE  14           H        ILE  14 -10.516 -14.138   1.241
   99    HA   ILE  14           HA       ILE  14 -12.828 -15.663   0.426
  100    HB   ILE  14           HB       ILE  14 -10.048 -16.667   1.108
  101   1HG1  ILE  14          2HG1      ILE  14 -10.983 -16.073  -1.676
  102   2HG1  ILE  14          1HG1      ILE  14 -10.423 -14.740  -0.670
  103   1HG2  ILE  14          1HG2      ILE  14 -12.497 -17.853  -0.052
  104   2HG2  ILE  14          3HG2      ILE  14 -11.011 -18.197  -0.938
  105   3HG2  ILE  14          2HG2      ILE  14 -11.145 -18.637   0.764
  106   1HD1  ILE  14          2HD1      ILE  14  -8.313 -16.004  -0.238
  107   2HD1  ILE  14          1HD1      ILE  14  -8.872 -17.257  -1.347
  108   3HD1  ILE  14          3HD1      ILE  14  -8.540 -15.633  -1.946
  109    H    PHE  15           H        PHE  15 -10.697 -15.777   3.292
  110    HA   PHE  15           HA       PHE  15 -12.077 -17.928   4.577
  111   1HB   PHE  15          2HB       PHE  15  -9.833 -17.161   5.287
  112   2HB   PHE  15          1HB       PHE  15 -10.534 -15.641   5.849
  113    HD1  PHE  15           HD1      PHE  15 -12.039 -15.605   7.816
  114    HD2  PHE  15           HD2      PHE  15 -10.198 -19.246   6.474
  115    HE1  PHE  15           HE1      PHE  15 -12.641 -16.701   9.959
  116    HE2  PHE  15           HE2      PHE  15 -10.801 -20.343   8.615
  117    HZ   PHE  15           HZ       PHE  15 -12.026 -19.073  10.358
  118    H    LYS  16           H        LYS  16 -12.592 -14.435   4.543
  119    HA   LYS  16           HA       LYS  16 -14.560 -14.377   6.634
  120   1HB   LYS  16          2HB       LYS  16 -13.848 -12.558   4.348
  121   2HB   LYS  16          1HB       LYS  16 -15.308 -12.250   5.289
  122   1HG   LYS  16          2HG       LYS  16 -13.840 -12.402   7.370
  123   2HG   LYS  16          1HG       LYS  16 -12.451 -12.366   6.284
  124   1HD   LYS  16          2HD       LYS  16 -13.411 -10.233   5.301
  125   2HD   LYS  16          1HD       LYS  16 -14.586 -10.241   6.617
  126   1HE   LYS  16          2HE       LYS  16 -12.687 -10.291   8.246
  127   2HE   LYS  16          1HE       LYS  16 -11.567 -10.139   6.892
  128   1HZ   LYS  16          2HZ       LYS  16 -13.139  -8.124   6.334
  129   2HZ   LYS  16          1HZ       LYS  16 -13.413  -8.167   8.010
  130   3HZ   LYS  16          3HZ       LYS  16 -11.839  -7.960   7.416
  131    H    ARG  17           H        ARG  17 -14.716 -15.094   3.193
  132    HA   ARG  17           HA       ARG  17 -17.598 -14.987   3.002
  133   1HB   ARG  17          2HB       ARG  17 -15.479 -16.346   1.320
  134   2HB   ARG  17          1HB       ARG  17 -17.196 -16.379   0.916
  135   1HG   ARG  17          2HG       ARG  17 -17.164 -13.846   1.027
  136   2HG   ARG  17          1HG       ARG  17 -15.407 -13.945   1.151
  137   1HD   ARG  17          2HD       ARG  17 -15.672 -15.498  -0.979
  138   2HD   ARG  17          1HD       ARG  17 -17.188 -14.617  -1.161
  139    HE   ARG  17           HE       ARG  17 -15.455 -12.566  -0.833
  140   1HH1  ARG  17          1HH1      ARG  17 -13.996 -15.318  -1.936
  141   2HH1  ARG  17          2HH1      ARG  17 -13.561 -14.705  -3.496
  142   1HH2  ARG  17          1HH2      ARG  17 -15.451 -11.815  -3.181
  143   2HH2  ARG  17          2HH2      ARG  17 -14.384 -12.722  -4.200
  144    H    PHE  18           H        PHE  18 -15.254 -17.472   3.861
  145    HA   PHE  18           HA       PHE  18 -17.157 -19.653   3.827
  146   1HB   PHE  18          2HB       PHE  18 -14.411 -19.281   5.015
  147   2HB   PHE  18          1HB       PHE  18 -15.349 -20.743   5.321
  148    HD1  PHE  18           HD1      PHE  18 -16.283 -22.012   3.272
  149    HD2  PHE  18           HD2      PHE  18 -13.184 -19.048   3.018
  150    HE1  PHE  18           HE1      PHE  18 -15.604 -22.910   1.062
  151    HE2  PHE  18           HE2      PHE  18 -12.507 -19.944   0.807
  152    HZ   PHE  18           HZ       PHE  18 -13.717 -21.876  -0.170
  153    H    ASP  19           H        ASP  19 -15.758 -17.683   6.457
  154    HA   ASP  19           HA       ASP  19 -17.217 -18.885   8.578
  155   1HB   ASP  19          2HB       ASP  19 -15.312 -17.090   8.645
  156   2HB   ASP  19          1HB       ASP  19 -16.636 -15.927   8.542
  157    H    ALA  20           H        ALA  20 -19.409 -19.204   8.290
  158    HA   ALA  20           HA       ALA  20 -21.125 -17.428   6.858
  159   1HB   ALA  20          1HB       ALA  20 -21.635 -19.814   7.233
  160   2HB   ALA  20          3HB       ALA  20 -21.840 -19.494   8.956
  161   3HB   ALA  20          2HB       ALA  20 -22.952 -18.780   7.787
  162    H    ASN  21           H        ASN  21 -20.833 -17.921  10.422
  163    HA   ASN  21           HA       ASN  21 -22.525 -15.537  10.807
  164   1HB   ASN  21          2HB       ASN  21 -22.444 -16.066  13.180
  165   2HB   ASN  21          1HB       ASN  21 -22.805 -17.531  12.271
  166   1HD2  ASN  21          1HD2      ASN  21 -21.568 -17.327  14.942
  167   2HD2  ASN  21          2HD2      ASN  21 -20.054 -18.078  14.826
  168    H    GLY  22           H        GLY  22 -19.168 -16.373  10.785
  169   1HA   GLY  22          1HA       GLY  22 -18.492 -13.531  11.112
  170   2HA   GLY  22          2HA       GLY  22 -17.366 -14.817  10.681
  171    H    ASP  23           H        ASP  23 -17.880 -16.576  12.854
  172    HA   ASP  23           HA       ASP  23 -17.292 -14.931  15.256
  173   1HB   ASP  23          2HB       ASP  23 -17.608 -16.998  16.543
  174   2HB   ASP  23          1HB       ASP  23 -18.996 -16.700  15.501
  175    H    GLY  24           H        GLY  24 -15.545 -16.062  12.792
  176   1HA   GLY  24          1HA       GLY  24 -13.126 -16.299  14.484
  177   2HA   GLY  24          2HA       GLY  24 -13.139 -15.981  12.753
  178    H    LYS  25           H        LYS  25 -15.281 -18.501  13.540
  179    HA   LYS  25           HA       LYS  25 -13.208 -20.479  12.708
  180   1HB   LYS  25          2HB       LYS  25 -14.121 -22.111  14.241
  181   2HB   LYS  25          1HB       LYS  25 -13.799 -20.639  15.157
  182   1HG   LYS  25          2HG       LYS  25 -16.110 -20.024  15.140
  183   2HG   LYS  25          1HG       LYS  25 -16.500 -21.261  13.947
  184   1HD   LYS  25          2HD       LYS  25 -15.640 -22.958  15.684
  185   2HD   LYS  25          1HD       LYS  25 -15.734 -21.634  16.846
  186   1HE   LYS  25          2HE       LYS  25 -17.806 -23.126  16.682
  187   2HE   LYS  25          1HE       LYS  25 -18.088 -21.392  16.528
  188   1HZ   LYS  25          2HZ       LYS  25 -17.514 -22.853  14.075
  189   2HZ   LYS  25          1HZ       LYS  25 -19.022 -23.151  14.797
  190   3HZ   LYS  25          3HZ       LYS  25 -18.595 -21.573  14.350
  191    H    ILE  26           H        ILE  26 -13.869 -21.990  11.216
  192    HA   ILE  26           HA       ILE  26 -16.643 -21.655  10.149
  193    HB   ILE  26           HB       ILE  26 -14.339 -22.827   8.600
  194   1HG1  ILE  26          2HG1      ILE  26 -15.069 -19.902   8.917
  195   2HG1  ILE  26          1HG1      ILE  26 -13.542 -20.659   9.368
  196   1HG2  ILE  26          3HG2      ILE  26 -16.685 -23.051   7.770
  197   2HG2  ILE  26          2HG2      ILE  26 -16.821 -21.293   7.769
  198   3HG2  ILE  26          1HG2      ILE  26 -15.674 -22.088   6.693
  199   1HD1  ILE  26          2HD1      ILE  26 -14.146 -21.296   6.628
  200   2HD1  ILE  26          1HD1      ILE  26 -14.245 -19.550   6.854
  201   3HD1  ILE  26          3HD1      ILE  26 -12.763 -20.410   7.270
  202    H    SER  27           H        SER  27 -17.924 -23.449  10.089
  203    HA   SER  27           HA       SER  27 -16.722 -26.015  11.012
  204   1HB   SER  27          2HB       SER  27 -18.794 -26.561  11.958
  205   2HB   SER  27          1HB       SER  27 -18.737 -24.814  12.201
  206    HG   SER  27           HG       SER  27 -20.562 -26.168  10.924
  207    H    ALA  28           H        ALA  28 -17.793 -27.999   9.982
  208    HA   ALA  28           HA       ALA  28 -17.421 -28.031   7.209
  209   1HB   ALA  28          1HB       ALA  28 -19.250 -29.742   8.917
  210   2HB   ALA  28          2HB       ALA  28 -17.599 -30.118   8.421
  211   3HB   ALA  28          3HB       ALA  28 -18.895 -30.086   7.224
  212    H    ALA  29           H        ALA  29 -20.445 -27.518   9.007
  213    HA   ALA  29           HA       ALA  29 -22.163 -27.268   6.773
  214   1HB   ALA  29          2HB       ALA  29 -23.118 -27.402   8.981
  215   2HB   ALA  29          1HB       ALA  29 -22.253 -25.955   9.499
  216   3HB   ALA  29          3HB       ALA  29 -23.558 -25.827   8.321
  217    H    GLU  30           H        GLU  30 -20.086 -24.867   8.359
  218    HA   GLU  30           HA       GLU  30 -21.019 -22.700   6.664
  219   1HB   GLU  30          2HB       GLU  30 -18.553 -22.950   8.410
  220   2HB   GLU  30          1HB       GLU  30 -19.062 -21.464   7.609
  221   1HG   GLU  30          2HG       GLU  30 -21.230 -21.580   8.822
  222   2HG   GLU  30          1HG       GLU  30 -20.663 -23.024   9.661
  223    H    LEU  31           H        LEU  31 -17.947 -24.533   6.804
  224    HA   LEU  31           HA       LEU  31 -16.890 -23.424   4.393
  225   1HB   LEU  31          2HB       LEU  31 -15.403 -24.594   5.886
  226   2HB   LEU  31          1HB       LEU  31 -16.378 -26.061   5.795
  227    HG   LEU  31           HG       LEU  31 -15.848 -26.270   3.395
  228   1HD1  LEU  31          1HD1      LEU  31 -14.555 -23.622   3.931
  229   2HD1  LEU  31          3HD1      LEU  31 -13.830 -24.682   2.722
  230   3HD1  LEU  31          2HD1      LEU  31 -15.498 -24.143   2.535
  231   1HD2  LEU  31          3HD2      LEU  31 -13.649 -26.072   5.429
  232   2HD2  LEU  31          2HD2      LEU  31 -14.312 -27.505   4.642
  233   3HD2  LEU  31          1HD2      LEU  31 -13.238 -26.425   3.751
  234    H    GLY  32           H        GLY  32 -18.823 -26.336   5.015
  235   1HA   GLY  32          1HA       GLY  32 -20.040 -27.696   3.540
  236   2HA   GLY  32          2HA       GLY  32 -18.837 -27.288   2.319
  237    H    GLU  33           H        GLU  33 -21.078 -25.163   4.099
  238    HA   GLU  33           HA       GLU  33 -22.968 -24.816   2.021
  239   1HB   GLU  33          2HB       GLU  33 -22.134 -23.232   4.413
  240   2HB   GLU  33          1HB       GLU  33 -23.138 -22.433   3.206
  241   1HG   GLU  33          2HG       GLU  33 -24.682 -24.468   3.349
  242   2HG   GLU  33          1HG       GLU  33 -23.770 -24.933   4.784
  243    H    ALA  34           H        ALA  34 -19.954 -23.046   2.691
  244    HA   ALA  34           HA       ALA  34 -20.332 -21.249   0.437
  245   1HB   ALA  34          2HB       ALA  34 -18.837 -20.231   1.841
  246   2HB   ALA  34          1HB       ALA  34 -18.236 -21.765   2.470
  247   3HB   ALA  34          3HB       ALA  34 -17.653 -21.158   0.920
  248    H    LEU  35           H        LEU  35 -18.542 -24.231   1.060
  249    HA   LEU  35           HA       LEU  35 -17.170 -24.391  -1.424
  250   1HB   LEU  35          2HB       LEU  35 -17.980 -26.322   0.698
  251   2HB   LEU  35          1HB       LEU  35 -17.522 -26.992  -0.868
  252    HG   LEU  35           HG       LEU  35 -15.855 -25.122   0.844
  253   1HD1  LEU  35          2HD1      LEU  35 -15.772 -28.067   0.214
  254   2HD1  LEU  35          1HD1      LEU  35 -14.297 -27.202   0.648
  255   3HD1  LEU  35          3HD1      LEU  35 -15.646 -27.269   1.782
  256   1HD2  LEU  35          1HD2      LEU  35 -15.550 -26.163  -1.965
  257   2HD2  LEU  35          3HD2      LEU  35 -15.299 -24.526  -1.359
  258   3HD2  LEU  35          2HD2      LEU  35 -14.125 -25.791  -0.996
  259    H    LYS  36           H        LYS  36 -20.494 -25.190  -0.534
  260    HA   LYS  36           HA       LYS  36 -21.288 -26.828  -2.639
  261   1HB   LYS  36          2HB       LYS  36 -22.597 -24.831  -0.926
  262   2HB   LYS  36          1HB       LYS  36 -23.383 -25.035  -2.493
  263   1HG   LYS  36          2HG       LYS  36 -23.582 -27.429  -2.143
  264   2HG   LYS  36          1HG       LYS  36 -22.636 -27.330  -0.656
  265   1HD   LYS  36          2HD       LYS  36 -24.655 -25.470  -0.248
  266   2HD   LYS  36          1HD       LYS  36 -25.480 -26.781  -1.094
  267   1HE   LYS  36          2HE       LYS  36 -24.556 -28.398   0.542
  268   2HE   LYS  36          1HE       LYS  36 -23.773 -27.071   1.399
  269   1HZ   LYS  36          1HZ       LYS  36 -26.547 -26.574   0.939
  270   2HZ   LYS  36          3HZ       LYS  36 -26.305 -27.999   1.826
  271   3HZ   LYS  36          2HZ       LYS  36 -25.667 -26.530   2.391
  272    H    THR  37           H        THR  37 -20.248 -23.509  -2.798
  273    HA   THR  37           HA       THR  37 -21.430 -22.622  -5.184
  274    HB   THR  37           HB       THR  37 -19.827 -21.343  -3.658
  275    HG1  THR  37           HG1      THR  37 -19.523 -21.352  -6.470
  276   1HG2  THR  37          3HG2      THR  37 -18.062 -23.148  -3.760
  277   2HG2  THR  37          2HG2      THR  37 -17.735 -22.642  -5.418
  278   3HG2  THR  37          1HG2      THR  37 -17.464 -21.521  -4.085
  279    H    LEU  38           H        LEU  38 -19.086 -25.122  -4.683
  280    HA   LEU  38           HA       LEU  38 -17.932 -25.208  -7.300
  281   1HB   LEU  38          2HB       LEU  38 -18.401 -27.376  -5.237
  282   2HB   LEU  38          1HB       LEU  38 -17.502 -27.642  -6.731
  283    HG   LEU  38           HG       LEU  38 -16.818 -25.501  -4.694
  284   1HD1  LEU  38          2HD1      LEU  38 -16.249 -28.366  -4.767
  285   2HD1  LEU  38          1HD1      LEU  38 -14.776 -27.397  -4.760
  286   3HD1  LEU  38          3HD1      LEU  38 -15.966 -27.202  -3.473
  287   1HD2  LEU  38          3HD2      LEU  38 -16.092 -25.041  -7.012
  288   2HD2  LEU  38          2HD2      LEU  38 -14.710 -25.381  -5.972
  289   3HD2  LEU  38          1HD2      LEU  38 -15.307 -26.618  -7.078
  290    H    GLY  39           H        GLY  39 -20.958 -26.426  -5.990
  291   1HA   GLY  39          1HA       GLY  39 -22.134 -26.650  -8.610
  292   2HA   GLY  39          2HA       GLY  39 -22.866 -27.219  -7.109
  293    H    SER  40           H        SER  40 -19.978 -28.663  -6.997
  294    HA   SER  40           HA       SER  40 -21.059 -31.190  -8.045
  295   1HB   SER  40          2HB       SER  40 -20.072 -30.524 -10.078
  296   2HB   SER  40          1HB       SER  40 -18.709 -29.754  -9.267
  297    HG   SER  40           HG       SER  40 -19.265 -32.529  -9.428
  298    H    ILE  41           H        ILE  41 -20.665 -30.788  -5.436
  299    HA   ILE  41           HA       ILE  41 -18.250 -32.422  -4.874
  300    HB   ILE  41           HB       ILE  41 -17.829 -29.894  -4.507
  301   1HG1  ILE  41          2HG1      ILE  41 -17.458 -31.458  -1.972
  302   2HG1  ILE  41          1HG1      ILE  41 -16.661 -32.007  -3.446
  303   1HG2  ILE  41          1HG2      ILE  41 -20.201 -29.921  -3.226
  304   2HG2  ILE  41          3HG2      ILE  41 -19.136 -30.234  -1.854
  305   3HG2  ILE  41          2HG2      ILE  41 -18.923 -28.775  -2.825
  306   1HD1  ILE  41          3HD1      ILE  41 -16.394 -29.121  -3.033
  307   2HD1  ILE  41          2HD1      ILE  41 -15.701 -30.060  -1.711
  308   3HD1  ILE  41          1HD1      ILE  41 -15.148 -30.325  -3.364
  309    H    THR  42           H        THR  42 -18.363 -33.027  -2.387
  310    HA   THR  42           HA       THR  42 -21.218 -33.544  -1.672
  311    HB   THR  42           HB       THR  42 -20.874 -35.787  -1.544
  312    HG1  THR  42           HG1      THR  42 -19.185 -36.639  -0.398
  313   1HG2  THR  42          2HG2      THR  42 -19.724 -35.217  -3.698
  314   2HG2  THR  42          1HG2      THR  42 -18.193 -35.191  -2.822
  315   3HG2  THR  42          3HG2      THR  42 -19.113 -36.692  -2.948
  316    HA   PRO  43           HA       PRO  43 -20.202 -32.064   2.373
  317   1HB   PRO  43          2HB       PRO  43 -21.464 -33.814   4.007
  318   2HB   PRO  43          1HB       PRO  43 -22.327 -32.600   3.059
  319   1HG   PRO  43          2HG       PRO  43 -21.900 -35.510   2.478
  320   2HG   PRO  43          1HG       PRO  43 -23.373 -34.549   2.310
  321   1HD   PRO  43          1HD       PRO  43 -21.818 -35.148   0.187
  322   2HD   PRO  43          2HD       PRO  43 -22.688 -33.616   0.300
  323    H    ASP  44           H        ASP  44 -19.742 -35.520   1.798
  324    HA   ASP  44           HA       ASP  44 -18.014 -36.011   4.027
  325   1HB   ASP  44          2HB       ASP  44 -18.108 -37.424   1.345
  326   2HB   ASP  44          1HB       ASP  44 -17.379 -38.055   2.822
  327    H    GLU  45           H        GLU  45 -17.453 -34.511   0.907
  328    HA   GLU  45           HA       GLU  45 -14.547 -34.861   1.067
  329   1HB   GLU  45          2HB       GLU  45 -16.325 -33.190  -0.737
  330   2HB   GLU  45          1HB       GLU  45 -14.569 -33.267  -0.888
  331   1HG   GLU  45          2HG       GLU  45 -14.817 -35.794  -1.068
  332   2HG   GLU  45          1HG       GLU  45 -16.555 -35.529  -1.218
  333    H    VAL  46           H        VAL  46 -16.956 -32.362   1.689
  334    HA   VAL  46           HA       VAL  46 -15.063 -30.284   2.318
  335    HB   VAL  46           HB       VAL  46 -17.976 -30.698   3.019
  336   1HG1  VAL  46          1HG1      VAL  46 -16.742 -29.357   4.772
  337   2HG1  VAL  46          3HG1      VAL  46 -16.322 -28.204   3.505
  338   3HG1  VAL  46          2HG1      VAL  46 -18.012 -28.463   3.940
  339   1HG2  VAL  46          2HG2      VAL  46 -16.527 -29.686   0.759
  340   2HG2  VAL  46          1HG2      VAL  46 -18.274 -29.822   0.967
  341   3HG2  VAL  46          3HG2      VAL  46 -17.434 -28.361   1.487
  342    H    LYS  47           H        LYS  47 -16.703 -32.778   4.200
  343    HA   LYS  47           HA       LYS  47 -15.833 -31.861   6.782
  344   1HB   LYS  47          2HB       LYS  47 -16.649 -34.595   5.767
  345   2HB   LYS  47          1HB       LYS  47 -16.270 -34.271   7.458
  346   1HG   LYS  47          2HG       LYS  47 -18.032 -32.530   7.508
  347   2HG   LYS  47          1HG       LYS  47 -18.424 -32.887   5.826
  348   1HD   LYS  47          2HD       LYS  47 -18.935 -35.238   6.480
  349   2HD   LYS  47          1HD       LYS  47 -18.631 -34.811   8.164
  350   1HE   LYS  47          2HE       LYS  47 -20.620 -33.720   8.373
  351   2HE   LYS  47          1HE       LYS  47 -20.510 -33.016   6.759
  352   1HZ   LYS  47          1HZ       LYS  47 -20.886 -35.507   6.072
  353   2HZ   LYS  47          3HZ       LYS  47 -21.625 -35.588   7.596
  354   3HZ   LYS  47          2HZ       LYS  47 -22.194 -34.485   6.434
  355    H    HIS  48           H        HIS  48 -14.450 -34.088   4.402
  356    HA   HIS  48           HA       HIS  48 -12.224 -34.931   6.000
  357   1HB   HIS  48          2HB       HIS  48 -12.794 -36.186   4.014
  358   2HB   HIS  48          1HB       HIS  48 -12.595 -34.759   2.996
  359    HD1  HIS  48           HD1      HIS  48 -10.640 -35.693   1.610
  360    HD2  HIS  48           HD2      HIS  48  -9.892 -35.704   5.710
  361    HE1  HIS  48           HE1      HIS  48  -8.176 -36.211   1.886
  362    H    MET  49           H        MET  49 -12.680 -32.216   3.742
  363    HA   MET  49           HA       MET  49 -10.006 -31.284   3.700
  364   1HB   MET  49          2HB       MET  49 -12.690 -29.968   3.382
  365   2HB   MET  49          1HB       MET  49 -11.232 -28.981   3.439
  366   1HG   MET  49          2HG       MET  49 -10.326 -30.671   1.657
  367   2HG   MET  49          1HG       MET  49 -12.030 -31.057   1.414
  368   1HE   MET  49          1HE       MET  49 -12.192 -30.603  -0.716
  369   2HE   MET  49          3HE       MET  49 -13.548 -29.529  -0.342
  370   3HE   MET  49          2HE       MET  49 -12.327 -29.038  -1.514
  371    H    MET  50           H        MET  50 -12.658 -30.616   5.954
  372    HA   MET  50           HA       MET  50 -11.266 -28.740   7.588
  373   1HB   MET  50          2HB       MET  50 -13.585 -30.605   8.034
  374   2HB   MET  50          1HB       MET  50 -12.923 -29.673   9.374
  375   1HG   MET  50          2HG       MET  50 -13.155 -27.619   7.846
  376   2HG   MET  50          1HG       MET  50 -14.157 -28.642   6.816
  377   1HE   MET  50          3HE       MET  50 -13.467 -26.881   9.882
  378   2HE   MET  50          2HE       MET  50 -14.951 -26.774  10.825
  379   3HE   MET  50          1HE       MET  50 -13.943 -28.214  10.942
  380    H    ALA  51           H        ALA  51 -11.650 -32.264   7.900
  381    HA   ALA  51           HA       ALA  51 -10.116 -32.593  10.264
  382   1HB   ALA  51          2HB       ALA  51 -11.509 -34.320   8.814
  383   2HB   ALA  51          1HB       ALA  51  -9.942 -34.629   8.068
  384   3HB   ALA  51          3HB       ALA  51 -10.157 -34.873   9.801
  385    H    GLU  52           H        GLU  52  -9.170 -31.797   7.045
  386    HA   GLU  52           HA       GLU  52  -6.330 -32.483   7.594
  387   1HB   GLU  52          2HB       GLU  52  -7.873 -31.705   5.126
  388   2HB   GLU  52          1HB       GLU  52  -6.115 -31.567   5.159
  389   1HG   GLU  52          2HG       GLU  52  -7.343 -34.119   6.122
  390   2HG   GLU  52          1HG       GLU  52  -7.303 -33.822   4.384
  391    H    ILE  53           H        ILE  53  -8.459 -29.733   7.009
  392    HA   ILE  53           HA       ILE  53  -6.273 -27.792   7.139
  393    HB   ILE  53           HB       ILE  53  -9.281 -27.433   7.222
  394   1HG1  ILE  53          2HG1      ILE  53  -7.317 -27.103   4.940
  395   2HG1  ILE  53          1HG1      ILE  53  -8.380 -28.493   5.150
  396   1HG2  ILE  53          2HG2      ILE  53  -7.035 -25.450   6.761
  397   2HG2  ILE  53          1HG2      ILE  53  -8.757 -25.091   6.624
  398   3HG2  ILE  53          3HG2      ILE  53  -8.070 -25.528   8.188
  399   1HD1  ILE  53          2HD1      ILE  53  -9.632 -25.787   5.229
  400   2HD1  ILE  53          1HD1      ILE  53  -9.096 -26.387   3.659
  401   3HD1  ILE  53          3HD1      ILE  53 -10.272 -27.305   4.600
  402    H    ASP  54           H        ASP  54  -8.690 -29.137   9.309
  403    HA   ASP  54           HA       ASP  54  -8.497 -27.270  11.435
  404   1HB   ASP  54          2HB       ASP  54 -10.064 -29.345  11.035
  405   2HB   ASP  54          1HB       ASP  54  -8.815 -30.219  11.911
  406    H    THR  55           H        THR  55  -6.422 -26.658  12.020
  407    HA   THR  55           HA       THR  55  -4.199 -28.485  12.162
  408    HB   THR  55           HB       THR  55  -3.033 -26.598  13.277
  409    HG1  THR  55           HG1      THR  55  -4.160 -25.095  14.187
  410   1HG2  THR  55          3HG2      THR  55  -4.741 -25.857  10.887
  411   2HG2  THR  55          2HG2      THR  55  -3.308 -24.974  11.413
  412   3HG2  THR  55          1HG2      THR  55  -3.160 -26.635  10.837
  413    H    ASP  56           H        ASP  56  -6.226 -26.993  14.692
  414    HA   ASP  56           HA       ASP  56  -4.882 -28.628  16.739
  415   1HB   ASP  56          2HB       ASP  56  -6.063 -27.359  18.342
  416   2HB   ASP  56          1HB       ASP  56  -5.733 -26.206  17.051
  417    H    GLY  57           H        GLY  57  -7.985 -28.506  15.072
  418   1HA   GLY  57          1HA       GLY  57  -8.489 -31.273  16.034
  419   2HA   GLY  57          2HA       GLY  57  -9.237 -30.539  14.621
  420    H    ASP  58           H        ASP  58  -9.882 -28.028  16.176
  421    HA   ASP  58           HA       ASP  58 -11.693 -28.965  18.288
  422   1HB   ASP  58          2HB       ASP  58 -12.260 -26.653  18.622
  423   2HB   ASP  58          1HB       ASP  58 -10.522 -26.716  18.344
  424    H    GLY  59           H        GLY  59 -11.831 -28.997  14.970
  425   1HA   GLY  59          1HA       GLY  59 -14.795 -29.164  15.060
  426   2HA   GLY  59          2HA       GLY  59 -13.770 -29.869  13.811
  427    H    PHE  60           H        PHE  60 -12.627 -26.798  14.476
  428    HA   PHE  60           HA       PHE  60 -14.125 -25.727  12.131
  429   1HB   PHE  60          2HB       PHE  60 -13.421 -24.081  14.569
  430   2HB   PHE  60          1HB       PHE  60 -14.403 -23.591  13.188
  431    HD1  PHE  60           HD1      PHE  60 -16.634 -24.635  12.801
  432    HD2  PHE  60           HD2      PHE  60 -14.342 -25.394  16.351
  433    HE1  PHE  60           HE1      PHE  60 -18.660 -25.514  13.923
  434    HE2  PHE  60           HE2      PHE  60 -16.368 -26.274  17.472
  435    HZ   PHE  60           HZ       PHE  60 -18.531 -26.336  16.258
  436    H    ILE  61           H        ILE  61 -13.026 -24.052  10.955
  437    HA   ILE  61           HA       ILE  61 -10.072 -24.160  11.278
  438    HB   ILE  61           HB       ILE  61 -11.651 -23.324   8.834
  439   1HG1  ILE  61          2HG1      ILE  61 -12.189 -25.648   9.309
  440   2HG1  ILE  61          1HG1      ILE  61 -11.058 -25.596   7.958
  441   1HG2  ILE  61          2HG2      ILE  61  -8.761 -24.151   9.248
  442   2HG2  ILE  61          1HG2      ILE  61  -9.492 -23.745   7.696
  443   3HG2  ILE  61          3HG2      ILE  61  -9.331 -22.511   8.945
  444   1HD1  ILE  61          2HD1      ILE  61  -9.190 -25.944   9.630
  445   2HD1  ILE  61          1HD1      ILE  61 -10.427 -26.230  10.854
  446   3HD1  ILE  61          3HD1      ILE  61 -10.291 -27.315   9.468
  447    H    SER  62           H        SER  62  -9.081 -22.245  11.835
  448    HA   SER  62           HA       SER  62 -10.786 -19.824  11.991
  449   1HB   SER  62          2HB       SER  62  -8.499 -19.044  13.167
  450   2HB   SER  62          1HB       SER  62  -9.739 -19.945  14.041
  451    HG   SER  62           HG       SER  62  -7.801 -20.980  14.347
  452    H    PHE  63           H        PHE  63  -9.635 -17.732  11.360
  453    HA   PHE  63           HA       PHE  63  -8.866 -17.796   8.650
  454   1HB   PHE  63          2HB       PHE  63  -9.535 -15.710   9.806
  455   2HB   PHE  63          1HB       PHE  63  -8.036 -15.754  10.738
  456    HD1  PHE  63           HD1      PHE  63  -8.922 -16.345   7.145
  457    HD2  PHE  63           HD2      PHE  63  -6.475 -14.208   9.952
  458    HE1  PHE  63           HE1      PHE  63  -7.727 -15.253   5.269
  459    HE2  PHE  63           HE2      PHE  63  -5.273 -13.121   8.076
  460    HZ   PHE  63           HZ       PHE  63  -5.905 -13.641   5.732
  461    H    GLN  64           H        GLN  64  -6.879 -17.836  11.579
  462    HA   GLN  64           HA       GLN  64  -4.335 -17.776  10.313
  463   1HB   GLN  64          2HB       GLN  64  -4.804 -17.527  12.782
  464   2HB   GLN  64          1HB       GLN  64  -5.068 -19.269  12.847
  465   1HG   GLN  64          2HG       GLN  64  -2.757 -18.780  13.484
  466   2HG   GLN  64          1HG       GLN  64  -2.769 -19.611  11.929
  467   1HE2  GLN  64          1HE2      GLN  64  -0.913 -18.662  10.957
  468   2HE2  GLN  64          2HE2      GLN  64  -0.752 -16.996  10.676
  469    H    GLU  65           H        GLU  65  -6.335 -20.566  11.348
  470    HA   GLU  65           HA       GLU  65  -4.590 -22.593  10.393
  471   1HB   GLU  65          2HB       GLU  65  -7.561 -22.459  10.857
  472   2HB   GLU  65          1HB       GLU  65  -6.820 -23.907  10.189
  473   1HG   GLU  65          2HG       GLU  65  -5.331 -24.070  12.135
  474   2HG   GLU  65          1HG       GLU  65  -6.016 -22.588  12.798
  475    H    PHE  66           H        PHE  66  -7.330 -20.961   8.809
  476    HA   PHE  66           HA       PHE  66  -7.125 -22.359   6.325
  477   1HB   PHE  66          2HB       PHE  66  -9.083 -20.970   6.987
  478   2HB   PHE  66          1HB       PHE  66  -8.090 -19.524   6.802
  479    HD1  PHE  66           HD1      PHE  66  -7.274 -18.826   4.577
  480    HD2  PHE  66           HD2      PHE  66  -9.875 -22.210   5.061
  481    HE1  PHE  66           HE1      PHE  66  -7.760 -18.799   2.147
  482    HE2  PHE  66           HE2      PHE  66 -10.361 -22.184   2.629
  483    HZ   PHE  66           HZ       PHE  66  -9.304 -20.478   1.172
  484    H    THR  67           H        THR  67  -5.519 -19.471   7.570
  485    HA   THR  67           HA       THR  67  -4.259 -18.732   5.086
  486    HB   THR  67           HB       THR  67  -3.536 -18.162   7.974
  487    HG1  THR  67           HG1      THR  67  -5.036 -16.946   5.967
  488   1HG2  THR  67          3HG2      THR  67  -2.322 -17.120   5.403
  489   2HG2  THR  67          2HG2      THR  67  -2.064 -16.382   6.984
  490   3HG2  THR  67          1HG2      THR  67  -1.499 -18.024   6.674
  491    H    ASP  68           H        ASP  68  -3.122 -20.603   7.912
  492    HA   ASP  68           HA       ASP  68  -0.536 -21.204   6.895
  493   1HB   ASP  68          2HB       ASP  68  -2.325 -22.840   8.720
  494   2HB   ASP  68          1HB       ASP  68  -0.608 -23.147   8.459
  495    H    PHE  69           H        PHE  69  -3.666 -22.788   6.414
  496    HA   PHE  69           HA       PHE  69  -2.536 -24.968   4.857
  497   1HB   PHE  69          2HB       PHE  69  -4.531 -25.679   5.749
  498   2HB   PHE  69          1HB       PHE  69  -5.228 -24.062   5.739
  499    HD1  PHE  69           HD1      PHE  69  -5.837 -23.056   3.446
  500    HD2  PHE  69           HD2      PHE  69  -5.149 -27.239   4.106
  501    HE1  PHE  69           HE1      PHE  69  -7.077 -23.588   1.360
  502    HE2  PHE  69           HE2      PHE  69  -6.386 -27.775   2.029
  503    HZ   PHE  69           HZ       PHE  69  -7.354 -25.951   0.653
  504    H    GLY  70           H        GLY  70  -4.063 -21.850   4.193
  505   1HA   GLY  70          1HA       GLY  70  -4.131 -20.581   2.219
  506   2HA   GLY  70          2HA       GLY  70  -4.365 -22.115   1.381
  507    H    ARG  71           H        ARG  71  -1.542 -21.482   3.363
  508    HA   ARG  71           HA       ARG  71   0.168 -20.602   1.201
  509   1HB   ARG  71          2HB       ARG  71   0.847 -21.850   3.885
  510   2HB   ARG  71          1HB       ARG  71   2.015 -21.096   2.798
  511   1HG   ARG  71          2HG       ARG  71   0.768 -18.966   2.946
  512   2HG   ARG  71          1HG       ARG  71  -0.384 -19.720   4.046
  513   1HD   ARG  71          2HD       ARG  71   2.589 -19.367   4.538
  514   2HD   ARG  71          1HD       ARG  71   1.291 -18.471   5.328
  515    HE   ARG  71           HE       ARG  71   0.931 -21.307   5.701
  516   1HH1  ARG  71          1HH1      ARG  71   2.422 -18.419   6.823
  517   2HH1  ARG  71          2HH1      ARG  71   2.927 -19.103   8.330
  518   1HH2  ARG  71          1HH2      ARG  71   1.738 -22.276   7.595
  519   2HH2  ARG  71          2HH2      ARG  71   2.539 -21.286   8.768
  520    H    ALA  72           H        ALA  72  -0.773 -23.712   2.516
  521    HA   ALA  72           HA       ALA  72   1.269 -25.267   1.189
  522   1HB   ALA  72          1HB       ALA  72   0.360 -26.789   2.581
  523   2HB   ALA  72          2HB       ALA  72  -1.029 -26.875   1.496
  524   3HB   ALA  72          3HB       ALA  72  -1.043 -25.756   2.861
  525    H    ASN  73           H        ASN  73  -1.680 -23.785   0.154
  526    HA   ASN  73           HA       ASN  73  -1.208 -24.793  -2.583
  527   1HB   ASN  73          2HB       ASN  73  -3.702 -25.321  -2.777
  528   2HB   ASN  73          1HB       ASN  73  -2.749 -26.464  -1.831
  529   1HD2  ASN  73          1HD2      ASN  73  -3.264 -26.705   0.386
  530   2HD2  ASN  73          2HD2      ASN  73  -4.470 -25.807   1.172
  531    H    ARG  74           H        ARG  74  -0.657 -22.285  -1.970
  532    HA   ARG  74           HA       ARG  74  -2.644 -20.330  -1.792
  533   1HB   ARG  74          2HB       ARG  74  -1.081 -18.840  -3.033
  534   2HB   ARG  74          1HB       ARG  74  -0.257 -19.765  -1.778
  535   1HG   ARG  74          2HG       ARG  74   0.413 -21.439  -3.501
  536   2HG   ARG  74          1HG       ARG  74  -0.335 -20.429  -4.737
  537   1HD   ARG  74          2HD       ARG  74   1.996 -19.689  -2.947
  538   2HD   ARG  74          1HD       ARG  74   2.036 -19.928  -4.694
  539    HE   ARG  74           HE       ARG  74   0.428 -17.907  -4.760
  540   1HH1  ARG  74          1HH1      ARG  74   3.459 -17.500  -4.079
  541   2HH1  ARG  74          2HH1      ARG  74   3.320 -16.276  -2.862
  542   1HH2  ARG  74          1HH2      ARG  74  -0.084 -16.750  -2.398
  543   2HH2  ARG  74          2HH2      ARG  74   1.314 -15.852  -1.909
  544    H    GLY  75           H        GLY  75  -1.578 -22.160  -4.606
  545   1HA   GLY  75          1HA       GLY  75  -2.511 -22.387  -6.726
  546   2HA   GLY  75          2HA       GLY  75  -3.079 -20.726  -6.567
  547    H    LEU  76           H        LEU  76  -3.976 -23.167  -4.223
  548    HA   LEU  76           HA       LEU  76  -6.426 -24.004  -5.463
  549   1HB   LEU  76          2HB       LEU  76  -5.293 -24.124  -2.695
  550   2HB   LEU  76          1HB       LEU  76  -7.009 -24.461  -2.919
  551    HG   LEU  76           HG       LEU  76  -4.712 -25.854  -4.330
  552   1HD1  LEU  76          2HD1      LEU  76  -5.957 -26.294  -1.810
  553   2HD1  LEU  76          1HD1      LEU  76  -6.512 -27.571  -2.892
  554   3HD1  LEU  76          3HD1      LEU  76  -4.784 -27.326  -2.630
  555   1HD2  LEU  76          1HD2      LEU  76  -7.674 -25.825  -4.742
  556   2HD2  LEU  76          3HD2      LEU  76  -6.380 -25.975  -5.930
  557   3HD2  LEU  76          2HD2      LEU  76  -6.827 -27.360  -4.933
  558    H    LEU  77           H        LEU  77  -5.738 -21.520  -3.007
  559    HA   LEU  77           HA       LEU  77  -8.411 -20.643  -2.646
  560   1HB   LEU  77          2HB       LEU  77  -5.916 -18.929  -2.521
  561   2HB   LEU  77          1HB       LEU  77  -7.449 -18.617  -1.715
  562    HG   LEU  77           HG       LEU  77  -6.310 -19.584   0.031
  563   1HD1  LEU  77          2HD1      LEU  77  -8.242 -21.137  -0.859
  564   2HD1  LEU  77          1HD1      LEU  77  -6.912 -22.240  -1.209
  565   3HD1  LEU  77          3HD1      LEU  77  -7.192 -21.691   0.444
  566   1HD2  LEU  77          2HD2      LEU  77  -4.515 -20.350  -2.021
  567   2HD2  LEU  77          1HD2      LEU  77  -4.231 -20.343  -0.280
  568   3HD2  LEU  77          3HD2      LEU  77  -4.865 -21.790  -1.065
  569    H    LYS  78           H        LYS  78  -5.929 -19.652  -4.974
  570    HA   LYS  78           HA       LYS  78  -7.357 -17.504  -6.165
  571   1HB   LYS  78          2HB       LYS  78  -5.415 -19.452  -7.447
  572   2HB   LYS  78          1HB       LYS  78  -5.925 -17.918  -8.151
  573   1HG   LYS  78          2HG       LYS  78  -5.104 -16.849  -5.948
  574   2HG   LYS  78          1HG       LYS  78  -4.281 -18.383  -5.661
  575   1HD   LYS  78          2HD       LYS  78  -3.957 -16.814  -8.229
  576   2HD   LYS  78          1HD       LYS  78  -2.897 -16.587  -6.838
  577   1HE   LYS  78          2HE       LYS  78  -2.252 -18.945  -6.904
  578   2HE   LYS  78          1HE       LYS  78  -3.383 -19.242  -8.224
  579   1HZ   LYS  78          3HZ       LYS  78  -1.565 -17.072  -8.728
  580   2HZ   LYS  78          2HZ       LYS  78  -0.783 -18.567  -8.517
  581   3HZ   LYS  78          1HZ       LYS  78  -1.980 -18.391  -9.712
  582    H    ASP  79           H        ASP  79  -7.644 -20.980  -6.552
  583    HA   ASP  79           HA       ASP  79  -9.258 -20.884  -8.951
  584   1HB   ASP  79          2HB       ASP  79  -8.041 -22.926  -8.219
  585   2HB   ASP  79          1HB       ASP  79  -9.112 -23.040  -6.823
  586    H    VAL  80           H        VAL  80  -9.952 -20.880  -5.487
  587    HA   VAL  80           HA       VAL  80 -12.861 -20.884  -6.000
  588    HB   VAL  80           HB       VAL  80 -11.538 -20.452  -3.321
  589   1HG1  VAL  80          2HG1      VAL  80 -14.188 -20.616  -4.194
  590   2HG1  VAL  80          1HG1      VAL  80 -13.858 -22.206  -3.509
  591   3HG1  VAL  80          3HG1      VAL  80 -13.631 -20.759  -2.528
  592   1HG2  VAL  80          2HG2      VAL  80 -11.909 -23.034  -4.856
  593   2HG2  VAL  80          1HG2      VAL  80 -10.415 -22.392  -4.173
  594   3HG2  VAL  80          3HG2      VAL  80 -11.689 -22.983  -3.106
  595    H    ALA  81           H        ALA  81 -10.277 -18.650  -5.226
  596    HA   ALA  81           HA       ALA  81 -11.856 -16.482  -4.249
  597   1HB   ALA  81          1HB       ALA  81  -9.885 -15.361  -4.228
  598   2HB   ALA  81          2HB       ALA  81  -9.567 -15.713  -5.926
  599   3HB   ALA  81          3HB       ALA  81  -9.171 -16.907  -4.690
  600    H    LYS  82           H        LYS  82 -11.558 -17.834  -7.409
  601    HA   LYS  82           HA       LYS  82 -12.608 -15.371  -8.689
  602   1HB   LYS  82          2HB       LYS  82 -12.168 -16.455 -10.787
  603   2HB   LYS  82          1HB       LYS  82 -10.774 -16.777  -9.755
  604   1HG   LYS  82          2HG       LYS  82 -11.765 -18.974  -9.146
  605   2HG   LYS  82          1HG       LYS  82 -13.109 -18.654 -10.243
  606   1HD   LYS  82          2HD       LYS  82 -11.238 -18.269 -12.025
  607   2HD   LYS  82          1HD       LYS  82 -10.214 -19.160 -10.899
  608   1HE   LYS  82          2HE       LYS  82 -12.068 -20.940 -10.881
  609   2HE   LYS  82          1HE       LYS  82 -12.725 -20.108 -12.291
  610   1HZ   LYS  82          2HZ       LYS  82  -9.899 -20.975 -12.146
  611   2HZ   LYS  82          1HZ       LYS  82 -11.126 -21.994 -12.730
  612   3HZ   LYS  82          3HZ       LYS  82 -10.794 -20.531 -13.520
  613    H    ILE  83           H        ILE  83 -13.571 -18.614  -7.757
  614    HA   ILE  83           HA       ILE  83 -15.976 -18.839  -9.236
  615    HB   ILE  83           HB       ILE  83 -15.330 -19.844  -6.450
  616   1HG1  ILE  83          2HG1      ILE  83 -15.007 -20.980  -9.234
  617   2HG1  ILE  83          1HG1      ILE  83 -13.772 -20.778  -7.992
  618   1HG2  ILE  83          3HG2      ILE  83 -17.806 -19.699  -7.171
  619   2HG2  ILE  83          2HG2      ILE  83 -17.403 -20.953  -8.345
  620   3HG2  ILE  83          1HG2      ILE  83 -17.217 -21.268  -6.619
  621   1HD1  ILE  83          3HD1      ILE  83 -15.774 -22.359  -6.802
  622   2HD1  ILE  83          2HD1      ILE  83 -15.569 -23.010  -8.428
  623   3HD1  ILE  83          1HD1      ILE  83 -14.183 -22.896  -7.343
  624    H    PHE  84           H        PHE  84 -15.243 -17.089  -6.272
  625    HA   PHE  84           HA       PHE  84 -18.079 -16.326  -5.932
  626   1HB   PHE  84          2HB       PHE  84 -15.576 -15.691  -4.345
  627   2HB   PHE  84          1HB       PHE  84 -17.174 -15.064  -3.942
  628    HD1  PHE  84           HD1      PHE  84 -15.123 -18.133  -4.252
  629    HD2  PHE  84           HD2      PHE  84 -18.874 -16.476  -2.974
  630    HE1  PHE  84           HE1      PHE  84 -15.656 -20.249  -3.075
  631    HE2  PHE  84           HE2      PHE  84 -19.407 -18.592  -1.797
  632    HZ   PHE  84           HZ       PHE  84 -17.799 -20.479  -1.848

  No H/Q in entry =         632
  Start of MODEL    9
    1    H1   ALA   1          3H        ALA   1   8.928 -13.458   2.723
    2    H2   ALA   1          2H        ALA   1   8.991 -15.118   2.363
    3    H3   ALA   1          1H        ALA   1  10.255 -14.384   3.231
    4    HA   ALA   1           HA       ALA   1  11.091 -13.290   1.390
    5   1HB   ALA   1          2HB       ALA   1   9.961 -15.968   0.537
    6   2HB   ALA   1          3HB       ALA   1  11.575 -15.639   1.167
    7   3HB   ALA   1          1HB       ALA   1  11.115 -15.052  -0.432
    8    H    ASP   2           H        ASP   2   8.750 -14.990  -0.586
    9    HA   ASP   2           HA       ASP   2   8.043 -12.459  -1.898
   10   1HB   ASP   2          2HB       ASP   2   7.300 -15.350  -2.402
   11   2HB   ASP   2          1HB       ASP   2   6.619 -14.017  -3.335
   12    H    ASP   3           H        ASP   3   6.881 -14.226   0.735
   13    HA   ASP   3           HA       ASP   3   4.051 -13.888   0.427
   14   1HB   ASP   3          2HB       ASP   3   5.229 -15.358   2.134
   15   2HB   ASP   3          1HB       ASP   3   5.571 -13.887   3.045
   16    H    HIS   4           H        HIS   4   2.860 -12.047   0.538
   17    HA   HIS   4           HA       HIS   4   4.011  -9.710   1.995
   18   1HB   HIS   4          2HB       HIS   4   2.706  -8.403   0.077
   19   2HB   HIS   4          1HB       HIS   4   4.365  -8.941  -0.159
   20    HD1  HIS   4           HD1      HIS   4   4.332  -9.519  -2.619
   21    HD2  HIS   4           HD2      HIS   4   1.191 -11.298  -0.535
   22    HE1  HIS   4           HE1      HIS   4   3.211 -11.112  -4.236
   23    HA   PRO   5           HA       PRO   5   0.027  -9.171   3.856
   24   1HB   PRO   5          2HB       PRO   5  -0.452  -6.517   3.610
   25   2HB   PRO   5          1HB       PRO   5   0.731  -7.179   4.743
   26   1HG   PRO   5          2HG       PRO   5   1.165  -6.007   2.015
   27   2HG   PRO   5          1HG       PRO   5   2.075  -5.719   3.502
   28   1HD   PRO   5          1HD       PRO   5   2.989  -7.400   1.617
   29   2HD   PRO   5          2HD       PRO   5   3.236  -7.727   3.333
   30    H    GLN   6           H        GLN   6   0.484  -8.053   0.585
   31    HA   GLN   6           HA       GLN   6  -2.202  -7.397  -0.086
   32   1HB   GLN   6          2HB       GLN   6   0.095  -8.496  -1.720
   33   2HB   GLN   6          1HB       GLN   6  -1.440  -8.004  -2.430
   34   1HG   GLN   6          2HG       GLN   6   0.469  -6.255  -0.855
   35   2HG   GLN   6          1HG       GLN   6   0.115  -6.140  -2.578
   36   1HE2  GLN   6          1HE2      GLN   6  -1.288  -5.646   0.663
   37   2HE2  GLN   6          2HE2      GLN   6  -2.561  -4.655   0.141
   38    H    ASP   7           H        ASP   7  -0.433 -10.469  -0.156
   39    HA   ASP   7           HA       ASP   7  -2.509 -12.039  -1.325
   40   1HB   ASP   7          2HB       ASP   7  -0.224 -12.728   0.527
   41   2HB   ASP   7          1HB       ASP   7  -1.338 -13.953  -0.082
   42    H    LYS   8           H        LYS   8  -1.721 -11.388   2.084
   43    HA   LYS   8           HA       LYS   8  -3.661 -12.967   3.334
   44   1HB   LYS   8          2HB       LYS   8  -2.332 -10.381   3.996
   45   2HB   LYS   8          1HB       LYS   8  -3.755 -10.824   4.942
   46   1HG   LYS   8          2HG       LYS   8  -2.498 -13.185   5.003
   47   2HG   LYS   8          1HG       LYS   8  -1.085 -12.151   4.793
   48   1HD   LYS   8          2HD       LYS   8  -2.001 -10.748   6.726
   49   2HD   LYS   8          1HD       LYS   8  -3.132 -12.069   7.019
   50   1HE   LYS   8          2HE       LYS   8  -1.386 -12.714   8.404
   51   2HE   LYS   8          1HE       LYS   8  -0.921 -13.536   6.914
   52   1HZ   LYS   8          3HZ       LYS   8   0.188 -11.158   6.522
   53   2HZ   LYS   8          2HZ       LYS   8   0.281 -11.234   8.217
   54   3HZ   LYS   8          1HZ       LYS   8   0.999 -12.447   7.269
   55    H    ALA   9           H        ALA   9  -4.046  -9.839   1.744
   56    HA   ALA   9           HA       ALA   9  -6.697  -9.260   2.557
   57   1HB   ALA   9          3HB       ALA   9  -5.001  -8.549   0.207
   58   2HB   ALA   9          2HB       ALA   9  -6.738  -8.275   0.060
   59   3HB   ALA   9          1HB       ALA   9  -5.827  -7.493   1.353
   60    H    GLU  10           H        GLU  10  -5.500 -11.173  -0.178
   61    HA   GLU  10           HA       GLU  10  -8.110 -11.901  -1.152
   62   1HB   GLU  10          2HB       GLU  10  -5.556 -13.500  -1.455
   63   2HB   GLU  10          1HB       GLU  10  -6.962 -13.522  -2.519
   64   1HG   GLU  10          2HG       GLU  10  -6.537 -11.028  -2.898
   65   2HG   GLU  10          1HG       GLU  10  -4.979 -11.275  -2.109
   66    H    ARG  11           H        ARG  11  -5.864 -13.376   1.145
   67    HA   ARG  11           HA       ARG  11  -7.365 -15.800   1.534
   68   1HB   ARG  11          2HB       ARG  11  -5.363 -14.335   3.268
   69   2HB   ARG  11          1HB       ARG  11  -6.074 -15.880   3.728
   70   1HG   ARG  11          2HG       ARG  11  -5.255 -16.805   1.519
   71   2HG   ARG  11          1HG       ARG  11  -4.372 -15.295   1.292
   72   1HD   ARG  11          2HD       ARG  11  -3.313 -15.722   3.572
   73   2HD   ARG  11          1HD       ARG  11  -4.005 -17.341   3.492
   74    HE   ARG  11           HE       ARG  11  -1.913 -16.287   1.650
   75   1HH1  ARG  11          1HH1      ARG  11  -2.505 -18.711   3.784
   76   2HH1  ARG  11          2HH1      ARG  11  -2.175 -20.026   2.708
   77   1HH2  ARG  11          1HH2      ARG  11  -2.058 -18.026  -0.123
   78   2HH2  ARG  11          2HH2      ARG  11  -1.919 -19.639   0.493
   79    H    GLU  12           H        GLU  12  -7.364 -12.657   3.160
   80    HA   GLU  12           HA       GLU  12  -9.213 -13.367   5.230
   81   1HB   GLU  12          2HB       GLU  12  -8.212 -10.814   4.041
   82   2HB   GLU  12          1HB       GLU  12  -9.656 -10.749   5.048
   83   1HG   GLU  12          2HG       GLU  12  -8.385 -12.001   6.824
   84   2HG   GLU  12          1HG       GLU  12  -6.938 -11.839   5.830
   85    H    ARG  13           H        ARG  13  -9.658 -11.984   1.993
   86    HA   ARG  13           HA       ARG  13 -12.504 -11.645   2.243
   87   1HB   ARG  13          2HB       ARG  13 -10.834 -12.063  -0.256
   88   2HB   ARG  13          1HB       ARG  13 -12.484 -11.442  -0.213
   89   1HG   ARG  13          2HG       ARG  13 -11.809  -9.457   0.931
   90   2HG   ARG  13          1HG       ARG  13 -10.220 -10.126   1.300
   91   1HD   ARG  13          2HD       ARG  13  -9.814  -8.684  -0.529
   92   2HD   ARG  13          1HD       ARG  13  -9.912 -10.283  -1.266
   93    HE   ARG  13           HE       ARG  13 -12.028  -9.677  -2.218
   94   1HH1  ARG  13          1HH1      ARG  13 -10.290  -7.032  -2.145
   95   2HH1  ARG  13          2HH1      ARG  13 -11.540  -5.895  -1.766
   96   1HH2  ARG  13          1HH2      ARG  13 -13.840  -8.324  -0.852
   97   2HH2  ARG  13          2HH2      ARG  13 -13.550  -6.626  -1.033
   98    H    ILE  14           H        ILE  14 -10.466 -14.280   1.030
   99    HA   ILE  14           HA       ILE  14 -12.686 -15.931   0.193
  100    HB   ILE  14           HB       ILE  14  -9.867 -16.747   0.962
  101   1HG1  ILE  14          2HG1      ILE  14 -10.897 -16.306  -1.833
  102   2HG1  ILE  14          1HG1      ILE  14 -10.246 -14.963  -0.898
  103   1HG2  ILE  14          3HG2      ILE  14 -12.074 -18.103  -0.609
  104   2HG2  ILE  14          2HG2      ILE  14 -10.397 -18.646  -0.626
  105   3HG2  ILE  14          1HG2      ILE  14 -11.316 -18.671   0.879
  106   1HD1  ILE  14          2HD1      ILE  14  -8.564 -17.366  -0.791
  107   2HD1  ILE  14          1HD1      ILE  14  -8.747 -16.721  -2.421
  108   3HD1  ILE  14          3HD1      ILE  14  -8.114 -15.696  -1.134
  109    H    PHE  15           H        PHE  15 -10.664 -15.806   3.135
  110    HA   PHE  15           HA       PHE  15 -12.028 -17.988   4.431
  111   1HB   PHE  15          2HB       PHE  15  -9.779 -17.186   5.130
  112   2HB   PHE  15          1HB       PHE  15 -10.511 -15.680   5.697
  113    HD1  PHE  15           HD1      PHE  15 -12.109 -15.715   7.614
  114    HD2  PHE  15           HD2      PHE  15 -10.028 -19.250   6.343
  115    HE1  PHE  15           HE1      PHE  15 -12.702 -16.833   9.749
  116    HE2  PHE  15           HE2      PHE  15 -10.622 -20.368   8.474
  117    HZ   PHE  15           HZ       PHE  15 -11.962 -19.164  10.178
  118    H    LYS  16           H        LYS  16 -12.538 -14.498   4.321
  119    HA   LYS  16           HA       LYS  16 -14.509 -14.373   6.399
  120   1HB   LYS  16          2HB       LYS  16 -13.841 -12.642   4.027
  121   2HB   LYS  16          1HB       LYS  16 -15.275 -12.303   4.995
  122   1HG   LYS  16          2HG       LYS  16 -13.853 -12.233   7.034
  123   2HG   LYS  16          1HG       LYS  16 -12.429 -12.496   6.027
  124   1HD   LYS  16          2HD       LYS  16 -13.019 -10.421   4.749
  125   2HD   LYS  16          1HD       LYS  16 -14.328 -10.135   5.896
  126   1HE   LYS  16          2HE       LYS  16 -12.352 -10.462   7.662
  127   2HE   LYS  16          1HE       LYS  16 -11.372  -9.931   6.295
  128   1HZ   LYS  16          3HZ       LYS  16 -13.370  -8.176   6.196
  129   2HZ   LYS  16          2HZ       LYS  16 -13.312  -8.459   7.871
  130   3HZ   LYS  16          1HZ       LYS  16 -11.930  -7.906   7.052
  131    H    ARG  17           H        ARG  17 -14.668 -15.240   2.992
  132    HA   ARG  17           HA       ARG  17 -17.562 -15.183   2.832
  133   1HB   ARG  17          2HB       ARG  17 -15.428 -16.517   1.150
  134   2HB   ARG  17          1HB       ARG  17 -17.148 -16.627   0.777
  135   1HG   ARG  17          2HG       ARG  17 -17.200 -14.084   0.836
  136   2HG   ARG  17          1HG       ARG  17 -15.439 -14.132   0.893
  137   1HD   ARG  17          2HD       ARG  17 -15.549 -15.598  -1.198
  138   2HD   ARG  17          1HD       ARG  17 -17.251 -15.149  -1.302
  139    HE   ARG  17           HE       ARG  17 -16.366 -12.727  -1.354
  140   1HH1  ARG  17          1HH1      ARG  17 -13.706 -14.680  -1.413
  141   2HH1  ARG  17          2HH1      ARG  17 -13.096 -14.147  -2.944
  142   1HH2  ARG  17          1HH2      ARG  17 -15.956 -12.369  -3.764
  143   2HH2  ARG  17          2HH2      ARG  17 -14.370 -12.840  -4.275
  144    H    PHE  18           H        PHE  18 -15.139 -17.620   3.647
  145    HA   PHE  18           HA       PHE  18 -16.972 -19.844   3.707
  146   1HB   PHE  18          2HB       PHE  18 -14.239 -19.341   4.867
  147   2HB   PHE  18          1HB       PHE  18 -15.128 -20.812   5.262
  148    HD1  PHE  18           HD1      PHE  18 -16.147 -22.120   3.222
  149    HD2  PHE  18           HD2      PHE  18 -12.940 -19.277   2.919
  150    HE1  PHE  18           HE1      PHE  18 -15.470 -23.114   1.054
  151    HE2  PHE  18           HE2      PHE  18 -12.264 -20.273   0.750
  152    HZ   PHE  18           HZ       PHE  18 -13.528 -22.191  -0.182
  153    H    ASP  19           H        ASP  19 -15.730 -17.670   6.242
  154    HA   ASP  19           HA       ASP  19 -17.170 -18.919   8.388
  155   1HB   ASP  19          2HB       ASP  19 -15.251 -17.138   8.465
  156   2HB   ASP  19          1HB       ASP  19 -16.567 -15.967   8.352
  157    H    ALA  20           H        ALA  20 -19.366 -19.219   8.079
  158    HA   ALA  20           HA       ALA  20 -21.048 -17.415   6.634
  159   1HB   ALA  20          3HB       ALA  20 -21.481 -19.757   8.444
  160   2HB   ALA  20          1HB       ALA  20 -21.949 -19.543   6.756
  161   3HB   ALA  20          2HB       ALA  20 -22.862 -18.739   8.033
  162    H    ASN  21           H        ASN  21 -20.789 -17.939  10.199
  163    HA   ASN  21           HA       ASN  21 -22.472 -15.559  10.598
  164   1HB   ASN  21          2HB       ASN  21 -22.413 -16.091  12.948
  165   2HB   ASN  21          1HB       ASN  21 -22.667 -17.591  12.062
  166   1HD2  ASN  21          1HD2      ASN  21 -21.455 -17.161  14.758
  167   2HD2  ASN  21          2HD2      ASN  21 -19.917 -17.867  14.683
  168    H    GLY  22           H        GLY  22 -19.100 -16.388  10.602
  169   1HA   GLY  22          1HA       GLY  22 -18.448 -13.528  10.848
  170   2HA   GLY  22          2HA       GLY  22 -17.319 -14.808  10.417
  171    H    ASP  23           H        ASP  23 -17.712 -16.535  12.618
  172    HA   ASP  23           HA       ASP  23 -17.079 -14.822  14.968
  173   1HB   ASP  23          2HB       ASP  23 -17.364 -16.869  16.319
  174   2HB   ASP  23          1HB       ASP  23 -18.793 -16.543  15.344
  175    H    GLY  24           H        GLY  24 -15.406 -16.037  12.497
  176   1HA   GLY  24          1HA       GLY  24 -12.949 -16.255  14.130
  177   2HA   GLY  24          2HA       GLY  24 -13.006 -16.008  12.388
  178    H    LYS  25           H        LYS  25 -15.147 -18.466  13.378
  179    HA   LYS  25           HA       LYS  25 -13.124 -20.510  12.576
  180   1HB   LYS  25          2HB       LYS  25 -13.960 -22.040  14.205
  181   2HB   LYS  25          1HB       LYS  25 -13.777 -20.507  15.055
  182   1HG   LYS  25          2HG       LYS  25 -16.141 -20.047  14.860
  183   2HG   LYS  25          1HG       LYS  25 -16.374 -21.438  13.801
  184   1HD   LYS  25          2HD       LYS  25 -15.555 -22.902  15.687
  185   2HD   LYS  25          1HD       LYS  25 -15.589 -21.477  16.727
  186   1HE   LYS  25          2HE       LYS  25 -17.682 -22.948  16.782
  187   2HE   LYS  25          1HE       LYS  25 -17.951 -21.232  16.477
  188   1HZ   LYS  25          2HZ       LYS  25 -17.590 -23.149  14.261
  189   2HZ   LYS  25          1HZ       LYS  25 -19.114 -22.897  14.967
  190   3HZ   LYS  25          3HZ       LYS  25 -18.302 -21.607  14.224
  191    H    ILE  26           H        ILE  26 -13.819 -22.037  11.116
  192    HA   ILE  26           HA       ILE  26 -16.618 -21.718  10.107
  193    HB   ILE  26           HB       ILE  26 -14.404 -22.929   8.478
  194   1HG1  ILE  26          2HG1      ILE  26 -14.957 -19.969   8.845
  195   2HG1  ILE  26          1HG1      ILE  26 -13.473 -20.815   9.285
  196   1HG2  ILE  26          3HG2      ILE  26 -16.885 -21.302   7.841
  197   2HG2  ILE  26          2HG2      ILE  26 -15.765 -21.951   6.643
  198   3HG2  ILE  26          1HG2      ILE  26 -16.711 -23.047   7.648
  199   1HD1  ILE  26          2HD1      ILE  26 -13.998 -21.479   6.586
  200   2HD1  ILE  26          1HD1      ILE  26 -14.245 -19.738   6.725
  201   3HD1  ILE  26          3HD1      ILE  26 -12.704 -20.451   7.201
  202    H    SER  27           H        SER  27 -17.884 -23.508  10.102
  203    HA   SER  27           HA       SER  27 -16.643 -26.068  10.998
  204   1HB   SER  27          2HB       SER  27 -18.709 -26.634  11.998
  205   2HB   SER  27          1HB       SER  27 -18.542 -24.911  12.338
  206    HG   SER  27           HG       SER  27 -20.199 -26.225  10.501
  207    H    ALA  28           H        ALA  28 -17.891 -28.048  10.091
  208    HA   ALA  28           HA       ALA  28 -17.612 -28.172   7.305
  209   1HB   ALA  28          2HB       ALA  28 -19.432 -29.760   9.133
  210   2HB   ALA  28          3HB       ALA  28 -17.822 -30.217   8.575
  211   3HB   ALA  28          1HB       ALA  28 -19.169 -30.162   7.436
  212    H    ALA  29           H        ALA  29 -20.583 -27.568   9.178
  213    HA   ALA  29           HA       ALA  29 -22.345 -27.286   6.992
  214   1HB   ALA  29          2HB       ALA  29 -22.420 -26.794   9.796
  215   2HB   ALA  29          3HB       ALA  29 -23.782 -26.900   8.681
  216   3HB   ALA  29          1HB       ALA  29 -23.015 -25.343   8.989
  217    H    GLU  30           H        GLU  30 -20.135 -24.935   8.455
  218    HA   GLU  30           HA       GLU  30 -21.051 -22.777   6.726
  219   1HB   GLU  30          2HB       GLU  30 -18.560 -23.032   8.433
  220   2HB   GLU  30          1HB       GLU  30 -19.090 -21.552   7.634
  221   1HG   GLU  30          2HG       GLU  30 -21.234 -21.675   8.900
  222   2HG   GLU  30          1HG       GLU  30 -20.623 -23.095   9.748
  223    H    LEU  31           H        LEU  31 -18.023 -24.672   6.910
  224    HA   LEU  31           HA       LEU  31 -16.908 -23.664   4.499
  225   1HB   LEU  31          2HB       LEU  31 -15.763 -25.080   6.300
  226   2HB   LEU  31          1HB       LEU  31 -16.520 -26.479   5.542
  227    HG   LEU  31           HG       LEU  31 -14.940 -24.525   3.882
  228   1HD1  LEU  31          1HD1      LEU  31 -13.736 -25.607   6.024
  229   2HD1  LEU  31          3HD1      LEU  31 -13.604 -26.982   4.926
  230   3HD1  LEU  31          2HD1      LEU  31 -12.904 -25.425   4.480
  231   1HD2  LEU  31          2HD2      LEU  31 -15.692 -27.453   3.695
  232   2HD2  LEU  31          1HD2      LEU  31 -16.212 -26.139   2.638
  233   3HD2  LEU  31          3HD2      LEU  31 -14.535 -26.686   2.605
  234    H    GLY  32           H        GLY  32 -18.909 -26.542   5.110
  235   1HA   GLY  32          1HA       GLY  32 -20.208 -27.821   3.640
  236   2HA   GLY  32          2HA       GLY  32 -18.996 -27.460   2.414
  237    H    GLU  33           H        GLU  33 -21.114 -25.246   4.215
  238    HA   GLU  33           HA       GLU  33 -23.033 -24.796   2.192
  239   1HB   GLU  33          2HB       GLU  33 -22.063 -23.310   4.574
  240   2HB   GLU  33          1HB       GLU  33 -22.947 -22.370   3.373
  241   1HG   GLU  33          2HG       GLU  33 -24.719 -24.221   3.449
  242   2HG   GLU  33          1HG       GLU  33 -23.894 -24.808   4.894
  243    H    ALA  34           H        ALA  34 -19.936 -23.128   2.780
  244    HA   ALA  34           HA       ALA  34 -20.270 -21.323   0.548
  245   1HB   ALA  34          2HB       ALA  34 -18.588 -20.416   1.776
  246   2HB   ALA  34          1HB       ALA  34 -18.187 -21.964   2.517
  247   3HB   ALA  34          3HB       ALA  34 -17.539 -21.552   0.930
  248    H    LEU  35           H        LEU  35 -18.710 -24.463   1.010
  249    HA   LEU  35           HA       LEU  35 -17.449 -24.668  -1.516
  250   1HB   LEU  35          2HB       LEU  35 -18.439 -26.612   0.523
  251   2HB   LEU  35          1HB       LEU  35 -18.066 -27.238  -1.080
  252    HG   LEU  35           HG       LEU  35 -16.202 -25.765   0.800
  253   1HD1  LEU  35          3HD1      LEU  35 -16.680 -28.553   0.020
  254   2HD1  LEU  35          2HD1      LEU  35 -14.994 -28.069  -0.151
  255   3HD1  LEU  35          1HD1      LEU  35 -15.802 -27.912   1.408
  256   1HD2  LEU  35          3HD2      LEU  35 -15.981 -26.368  -2.145
  257   2HD2  LEU  35          2HD2      LEU  35 -15.598 -24.872  -1.295
  258   3HD2  LEU  35          1HD2      LEU  35 -14.537 -26.272  -1.138
  259    H    LYS  36           H        LYS  36 -20.822 -25.162  -0.578
  260    HA   LYS  36           HA       LYS  36 -21.883 -26.616  -2.658
  261   1HB   LYS  36          2HB       LYS  36 -22.837 -24.403  -0.975
  262   2HB   LYS  36          1HB       LYS  36 -23.673 -24.523  -2.523
  263   1HG   LYS  36          2HG       LYS  36 -24.089 -26.935  -2.081
  264   2HG   LYS  36          1HG       LYS  36 -23.317 -26.759  -0.505
  265   1HD   LYS  36          2HD       LYS  36 -25.717 -26.575  -0.198
  266   2HD   LYS  36          1HD       LYS  36 -25.006 -24.979   0.047
  267   1HE   LYS  36          2HE       LYS  36 -25.587 -25.326  -2.747
  268   2HE   LYS  36          1HE       LYS  36 -27.030 -25.711  -1.810
  269   1HZ   LYS  36          1HZ       LYS  36 -25.663 -23.394  -0.831
  270   2HZ   LYS  36          3HZ       LYS  36 -26.157 -23.212  -2.444
  271   3HZ   LYS  36          2HZ       LYS  36 -27.298 -23.591  -1.245
  272    H    THR  37           H        THR  37 -20.441 -23.437  -2.874
  273    HA   THR  37           HA       THR  37 -21.487 -22.454  -5.264
  274    HB   THR  37           HB       THR  37 -19.685 -21.424  -3.749
  275    HG1  THR  37           HG1      THR  37 -20.396 -20.673  -5.886
  276   1HG2  THR  37          3HG2      THR  37 -18.199 -23.498  -4.036
  277   2HG2  THR  37          2HG2      THR  37 -17.796 -22.847  -5.625
  278   3HG2  THR  37          1HG2      THR  37 -17.405 -21.929  -4.171
  279    H    LEU  38           H        LEU  38 -19.455 -25.221  -4.744
  280    HA   LEU  38           HA       LEU  38 -18.384 -25.527  -7.374
  281   1HB   LEU  38          2HB       LEU  38 -19.119 -27.553  -5.248
  282   2HB   LEU  38          1HB       LEU  38 -18.330 -27.998  -6.761
  283    HG   LEU  38           HG       LEU  38 -17.038 -25.732  -5.425
  284   1HD1  LEU  38          3HD1      LEU  38 -17.551 -28.289  -3.958
  285   2HD1  LEU  38          2HD1      LEU  38 -15.959 -27.547  -3.801
  286   3HD1  LEU  38          1HD1      LEU  38 -17.401 -26.649  -3.329
  287   1HD2  LEU  38          3HD2      LEU  38 -16.425 -27.955  -7.128
  288   2HD2  LEU  38          2HD2      LEU  38 -15.405 -26.574  -6.724
  289   3HD2  LEU  38          1HD2      LEU  38 -15.366 -28.023  -5.719
  290    H    GLY  39           H        GLY  39 -21.496 -26.427  -5.969
  291   1HA   GLY  39          1HA       GLY  39 -22.685 -26.568  -8.633
  292   2HA   GLY  39          2HA       GLY  39 -23.532 -26.820  -7.106
  293    H    SER  40           H        SER  40 -20.781 -28.700  -7.045
  294    HA   SER  40           HA       SER  40 -22.353 -31.133  -7.534
  295   1HB   SER  40          2HB       SER  40 -20.453 -30.056  -9.486
  296   2HB   SER  40          1HB       SER  40 -20.078 -31.711  -9.005
  297    HG   SER  40           HG       SER  40 -22.428 -32.066  -9.361
  298    H    ILE  41           H        ILE  41 -21.655 -30.844  -5.119
  299    HA   ILE  41           HA       ILE  41 -19.280 -32.556  -4.737
  300    HB   ILE  41           HB       ILE  41 -18.640 -30.037  -4.629
  301   1HG1  ILE  41          2HG1      ILE  41 -18.012 -31.671  -2.166
  302   2HG1  ILE  41          1HG1      ILE  41 -17.347 -32.067  -3.751
  303   1HG2  ILE  41          3HG2      ILE  41 -20.736 -29.677  -3.082
  304   2HG2  ILE  41          2HG2      ILE  41 -19.655 -30.244  -1.807
  305   3HG2  ILE  41          1HG2      ILE  41 -19.243 -28.801  -2.738
  306   1HD1  ILE  41          3HD1      ILE  41 -17.058 -29.379  -2.374
  307   2HD1  ILE  41          2HD1      ILE  41 -15.811 -30.625  -2.420
  308   3HD1  ILE  41          1HD1      ILE  41 -16.334 -29.844  -3.913
  309    H    THR  42           H        THR  42 -19.140 -33.217  -2.348
  310    HA   THR  42           HA       THR  42 -21.902 -33.345  -1.200
  311    HB   THR  42           HB       THR  42 -21.730 -35.598  -1.174
  312    HG1  THR  42           HG1      THR  42 -20.039 -36.553   0.052
  313   1HG2  THR  42          1HG2      THR  42 -20.342 -35.252  -3.224
  314   2HG2  THR  42          3HG2      THR  42 -18.901 -35.281  -2.206
  315   3HG2  THR  42          2HG2      THR  42 -19.913 -36.719  -2.343
  316    HA   PRO  43           HA       PRO  43 -20.274 -31.829   2.633
  317   1HB   PRO  43          2HB       PRO  43 -21.467 -33.399   4.481
  318   2HB   PRO  43          1HB       PRO  43 -22.345 -32.165   3.576
  319   1HG   PRO  43          2HG       PRO  43 -22.226 -35.121   3.130
  320   2HG   PRO  43          1HG       PRO  43 -23.617 -34.036   3.036
  321   1HD   PRO  43          1HD       PRO  43 -22.297 -34.922   0.833
  322   2HD   PRO  43          2HD       PRO  43 -23.096 -33.351   0.896
  323    H    ASP  44           H        ASP  44 -20.091 -35.289   2.017
  324    HA   ASP  44           HA       ASP  44 -18.298 -36.018   4.099
  325   1HB   ASP  44          2HB       ASP  44 -18.598 -37.134   1.295
  326   2HB   ASP  44          1HB       ASP  44 -17.666 -37.906   2.579
  327    H    GLU  45           H        GLU  45 -17.737 -34.362   1.045
  328    HA   GLU  45           HA       GLU  45 -14.832 -34.713   1.196
  329   1HB   GLU  45          2HB       GLU  45 -16.558 -32.892  -0.512
  330   2HB   GLU  45          1HB       GLU  45 -14.816 -33.088  -0.698
  331   1HG   GLU  45          2HG       GLU  45 -15.267 -35.590  -0.963
  332   2HG   GLU  45          1HG       GLU  45 -16.973 -35.169  -1.110
  333    H    VAL  46           H        VAL  46 -17.245 -32.311   2.053
  334    HA   VAL  46           HA       VAL  46 -15.413 -30.190   2.692
  335    HB   VAL  46           HB       VAL  46 -18.214 -30.810   3.660
  336   1HG1  VAL  46          2HG1      VAL  46 -16.299 -29.045   4.805
  337   2HG1  VAL  46          1HG1      VAL  46 -17.469 -28.047   3.941
  338   3HG1  VAL  46          3HG1      VAL  46 -18.017 -29.168   5.188
  339   1HG2  VAL  46          2HG2      VAL  46 -17.442 -30.059   1.199
  340   2HG2  VAL  46          1HG2      VAL  46 -18.940 -29.480   1.927
  341   3HG2  VAL  46          3HG2      VAL  46 -17.496 -28.470   1.961
  342    H    LYS  47           H        LYS  47 -16.706 -32.920   4.490
  343    HA   LYS  47           HA       LYS  47 -15.661 -32.103   7.061
  344   1HB   LYS  47          2HB       LYS  47 -17.418 -33.769   7.006
  345   2HB   LYS  47          1HB       LYS  47 -16.451 -34.821   5.972
  346   1HG   LYS  47          2HG       LYS  47 -14.797 -35.098   7.764
  347   2HG   LYS  47          1HG       LYS  47 -15.702 -33.990   8.794
  348   1HD   LYS  47          2HD       LYS  47 -16.478 -36.060   9.545
  349   2HD   LYS  47          1HD       LYS  47 -17.695 -35.649   8.336
  350   1HE   LYS  47          2HE       LYS  47 -15.434 -36.964   7.090
  351   2HE   LYS  47          1HE       LYS  47 -16.082 -37.958   8.396
  352   1HZ   LYS  47          2HZ       LYS  47 -18.338 -37.430   7.378
  353   2HZ   LYS  47          1HZ       LYS  47 -17.475 -36.928   6.003
  354   3HZ   LYS  47          3HZ       LYS  47 -17.346 -38.529   6.544
  355    H    HIS  48           H        HIS  48 -14.427 -34.054   4.388
  356    HA   HIS  48           HA       HIS  48 -12.024 -34.907   5.731
  357   1HB   HIS  48          2HB       HIS  48 -12.759 -36.084   3.743
  358   2HB   HIS  48          1HB       HIS  48 -12.685 -34.603   2.788
  359    HD1  HIS  48           HD1      HIS  48 -10.896 -35.771   1.223
  360    HD2  HIS  48           HD2      HIS  48  -9.672 -35.244   5.173
  361    HE1  HIS  48           HE1      HIS  48  -8.389 -36.133   1.250
  362    H    MET  49           H        MET  49 -12.835 -32.113   3.676
  363    HA   MET  49           HA       MET  49 -10.189 -31.062   3.484
  364   1HB   MET  49          2HB       MET  49 -12.951 -29.907   3.267
  365   2HB   MET  49          1HB       MET  49 -11.564 -28.821   3.324
  366   1HG   MET  49          2HG       MET  49 -10.613 -30.505   1.496
  367   2HG   MET  49          1HG       MET  49 -12.327 -30.819   1.230
  368   1HE   MET  49          1HE       MET  49 -12.873 -30.282  -0.579
  369   2HE   MET  49          3HE       MET  49 -13.438 -28.669  -1.037
  370   3HE   MET  49          2HE       MET  49 -11.891 -29.268  -1.632
  371    H    MET  50           H        MET  50 -12.810 -30.440   5.805
  372    HA   MET  50           HA       MET  50 -11.358 -28.595   7.426
  373   1HB   MET  50          2HB       MET  50 -13.716 -30.404   7.904
  374   2HB   MET  50          1HB       MET  50 -13.023 -29.466   9.224
  375   1HG   MET  50          2HG       MET  50 -13.221 -27.436   7.649
  376   2HG   MET  50          1HG       MET  50 -14.275 -28.456   6.670
  377   1HE   MET  50          3HE       MET  50 -13.442 -26.763   9.797
  378   2HE   MET  50          2HE       MET  50 -14.894 -26.673  10.789
  379   3HE   MET  50          1HE       MET  50 -13.945 -28.157  10.762
  380    H    ALA  51           H        ALA  51 -11.842 -32.112   7.734
  381    HA   ALA  51           HA       ALA  51 -10.260 -32.472  10.069
  382   1HB   ALA  51          2HB       ALA  51 -11.630 -34.296   9.295
  383   2HB   ALA  51          3HB       ALA  51  -9.953 -34.831   9.179
  384   3HB   ALA  51          1HB       ALA  51 -10.818 -34.317   7.730
  385    H    GLU  52           H        GLU  52  -9.378 -31.653   6.856
  386    HA   GLU  52           HA       GLU  52  -6.556 -32.485   7.296
  387   1HB   GLU  52          2HB       GLU  52  -8.165 -31.671   4.896
  388   2HB   GLU  52          1HB       GLU  52  -6.411 -31.494   4.858
  389   1HG   GLU  52          2HG       GLU  52  -6.418 -33.960   5.761
  390   2HG   GLU  52          1HG       GLU  52  -8.056 -33.999   5.107
  391    H    ILE  53           H        ILE  53  -8.587 -29.640   6.825
  392    HA   ILE  53           HA       ILE  53  -6.313 -27.798   6.909
  393    HB   ILE  53           HB       ILE  53  -9.300 -27.314   7.073
  394   1HG1  ILE  53          2HG1      ILE  53  -7.365 -27.031   4.759
  395   2HG1  ILE  53          1HG1      ILE  53  -8.496 -28.366   4.962
  396   1HG2  ILE  53          3HG2      ILE  53  -7.695 -25.545   8.020
  397   2HG2  ILE  53          2HG2      ILE  53  -7.144 -25.324   6.358
  398   3HG2  ILE  53          1HG2      ILE  53  -8.827 -25.008   6.780
  399   1HD1  ILE  53          3HD1      ILE  53 -10.371 -26.724   4.988
  400   2HD1  ILE  53          2HD1      ILE  53  -9.211 -25.436   4.660
  401   3HD1  ILE  53          1HD1      ILE  53  -9.478 -26.708   3.467
  402    H    ASP  54           H        ASP  54  -8.730 -29.065   9.128
  403    HA   ASP  54           HA       ASP  54  -8.434 -27.243  11.270
  404   1HB   ASP  54          2HB       ASP  54 -10.044 -29.287  10.876
  405   2HB   ASP  54          1HB       ASP  54  -8.792 -30.191  11.715
  406    H    THR  55           H        THR  55  -6.318 -26.675  11.785
  407    HA   THR  55           HA       THR  55  -4.137 -28.556  11.869
  408    HB   THR  55           HB       THR  55  -2.909 -26.707  12.996
  409    HG1  THR  55           HG1      THR  55  -4.107 -25.398  14.090
  410   1HG2  THR  55          1HG2      THR  55  -4.571 -26.126  10.546
  411   2HG2  THR  55          3HG2      THR  55  -3.365 -24.984  11.138
  412   3HG2  THR  55          2HG2      THR  55  -2.875 -26.601  10.630
  413    H    ASP  56           H        ASP  56  -6.092 -27.049  14.436
  414    HA   ASP  56           HA       ASP  56  -4.746 -28.722  16.454
  415   1HB   ASP  56          2HB       ASP  56  -6.686 -27.618  17.909
  416   2HB   ASP  56          1HB       ASP  56  -5.241 -26.709  17.470
  417    H    GLY  57           H        GLY  57  -7.794 -28.653  14.700
  418   1HA   GLY  57          1HA       GLY  57  -8.313 -31.394  15.688
  419   2HA   GLY  57          2HA       GLY  57  -9.109 -30.628  14.316
  420    H    ASP  58           H        ASP  58  -9.647 -28.145  15.933
  421    HA   ASP  58           HA       ASP  58 -11.396 -29.084  18.092
  422   1HB   ASP  58          2HB       ASP  58 -11.770 -26.799  18.601
  423   2HB   ASP  58          1HB       ASP  58 -10.088 -26.869  18.077
  424    H    GLY  59           H        GLY  59 -11.679 -29.016  14.787
  425   1HA   GLY  59          1HA       GLY  59 -14.642 -29.067  15.012
  426   2HA   GLY  59          2HA       GLY  59 -13.705 -29.806  13.717
  427    H    PHE  60           H        PHE  60 -12.506 -26.718  14.413
  428    HA   PHE  60           HA       PHE  60 -14.022 -25.639  12.079
  429   1HB   PHE  60          2HB       PHE  60 -13.264 -23.981  14.489
  430   2HB   PHE  60          1HB       PHE  60 -14.309 -23.521  13.145
  431    HD1  PHE  60           HD1      PHE  60 -16.461 -24.884  12.778
  432    HD2  PHE  60           HD2      PHE  60 -14.166 -25.012  16.402
  433    HE1  PHE  60           HE1      PHE  60 -18.426 -25.782  13.992
  434    HE2  PHE  60           HE2      PHE  60 -16.128 -25.909  17.616
  435    HZ   PHE  60           HZ       PHE  60 -18.262 -26.297  16.412
  436    H    ILE  61           H        ILE  61 -12.928 -23.967  10.880
  437    HA   ILE  61           HA       ILE  61  -9.971 -24.102  11.168
  438    HB   ILE  61           HB       ILE  61 -11.558 -23.217   8.747
  439   1HG1  ILE  61          2HG1      ILE  61 -12.120 -25.553   9.303
  440   2HG1  ILE  61          1HG1      ILE  61 -11.132 -25.477   7.845
  441   1HG2  ILE  61          2HG2      ILE  61  -9.107 -22.563   9.051
  442   2HG2  ILE  61          1HG2      ILE  61  -8.733 -24.282   8.932
  443   3HG2  ILE  61          3HG2      ILE  61  -9.487 -23.447   7.574
  444   1HD1  ILE  61          3HD1      ILE  61 -10.073 -26.024  10.635
  445   2HD1  ILE  61          2HD1      ILE  61 -10.356 -27.254   9.403
  446   3HD1  ILE  61          1HD1      ILE  61  -9.125 -26.016   9.148
  447    H    SER  62           H        SER  62  -8.952 -22.216  11.731
  448    HA   SER  62           HA       SER  62 -10.600 -19.768  11.959
  449   1HB   SER  62          2HB       SER  62  -7.750 -19.912  12.874
  450   2HB   SER  62          1HB       SER  62  -9.110 -19.050  13.591
  451    HG   SER  62           HG       SER  62  -9.970 -21.135  14.142
  452    H    PHE  63           H        PHE  63  -9.432 -17.690  11.311
  453    HA   PHE  63           HA       PHE  63  -8.769 -17.758   8.563
  454   1HB   PHE  63          2HB       PHE  63  -9.427 -15.676   9.729
  455   2HB   PHE  63          1HB       PHE  63  -7.903 -15.700  10.622
  456    HD1  PHE  63           HD1      PHE  63  -8.852 -16.340   7.055
  457    HD2  PHE  63           HD2      PHE  63  -6.408 -14.110   9.791
  458    HE1  PHE  63           HE1      PHE  63  -7.719 -15.243   5.147
  459    HE2  PHE  63           HE2      PHE  63  -5.270 -13.013   7.880
  460    HZ   PHE  63           HZ       PHE  63  -5.931 -13.578   5.555
  461    H    GLN  64           H        GLN  64  -6.677 -17.763  11.422
  462    HA   GLN  64           HA       GLN  64  -4.188 -17.699  10.031
  463   1HB   GLN  64          2HB       GLN  64  -4.547 -17.361  12.511
  464   2HB   GLN  64          1HB       GLN  64  -4.775 -19.104  12.652
  465   1HG   GLN  64          2HG       GLN  64  -2.312 -17.901  11.371
  466   2HG   GLN  64          1HG       GLN  64  -2.403 -18.230  13.101
  467   1HE2  GLN  64          1HE2      GLN  64  -0.847 -19.574  10.758
  468   2HE2  GLN  64          2HE2      GLN  64  -1.182 -21.225  10.961
  469    H    GLU  65           H        GLU  65  -6.158 -20.440  11.218
  470    HA   GLU  65           HA       GLU  65  -4.459 -22.530  10.326
  471   1HB   GLU  65          2HB       GLU  65  -7.396 -22.282  10.858
  472   2HB   GLU  65          1HB       GLU  65  -6.795 -23.740  10.080
  473   1HG   GLU  65          2HG       GLU  65  -5.209 -24.078  11.946
  474   2HG   GLU  65          1HG       GLU  65  -5.826 -22.624  12.729
  475    H    PHE  66           H        PHE  66  -7.185 -20.925   8.687
  476    HA   PHE  66           HA       PHE  66  -7.033 -22.384   6.254
  477   1HB   PHE  66          2HB       PHE  66  -8.900 -20.845   6.903
  478   2HB   PHE  66          1HB       PHE  66  -7.829 -19.478   6.592
  479    HD1  PHE  66           HD1      PHE  66  -7.082 -18.948   4.311
  480    HD2  PHE  66           HD2      PHE  66  -9.776 -22.205   5.083
  481    HE1  PHE  66           HE1      PHE  66  -7.634 -19.066   1.896
  482    HE2  PHE  66           HE2      PHE  66 -10.327 -22.322   2.669
  483    HZ   PHE  66           HZ       PHE  66  -9.257 -20.752   1.075
  484    H    THR  67           H        THR  67  -5.339 -19.473   7.337
  485    HA   THR  67           HA       THR  67  -4.035 -18.919   4.844
  486    HB   THR  67           HB       THR  67  -3.326 -18.253   7.712
  487    HG1  THR  67           HG1      THR  67  -4.920 -16.960   7.181
  488   1HG2  THR  67          3HG2      THR  67  -1.276 -18.377   6.313
  489   2HG2  THR  67          2HG2      THR  67  -2.010 -17.253   5.168
  490   3HG2  THR  67          1HG2      THR  67  -1.638 -16.724   6.809
  491    H    ASP  68           H        ASP  68  -2.997 -20.771   7.718
  492    HA   ASP  68           HA       ASP  68  -0.423 -21.487   6.746
  493   1HB   ASP  68          2HB       ASP  68  -1.288 -21.843   9.095
  494   2HB   ASP  68          1HB       ASP  68  -2.205 -23.217   8.479
  495    H    PHE  69           H        PHE  69  -3.588 -23.025   6.289
  496    HA   PHE  69           HA       PHE  69  -2.526 -25.268   4.800
  497   1HB   PHE  69          2HB       PHE  69  -4.585 -25.867   5.597
  498   2HB   PHE  69          1HB       PHE  69  -5.184 -24.211   5.579
  499    HD1  PHE  69           HD1      PHE  69  -5.727 -23.161   3.311
  500    HD2  PHE  69           HD2      PHE  69  -5.191 -27.376   3.895
  501    HE1  PHE  69           HE1      PHE  69  -6.938 -23.608   1.190
  502    HE2  PHE  69           HE2      PHE  69  -6.397 -27.829   1.781
  503    HZ   PHE  69           HZ       PHE  69  -7.275 -25.945   0.424
  504    H    GLY  70           H        GLY  70  -3.828 -22.089   3.981
  505   1HA   GLY  70          1HA       GLY  70  -3.744 -20.887   1.966
  506   2HA   GLY  70          2HA       GLY  70  -4.049 -22.431   1.171
  507    H    ARG  71           H        ARG  71  -1.251 -21.752   3.219
  508    HA   ARG  71           HA       ARG  71   0.572 -21.110   1.093
  509   1HB   ARG  71          2HB       ARG  71   1.071 -22.288   3.844
  510   2HB   ARG  71          1HB       ARG  71   2.337 -21.693   2.770
  511   1HG   ARG  71          2HG       ARG  71   1.176 -19.467   2.736
  512   2HG   ARG  71          1HG       ARG  71   0.049 -20.085   3.943
  513   1HD   ARG  71          2HD       ARG  71   3.059 -19.864   4.261
  514   2HD   ARG  71          1HD       ARG  71   1.857 -18.835   5.040
  515    HE   ARG  71           HE       ARG  71   1.594 -21.720   5.578
  516   1HH1  ARG  71          1HH1      ARG  71   0.420 -19.822   7.456
  517   2HH1  ARG  71          2HH1      ARG  71   1.606 -19.705   8.713
  518   1HH2  ARG  71          1HH2      ARG  71   4.158 -21.062   6.798
  519   2HH2  ARG  71          2HH2      ARG  71   3.721 -20.407   8.340
  520    H    ALA  72           H        ALA  72  -0.622 -24.125   2.417
  521    HA   ALA  72           HA       ALA  72   1.398 -25.810   1.196
  522   1HB   ALA  72          3HB       ALA  72   0.400 -27.254   2.611
  523   2HB   ALA  72          1HB       ALA  72  -0.980 -27.297   1.515
  524   3HB   ALA  72          2HB       ALA  72  -0.952 -26.145   2.850
  525    H    ASN  73           H        ASN  73  -1.486 -24.244   0.102
  526    HA   ASN  73           HA       ASN  73  -1.020 -25.300  -2.614
  527   1HB   ASN  73          2HB       ASN  73  -3.846 -25.371  -1.608
  528   2HB   ASN  73          1HB       ASN  73  -3.102 -26.299  -2.911
  529   1HD2  ASN  73          1HD2      ASN  73  -4.120 -26.493   0.323
  530   2HD2  ASN  73          2HD2      ASN  73  -3.265 -27.889   0.768
  531    H    ARG  74           H        ARG  74  -0.392 -22.816  -2.085
  532    HA   ARG  74           HA       ARG  74  -2.324 -20.795  -1.908
  533   1HB   ARG  74          2HB       ARG  74   0.243 -20.861  -3.522
  534   2HB   ARG  74          1HB       ARG  74  -0.710 -19.400  -3.256
  535   1HG   ARG  74          2HG       ARG  74  -0.511 -19.882  -0.759
  536   2HG   ARG  74          1HG       ARG  74   0.689 -21.105  -1.181
  537   1HD   ARG  74          2HD       ARG  74   0.841 -18.156  -1.885
  538   2HD   ARG  74          1HD       ARG  74   1.785 -18.965  -0.635
  539    HE   ARG  74           HE       ARG  74   2.605 -20.417  -2.676
  540   1HH1  ARG  74          1HH1      ARG  74   2.936 -17.168  -2.016
  541   2HH1  ARG  74          2HH1      ARG  74   3.479 -16.710  -3.595
  542   1HH2  ARG  74          1HH2      ARG  74   2.800 -19.800  -5.014
  543   2HH2  ARG  74          2HH2      ARG  74   3.402 -18.199  -5.293
  544    H    GLY  75           H        GLY  75  -1.261 -22.631  -4.733
  545   1HA   GLY  75          1HA       GLY  75  -2.248 -22.903  -6.828
  546   2HA   GLY  75          2HA       GLY  75  -2.736 -21.212  -6.705
  547    H    LEU  76           H        LEU  76  -3.698 -23.626  -4.349
  548    HA   LEU  76           HA       LEU  76  -6.232 -24.296  -5.530
  549   1HB   LEU  76          2HB       LEU  76  -5.133 -24.470  -2.725
  550   2HB   LEU  76          1HB       LEU  76  -6.799 -24.920  -3.087
  551    HG   LEU  76           HG       LEU  76  -4.327 -26.088  -4.403
  552   1HD1  LEU  76          3HD1      LEU  76  -5.476 -26.661  -1.914
  553   2HD1  LEU  76          2HD1      LEU  76  -6.107 -27.908  -2.990
  554   3HD1  LEU  76          1HD1      LEU  76  -4.366 -27.693  -2.816
  555   1HD2  LEU  76          3HD2      LEU  76  -7.243 -26.228  -4.968
  556   2HD2  LEU  76          2HD2      LEU  76  -5.875 -26.405  -6.067
  557   3HD2  LEU  76          1HD2      LEU  76  -6.360 -27.754  -5.040
  558    H    LEU  77           H        LEU  77  -5.297 -21.919  -3.054
  559    HA   LEU  77           HA       LEU  77  -7.909 -20.905  -2.557
  560   1HB   LEU  77          2HB       LEU  77  -5.253 -19.446  -2.434
  561   2HB   LEU  77          1HB       LEU  77  -6.756 -18.899  -1.690
  562    HG   LEU  77           HG       LEU  77  -5.150 -21.375  -1.012
  563   1HD1  LEU  77          1HD1      LEU  77  -5.793 -18.760   0.292
  564   2HD1  LEU  77          3HD1      LEU  77  -5.617 -20.180   1.323
  565   3HD1  LEU  77          2HD1      LEU  77  -4.282 -19.668   0.291
  566   1HD2  LEU  77          2HD2      LEU  77  -7.984 -20.605  -0.290
  567   2HD2  LEU  77          1HD2      LEU  77  -7.415 -22.123  -0.982
  568   3HD2  LEU  77          3HD2      LEU  77  -7.035 -21.720   0.693
  569    H    LYS  78           H        LYS  78  -5.509 -20.080  -5.025
  570    HA   LYS  78           HA       LYS  78  -6.831 -17.767  -6.055
  571   1HB   LYS  78          2HB       LYS  78  -5.081 -19.798  -7.476
  572   2HB   LYS  78          1HB       LYS  78  -5.534 -18.225  -8.131
  573   1HG   LYS  78          2HG       LYS  78  -4.536 -17.229  -5.980
  574   2HG   LYS  78          1HG       LYS  78  -3.819 -18.819  -5.713
  575   1HD   LYS  78          2HD       LYS  78  -3.439 -17.128  -8.205
  576   2HD   LYS  78          1HD       LYS  78  -2.260 -17.297  -6.904
  577   1HE   LYS  78          2HE       LYS  78  -1.722 -19.465  -7.489
  578   2HE   LYS  78          1HE       LYS  78  -3.329 -19.801  -8.132
  579   1HZ   LYS  78          1HZ       LYS  78  -1.568 -17.850  -9.464
  580   2HZ   LYS  78          3HZ       LYS  78  -1.376 -19.510  -9.756
  581   3HZ   LYS  78          2HZ       LYS  78  -2.853 -18.750 -10.115
  582    H    ASP  79           H        ASP  79  -7.497 -21.168  -6.372
  583    HA   ASP  79           HA       ASP  79  -9.165 -20.892  -8.748
  584   1HB   ASP  79          2HB       ASP  79  -8.060 -23.034  -8.190
  585   2HB   ASP  79          1HB       ASP  79  -9.011 -23.132  -6.708
  586    H    VAL  80           H        VAL  80  -9.683 -20.969  -5.253
  587    HA   VAL  80           HA       VAL  80 -12.601 -20.885  -5.556
  588    HB   VAL  80           HB       VAL  80 -11.028 -20.340  -3.032
  589   1HG1  VAL  80          2HG1      VAL  80 -13.809 -20.610  -3.736
  590   2HG1  VAL  80          1HG1      VAL  80 -13.354 -21.910  -2.634
  591   3HG1  VAL  80          3HG1      VAL  80 -13.102 -20.228  -2.166
  592   1HG2  VAL  80          3HG2      VAL  80 -11.743 -22.984  -4.325
  593   2HG2  VAL  80          2HG2      VAL  80 -10.134 -22.406  -3.895
  594   3HG2  VAL  80          1HG2      VAL  80 -11.289 -22.826  -2.629
  595    H    ALA  81           H        ALA  81  -9.959 -18.631  -5.055
  596    HA   ALA  81           HA       ALA  81 -11.466 -16.393  -4.136
  597   1HB   ALA  81          2HB       ALA  81  -9.581 -15.066  -4.727
  598   2HB   ALA  81          1HB       ALA  81  -8.917 -16.638  -4.280
  599   3HB   ALA  81          3HB       ALA  81  -9.081 -16.201  -5.981
  600    H    LYS  82           H        LYS  82 -11.424 -17.967  -7.188
  601    HA   LYS  82           HA       LYS  82 -12.477 -15.573  -8.591
  602   1HB   LYS  82          2HB       LYS  82 -11.920 -18.369  -9.634
  603   2HB   LYS  82          1HB       LYS  82 -12.351 -16.966 -10.612
  604   1HG   LYS  82          2HG       LYS  82 -10.284 -15.845  -9.478
  605   2HG   LYS  82          1HG       LYS  82  -9.805 -17.498  -9.093
  606   1HD   LYS  82          2HD       LYS  82  -9.974 -18.090 -11.496
  607   2HD   LYS  82          1HD       LYS  82 -10.407 -16.421 -11.866
  608   1HE   LYS  82          2HE       LYS  82  -7.948 -16.764 -10.251
  609   2HE   LYS  82          1HE       LYS  82  -7.851 -17.359 -11.908
  610   1HZ   LYS  82          2HZ       LYS  82  -9.060 -14.733 -11.452
  611   2HZ   LYS  82          1HZ       LYS  82  -7.370 -14.863 -11.330
  612   3HZ   LYS  82          3HZ       LYS  82  -8.149 -15.292 -12.773
  613    H    ILE  83           H        ILE  83 -13.484 -18.679  -7.308
  614    HA   ILE  83           HA       ILE  83 -16.010 -18.911  -8.582
  615    HB   ILE  83           HB       ILE  83 -15.166 -19.739  -5.790
  616   1HG1  ILE  83          2HG1      ILE  83 -15.131 -21.082  -8.498
  617   2HG1  ILE  83          1HG1      ILE  83 -13.794 -20.868  -7.371
  618   1HG2  ILE  83          1HG2      ILE  83 -17.748 -19.604  -6.835
  619   2HG2  ILE  83          3HG2      ILE  83 -17.276 -21.285  -7.088
  620   3HG2  ILE  83          2HG2      ILE  83 -17.233 -20.591  -5.467
  621   1HD1  ILE  83          1HD1      ILE  83 -14.992 -22.360  -5.749
  622   2HD1  ILE  83          3HD1      ILE  83 -16.215 -22.654  -6.985
  623   3HD1  ILE  83          2HD1      ILE  83 -14.551 -23.177  -7.249
  624    H    PHE  84           H        PHE  84 -14.988 -17.048  -5.764
  625    HA   PHE  84           HA       PHE  84 -17.755 -16.054  -5.377
  626   1HB   PHE  84          2HB       PHE  84 -15.205 -15.544  -3.816
  627   2HB   PHE  84          1HB       PHE  84 -16.797 -14.924  -3.379
  628    HD1  PHE  84           HD1      PHE  84 -14.719 -17.966  -3.715
  629    HD2  PHE  84           HD2      PHE  84 -18.512 -16.374  -2.473
  630    HE1  PHE  84           HE1      PHE  84 -15.242 -20.101  -2.566
  631    HE2  PHE  84           HE2      PHE  84 -19.032 -18.509  -1.324
  632    HZ   PHE  84           HZ       PHE  84 -17.397 -20.373  -1.370

  No H/Q in entry =         632
  Start of MODEL   10
    1    H1   ALA   1          1H        ALA   1  10.365 -15.563  -1.348
    2    H2   ALA   1          3H        ALA   1  11.445 -15.700  -0.047
    3    H3   ALA   1          2H        ALA   1   9.909 -16.420   0.046
    4    HA   ALA   1           HA       ALA   1   9.487 -14.562   1.256
    5   1HB   ALA   1          2HB       ALA   1  10.838 -12.704   1.278
    6   2HB   ALA   1          1HB       ALA   1  11.959 -13.810   0.485
    7   3HB   ALA   1          3HB       ALA   1  11.008 -12.679  -0.477
    8    H    ASP   2           H        ASP   2   8.352 -15.620  -1.313
    9    HA   ASP   2           HA       ASP   2   7.331 -13.273  -2.729
   10   1HB   ASP   2          2HB       ASP   2   6.509 -16.192  -2.859
   11   2HB   ASP   2          1HB       ASP   2   5.961 -14.931  -3.965
   12    H    ASP   3           H        ASP   3   6.583 -14.727   0.202
   13    HA   ASP   3           HA       ASP   3   3.679 -14.343   0.074
   14   1HB   ASP   3          2HB       ASP   3   4.891 -16.070   1.524
   15   2HB   ASP   3          1HB       ASP   3   5.354 -14.723   2.565
   16    H    HIS   4           H        HIS   4   3.003 -12.241  -0.058
   17    HA   HIS   4           HA       HIS   4   4.348 -10.249   1.725
   18   1HB   HIS   4          2HB       HIS   4   2.615  -9.008  -0.217
   19   2HB   HIS   4          1HB       HIS   4   4.353  -8.816  -0.015
   20    HD1  HIS   4           HD1      HIS   4   1.790 -10.616  -2.043
   21    HD2  HIS   4           HD2      HIS   4   5.943 -10.537  -1.685
   22    HE1  HIS   4           HE1      HIS   4   2.706 -11.850  -4.056
   23    HA   PRO   5           HA       PRO   5   0.587  -9.444   3.924
   24   1HB   PRO   5          2HB       PRO   5   0.226  -6.769   3.779
   25   2HB   PRO   5          1HB       PRO   5   1.488  -7.513   4.764
   26   1HG   PRO   5          2HG       PRO   5   1.687  -6.277   2.043
   27   2HG   PRO   5          1HG       PRO   5   2.777  -6.106   3.422
   28   1HD   PRO   5          1HD       PRO   5   3.329  -7.762   1.362
   29   2HD   PRO   5          2HD       PRO   5   3.817  -8.134   3.015
   30    H    GLN   6           H        GLN   6   0.758  -8.253   0.642
   31    HA   GLN   6           HA       GLN   6  -1.969  -7.473   0.311
   32   1HB   GLN   6          2HB       GLN   6   0.253  -8.306  -1.510
   33   2HB   GLN   6          1HB       GLN   6  -1.384  -8.261  -2.161
   34   1HG   GLN   6          2HG       GLN   6  -1.629  -5.942  -1.655
   35   2HG   GLN   6          1HG       GLN   6  -0.198  -5.944  -0.624
   36   1HE2  GLN   6          1HE2      GLN   6   1.930  -6.495  -1.830
   37   2HE2  GLN   6          2HE2      GLN   6   2.090  -5.922  -3.421
   38    H    ASP   7           H        ASP   7  -0.343 -10.598   0.155
   39    HA   ASP   7           HA       ASP   7  -2.467 -12.098  -1.012
   40   1HB   ASP   7          2HB       ASP   7  -0.302 -12.893   0.950
   41   2HB   ASP   7          1HB       ASP   7  -1.407 -14.050   0.208
   42    H    LYS   8           H        LYS   8  -1.708 -11.418   2.397
   43    HA   LYS   8           HA       LYS   8  -3.721 -12.880   3.655
   44   1HB   LYS   8          2HB       LYS   8  -2.495 -10.199   4.269
   45   2HB   LYS   8          1HB       LYS   8  -3.770 -10.860   5.294
   46   1HG   LYS   8          2HG       LYS   8  -2.406 -12.968   5.486
   47   2HG   LYS   8          1HG       LYS   8  -1.099 -12.133   4.649
   48   1HD   LYS   8          2HD       LYS   8  -0.599 -11.820   6.942
   49   2HD   LYS   8          1HD       LYS   8  -1.367 -10.307   6.460
   50   1HE   LYS   8          2HE       LYS   8  -3.543 -11.176   7.306
   51   2HE   LYS   8          1HE       LYS   8  -2.720 -12.636   7.856
   52   1HZ   LYS   8          3HZ       LYS   8  -1.221 -10.594   8.867
   53   2HZ   LYS   8          2HZ       LYS   8  -2.819 -10.045   9.056
   54   3HZ   LYS   8          1HZ       LYS   8  -2.342 -11.530   9.730
   55    H    ALA   9           H        ALA   9  -3.998  -9.796   1.950
   56    HA   ALA   9           HA       ALA   9  -6.664  -9.166   2.713
   57   1HB   ALA   9          3HB       ALA   9  -4.750  -8.212   0.805
   58   2HB   ALA   9          1HB       ALA   9  -6.197  -7.396   1.398
   59   3HB   ALA   9          2HB       ALA   9  -6.291  -8.437  -0.023
   60    H    GLU  10           H        GLU  10  -5.419 -11.063  -0.019
   61    HA   GLU  10           HA       GLU  10  -8.027 -11.772  -1.026
   62   1HB   GLU  10          2HB       GLU  10  -5.453 -13.341  -1.350
   63   2HB   GLU  10          1HB       GLU  10  -6.863 -13.379  -2.409
   64   1HG   GLU  10          2HG       GLU  10  -6.481 -10.876  -2.771
   65   2HG   GLU  10          1HG       GLU  10  -4.918 -11.099  -1.985
   66    H    ARG  11           H        ARG  11  -5.768 -13.282   1.237
   67    HA   ARG  11           HA       ARG  11  -7.279 -15.708   1.594
   68   1HB   ARG  11          2HB       ARG  11  -5.249 -14.297   3.342
   69   2HB   ARG  11          1HB       ARG  11  -5.936 -15.870   3.735
   70   1HG   ARG  11          2HG       ARG  11  -5.174 -16.593   1.381
   71   2HG   ARG  11          1HG       ARG  11  -4.204 -15.120   1.376
   72   1HD   ARG  11          2HD       ARG  11  -3.367 -15.977   3.704
   73   2HD   ARG  11          1HD       ARG  11  -3.961 -17.541   3.144
   74    HE   ARG  11           HE       ARG  11  -1.737 -16.003   1.916
   75   1HH1  ARG  11          1HH1      ARG  11  -3.446 -17.536  -0.070
   76   2HH1  ARG  11          2HH1      ARG  11  -2.602 -19.047  -0.151
   77   1HH2  ARG  11          1HH2      ARG  11  -0.780 -18.487   2.746
   78   2HH2  ARG  11          2HH2      ARG  11  -1.095 -19.585   1.444
   79    H    GLU  12           H        GLU  12  -7.218 -12.600   3.280
   80    HA   GLU  12           HA       GLU  12  -9.059 -13.333   5.357
   81   1HB   GLU  12          2HB       GLU  12  -7.970 -10.789   4.251
   82   2HB   GLU  12          1HB       GLU  12  -9.465 -10.681   5.178
   83   1HG   GLU  12          2HG       GLU  12  -8.352 -11.965   7.020
   84   2HG   GLU  12          1HG       GLU  12  -6.846 -11.896   6.104
   85    H    ARG  13           H        ARG  13  -9.503 -11.887   2.149
   86    HA   ARG  13           HA       ARG  13 -12.344 -11.507   2.422
   87   1HB   ARG  13          2HB       ARG  13 -10.662 -11.865  -0.076
   88   2HB   ARG  13          1HB       ARG  13 -12.321 -11.270  -0.042
   89   1HG   ARG  13          2HG       ARG  13 -11.693  -9.303   1.149
   90   2HG   ARG  13          1HG       ARG  13 -10.104  -9.956   1.540
   91   1HD   ARG  13          2HD       ARG  13  -9.685  -8.464  -0.250
   92   2HD   ARG  13          1HD       ARG  13  -9.730 -10.051  -1.018
   93    HE   ARG  13           HE       ARG  13 -11.489  -9.163  -2.297
   94   1HH1  ARG  13          1HH1      ARG  13 -13.439  -9.506  -0.079
   95   2HH1  ARG  13          2HH1      ARG  13 -14.054  -7.900   0.133
   96   1HH2  ARG  13          1HH2      ARG  13 -11.459  -6.394  -1.605
   97   2HH2  ARG  13          2HH2      ARG  13 -12.933  -6.139  -0.731
   98    H    ILE  14           H        ILE  14 -10.347 -14.139   1.142
   99    HA   ILE  14           HA       ILE  14 -12.600 -15.736   0.281
  100    HB   ILE  14           HB       ILE  14  -9.784 -16.616   0.990
  101   1HG1  ILE  14          2HG1      ILE  14 -10.818 -16.088  -1.784
  102   2HG1  ILE  14          1HG1      ILE  14 -10.185 -14.763  -0.813
  103   1HG2  ILE  14          2HG2      ILE  14 -12.081 -17.889  -0.504
  104   2HG2  ILE  14          1HG2      ILE  14 -10.413 -18.409  -0.749
  105   3HG2  ILE  14          3HG2      ILE  14 -11.158 -18.550   0.844
  106   1HD1  ILE  14          1HD1      ILE  14  -8.611 -17.313  -1.116
  107   2HD1  ILE  14          3HD1      ILE  14  -8.541 -16.069  -2.366
  108   3HD1  ILE  14          2HD1      ILE  14  -8.030 -15.695  -0.720
  109    H    PHE  15           H        PHE  15 -10.555 -15.689   3.207
  110    HA   PHE  15           HA       PHE  15 -11.905 -17.900   4.465
  111   1HB   PHE  15          2HB       PHE  15  -9.672 -17.109   5.203
  112   2HB   PHE  15          1HB       PHE  15 -10.402 -15.605   5.769
  113    HD1  PHE  15           HD1      PHE  15 -11.880 -15.585   7.733
  114    HD2  PHE  15           HD2      PHE  15 -10.083 -19.228   6.341
  115    HE1  PHE  15           HE1      PHE  15 -12.507 -16.708   9.857
  116    HE2  PHE  15           HE2      PHE  15 -10.706 -20.350   8.462
  117    HZ   PHE  15           HZ       PHE  15 -11.923 -19.095  10.221
  118    H    LYS  16           H        LYS  16 -12.432 -14.409   4.434
  119    HA   LYS  16           HA       LYS  16 -14.445 -14.366   6.484
  120   1HB   LYS  16          2HB       LYS  16 -13.706 -12.536   4.211
  121   2HB   LYS  16          1HB       LYS  16 -15.169 -12.235   5.147
  122   1HG   LYS  16          2HG       LYS  16 -13.861 -12.166   7.217
  123   2HG   LYS  16          1HG       LYS  16 -12.390 -12.550   6.323
  124   1HD   LYS  16          2HD       LYS  16 -12.689 -10.460   4.999
  125   2HD   LYS  16          1HD       LYS  16 -14.101 -10.068   5.980
  126   1HE   LYS  16          2HE       LYS  16 -12.625 -10.183   8.017
  127   2HE   LYS  16          1HE       LYS  16 -11.241 -10.364   6.939
  128   1HZ   LYS  16          1HZ       LYS  16 -11.813  -8.259   5.906
  129   2HZ   LYS  16          3HZ       LYS  16 -13.143  -8.084   6.943
  130   3HZ   LYS  16          2HZ       LYS  16 -11.566  -8.059   7.575
  131    H    ARG  17           H        ARG  17 -14.489 -15.142   3.066
  132    HA   ARG  17           HA       ARG  17 -17.365 -15.022   2.761
  133   1HB   ARG  17          2HB       ARG  17 -15.138 -16.317   1.184
  134   2HB   ARG  17          1HB       ARG  17 -16.830 -16.547   0.743
  135   1HG   ARG  17          2HG       ARG  17 -16.964 -13.943   0.888
  136   2HG   ARG  17          1HG       ARG  17 -15.208 -14.010   0.752
  137   1HD   ARG  17          2HD       ARG  17 -15.650 -15.576  -1.278
  138   2HD   ARG  17          1HD       ARG  17 -17.285 -14.918  -1.233
  139    HE   ARG  17           HE       ARG  17 -16.190 -12.641  -1.486
  140   1HH1  ARG  17          1HH1      ARG  17 -13.631 -14.696  -1.380
  141   2HH1  ARG  17          2HH1      ARG  17 -12.988 -14.315  -2.942
  142   1HH2  ARG  17          1HH2      ARG  17 -15.772 -12.507  -3.941
  143   2HH2  ARG  17          2HH2      ARG  17 -14.200 -13.076  -4.393
  144    H    PHE  18           H        PHE  18 -15.045 -17.536   3.647
  145    HA   PHE  18           HA       PHE  18 -16.961 -19.695   3.640
  146   1HB   PHE  18          2HB       PHE  18 -14.236 -19.315   4.870
  147   2HB   PHE  18          1HB       PHE  18 -15.184 -20.769   5.183
  148    HD1  PHE  18           HD1      PHE  18 -16.166 -21.980   3.073
  149    HD2  PHE  18           HD2      PHE  18 -12.890 -19.203   2.958
  150    HE1  PHE  18           HE1      PHE  18 -15.451 -22.913   0.890
  151    HE2  PHE  18           HE2      PHE  18 -12.176 -20.137   0.774
  152    HZ   PHE  18           HZ       PHE  18 -13.457 -21.992  -0.259
  153    H    ASP  19           H        ASP  19 -15.609 -17.676   6.253
  154    HA   ASP  19           HA       ASP  19 -17.120 -18.844   8.368
  155   1HB   ASP  19          2HB       ASP  19 -15.186 -17.073   8.437
  156   2HB   ASP  19          1HB       ASP  19 -16.496 -15.897   8.316
  157    H    ALA  20           H        ALA  20 -19.313 -19.126   8.045
  158    HA   ALA  20           HA       ALA  20 -20.965 -17.318   6.568
  159   1HB   ALA  20          2HB       ALA  20 -21.467 -19.736   6.999
  160   2HB   ALA  20          1HB       ALA  20 -21.842 -19.313   8.669
  161   3HB   ALA  20          3HB       ALA  20 -22.818 -18.659   7.354
  162    H    ASN  21           H        ASN  21 -20.732 -17.818  10.136
  163    HA   ASN  21           HA       ASN  21 -22.406 -15.418  10.498
  164   1HB   ASN  21          2HB       ASN  21 -22.364 -15.948  12.869
  165   2HB   ASN  21          1HB       ASN  21 -22.725 -17.409  11.956
  166   1HD2  ASN  21          1HD2      ASN  21 -21.532 -17.206  14.647
  167   2HD2  ASN  21          2HD2      ASN  21 -20.027 -17.979  14.560
  168    H    GLY  22           H        GLY  22 -19.037 -16.333  10.711
  169   1HA   GLY  22          1HA       GLY  22 -18.369 -13.464  11.009
  170   2HA   GLY  22          2HA       GLY  22 -17.245 -14.736  10.542
  171    H    ASP  23           H        ASP  23 -17.922 -16.524  12.732
  172    HA   ASP  23           HA       ASP  23 -17.262 -14.950  15.150
  173   1HB   ASP  23          2HB       ASP  23 -17.518 -17.087  16.369
  174   2HB   ASP  23          1HB       ASP  23 -18.941 -16.721  15.398
  175    H    GLY  24           H        GLY  24 -15.517 -16.026  12.648
  176   1HA   GLY  24          1HA       GLY  24 -13.081 -16.244  14.313
  177   2HA   GLY  24          2HA       GLY  24 -13.118 -15.949  12.577
  178    H    LYS  25           H        LYS  25 -15.251 -18.448  13.330
  179    HA   LYS  25           HA       LYS  25 -13.173 -20.447  12.564
  180   1HB   LYS  25          2HB       LYS  25 -14.118 -22.060  14.096
  181   2HB   LYS  25          1HB       LYS  25 -13.801 -20.582  15.006
  182   1HG   LYS  25          2HG       LYS  25 -16.104 -19.963  14.978
  183   2HG   LYS  25          1HG       LYS  25 -16.491 -21.176  13.757
  184   1HD   LYS  25          2HD       LYS  25 -15.604 -22.882  15.526
  185   2HD   LYS  25          1HD       LYS  25 -15.858 -21.568  16.676
  186   1HE   LYS  25          2HE       LYS  25 -18.213 -21.446  15.384
  187   2HE   LYS  25          1HE       LYS  25 -17.856 -23.155  15.136
  188   1HZ   LYS  25          2HZ       LYS  25 -17.477 -23.345  17.544
  189   2HZ   LYS  25          1HZ       LYS  25 -17.962 -21.728  17.736
  190   3HZ   LYS  25          3HZ       LYS  25 -19.068 -22.882  17.169
  191    H    ILE  26           H        ILE  26 -13.821 -21.978  11.081
  192    HA   ILE  26           HA       ILE  26 -16.576 -21.639   9.963
  193    HB   ILE  26           HB       ILE  26 -14.275 -22.871   8.465
  194   1HG1  ILE  26          2HG1      ILE  26 -14.932 -19.922   8.724
  195   2HG1  ILE  26          1HG1      ILE  26 -13.441 -20.710   9.239
  196   1HG2  ILE  26          2HG2      ILE  26 -16.573 -23.068   7.568
  197   2HG2  ILE  26          1HG2      ILE  26 -16.740 -21.313   7.625
  198   3HG2  ILE  26          3HG2      ILE  26 -15.570 -22.052   6.533
  199   1HD1  ILE  26          1HD1      ILE  26 -13.993 -21.369   6.485
  200   2HD1  ILE  26          3HD1      ILE  26 -14.012 -19.619   6.694
  201   3HD1  ILE  26          2HD1      ILE  26 -12.587 -20.547   7.162
  202    H    SER  27           H        SER  27 -17.873 -23.416   9.924
  203    HA   SER  27           HA       SER  27 -16.700 -25.980  10.897
  204   1HB   SER  27          2HB       SER  27 -18.779 -26.490  11.852
  205   2HB   SER  27          1HB       SER  27 -18.688 -24.743  12.080
  206    HG   SER  27           HG       SER  27 -20.314 -24.519  10.795
  207    H    ALA  28           H        ALA  28 -17.819 -27.967   9.916
  208    HA   ALA  28           HA       ALA  28 -17.453 -28.064   7.143
  209   1HB   ALA  28          2HB       ALA  28 -19.424 -29.946   7.520
  210   2HB   ALA  28          3HB       ALA  28 -18.783 -29.761   9.151
  211   3HB   ALA  28          1HB       ALA  28 -17.709 -30.220   7.830
  212    H    ALA  29           H        ALA  29 -20.471 -27.476   8.937
  213    HA   ALA  29           HA       ALA  29 -22.190 -27.252   6.703
  214   1HB   ALA  29          2HB       ALA  29 -22.516 -27.023   9.404
  215   2HB   ALA  29          3HB       ALA  29 -23.747 -26.571   8.224
  216   3HB   ALA  29          1HB       ALA  29 -22.683 -25.340   8.904
  217    H    GLU  30           H        GLU  30 -20.079 -24.836   8.224
  218    HA   GLU  30           HA       GLU  30 -20.989 -22.698   6.483
  219   1HB   GLU  30          2HB       GLU  30 -18.527 -22.952   8.232
  220   2HB   GLU  30          1HB       GLU  30 -19.001 -21.476   7.391
  221   1HG   GLU  30          2HG       GLU  30 -21.177 -21.520   8.598
  222   2HG   GLU  30          1HG       GLU  30 -20.640 -22.951   9.477
  223    H    LEU  31           H        LEU  31 -17.946 -24.575   6.646
  224    HA   LEU  31           HA       LEU  31 -16.883 -23.523   4.209
  225   1HB   LEU  31          2HB       LEU  31 -15.407 -24.695   5.719
  226   2HB   LEU  31          1HB       LEU  31 -16.400 -26.151   5.644
  227    HG   LEU  31           HG       LEU  31 -15.916 -26.236   3.160
  228   1HD1  LEU  31          3HD1      LEU  31 -13.941 -24.075   3.955
  229   2HD1  LEU  31          2HD1      LEU  31 -13.909 -24.938   2.418
  230   3HD1  LEU  31          1HD1      LEU  31 -15.281 -23.908   2.821
  231   1HD2  LEU  31          2HD2      LEU  31 -14.319 -27.000   5.376
  232   2HD2  LEU  31          1HD2      LEU  31 -14.336 -27.721   3.767
  233   3HD2  LEU  31          3HD2      LEU  31 -13.211 -26.413   4.135
  234    H    GLY  32           H        GLY  32 -18.869 -26.385   4.896
  235   1HA   GLY  32          1HA       GLY  32 -20.110 -27.754   3.450
  236   2HA   GLY  32          2HA       GLY  32 -18.913 -27.380   2.212
  237    H    GLU  33           H        GLU  33 -21.121 -25.219   3.990
  238    HA   GLU  33           HA       GLU  33 -23.019 -24.857   1.925
  239   1HB   GLU  33          2HB       GLU  33 -22.161 -23.307   4.316
  240   2HB   GLU  33          1HB       GLU  33 -23.094 -22.441   3.098
  241   1HG   GLU  33          2HG       GLU  33 -24.767 -24.353   3.181
  242   2HG   GLU  33          1HG       GLU  33 -23.896 -24.947   4.595
  243    H    ALA  34           H        ALA  34 -19.985 -23.106   2.564
  244    HA   ALA  34           HA       ALA  34 -20.351 -21.329   0.296
  245   1HB   ALA  34          2HB       ALA  34 -18.774 -20.294   1.562
  246   2HB   ALA  34          1HB       ALA  34 -18.325 -21.797   2.370
  247   3HB   ALA  34          3HB       ALA  34 -17.627 -21.396   0.800
  248    H    LEU  35           H        LEU  35 -18.616 -24.346   0.914
  249    HA   LEU  35           HA       LEU  35 -17.282 -24.537  -1.594
  250   1HB   LEU  35          2HB       LEU  35 -18.065 -26.437   0.562
  251   2HB   LEU  35          1HB       LEU  35 -17.654 -27.129  -1.007
  252    HG   LEU  35           HG       LEU  35 -15.921 -25.266   0.643
  253   1HD1  LEU  35          1HD1      LEU  35 -16.063 -28.206   0.224
  254   2HD1  LEU  35          3HD1      LEU  35 -14.451 -27.492   0.223
  255   3HD1  LEU  35          2HD1      LEU  35 -15.502 -27.296   1.626
  256   1HD2  LEU  35          1HD2      LEU  35 -15.763 -26.266  -2.177
  257   2HD2  LEU  35          3HD2      LEU  35 -15.326 -24.686  -1.527
  258   3HD2  LEU  35          2HD2      LEU  35 -14.267 -26.071  -1.265
  259    H    LYS  36           H        LYS  36 -20.591 -25.341  -0.627
  260    HA   LYS  36           HA       LYS  36 -21.423 -26.975  -2.715
  261   1HB   LYS  36          2HB       LYS  36 -22.687 -25.127  -0.879
  262   2HB   LYS  36          1HB       LYS  36 -23.468 -25.050  -2.459
  263   1HG   LYS  36          2HG       LYS  36 -23.775 -27.476  -2.460
  264   2HG   LYS  36          1HG       LYS  36 -22.911 -27.610  -0.929
  265   1HD   LYS  36          2HD       LYS  36 -24.999 -25.655  -0.653
  266   2HD   LYS  36          1HD       LYS  36 -25.686 -27.134  -1.321
  267   1HE   LYS  36          2HE       LYS  36 -24.107 -26.818   1.242
  268   2HE   LYS  36          1HE       LYS  36 -25.768 -27.383   1.060
  269   1HZ   LYS  36          2HZ       LYS  36 -24.419 -29.089  -0.513
  270   2HZ   LYS  36          1HZ       LYS  36 -23.286 -28.816   0.723
  271   3HZ   LYS  36          3HZ       LYS  36 -24.832 -29.398   1.106
  272    H    THR  37           H        THR  37 -20.428 -23.641  -2.886
  273    HA   THR  37           HA       THR  37 -21.665 -22.768  -5.248
  274    HB   THR  37           HB       THR  37 -20.061 -21.463  -3.756
  275    HG1  THR  37           HG1      THR  37 -19.928 -20.124  -5.365
  276   1HG2  THR  37          3HG2      THR  37 -18.058 -22.989  -5.439
  277   2HG2  THR  37          2HG2      THR  37 -17.663 -21.576  -4.460
  278   3HG2  THR  37          1HG2      THR  37 -18.228 -23.055  -3.685
  279    H    LEU  38           H        LEU  38 -19.313 -25.260  -4.797
  280    HA   LEU  38           HA       LEU  38 -18.223 -25.309  -7.459
  281   1HB   LEU  38          2HB       LEU  38 -18.529 -27.482  -5.368
  282   2HB   LEU  38          1HB       LEU  38 -17.646 -27.697  -6.879
  283    HG   LEU  38           HG       LEU  38 -17.028 -25.743  -4.648
  284   1HD1  LEU  38          3HD1      LEU  38 -16.273 -28.242  -4.671
  285   2HD1  LEU  38          2HD1      LEU  38 -15.161 -27.723  -5.937
  286   3HD1  LEU  38          1HD1      LEU  38 -15.069 -26.999  -4.331
  287   1HD2  LEU  38          3HD2      LEU  38 -16.119 -25.853  -7.516
  288   2HD2  LEU  38          2HD2      LEU  38 -16.585 -24.450  -6.554
  289   3HD2  LEU  38          1HD2      LEU  38 -15.034 -25.241  -6.267
  290    H    GLY  39           H        GLY  39 -21.172 -26.555  -6.029
  291   1HA   GLY  39          1HA       GLY  39 -22.417 -26.907  -8.596
  292   2HA   GLY  39          2HA       GLY  39 -23.081 -27.456  -7.058
  293    H    SER  40           H        SER  40 -20.175 -28.819  -6.953
  294    HA   SER  40           HA       SER  40 -21.194 -31.392  -7.955
  295   1HB   SER  40          2HB       SER  40 -19.158 -29.788  -9.363
  296   2HB   SER  40          1HB       SER  40 -18.683 -31.460  -9.058
  297    HG   SER  40           HG       SER  40 -21.204 -30.771 -10.124
  298    H    ILE  41           H        ILE  41 -20.899 -31.091  -5.381
  299    HA   ILE  41           HA       ILE  41 -18.467 -32.636  -4.747
  300    HB   ILE  41           HB       ILE  41 -18.006 -30.098  -4.497
  301   1HG1  ILE  41          2HG1      ILE  41 -17.625 -31.649  -1.943
  302   2HG1  ILE  41          1HG1      ILE  41 -16.792 -32.132  -3.421
  303   1HG2  ILE  41          3HG2      ILE  41 -20.356 -30.050  -3.166
  304   2HG2  ILE  41          2HG2      ILE  41 -19.262 -30.310  -1.808
  305   3HG2  ILE  41          1HG2      ILE  41 -19.058 -28.898  -2.846
  306   1HD1  ILE  41          2HD1      ILE  41 -16.673 -29.242  -2.770
  307   2HD1  ILE  41          1HD1      ILE  41 -15.795 -30.306  -1.671
  308   3HD1  ILE  41          3HD1      ILE  41 -15.413 -30.308  -3.392
  309    H    THR  42           H        THR  42 -18.568 -33.223  -2.287
  310    HA   THR  42           HA       THR  42 -21.432 -33.641  -1.525
  311    HB   THR  42           HB       THR  42 -21.098 -35.877  -1.339
  312    HG1  THR  42           HG1      THR  42 -18.998 -36.566  -0.308
  313   1HG2  THR  42          2HG2      THR  42 -19.788 -35.386  -3.434
  314   2HG2  THR  42          1HG2      THR  42 -18.325 -35.377  -2.447
  315   3HG2  THR  42          3HG2      THR  42 -19.280 -36.853  -2.598
  316    HA   PRO  43           HA       PRO  43 -20.411 -31.948   2.435
  317   1HB   PRO  43          2HB       PRO  43 -21.738 -33.568   4.149
  318   2HB   PRO  43          1HB       PRO  43 -22.559 -32.389   3.122
  319   1HG   PRO  43          2HG       PRO  43 -22.204 -35.336   2.717
  320   2HG   PRO  43          1HG       PRO  43 -23.648 -34.348   2.472
  321   1HD   PRO  43          1HD       PRO  43 -22.079 -35.115   0.412
  322   2HD   PRO  43          2HD       PRO  43 -22.917 -33.562   0.418
  323    H    ASP  44           H        ASP  44 -20.025 -35.433   2.021
  324    HA   ASP  44           HA       ASP  44 -18.325 -35.845   4.300
  325   1HB   ASP  44          2HB       ASP  44 -18.657 -37.398   1.721
  326   2HB   ASP  44          1HB       ASP  44 -17.679 -37.955   3.079
  327    H    GLU  45           H        GLU  45 -17.723 -34.520   1.122
  328    HA   GLU  45           HA       GLU  45 -14.845 -35.022   1.225
  329   1HB   GLU  45          2HB       GLU  45 -16.539 -33.224  -0.538
  330   2HB   GLU  45          1HB       GLU  45 -14.805 -33.468  -0.745
  331   1HG   GLU  45          2HG       GLU  45 -16.859 -35.700  -0.776
  332   2HG   GLU  45          1HG       GLU  45 -16.190 -34.944  -2.223
  333    H    VAL  46           H        VAL  46 -17.082 -32.400   1.946
  334    HA   VAL  46           HA       VAL  46 -15.057 -30.421   2.479
  335    HB   VAL  46           HB       VAL  46 -17.938 -30.677   3.372
  336   1HG1  VAL  46          2HG1      VAL  46 -16.490 -29.341   4.964
  337   2HG1  VAL  46          1HG1      VAL  46 -16.139 -28.251   3.623
  338   3HG1  VAL  46          3HG1      VAL  46 -17.792 -28.420   4.212
  339   1HG2  VAL  46          2HG2      VAL  46 -16.625 -29.822   0.968
  340   2HG2  VAL  46          1HG2      VAL  46 -18.353 -29.859   1.317
  341   3HG2  VAL  46          3HG2      VAL  46 -17.405 -28.426   1.713
  342    H    LYS  47           H        LYS  47 -16.704 -32.852   4.421
  343    HA   LYS  47           HA       LYS  47 -15.712 -31.989   6.975
  344   1HB   LYS  47          2HB       LYS  47 -17.564 -33.581   6.825
  345   2HB   LYS  47          1HB       LYS  47 -16.522 -34.751   6.016
  346   1HG   LYS  47          2HG       LYS  47 -15.063 -34.804   8.030
  347   2HG   LYS  47          1HG       LYS  47 -16.166 -33.689   8.837
  348   1HD   LYS  47          2HD       LYS  47 -16.814 -35.868   9.568
  349   2HD   LYS  47          1HD       LYS  47 -18.009 -35.403   8.357
  350   1HE   LYS  47          2HE       LYS  47 -17.423 -37.124   7.022
  351   2HE   LYS  47          1HE       LYS  47 -15.718 -36.679   7.111
  352   1HZ   LYS  47          3HZ       LYS  47 -16.920 -37.934   9.459
  353   2HZ   LYS  47          2HZ       LYS  47 -16.616 -38.924   8.112
  354   3HZ   LYS  47          1HZ       LYS  47 -15.344 -38.070   8.846
  355    H    HIS  48           H        HIS  48 -14.457 -34.198   4.512
  356    HA   HIS  48           HA       HIS  48 -12.179 -35.091   6.013
  357   1HB   HIS  48          2HB       HIS  48 -12.949 -36.261   3.989
  358   2HB   HIS  48          1HB       HIS  48 -12.554 -34.847   3.010
  359    HD1  HIS  48           HD1      HIS  48 -10.563 -35.649   1.689
  360    HD2  HIS  48           HD2      HIS  48 -10.179 -36.472   5.756
  361    HE1  HIS  48           HE1      HIS  48  -8.214 -36.536   2.020
  362    H    MET  49           H        MET  49 -12.643 -32.406   3.704
  363    HA   MET  49           HA       MET  49  -9.954 -31.498   3.669
  364   1HB   MET  49          2HB       MET  49 -12.604 -30.099   3.302
  365   2HB   MET  49          1HB       MET  49 -11.074 -29.237   3.175
  366   1HG   MET  49          2HG       MET  49 -10.350 -30.963   1.473
  367   2HG   MET  49          1HG       MET  49 -12.002 -31.581   1.499
  368   1HE   MET  49          1HE       MET  49 -13.875 -30.709   0.817
  369   2HE   MET  49          3HE       MET  49 -14.059 -29.059   1.429
  370   3HE   MET  49          2HE       MET  49 -14.152 -29.376  -0.301
  371    H    MET  50           H        MET  50 -12.660 -30.705   5.819
  372    HA   MET  50           HA       MET  50 -11.296 -28.755   7.388
  373   1HB   MET  50          2HB       MET  50 -13.673 -30.527   7.787
  374   2HB   MET  50          1HB       MET  50 -12.994 -29.713   9.194
  375   1HG   MET  50          2HG       MET  50 -13.082 -27.561   7.799
  376   2HG   MET  50          1HG       MET  50 -14.094 -28.463   6.671
  377   1HE   MET  50          3HE       MET  50 -13.455 -26.858   9.819
  378   2HE   MET  50          2HE       MET  50 -14.964 -26.742  10.721
  379   3HE   MET  50          1HE       MET  50 -13.997 -28.213  10.819
  380    H    ALA  51           H        ALA  51 -11.681 -32.260   7.841
  381    HA   ALA  51           HA       ALA  51 -10.196 -32.487  10.251
  382   1HB   ALA  51          2HB       ALA  51 -11.434 -34.399   9.506
  383   2HB   ALA  51          3HB       ALA  51  -9.734 -34.858   9.418
  384   3HB   ALA  51          1HB       ALA  51 -10.604 -34.413   7.951
  385    H    GLU  52           H        GLU  52  -9.183 -31.889   6.994
  386    HA   GLU  52           HA       GLU  52  -6.357 -32.542   7.623
  387   1HB   GLU  52          2HB       GLU  52  -7.859 -31.819   5.117
  388   2HB   GLU  52          1HB       GLU  52  -6.106 -31.647   5.170
  389   1HG   GLU  52          2HG       GLU  52  -6.091 -34.072   6.072
  390   2HG   GLU  52          1HG       GLU  52  -7.756 -34.155   5.497
  391    H    ILE  53           H        ILE  53  -8.466 -29.799   6.969
  392    HA   ILE  53           HA       ILE  53  -6.287 -27.851   7.085
  393    HB   ILE  53           HB       ILE  53  -9.299 -27.525   7.146
  394   1HG1  ILE  53          2HG1      ILE  53  -7.301 -27.171   4.899
  395   2HG1  ILE  53          1HG1      ILE  53  -8.371 -28.558   5.082
  396   1HG2  ILE  53          1HG2      ILE  53  -7.874 -25.651   8.129
  397   2HG2  ILE  53          3HG2      ILE  53  -7.206 -25.439   6.511
  398   3HG2  ILE  53          2HG2      ILE  53  -8.930 -25.194   6.793
  399   1HD1  ILE  53          1HD1      ILE  53  -9.522 -25.783   5.073
  400   2HD1  ILE  53          3HD1      ILE  53  -9.109 -26.564   3.545
  401   3HD1  ILE  53          2HD1      ILE  53 -10.288 -27.308   4.627
  402    H    ASP  54           H        ASP  54  -8.650 -29.238   9.278
  403    HA   ASP  54           HA       ASP  54  -8.496 -27.323  11.379
  404   1HB   ASP  54          2HB       ASP  54 -10.049 -29.418  10.980
  405   2HB   ASP  54          1HB       ASP  54  -8.809 -30.262  11.897
  406    H    THR  55           H        THR  55  -6.419 -26.704  11.964
  407    HA   THR  55           HA       THR  55  -4.211 -28.553  12.159
  408    HB   THR  55           HB       THR  55  -3.018 -26.657  13.210
  409    HG1  THR  55           HG1      THR  55  -4.542 -25.686  14.422
  410   1HG2  THR  55          1HG2      THR  55  -4.703 -26.159  10.759
  411   2HG2  THR  55          3HG2      THR  55  -3.528 -24.971  11.323
  412   3HG2  THR  55          2HG2      THR  55  -2.993 -26.582  10.847
  413    H    ASP  56           H        ASP  56  -6.219 -26.951  14.640
  414    HA   ASP  56           HA       ASP  56  -4.915 -28.555  16.735
  415   1HB   ASP  56          2HB       ASP  56  -6.090 -27.231  18.299
  416   2HB   ASP  56          1HB       ASP  56  -5.720 -26.117  16.985
  417    H    GLY  57           H        GLY  57  -7.968 -28.498  14.984
  418   1HA   GLY  57          1HA       GLY  57  -8.510 -31.211  16.058
  419   2HA   GLY  57          2HA       GLY  57  -9.246 -30.519  14.617
  420    H    ASP  58           H        ASP  58  -9.875 -27.959  16.135
  421    HA   ASP  58           HA       ASP  58 -11.725 -28.848  18.232
  422   1HB   ASP  58          2HB       ASP  58 -12.268 -26.529  18.531
  423   2HB   ASP  58          1HB       ASP  58 -10.530 -26.609  18.260
  424    H    GLY  59           H        GLY  59 -11.831 -28.953  14.920
  425   1HA   GLY  59          1HA       GLY  59 -14.796 -29.090  14.981
  426   2HA   GLY  59          2HA       GLY  59 -13.763 -29.814  13.750
  427    H    PHE  60           H        PHE  60 -12.614 -26.740  14.376
  428    HA   PHE  60           HA       PHE  60 -14.094 -25.695  12.008
  429   1HB   PHE  60          2HB       PHE  60 -13.407 -24.011  14.423
  430   2HB   PHE  60          1HB       PHE  60 -14.388 -23.548  13.033
  431    HD1  PHE  60           HD1      PHE  60 -16.620 -24.575  12.671
  432    HD2  PHE  60           HD2      PHE  60 -14.316 -25.329  16.214
  433    HE1  PHE  60           HE1      PHE  60 -18.644 -25.448  13.802
  434    HE2  PHE  60           HE2      PHE  60 -16.342 -26.197  17.347
  435    HZ   PHE  60           HZ       PHE  60 -18.509 -26.259  16.141
  436    H    ILE  61           H        ILE  61 -12.980 -24.039  10.816
  437    HA   ILE  61           HA       ILE  61 -10.031 -24.166  11.164
  438    HB   ILE  61           HB       ILE  61 -11.600 -23.326   8.715
  439   1HG1  ILE  61          2HG1      ILE  61 -12.127 -25.653   9.201
  440   2HG1  ILE  61          1HG1      ILE  61 -11.000 -25.598   7.846
  441   1HG2  ILE  61          1HG2      ILE  61  -9.217 -22.548   8.968
  442   2HG2  ILE  61          3HG2      ILE  61  -8.726 -24.241   9.016
  443   3HG2  ILE  61          2HG2      ILE  61  -9.485 -23.583   7.566
  444   1HD1  ILE  61          1HD1      ILE  61  -9.123 -25.952   9.489
  445   2HD1  ILE  61          3HD1      ILE  61 -10.337 -26.196  10.745
  446   3HD1  ILE  61          2HD1      ILE  61 -10.241 -27.314   9.382
  447    H    SER  62           H        SER  62  -9.030 -22.278  11.755
  448    HA   SER  62           HA       SER  62 -10.690 -19.829  11.914
  449   1HB   SER  62          2HB       SER  62  -7.930 -20.403  13.043
  450   2HB   SER  62          1HB       SER  62  -8.902 -18.967  13.366
  451    HG   SER  62           HG       SER  62  -8.935 -21.116  14.749
  452    H    PHE  63           H        PHE  63  -9.428 -17.747  11.352
  453    HA   PHE  63           HA       PHE  63  -8.710 -17.786   8.618
  454   1HB   PHE  63          2HB       PHE  63  -9.323 -15.708   9.828
  455   2HB   PHE  63          1HB       PHE  63  -7.801 -15.794  10.720
  456    HD1  PHE  63           HD1      PHE  63  -8.804 -16.303   7.145
  457    HD2  PHE  63           HD2      PHE  63  -6.218 -14.281   9.911
  458    HE1  PHE  63           HE1      PHE  63  -7.639 -15.209   5.253
  459    HE2  PHE  63           HE2      PHE  63  -5.047 -13.190   8.019
  460    HZ   PHE  63           HZ       PHE  63  -5.762 -13.651   5.686
  461    H    GLN  64           H        GLN  64  -6.675 -17.872  11.521
  462    HA   GLN  64           HA       GLN  64  -4.154 -17.867  10.205
  463   1HB   GLN  64          2HB       GLN  64  -4.570 -17.599  12.683
  464   2HB   GLN  64          1HB       GLN  64  -4.858 -19.337  12.760
  465   1HG   GLN  64          2HG       GLN  64  -2.535 -18.916  13.345
  466   2HG   GLN  64          1HG       GLN  64  -2.580 -19.697  11.765
  467   1HE2  GLN  64          1HE2      GLN  64  -0.845 -18.745  10.643
  468   2HE2  GLN  64          2HE2      GLN  64  -0.617 -17.071  10.476
  469    H    GLU  65           H        GLU  65  -6.208 -20.601  11.265
  470    HA   GLU  65           HA       GLU  65  -4.526 -22.682  10.307
  471   1HB   GLU  65          2HB       GLU  65  -7.466 -22.434  10.850
  472   2HB   GLU  65          1HB       GLU  65  -6.851 -23.884  10.067
  473   1HG   GLU  65          2HG       GLU  65  -5.300 -24.261  11.930
  474   2HG   GLU  65          1HG       GLU  65  -5.846 -22.775  12.705
  475    H    PHE  66           H        PHE  66  -7.214 -20.962   8.733
  476    HA   PHE  66           HA       PHE  66  -7.080 -22.366   6.250
  477   1HB   PHE  66          2HB       PHE  66  -8.974 -20.895   6.928
  478   2HB   PHE  66          1HB       PHE  66  -7.923 -19.492   6.735
  479    HD1  PHE  66           HD1      PHE  66  -7.102 -18.822   4.506
  480    HD2  PHE  66           HD2      PHE  66  -9.826 -22.107   5.007
  481    HE1  PHE  66           HE1      PHE  66  -7.608 -18.774   2.079
  482    HE2  PHE  66           HE2      PHE  66 -10.331 -22.058   2.580
  483    HZ   PHE  66           HZ       PHE  66  -9.222 -20.392   1.116
  484    H    THR  67           H        THR  67  -5.358 -19.543   7.486
  485    HA   THR  67           HA       THR  67  -4.067 -18.870   4.996
  486    HB   THR  67           HB       THR  67  -3.316 -18.300   7.879
  487    HG1  THR  67           HG1      THR  67  -4.716 -16.782   7.627
  488   1HG2  THR  67          1HG2      THR  67  -2.074 -17.427   5.269
  489   2HG2  THR  67          3HG2      THR  67  -1.897 -16.481   6.747
  490   3HG2  THR  67          2HG2      THR  67  -1.277 -18.129   6.677
  491    H    ASP  68           H        ASP  68  -3.006 -20.733   7.855
  492    HA   ASP  68           HA       ASP  68  -0.438 -21.441   6.881
  493   1HB   ASP  68          2HB       ASP  68  -2.305 -23.044   8.656
  494   2HB   ASP  68          1HB       ASP  68  -0.580 -23.347   8.461
  495    H    PHE  69           H        PHE  69  -3.613 -22.911   6.339
  496    HA   PHE  69           HA       PHE  69  -2.512 -25.123   4.793
  497   1HB   PHE  69          2HB       PHE  69  -4.518 -25.799   5.694
  498   2HB   PHE  69          1HB       PHE  69  -5.195 -24.174   5.667
  499    HD1  PHE  69           HD1      PHE  69  -5.814 -23.181   3.387
  500    HD2  PHE  69           HD2      PHE  69  -5.110 -27.363   4.039
  501    HE1  PHE  69           HE1      PHE  69  -7.052 -23.716   1.299
  502    HE2  PHE  69           HE2      PHE  69  -6.338 -27.900   1.957
  503    HZ   PHE  69           HZ       PHE  69  -7.314 -26.077   0.584
  504    H    GLY  70           H        GLY  70  -3.947 -21.960   4.157
  505   1HA   GLY  70          1HA       GLY  70  -3.979 -20.672   2.193
  506   2HA   GLY  70          2HA       GLY  70  -4.269 -22.190   1.341
  507    H    ARG  71           H        ARG  71  -1.437 -21.542   3.332
  508    HA   ARG  71           HA       ARG  71   0.327 -20.762   1.199
  509   1HB   ARG  71          2HB       ARG  71   0.944 -22.126   3.842
  510   2HB   ARG  71          1HB       ARG  71   2.143 -21.386   2.782
  511   1HG   ARG  71          2HG       ARG  71   0.981 -19.209   3.009
  512   2HG   ARG  71          1HG       ARG  71  -0.189 -19.956   4.097
  513   1HD   ARG  71          2HD       ARG  71   2.801 -19.731   4.561
  514   2HD   ARG  71          1HD       ARG  71   1.545 -18.825   5.405
  515    HE   ARG  71           HE       ARG  71   1.014 -21.611   5.712
  516   1HH1  ARG  71          1HH1      ARG  71   3.639 -19.501   6.356
  517   2HH1  ARG  71          2HH1      ARG  71   3.911 -20.098   7.958
  518   1HH2  ARG  71          1HH2      ARG  71   1.195 -22.252   7.904
  519   2HH2  ARG  71          2HH2      ARG  71   2.527 -21.656   8.835
  520    H    ALA  72           H        ALA  72  -0.750 -23.848   2.470
  521    HA   ALA  72           HA       ALA  72   1.145 -25.370   0.814
  522   1HB   ALA  72          3HB       ALA  72   0.751 -26.730   2.594
  523   2HB   ALA  72          1HB       ALA  72  -0.714 -27.181   1.723
  524   3HB   ALA  72          2HB       ALA  72  -0.779 -25.938   2.974
  525    H    ASN  73           H        ASN  73  -1.672 -23.714   0.215
  526    HA   ASN  73           HA       ASN  73  -2.116 -25.211  -2.279
  527   1HB   ASN  73          2HB       ASN  73  -4.260 -24.823  -0.167
  528   2HB   ASN  73          1HB       ASN  73  -4.599 -25.295  -1.830
  529   1HD2  ASN  73          1HD2      ASN  73  -3.546 -26.451   1.273
  530   2HD2  ASN  73          2HD2      ASN  73  -3.250 -28.055   0.808
  531    H    ARG  74           H        ARG  74  -0.985 -22.734  -2.030
  532    HA   ARG  74           HA       ARG  74  -2.733 -20.502  -1.990
  533   1HB   ARG  74          2HB       ARG  74  -0.133 -20.969  -3.474
  534   2HB   ARG  74          1HB       ARG  74  -0.958 -19.410  -3.447
  535   1HG   ARG  74          2HG       ARG  74  -0.901 -19.536  -0.917
  536   2HG   ARG  74          1HG       ARG  74   0.148 -20.944  -1.080
  537   1HD   ARG  74          2HD       ARG  74   0.716 -18.178  -2.193
  538   2HD   ARG  74          1HD       ARG  74   1.483 -18.893  -0.774
  539    HE   ARG  74           HE       ARG  74   1.950 -20.725  -2.818
  540   1HH1  ARG  74          1HH1      ARG  74   3.961 -18.873  -1.343
  541   2HH1  ARG  74          2HH1      ARG  74   4.754 -18.144  -2.701
  542   1HH2  ARG  74          1HH2      ARG  74   2.342 -19.141  -4.983
  543   2HH2  ARG  74          2HH2      ARG  74   3.838 -18.297  -4.760
  544    H    GLY  75           H        GLY  75  -1.637 -22.506  -4.709
  545   1HA   GLY  75          1HA       GLY  75  -2.615 -22.878  -6.800
  546   2HA   GLY  75          2HA       GLY  75  -3.043 -21.167  -6.769
  547    H    LEU  76           H        LEU  76  -4.182 -23.158  -4.179
  548    HA   LEU  76           HA       LEU  76  -6.726 -23.823  -5.465
  549   1HB   LEU  76          2HB       LEU  76  -5.749 -24.046  -2.608
  550   2HB   LEU  76          1HB       LEU  76  -7.347 -24.574  -3.134
  551    HG   LEU  76           HG       LEU  76  -6.181 -26.006  -4.872
  552   1HD1  LEU  76          1HD1      LEU  76  -3.844 -24.824  -3.452
  553   2HD1  LEU  76          3HD1      LEU  76  -3.730 -26.521  -3.914
  554   3HD1  LEU  76          2HD1      LEU  76  -4.013 -25.289  -5.143
  555   1HD2  LEU  76          3HD2      LEU  76  -6.139 -26.383  -1.925
  556   2HD2  LEU  76          2HD2      LEU  76  -6.897 -27.371  -3.176
  557   3HD2  LEU  76          1HD2      LEU  76  -5.167 -27.514  -2.866
  558    H    LEU  77           H        LEU  77  -5.616 -21.532  -2.992
  559    HA   LEU  77           HA       LEU  77  -8.212 -20.367  -2.543
  560   1HB   LEU  77          2HB       LEU  77  -5.622 -18.879  -2.149
  561   2HB   LEU  77          1HB       LEU  77  -7.102 -18.785  -1.197
  562    HG   LEU  77           HG       LEU  77  -5.085 -21.038  -1.273
  563   1HD1  LEU  77          1HD1      LEU  77  -5.916 -18.918   0.623
  564   2HD1  LEU  77          3HD1      LEU  77  -5.666 -20.514   1.332
  565   3HD1  LEU  77          2HD1      LEU  77  -4.357 -19.727   0.449
  566   1HD2  LEU  77          1HD2      LEU  77  -7.438 -21.907  -1.406
  567   2HD2  LEU  77          3HD2      LEU  77  -6.611 -22.349   0.088
  568   3HD2  LEU  77          2HD2      LEU  77  -7.794 -21.040   0.089
  569    H    LYS  78           H        LYS  78  -5.807 -19.921  -5.021
  570    HA   LYS  78           HA       LYS  78  -6.785 -17.286  -5.823
  571   1HB   LYS  78          2HB       LYS  78  -4.922 -19.283  -7.133
  572   2HB   LYS  78          1HB       LYS  78  -5.328 -17.724  -7.851
  573   1HG   LYS  78          2HG       LYS  78  -4.595 -16.707  -5.592
  574   2HG   LYS  78          1HG       LYS  78  -3.850 -18.274  -5.276
  575   1HD   LYS  78          2HD       LYS  78  -3.273 -16.442  -7.624
  576   2HD   LYS  78          1HD       LYS  78  -2.189 -16.795  -6.278
  577   1HE   LYS  78          2HE       LYS  78  -2.071 -19.143  -6.941
  578   2HE   LYS  78          1HE       LYS  78  -3.250 -18.868  -8.224
  579   1HZ   LYS  78          3HZ       LYS  78  -0.825 -17.220  -8.160
  580   2HZ   LYS  78          2HZ       LYS  78  -0.703 -18.819  -8.721
  581   3HZ   LYS  78          1HZ       LYS  78  -1.752 -17.724  -9.488
  582    H    ASP  79           H        ASP  79  -7.525 -20.617  -6.575
  583    HA   ASP  79           HA       ASP  79  -9.085 -19.861  -8.965
  584   1HB   ASP  79          2HB       ASP  79  -7.810 -21.984  -8.954
  585   2HB   ASP  79          1HB       ASP  79  -8.769 -22.541  -7.583
  586    H    VAL  80           H        VAL  80  -9.634 -21.048  -5.673
  587    HA   VAL  80           HA       VAL  80 -12.494 -21.251  -5.915
  588    HB   VAL  80           HB       VAL  80 -10.899 -22.216  -4.100
  589   1HG1  VAL  80          3HG1      VAL  80  -9.946 -20.017  -3.449
  590   2HG1  VAL  80          2HG1      VAL  80 -11.538 -19.517  -2.880
  591   3HG1  VAL  80          1HG1      VAL  80 -10.694 -20.846  -2.084
  592   1HG2  VAL  80          1HG2      VAL  80 -13.651 -21.085  -3.743
  593   2HG2  VAL  80          3HG2      VAL  80 -13.139 -22.772  -3.807
  594   3HG2  VAL  80          2HG2      VAL  80 -12.845 -21.815  -2.355
  595    H    ALA  81           H        ALA  81 -10.335 -18.714  -4.740
  596    HA   ALA  81           HA       ALA  81 -12.204 -16.861  -3.784
  597   1HB   ALA  81          1HB       ALA  81  -9.693 -16.616  -3.745
  598   2HB   ALA  81          3HB       ALA  81  -9.776 -16.137  -5.440
  599   3HB   ALA  81          2HB       ALA  81 -10.557 -15.149  -4.206
  600    H    LYS  82           H        LYS  82 -11.279 -17.515  -7.142
  601    HA   LYS  82           HA       LYS  82 -12.728 -15.322  -8.293
  602   1HB   LYS  82          2HB       LYS  82 -11.981 -18.015  -9.475
  603   2HB   LYS  82          1HB       LYS  82 -12.581 -16.639 -10.401
  604   1HG   LYS  82          2HG       LYS  82 -10.653 -15.288  -9.517
  605   2HG   LYS  82          1HG       LYS  82 -10.024 -16.761  -8.777
  606   1HD   LYS  82          2HD       LYS  82 -10.105 -17.818 -11.090
  607   2HD   LYS  82          1HD       LYS  82 -10.432 -16.205 -11.726
  608   1HE   LYS  82          2HE       LYS  82  -8.332 -15.411 -10.584
  609   2HE   LYS  82          1HE       LYS  82  -7.986 -17.089 -10.168
  610   1HZ   LYS  82          3HZ       LYS  82  -8.641 -16.775 -12.929
  611   2HZ   LYS  82          2HZ       LYS  82  -7.300 -15.830 -12.489
  612   3HZ   LYS  82          1HZ       LYS  82  -7.286 -17.508 -12.220
  613    H    ILE  83           H        ILE  83 -13.693 -18.476  -7.144
  614    HA   ILE  83           HA       ILE  83 -16.160 -18.738  -8.536
  615    HB   ILE  83           HB       ILE  83 -15.580 -19.620  -5.698
  616   1HG1  ILE  83          2HG1      ILE  83 -14.847 -20.825  -8.373
  617   2HG1  ILE  83          1HG1      ILE  83 -13.780 -20.457  -7.020
  618   1HG2  ILE  83          2HG2      ILE  83 -17.491 -20.578  -7.847
  619   2HG2  ILE  83          1HG2      ILE  83 -17.176 -21.454  -6.350
  620   3HG2  ILE  83          3HG2      ILE  83 -17.915 -19.854  -6.295
  621   1HD1  ILE  83          3HD1      ILE  83 -16.001 -22.524  -6.960
  622   2HD1  ILE  83          2HD1      ILE  83 -14.291 -22.890  -7.183
  623   3HD1  ILE  83          1HD1      ILE  83 -14.852 -22.191  -5.663
  624    H    PHE  84           H        PHE  84 -15.378 -17.157  -5.459
  625    HA   PHE  84           HA       PHE  84 -18.148 -16.144  -5.241
  626   1HB   PHE  84          2HB       PHE  84 -15.721 -15.830  -3.452
  627   2HB   PHE  84          1HB       PHE  84 -17.305 -15.141  -3.100
  628    HD1  PHE  84           HD1      PHE  84 -15.428 -18.304  -3.572
  629    HD2  PHE  84           HD2      PHE  84 -19.127 -16.507  -2.329
  630    HE1  PHE  84           HE1      PHE  84 -16.159 -20.472  -2.614
  631    HE2  PHE  84           HE2      PHE  84 -19.857 -18.675  -1.371
  632    HZ   PHE  84           HZ       PHE  84 -18.374 -20.656  -1.514

  No H/Q in entry =         632
  Start of MODEL   11
    1    H1   ALA   1          2H        ALA   1  11.722 -13.533  -0.890
    2    H2   ALA   1          1H        ALA   1  12.524 -12.679   0.341
    3    H3   ALA   1          3H        ALA   1  12.381 -14.366   0.436
    4    HA   ALA   1           HA       ALA   1  10.388 -14.263   1.378
    5   1HB   ALA   1          1HB       ALA   1  11.529 -11.531   1.581
    6   2HB   ALA   1          2HB       ALA   1  10.983 -12.621   2.856
    7   3HB   ALA   1          3HB       ALA   1   9.808 -11.672   1.945
    8    H    ASP   2           H        ASP   2   9.216 -14.930  -0.553
    9    HA   ASP   2           HA       ASP   2   8.035 -12.836  -2.247
   10   1HB   ASP   2          2HB       ASP   2   7.630 -15.842  -2.179
   11   2HB   ASP   2          1HB       ASP   2   6.931 -14.760  -3.384
   12    H    ASP   3           H        ASP   3   7.392 -13.682   0.799
   13    HA   ASP   3           HA       ASP   3   4.462 -13.959   0.545
   14   1HB   ASP   3          2HB       ASP   3   5.806 -15.225   2.276
   15   2HB   ASP   3          1HB       ASP   3   6.112 -13.681   3.071
   16    H    HIS   4           H        HIS   4   3.278 -12.128   0.284
   17    HA   HIS   4           HA       HIS   4   4.260  -9.628   1.609
   18   1HB   HIS   4          2HB       HIS   4   3.813 -10.073  -1.098
   19   2HB   HIS   4          1HB       HIS   4   2.321  -9.297  -0.569
   20    HD1  HIS   4           HD1      HIS   4   2.403  -6.817  -0.526
   21    HD2  HIS   4           HD2      HIS   4   6.206  -8.471  -0.111
   22    HE1  HIS   4           HE1      HIS   4   4.021  -4.874  -0.449
   23    HA   PRO   5           HA       PRO   5   0.466  -9.585   3.939
   24   1HB   PRO   5          2HB       PRO   5  -0.072  -6.928   4.015
   25   2HB   PRO   5          1HB       PRO   5   1.187  -7.683   4.997
   26   1HG   PRO   5          2HG       PRO   5   1.437  -6.231   2.380
   27   2HG   PRO   5          1HG       PRO   5   2.423  -6.062   3.838
   28   1HD   PRO   5          1HD       PRO   5   3.286  -7.525   1.775
   29   2HD   PRO   5          2HD       PRO   5   3.585  -8.048   3.433
   30    H    GLN   6           H        GLN   6   0.723  -8.190   0.793
   31    HA   GLN   6           HA       GLN   6  -1.960  -7.446   0.263
   32   1HB   GLN   6          2HB       GLN   6   0.412  -8.258  -1.337
   33   2HB   GLN   6          1HB       GLN   6  -1.155  -8.408  -2.140
   34   1HG   GLN   6          2HG       GLN   6  -1.496  -6.145  -2.190
   35   2HG   GLN   6          1HG       GLN   6  -0.711  -5.889  -0.632
   36   1HE2  GLN   6          1HE2      GLN   6   1.291  -4.871  -0.779
   37   2HE2  GLN   6          2HE2      GLN   6   2.308  -4.904  -2.138
   38    H    ASP   7           H        ASP   7  -0.326 -10.581   0.026
   39    HA   ASP   7           HA       ASP   7  -2.469 -12.061  -1.104
   40   1HB   ASP   7          2HB       ASP   7  -0.266 -12.896   0.801
   41   2HB   ASP   7          1HB       ASP   7  -1.363 -14.036   0.022
   42    H    LYS   8           H        LYS   8  -1.671 -11.373   2.288
   43    HA   LYS   8           HA       LYS   8  -3.627 -12.911   3.572
   44   1HB   LYS   8          2HB       LYS   8  -2.299 -10.304   4.181
   45   2HB   LYS   8          1HB       LYS   8  -3.691 -10.770   5.159
   46   1HG   LYS   8          2HG       LYS   8  -2.421 -13.098   5.252
   47   2HG   LYS   8          1HG       LYS   8  -1.013 -12.090   4.917
   48   1HD   LYS   8          2HD       LYS   8  -1.680 -10.628   6.849
   49   2HD   LYS   8          1HD       LYS   8  -2.957 -11.784   7.226
   50   1HE   LYS   8          2HE       LYS   8  -1.483 -13.087   8.320
   51   2HE   LYS   8          1HE       LYS   8  -0.490 -13.212   6.867
   52   1HZ   LYS   8          3HZ       LYS   8  -0.370 -10.741   8.438
   53   2HZ   LYS   8          2HZ       LYS   8   0.434 -12.114   9.034
   54   3HZ   LYS   8          1HZ       LYS   8   0.833 -11.488   7.506
   55    H    ALA   9           H        ALA   9  -3.973  -9.808   1.922
   56    HA   ALA   9           HA       ALA   9  -6.637  -9.221   2.726
   57   1HB   ALA   9          3HB       ALA   9  -4.763  -8.119   0.941
   58   2HB   ALA   9          1HB       ALA   9  -6.344  -7.455   1.350
   59   3HB   ALA   9          2HB       ALA   9  -6.167  -8.513  -0.050
   60    H    GLU  10           H        GLU  10  -5.404 -11.077  -0.039
   61    HA   GLU  10           HA       GLU  10  -8.000 -11.773  -1.063
   62   1HB   GLU  10          2HB       GLU  10  -5.400 -13.307  -1.348
   63   2HB   GLU  10          1HB       GLU  10  -6.819 -13.456  -2.384
   64   1HG   GLU  10          2HG       GLU  10  -5.193 -10.921  -2.012
   65   2HG   GLU  10          1HG       GLU  10  -5.081 -12.001  -3.402
   66    H    ARG  11           H        ARG  11  -5.738 -13.424   1.118
   67    HA   ARG  11           HA       ARG  11  -7.336 -15.774   1.497
   68   1HB   ARG  11          2HB       ARG  11  -5.232 -14.445   3.219
   69   2HB   ARG  11          1HB       ARG  11  -5.981 -15.983   3.636
   70   1HG   ARG  11          2HG       ARG  11  -5.290 -16.748   1.267
   71   2HG   ARG  11          1HG       ARG  11  -4.245 -15.329   1.253
   72   1HD   ARG  11          2HD       ARG  11  -3.496 -16.269   3.616
   73   2HD   ARG  11          1HD       ARG  11  -4.080 -17.793   2.948
   74    HE   ARG  11           HE       ARG  11  -1.859 -16.171   1.792
   75   1HH1  ARG  11          1HH1      ARG  11  -3.289 -17.829  -0.236
   76   2HH1  ARG  11          2HH1      ARG  11  -2.409 -19.320  -0.181
   77   1HH2  ARG  11          1HH2      ARG  11  -0.897 -18.625   2.861
   78   2HH2  ARG  11          2HH2      ARG  11  -1.055 -19.771   1.571
   79    H    GLU  12           H        GLU  12  -7.193 -12.671   3.184
   80    HA   GLU  12           HA       GLU  12  -9.013 -13.375   5.292
   81   1HB   GLU  12          2HB       GLU  12  -7.832 -10.878   4.213
   82   2HB   GLU  12          1HB       GLU  12  -9.370 -10.692   5.056
   83   1HG   GLU  12          2HG       GLU  12  -8.391 -12.030   6.960
   84   2HG   GLU  12          1HG       GLU  12  -6.835 -11.953   6.134
   85    H    ARG  13           H        ARG  13  -9.484 -11.874   2.109
   86    HA   ARG  13           HA       ARG  13 -12.312 -11.459   2.425
   87   1HB   ARG  13          2HB       ARG  13 -10.650 -11.822  -0.087
   88   2HB   ARG  13          1HB       ARG  13 -12.317 -11.246  -0.055
   89   1HG   ARG  13          2HG       ARG  13 -11.692  -9.286   1.199
   90   2HG   ARG  13          1HG       ARG  13 -10.064  -9.906   1.463
   91   1HD   ARG  13          2HD       ARG  13  -9.671  -8.489  -0.330
   92   2HD   ARG  13          1HD       ARG  13 -10.030  -9.985  -1.192
   93    HE   ARG  13           HE       ARG  13 -12.494  -8.672  -0.833
   94   1HH1  ARG  13          1HH1      ARG  13  -9.977  -6.712  -1.451
   95   2HH1  ARG  13          2HH1      ARG  13 -10.374  -6.339  -3.095
   96   1HH2  ARG  13          1HH2      ARG  13 -12.793  -8.809  -3.348
   97   2HH2  ARG  13          2HH2      ARG  13 -11.970  -7.525  -4.168
   98    H    ILE  14           H        ILE  14 -10.376 -14.115   1.097
   99    HA   ILE  14           HA       ILE  14 -12.656 -15.684   0.260
  100    HB   ILE  14           HB       ILE  14  -9.861 -16.627   0.968
  101   1HG1  ILE  14          2HG1      ILE  14 -10.835 -16.049  -1.814
  102   2HG1  ILE  14          1HG1      ILE  14 -10.224 -14.731  -0.815
  103   1HG2  ILE  14          1HG2      ILE  14 -12.197 -17.820  -0.519
  104   2HG2  ILE  14          3HG2      ILE  14 -10.547 -18.351  -0.848
  105   3HG2  ILE  14          2HG2      ILE  14 -11.230 -18.539   0.767
  106   1HD1  ILE  14          1HD1      ILE  14  -8.691 -17.302  -1.278
  107   2HD1  ILE  14          3HD1      ILE  14  -8.480 -15.863  -2.276
  108   3HD1  ILE  14          2HD1      ILE  14  -8.089 -15.809  -0.556
  109    H    PHE  15           H        PHE  15 -10.577 -15.691   3.157
  110    HA   PHE  15           HA       PHE  15 -11.953 -17.868   4.440
  111   1HB   PHE  15          2HB       PHE  15  -9.695 -17.092   5.136
  112   2HB   PHE  15          1HB       PHE  15 -10.409 -15.589   5.724
  113    HD1  PHE  15           HD1      PHE  15 -11.975 -15.619   7.657
  114    HD2  PHE  15           HD2      PHE  15  -9.971 -19.174   6.321
  115    HE1  PHE  15           HE1      PHE  15 -12.564 -16.752   9.785
  116    HE2  PHE  15           HE2      PHE  15 -10.555 -20.306   8.448
  117    HZ   PHE  15           HZ       PHE  15 -11.855 -19.098  10.181
  118    H    LYS  16           H        LYS  16 -12.432 -14.375   4.375
  119    HA   LYS  16           HA       LYS  16 -14.388 -14.247   6.465
  120   1HB   LYS  16          2HB       LYS  16 -13.668 -12.500   4.130
  121   2HB   LYS  16          1HB       LYS  16 -15.137 -12.162   5.044
  122   1HG   LYS  16          2HG       LYS  16 -13.787 -12.122   7.138
  123   2HG   LYS  16          1HG       LYS  16 -12.329 -12.365   6.175
  124   1HD   LYS  16          2HD       LYS  16 -12.965 -10.274   4.882
  125   2HD   LYS  16          1HD       LYS  16 -14.217  -9.998   6.093
  126   1HE   LYS  16          2HE       LYS  16 -11.577 -10.586   7.245
  127   2HE   LYS  16          1HE       LYS  16 -11.611  -9.109   6.282
  128   1HZ   LYS  16          3HZ       LYS  16 -13.933  -9.236   7.860
  129   2HZ   LYS  16          2HZ       LYS  16 -12.586  -9.491   8.863
  130   3HZ   LYS  16          1HZ       LYS  16 -12.685  -8.090   7.907
  131    H    ARG  17           H        ARG  17 -14.574 -15.090   3.053
  132    HA   ARG  17           HA       ARG  17 -17.468 -14.980   2.907
  133   1HB   ARG  17          2HB       ARG  17 -15.376 -16.356   1.203
  134   2HB   ARG  17          1HB       ARG  17 -17.100 -16.392   0.832
  135   1HG   ARG  17          2HG       ARG  17 -17.065 -13.859   0.904
  136   2HG   ARG  17          1HG       ARG  17 -15.307 -13.957   0.998
  137   1HD   ARG  17          2HD       ARG  17 -15.525 -15.489  -1.107
  138   2HD   ARG  17          1HD       ARG  17 -17.122 -14.757  -1.264
  139    HE   ARG  17           HE       ARG  17 -15.536 -12.555  -0.998
  140   1HH1  ARG  17          1HH1      ARG  17 -13.532 -14.778  -2.046
  141   2HH1  ARG  17          2HH1      ARG  17 -13.454 -14.307  -3.710
  142   1HH2  ARG  17          1HH2      ARG  17 -16.210 -12.212  -3.523
  143   2HH2  ARG  17          2HH2      ARG  17 -14.969 -12.855  -4.547
  144    H    PHE  18           H        PHE  18 -15.081 -17.466   3.677
  145    HA   PHE  18           HA       PHE  18 -16.948 -19.660   3.736
  146   1HB   PHE  18          2HB       PHE  18 -14.190 -19.204   4.849
  147   2HB   PHE  18          1HB       PHE  18 -15.095 -20.656   5.275
  148    HD1  PHE  18           HD1      PHE  18 -16.136 -22.005   3.296
  149    HD2  PHE  18           HD2      PHE  18 -12.974 -19.132   2.846
  150    HE1  PHE  18           HE1      PHE  18 -15.519 -23.025   1.121
  151    HE2  PHE  18           HE2      PHE  18 -12.358 -20.152   0.671
  152    HZ   PHE  18           HZ       PHE  18 -13.631 -22.098  -0.191
  153    H    ASP  19           H        ASP  19 -15.643 -17.519   6.264
  154    HA   ASP  19           HA       ASP  19 -17.057 -18.746   8.434
  155   1HB   ASP  19          2HB       ASP  19 -15.136 -16.953   8.451
  156   2HB   ASP  19          1HB       ASP  19 -16.466 -15.795   8.382
  157    H    ALA  20           H        ALA  20 -19.254 -19.050   8.151
  158    HA   ALA  20           HA       ALA  20 -20.958 -17.263   6.716
  159   1HB   ALA  20          2HB       ALA  20 -21.440 -19.521   8.646
  160   2HB   ALA  20          3HB       ALA  20 -21.752 -19.464   6.911
  161   3HB   ALA  20          1HB       ALA  20 -22.784 -18.563   8.023
  162    H    ASN  21           H        ASN  21 -20.622 -17.729  10.279
  163    HA   ASN  21           HA       ASN  21 -22.294 -15.326  10.661
  164   1HB   ASN  21          2HB       ASN  21 -22.188 -15.846  13.045
  165   2HB   ASN  21          1HB       ASN  21 -22.622 -17.292  12.138
  166   1HD2  ASN  21          1HD2      ASN  21 -21.369 -17.215  14.781
  167   2HD2  ASN  21          2HD2      ASN  21 -19.872 -17.995  14.638
  168    H    GLY  22           H        GLY  22 -18.935 -16.253  10.761
  169   1HA   GLY  22          1HA       GLY  22 -18.230 -13.400  11.064
  170   2HA   GLY  22          2HA       GLY  22 -17.125 -14.690  10.595
  171    H    ASP  23           H        ASP  23 -17.814 -16.457  12.800
  172    HA   ASP  23           HA       ASP  23 -17.130 -14.888  15.211
  173   1HB   ASP  23          2HB       ASP  23 -17.413 -17.002  16.436
  174   2HB   ASP  23          1HB       ASP  23 -18.815 -16.680  15.420
  175    H    GLY  24           H        GLY  24 -15.401 -15.997  12.696
  176   1HA   GLY  24          1HA       GLY  24 -12.959 -16.216  14.359
  177   2HA   GLY  24          2HA       GLY  24 -12.996 -15.898  12.626
  178    H    LYS  25           H        LYS  25 -15.134 -18.404  13.334
  179    HA   LYS  25           HA       LYS  25 -13.064 -20.388  12.519
  180   1HB   LYS  25          2HB       LYS  25 -14.035 -22.037  14.040
  181   2HB   LYS  25          1HB       LYS  25 -13.559 -20.605  14.951
  182   1HG   LYS  25          2HG       LYS  25 -15.808 -19.845  15.118
  183   2HG   LYS  25          1HG       LYS  25 -16.361 -20.977  13.882
  184   1HD   LYS  25          2HD       LYS  25 -15.529 -22.829  15.490
  185   2HD   LYS  25          1HD       LYS  25 -15.507 -21.562  16.718
  186   1HE   LYS  25          2HE       LYS  25 -17.664 -22.876  16.621
  187   2HE   LYS  25          1HE       LYS  25 -17.866 -21.135  16.419
  188   1HZ   LYS  25          1HZ       LYS  25 -17.400 -22.614  13.975
  189   2HZ   LYS  25          3HZ       LYS  25 -18.868 -22.965  14.749
  190   3HZ   LYS  25          2HZ       LYS  25 -18.507 -21.367  14.300
  191    H    ILE  26           H        ILE  26 -13.753 -21.950  11.076
  192    HA   ILE  26           HA       ILE  26 -16.511 -21.572   9.983
  193    HB   ILE  26           HB       ILE  26 -14.228 -22.867   8.502
  194   1HG1  ILE  26          2HG1      ILE  26 -14.895 -19.912   8.661
  195   2HG1  ILE  26          1HG1      ILE  26 -13.410 -20.676   9.228
  196   1HG2  ILE  26          1HG2      ILE  26 -16.549 -23.079   7.636
  197   2HG2  ILE  26          3HG2      ILE  26 -16.681 -21.320   7.609
  198   3HG2  ILE  26          2HG2      ILE  26 -15.527 -22.134   6.553
  199   1HD1  ILE  26          3HD1      ILE  26 -13.918 -21.438   6.492
  200   2HD1  ILE  26          2HD1      ILE  26 -13.943 -19.681   6.636
  201   3HD1  ILE  26          1HD1      ILE  26 -12.525 -20.587   7.159
  202    H    SER  27           H        SER  27 -17.849 -23.323   9.947
  203    HA   SER  27           HA       SER  27 -16.750 -25.900  10.970
  204   1HB   SER  27          2HB       SER  27 -18.835 -26.329  11.945
  205   2HB   SER  27          1HB       SER  27 -18.704 -24.580  12.131
  206    HG   SER  27           HG       SER  27 -20.618 -25.850  10.958
  207    H    ALA  28           H        ALA  28 -17.892 -27.872  10.012
  208    HA   ALA  28           HA       ALA  28 -17.560 -28.010   7.239
  209   1HB   ALA  28          3HB       ALA  28 -19.751 -29.640   8.465
  210   2HB   ALA  28          2HB       ALA  28 -18.474 -30.141   7.357
  211   3HB   ALA  28          1HB       ALA  28 -18.108 -29.872   9.062
  212    H    ALA  29           H        ALA  29 -20.549 -27.340   9.047
  213    HA   ALA  29           HA       ALA  29 -22.277 -27.101   6.824
  214   1HB   ALA  29          2HB       ALA  29 -23.371 -27.085   8.896
  215   2HB   ALA  29          1HB       ALA  29 -22.260 -25.898   9.579
  216   3HB   ALA  29          3HB       ALA  29 -23.477 -25.395   8.406
  217    H    GLU  30           H        GLU  30 -20.091 -24.722   8.294
  218    HA   GLU  30           HA       GLU  30 -20.983 -22.585   6.538
  219   1HB   GLU  30          2HB       GLU  30 -18.501 -22.851   8.260
  220   2HB   GLU  30          1HB       GLU  30 -18.979 -21.378   7.417
  221   1HG   GLU  30          2HG       GLU  30 -21.129 -21.386   8.662
  222   2HG   GLU  30          1HG       GLU  30 -20.602 -22.824   9.535
  223    H    LEU  31           H        LEU  31 -17.967 -24.512   6.692
  224    HA   LEU  31           HA       LEU  31 -16.942 -23.496   4.215
  225   1HB   LEU  31          2HB       LEU  31 -15.504 -24.664   5.839
  226   2HB   LEU  31          1HB       LEU  31 -16.410 -26.155   5.582
  227    HG   LEU  31           HG       LEU  31 -15.803 -25.821   3.072
  228   1HD1  LEU  31          1HD1      LEU  31 -14.742 -23.474   4.019
  229   2HD1  LEU  31          3HD1      LEU  31 -13.317 -24.510   3.967
  230   3HD1  LEU  31          2HD1      LEU  31 -14.267 -24.242   2.505
  231   1HD2  LEU  31          1HD2      LEU  31 -14.793 -27.408   4.964
  232   2HD2  LEU  31          3HD2      LEU  31 -14.061 -27.315   3.362
  233   3HD2  LEU  31          2HD2      LEU  31 -13.365 -26.406   4.703
  234    H    GLY  32           H        GLY  32 -18.977 -26.274   5.018
  235   1HA   GLY  32          1HA       GLY  32 -20.227 -27.700   3.633
  236   2HA   GLY  32          2HA       GLY  32 -19.031 -27.392   2.375
  237    H    GLU  33           H        GLU  33 -21.223 -25.155   4.083
  238    HA   GLU  33           HA       GLU  33 -23.108 -24.837   2.003
  239   1HB   GLU  33          2HB       GLU  33 -22.214 -23.170   4.317
  240   2HB   GLU  33          1HB       GLU  33 -23.219 -22.408   3.086
  241   1HG   GLU  33          2HG       GLU  33 -24.027 -25.084   4.173
  242   2HG   GLU  33          1HG       GLU  33 -24.343 -23.640   5.133
  243    H    ALA  34           H        ALA  34 -20.056 -23.107   2.595
  244    HA   ALA  34           HA       ALA  34 -20.385 -21.400   0.267
  245   1HB   ALA  34          1HB       ALA  34 -18.691 -20.323   1.295
  246   2HB   ALA  34          3HB       ALA  34 -18.533 -21.651   2.445
  247   3HB   ALA  34          2HB       ALA  34 -17.625 -21.681   0.933
  248    H    LEU  35           H        LEU  35 -18.691 -24.414   1.002
  249    HA   LEU  35           HA       LEU  35 -17.331 -24.723  -1.471
  250   1HB   LEU  35          2HB       LEU  35 -18.058 -26.425   0.806
  251   2HB   LEU  35          1HB       LEU  35 -17.989 -27.303  -0.722
  252    HG   LEU  35           HG       LEU  35 -15.800 -25.560   0.452
  253   1HD1  LEU  35          2HD1      LEU  35 -16.154 -28.540   0.073
  254   2HD1  LEU  35          1HD1      LEU  35 -14.571 -27.805   0.330
  255   3HD1  LEU  35          3HD1      LEU  35 -15.819 -27.669   1.569
  256   1HD2  LEU  35          1HD2      LEU  35 -16.215 -26.805  -2.245
  257   2HD2  LEU  35          3HD2      LEU  35 -15.500 -25.245  -1.832
  258   3HD2  LEU  35          2HD2      LEU  35 -14.580 -26.730  -1.587
  259    H    LYS  36           H        LYS  36 -20.682 -25.398  -0.551
  260    HA   LYS  36           HA       LYS  36 -21.547 -27.057  -2.597
  261   1HB   LYS  36          2HB       LYS  36 -22.760 -25.193  -0.808
  262   2HB   LYS  36          1HB       LYS  36 -23.434 -24.909  -2.413
  263   1HG   LYS  36          2HG       LYS  36 -24.108 -27.209  -2.622
  264   2HG   LYS  36          1HG       LYS  36 -23.208 -27.664  -1.175
  265   1HD   LYS  36          2HD       LYS  36 -24.964 -25.540  -0.452
  266   2HD   LYS  36          1HD       LYS  36 -25.908 -26.716  -1.365
  267   1HE   LYS  36          2HE       LYS  36 -24.228 -28.211   0.354
  268   2HE   LYS  36          1HE       LYS  36 -24.905 -26.910   1.334
  269   1HZ   LYS  36          3HZ       LYS  36 -26.810 -28.142  -0.435
  270   2HZ   LYS  36          2HZ       LYS  36 -26.170 -29.215   0.717
  271   3HZ   LYS  36          1HZ       LYS  36 -26.939 -27.785   1.219
  272    H    THR  37           H        THR  37 -20.417 -23.768  -2.859
  273    HA   THR  37           HA       THR  37 -21.531 -22.929  -5.283
  274    HB   THR  37           HB       THR  37 -19.909 -21.652  -3.789
  275    HG1  THR  37           HG1      THR  37 -20.514 -20.889  -5.838
  276   1HG2  THR  37          1HG2      THR  37 -18.220 -23.552  -3.814
  277   2HG2  THR  37          3HG2      THR  37 -17.816 -23.058  -5.458
  278   3HG2  THR  37          2HG2      THR  37 -17.555 -21.946  -4.115
  279    H    LEU  38           H        LEU  38 -19.253 -25.474  -4.679
  280    HA   LEU  38           HA       LEU  38 -18.093 -25.688  -7.283
  281   1HB   LEU  38          2HB       LEU  38 -18.646 -27.764  -5.149
  282   2HB   LEU  38          1HB       LEU  38 -17.766 -28.124  -6.634
  283    HG   LEU  38           HG       LEU  38 -16.994 -26.147  -4.471
  284   1HD1  LEU  38          1HD1      LEU  38 -16.261 -28.879  -5.177
  285   2HD1  LEU  38          3HD1      LEU  38 -14.856 -27.812  -5.159
  286   3HD1  LEU  38          2HD1      LEU  38 -15.871 -27.959  -3.724
  287   1HD2  LEU  38          2HD2      LEU  38 -16.250 -26.321  -7.338
  288   2HD2  LEU  38          1HD2      LEU  38 -16.206 -24.938  -6.246
  289   3HD2  LEU  38          3HD2      LEU  38 -14.909 -26.132  -6.210
  290    H    GLY  39           H        GLY  39 -21.163 -26.778  -5.956
  291   1HA   GLY  39          1HA       GLY  39 -22.328 -27.040  -8.580
  292   2HA   GLY  39          2HA       GLY  39 -23.091 -27.529  -7.067
  293    H    SER  40           H        SER  40 -20.246 -29.064  -6.897
  294    HA   SER  40           HA       SER  40 -21.412 -31.594  -7.837
  295   1HB   SER  40          2HB       SER  40 -19.374 -30.121  -9.348
  296   2HB   SER  40          1HB       SER  40 -18.894 -31.775  -8.967
  297    HG   SER  40           HG       SER  40 -21.047 -30.836 -10.487
  298    H    ILE  41           H        ILE  41 -20.994 -31.130  -5.254
  299    HA   ILE  41           HA       ILE  41 -18.603 -32.785  -4.651
  300    HB   ILE  41           HB       ILE  41 -18.135 -30.263  -4.352
  301   1HG1  ILE  41          2HG1      ILE  41 -17.815 -31.748  -1.765
  302   2HG1  ILE  41          1HG1      ILE  41 -17.023 -32.367  -3.214
  303   1HG2  ILE  41          3HG2      ILE  41 -20.524 -30.241  -3.063
  304   2HG2  ILE  41          2HG2      ILE  41 -19.436 -30.460  -1.692
  305   3HG2  ILE  41          1HG2      ILE  41 -19.249 -29.062  -2.754
  306   1HD1  ILE  41          2HD1      ILE  41 -16.290 -29.813  -3.459
  307   2HD1  ILE  41          1HD1      ILE  41 -16.522 -29.831  -1.711
  308   3HD1  ILE  41          3HD1      ILE  41 -15.370 -30.937  -2.459
  309    H    THR  42           H        THR  42 -18.717 -33.351  -2.168
  310    HA   THR  42           HA       THR  42 -21.582 -33.810  -1.441
  311    HB   THR  42           HB       THR  42 -21.254 -36.048  -1.237
  312    HG1  THR  42           HG1      THR  42 -19.273 -36.836  -0.246
  313   1HG2  THR  42          3HG2      THR  42 -20.121 -35.621  -3.402
  314   2HG2  THR  42          2HG2      THR  42 -18.587 -35.453  -2.546
  315   3HG2  THR  42          1HG2      THR  42 -19.424 -37.006  -2.559
  316    HA   PRO  43           HA       PRO  43 -20.587 -32.241   2.576
  317   1HB   PRO  43          2HB       PRO  43 -21.831 -33.960   4.255
  318   2HB   PRO  43          1HB       PRO  43 -22.708 -32.787   3.269
  319   1HG   PRO  43          2HG       PRO  43 -22.246 -35.706   2.781
  320   2HG   PRO  43          1HG       PRO  43 -23.727 -34.766   2.571
  321   1HD   PRO  43          1HD       PRO  43 -22.139 -35.422   0.484
  322   2HD   PRO  43          2HD       PRO  43 -23.046 -33.910   0.530
  323    H    ASP  44           H        ASP  44 -20.096 -35.707   2.095
  324    HA   ASP  44           HA       ASP  44 -18.359 -36.107   4.339
  325   1HB   ASP  44          2HB       ASP  44 -18.517 -37.628   1.720
  326   2HB   ASP  44          1HB       ASP  44 -17.714 -38.193   3.184
  327    H    GLU  45           H        GLU  45 -17.805 -34.690   1.181
  328    HA   GLU  45           HA       GLU  45 -14.905 -35.084   1.336
  329   1HB   GLU  45          2HB       GLU  45 -16.685 -33.477  -0.517
  330   2HB   GLU  45          1HB       GLU  45 -14.927 -33.516  -0.658
  331   1HG   GLU  45          2HG       GLU  45 -15.181 -36.088  -0.699
  332   2HG   GLU  45          1HG       GLU  45 -16.889 -35.783  -1.018
  333    H    VAL  46           H        VAL  46 -17.265 -32.510   1.866
  334    HA   VAL  46           HA       VAL  46 -15.346 -30.448   2.424
  335    HB   VAL  46           HB       VAL  46 -18.221 -30.786   3.325
  336   1HG1  VAL  46          3HG1      VAL  46 -16.477 -29.161   4.577
  337   2HG1  VAL  46          2HG1      VAL  46 -16.896 -28.119   3.218
  338   3HG1  VAL  46          1HG1      VAL  46 -18.158 -28.703   4.304
  339   1HG2  VAL  46          1HG2      VAL  46 -16.970 -30.060   0.841
  340   2HG2  VAL  46          3HG2      VAL  46 -18.690 -30.178   1.210
  341   3HG2  VAL  46          2HG2      VAL  46 -17.833 -28.661   1.481
  342    H    LYS  47           H        LYS  47 -16.920 -32.913   4.384
  343    HA   LYS  47           HA       LYS  47 -15.981 -31.940   6.931
  344   1HB   LYS  47          2HB       LYS  47 -16.808 -34.713   6.020
  345   2HB   LYS  47          1HB       LYS  47 -16.452 -34.294   7.696
  346   1HG   LYS  47          2HG       LYS  47 -18.220 -32.542   7.601
  347   2HG   LYS  47          1HG       LYS  47 -18.608 -33.053   5.958
  348   1HD   LYS  47          2HD       LYS  47 -19.051 -35.360   6.847
  349   2HD   LYS  47          1HD       LYS  47 -18.819 -34.727   8.477
  350   1HE   LYS  47          2HE       LYS  47 -20.648 -33.045   6.987
  351   2HE   LYS  47          1HE       LYS  47 -21.207 -34.719   6.984
  352   1HZ   LYS  47          3HZ       LYS  47 -20.416 -33.178   9.397
  353   2HZ   LYS  47          2HZ       LYS  47 -22.014 -33.492   8.914
  354   3HZ   LYS  47          1HZ       LYS  47 -20.997 -34.771   9.379
  355    H    HIS  48           H        HIS  48 -14.696 -34.212   4.542
  356    HA   HIS  48           HA       HIS  48 -12.425 -35.043   6.088
  357   1HB   HIS  48          2HB       HIS  48 -13.185 -36.281   4.094
  358   2HB   HIS  48          1HB       HIS  48 -12.766 -34.903   3.076
  359    HD1  HIS  48           HD1      HIS  48 -10.725 -35.664   1.830
  360    HD2  HIS  48           HD2      HIS  48 -10.480 -36.541   5.897
  361    HE1  HIS  48           HE1      HIS  48  -8.394 -36.573   2.227
  362    H    MET  49           H        MET  49 -12.953 -32.376   3.789
  363    HA   MET  49           HA       MET  49 -10.269 -31.466   3.634
  364   1HB   MET  49          2HB       MET  49 -12.956 -30.163   3.335
  365   2HB   MET  49          1HB       MET  49 -11.509 -29.160   3.366
  366   1HG   MET  49          2HG       MET  49 -10.624 -30.925   1.610
  367   2HG   MET  49          1HG       MET  49 -12.343 -31.223   1.356
  368   1HE   MET  49          3HE       MET  49 -13.696 -30.105  -0.124
  369   2HE   MET  49          2HE       MET  49 -13.124 -28.887  -1.262
  370   3HE   MET  49          1HE       MET  49 -12.298 -30.439  -1.156
  371    H    MET  50           H        MET  50 -12.864 -30.674   5.918
  372    HA   MET  50           HA       MET  50 -11.382 -28.798   7.472
  373   1HB   MET  50          2HB       MET  50 -13.757 -30.564   8.016
  374   2HB   MET  50          1HB       MET  50 -13.044 -29.605   9.309
  375   1HG   MET  50          2HG       MET  50 -13.243 -27.594   7.753
  376   2HG   MET  50          1HG       MET  50 -14.238 -28.613   6.714
  377   1HE   MET  50          3HE       MET  50 -13.540 -26.940   9.833
  378   2HE   MET  50          2HE       MET  50 -15.059 -26.702  10.694
  379   3HE   MET  50          1HE       MET  50 -14.182 -28.220  10.872
  380    H    ALA  51           H        ALA  51 -11.888 -32.293   7.899
  381    HA   ALA  51           HA       ALA  51 -10.335 -32.614  10.247
  382   1HB   ALA  51          3HB       ALA  51 -11.398 -34.594   9.776
  383   2HB   ALA  51          1HB       ALA  51  -9.867 -34.960   8.981
  384   3HB   ALA  51          2HB       ALA  51 -11.237 -34.383   8.033
  385    H    GLU  52           H        GLU  52  -9.398 -31.910   7.005
  386    HA   GLU  52           HA       GLU  52  -6.575 -32.682   7.536
  387   1HB   GLU  52          2HB       GLU  52  -8.137 -31.931   5.080
  388   2HB   GLU  52          1HB       GLU  52  -6.380 -31.763   5.079
  389   1HG   GLU  52          2HG       GLU  52  -6.350 -34.190   5.981
  390   2HG   GLU  52          1HG       GLU  52  -8.028 -34.266   5.442
  391    H    ILE  53           H        ILE  53  -8.627 -29.876   6.960
  392    HA   ILE  53           HA       ILE  53  -6.385 -27.997   7.030
  393    HB   ILE  53           HB       ILE  53  -9.380 -27.559   7.166
  394   1HG1  ILE  53          2HG1      ILE  53  -7.444 -27.283   4.855
  395   2HG1  ILE  53          1HG1      ILE  53  -8.544 -28.640   5.081
  396   1HG2  ILE  53          1HG2      ILE  53  -7.822 -25.744   8.088
  397   2HG2  ILE  53          3HG2      ILE  53  -7.242 -25.555   6.434
  398   3HG2  ILE  53          2HG2      ILE  53  -8.938 -25.251   6.813
  399   1HD1  ILE  53          2HD1      ILE  53  -9.536 -25.790   5.006
  400   2HD1  ILE  53          1HD1      ILE  53  -9.347 -26.746   3.536
  401   3HD1  ILE  53          3HD1      ILE  53 -10.462 -27.276   4.796
  402    H    ASP  54           H        ASP  54  -8.784 -29.276   9.262
  403    HA   ASP  54           HA       ASP  54  -8.517 -27.392  11.365
  404   1HB   ASP  54          2HB       ASP  54 -10.124 -29.454  10.978
  405   2HB   ASP  54          1HB       ASP  54  -8.893 -30.322  11.884
  406    H    THR  55           H        THR  55  -6.409 -26.832  11.909
  407    HA   THR  55           HA       THR  55  -4.254 -28.749  12.064
  408    HB   THR  55           HB       THR  55  -3.020 -26.860  13.168
  409    HG1  THR  55           HG1      THR  55  -4.429 -25.646  14.195
  410   1HG2  THR  55          2HG2      THR  55  -4.539 -26.417  10.597
  411   2HG2  THR  55          1HG2      THR  55  -3.315 -25.283  11.166
  412   3HG2  THR  55          3HG2      THR  55  -2.870 -26.950  10.800
  413    H    ASP  56           H        ASP  56  -6.236 -27.132  14.549
  414    HA   ASP  56           HA       ASP  56  -4.906 -28.719  16.646
  415   1HB   ASP  56          2HB       ASP  56  -6.043 -27.370  18.212
  416   2HB   ASP  56          1HB       ASP  56  -5.709 -26.268  16.877
  417    H    GLY  57           H        GLY  57  -8.049 -28.541  15.045
  418   1HA   GLY  57          1HA       GLY  57  -8.599 -31.279  16.078
  419   2HA   GLY  57          2HA       GLY  57  -9.335 -30.575  14.642
  420    H    ASP  58           H        ASP  58  -9.914 -27.999  16.094
  421    HA   ASP  58           HA       ASP  58 -11.741 -28.810  18.246
  422   1HB   ASP  58          2HB       ASP  58 -12.216 -26.476  18.524
  423   2HB   ASP  58          1HB       ASP  58 -10.487 -26.596  18.211
  424    H    GLY  59           H        GLY  59 -11.879 -28.916  14.924
  425   1HA   GLY  59          1HA       GLY  59 -14.847 -29.014  15.017
  426   2HA   GLY  59          2HA       GLY  59 -13.838 -29.770  13.784
  427    H    PHE  60           H        PHE  60 -12.584 -26.740  14.336
  428    HA   PHE  60           HA       PHE  60 -14.072 -25.678  11.985
  429   1HB   PHE  60          2HB       PHE  60 -13.359 -23.986  14.386
  430   2HB   PHE  60          1HB       PHE  60 -14.345 -23.527  12.998
  431    HD1  PHE  60           HD1      PHE  60 -14.228 -25.491  16.110
  432    HD2  PHE  60           HD2      PHE  60 -16.624 -24.341  12.739
  433    HE1  PHE  60           HE1      PHE  60 -16.252 -26.342  17.259
  434    HE2  PHE  60           HE2      PHE  60 -18.645 -25.196  13.884
  435    HZ   PHE  60           HZ       PHE  60 -18.464 -26.198  16.147
  436    H    ILE  61           H        ILE  61 -12.951 -24.034  10.791
  437    HA   ILE  61           HA       ILE  61  -9.999 -24.194  11.113
  438    HB   ILE  61           HB       ILE  61 -11.571 -23.326   8.676
  439   1HG1  ILE  61          2HG1      ILE  61 -12.149 -25.642   9.175
  440   2HG1  ILE  61          1HG1      ILE  61 -11.047 -25.609   7.799
  441   1HG2  ILE  61          2HG2      ILE  61  -9.150 -22.627   8.943
  442   2HG2  ILE  61          1HG2      ILE  61  -8.728 -24.339   8.924
  443   3HG2  ILE  61          3HG2      ILE  61  -9.481 -23.602   7.511
  444   1HD1  ILE  61          1HD1      ILE  61  -9.148 -26.032   9.382
  445   2HD1  ILE  61          3HD1      ILE  61 -10.323 -26.206  10.685
  446   3HD1  ILE  61          2HD1      ILE  61 -10.321 -27.350   9.341
  447    H    SER  62           H        SER  62  -8.997 -22.331  11.744
  448    HA   SER  62           HA       SER  62 -10.612 -19.856  11.902
  449   1HB   SER  62          2HB       SER  62  -8.020 -19.396  12.926
  450   2HB   SER  62          1HB       SER  62  -9.499 -19.651  13.853
  451    HG   SER  62           HG       SER  62  -7.535 -21.509  13.079
  452    H    PHE  63           H        PHE  63  -9.385 -17.791  11.290
  453    HA   PHE  63           HA       PHE  63  -8.679 -17.854   8.556
  454   1HB   PHE  63          2HB       PHE  63  -9.287 -15.766   9.745
  455   2HB   PHE  63          1HB       PHE  63  -7.763 -15.840  10.634
  456    HD1  PHE  63           HD1      PHE  63  -8.777 -16.374   7.063
  457    HD2  PHE  63           HD2      PHE  63  -6.179 -14.342   9.811
  458    HE1  PHE  63           HE1      PHE  63  -7.616 -15.291   5.162
  459    HE2  PHE  63           HE2      PHE  63  -5.014 -13.261   7.909
  460    HZ   PHE  63           HZ       PHE  63  -5.736 -13.733   5.583
  461    H    GLN  64           H        GLN  64  -6.630 -17.937  11.447
  462    HA   GLN  64           HA       GLN  64  -4.114 -17.932  10.114
  463   1HB   GLN  64          2HB       GLN  64  -4.510 -17.656  12.592
  464   2HB   GLN  64          1HB       GLN  64  -4.812 -19.390  12.679
  465   1HG   GLN  64          2HG       GLN  64  -2.482 -18.992  13.248
  466   2HG   GLN  64          1HG       GLN  64  -2.543 -19.773  11.668
  467   1HE2  GLN  64          1HE2      GLN  64  -1.022 -18.815  10.313
  468   2HE2  GLN  64          2HE2      GLN  64  -0.688 -17.152  10.239
  469    H    GLU  65           H        GLU  65  -6.152 -20.655  11.223
  470    HA   GLU  65           HA       GLU  65  -4.507 -22.757  10.259
  471   1HB   GLU  65          2HB       GLU  65  -7.379 -22.443  10.957
  472   2HB   GLU  65          1HB       GLU  65  -6.966 -23.826   9.949
  473   1HG   GLU  65          2HG       GLU  65  -5.370 -24.620  11.586
  474   2HG   GLU  65          1HG       GLU  65  -5.559 -23.155  12.548
  475    H    PHE  66           H        PHE  66  -7.190 -21.033   8.684
  476    HA   PHE  66           HA       PHE  66  -7.070 -22.435   6.204
  477   1HB   PHE  66          2HB       PHE  66  -8.932 -20.920   6.924
  478   2HB   PHE  66          1HB       PHE  66  -7.864 -19.544   6.650
  479    HD1  PHE  66           HD1      PHE  66  -7.086 -18.977   4.374
  480    HD2  PHE  66           HD2      PHE  66  -9.876 -22.168   5.075
  481    HE1  PHE  66           HE1      PHE  66  -7.664 -19.003   1.963
  482    HE2  PHE  66           HE2      PHE  66 -10.454 -22.194   2.663
  483    HZ   PHE  66           HZ       PHE  66  -9.348 -20.611   1.107
  484    H    THR  67           H        THR  67  -5.343 -19.593   7.402
  485    HA   THR  67           HA       THR  67  -4.058 -18.923   4.923
  486    HB   THR  67           HB       THR  67  -3.249 -18.422   7.803
  487    HG1  THR  67           HG1      THR  67  -4.323 -16.594   7.554
  488   1HG2  THR  67          3HG2      THR  67  -1.325 -18.400   6.171
  489   2HG2  THR  67          2HG2      THR  67  -2.157 -17.111   5.302
  490   3HG2  THR  67          1HG2      THR  67  -1.623 -16.852   6.963
  491    H    ASP  68           H        ASP  68  -2.980 -20.871   7.720
  492    HA   ASP  68           HA       ASP  68  -0.436 -21.582   6.659
  493   1HB   ASP  68          2HB       ASP  68  -2.251 -23.156   8.511
  494   2HB   ASP  68          1HB       ASP  68  -0.541 -23.493   8.242
  495    H    PHE  69           H        PHE  69  -3.632 -23.056   6.262
  496    HA   PHE  69           HA       PHE  69  -2.623 -25.279   4.687
  497   1HB   PHE  69          2HB       PHE  69  -4.628 -25.911   5.613
  498   2HB   PHE  69          1HB       PHE  69  -5.255 -24.266   5.625
  499    HD1  PHE  69           HD1      PHE  69  -5.891 -23.226   3.363
  500    HD2  PHE  69           HD2      PHE  69  -5.331 -27.436   3.970
  501    HE1  PHE  69           HE1      PHE  69  -7.203 -23.697   1.307
  502    HE2  PHE  69           HE2      PHE  69  -6.635 -27.911   1.920
  503    HZ   PHE  69           HZ       PHE  69  -7.576 -26.041   0.585
  504    H    GLY  70           H        GLY  70  -4.069 -22.116   4.044
  505   1HA   GLY  70          1HA       GLY  70  -4.091 -20.832   2.080
  506   2HA   GLY  70          2HA       GLY  70  -4.419 -22.350   1.243
  507    H    ARG  71           H        ARG  71  -1.533 -21.900   3.174
  508    HA   ARG  71           HA       ARG  71   0.192 -21.086   0.996
  509   1HB   ARG  71          2HB       ARG  71   0.819 -22.400   3.658
  510   2HB   ARG  71          1HB       ARG  71   2.033 -21.754   2.555
  511   1HG   ARG  71          2HG       ARG  71   0.932 -19.525   2.701
  512   2HG   ARG  71          1HG       ARG  71  -0.203 -20.187   3.875
  513   1HD   ARG  71          2HD       ARG  71   2.811 -20.077   4.199
  514   2HD   ARG  71          1HD       ARG  71   1.651 -19.029   5.015
  515    HE   ARG  71           HE       ARG  71   1.036 -21.801   5.516
  516   1HH1  ARG  71          1HH1      ARG  71   2.846 -19.033   6.456
  517   2HH1  ARG  71          2HH1      ARG  71   3.365 -19.713   7.962
  518   1HH2  ARG  71          1HH2      ARG  71   1.853 -22.781   7.403
  519   2HH2  ARG  71          2HH2      ARG  71   2.803 -21.835   8.497
  520    H    ALA  72           H        ALA  72  -0.946 -24.147   2.253
  521    HA   ALA  72           HA       ALA  72   0.980 -25.814   0.894
  522   1HB   ALA  72          2HB       ALA  72  -0.037 -27.294   2.259
  523   2HB   ALA  72          3HB       ALA  72  -1.425 -27.261   1.173
  524   3HB   ALA  72          1HB       ALA  72  -1.364 -26.168   2.557
  525    H    ASN  73           H        ASN  73  -1.903 -24.145  -0.077
  526    HA   ASN  73           HA       ASN  73  -1.483 -25.077  -2.850
  527   1HB   ASN  73          2HB       ASN  73  -4.296 -25.121  -1.800
  528   2HB   ASN  73          1HB       ASN  73  -3.605 -25.991  -3.170
  529   1HD2  ASN  73          1HD2      ASN  73  -4.411 -26.243   0.168
  530   2HD2  ASN  73          2HD2      ASN  73  -3.646 -27.727   0.471
  531    H    ARG  74           H        ARG  74  -0.785 -22.634  -2.200
  532    HA   ARG  74           HA       ARG  74  -2.659 -20.572  -1.920
  533   1HB   ARG  74          2HB       ARG  74  -0.143 -20.576  -3.620
  534   2HB   ARG  74          1HB       ARG  74  -1.021 -19.132  -3.117
  535   1HG   ARG  74          2HG       ARG  74  -0.668 -19.791  -0.735
  536   2HG   ARG  74          1HG       ARG  74   0.295 -21.163  -1.287
  537   1HD   ARG  74          2HD       ARG  74   1.845 -19.593  -2.427
  538   2HD   ARG  74          1HD       ARG  74   0.899 -18.236  -1.813
  539    HE   ARG  74           HE       ARG  74   1.539 -19.629   0.476
  540   1HH1  ARG  74          1HH1      ARG  74   3.052 -17.727  -1.912
  541   2HH1  ARG  74          2HH1      ARG  74   4.616 -17.766  -1.168
  542   1HH2  ARG  74          1HH2      ARG  74   3.673 -19.992   1.316
  543   2HH2  ARG  74          2HH2      ARG  74   4.967 -19.049   0.658
  544    H    GLY  75           H        GLY  75  -1.870 -22.507  -4.731
  545   1HA   GLY  75          1HA       GLY  75  -2.851 -22.614  -6.846
  546   2HA   GLY  75          2HA       GLY  75  -3.181 -20.888  -6.696
  547    H    LEU  76           H        LEU  76  -4.324 -23.261  -4.375
  548    HA   LEU  76           HA       LEU  76  -6.927 -23.666  -5.523
  549   1HB   LEU  76          2HB       LEU  76  -5.868 -23.952  -2.704
  550   2HB   LEU  76          1HB       LEU  76  -7.529 -24.352  -3.141
  551    HG   LEU  76           HG       LEU  76  -5.052 -25.550  -4.419
  552   1HD1  LEU  76          2HD1      LEU  76  -6.221 -26.123  -1.937
  553   2HD1  LEU  76          1HD1      LEU  76  -6.849 -27.362  -3.024
  554   3HD1  LEU  76          3HD1      LEU  76  -5.107 -27.156  -2.834
  555   1HD2  LEU  76          1HD2      LEU  76  -7.875 -25.482  -5.144
  556   2HD2  LEU  76          3HD2      LEU  76  -6.496 -26.068  -6.076
  557   3HD2  LEU  76          2HD2      LEU  76  -7.297 -27.134  -4.922
  558    H    LEU  77           H        LEU  77  -5.709 -21.406  -3.068
  559    HA   LEU  77           HA       LEU  77  -8.271 -20.178  -2.583
  560   1HB   LEU  77          2HB       LEU  77  -5.644 -18.752  -2.205
  561   2HB   LEU  77          1HB       LEU  77  -7.110 -18.640  -1.232
  562    HG   LEU  77           HG       LEU  77  -5.131 -20.925  -1.355
  563   1HD1  LEU  77          3HD1      LEU  77  -5.774 -18.749   0.485
  564   2HD1  LEU  77          2HD1      LEU  77  -5.834 -20.327   1.273
  565   3HD1  LEU  77          1HD1      LEU  77  -4.362 -19.807   0.452
  566   1HD2  LEU  77          1HD2      LEU  77  -7.453 -21.811  -1.472
  567   2HD2  LEU  77          3HD2      LEU  77  -6.677 -22.195   0.066
  568   3HD2  LEU  77          2HD2      LEU  77  -7.858 -20.889  -0.024
  569    H    LYS  78           H        LYS  78  -5.795 -19.705  -5.017
  570    HA   LYS  78           HA       LYS  78  -6.815 -17.091  -5.841
  571   1HB   LYS  78          2HB       LYS  78  -4.898 -19.041  -7.153
  572   2HB   LYS  78          1HB       LYS  78  -5.294 -17.454  -7.815
  573   1HG   LYS  78          2HG       LYS  78  -4.589 -16.502  -5.540
  574   2HG   LYS  78          1HG       LYS  78  -3.897 -18.090  -5.209
  575   1HD   LYS  78          2HD       LYS  78  -3.220 -16.431  -7.655
  576   2HD   LYS  78          1HD       LYS  78  -2.253 -16.445  -6.181
  577   1HE   LYS  78          2HE       LYS  78  -2.293 -19.049  -6.501
  578   2HE   LYS  78          1HE       LYS  78  -2.699 -18.653  -8.171
  579   1HZ   LYS  78          1HZ       LYS  78  -0.686 -16.992  -7.793
  580   2HZ   LYS  78          3HZ       LYS  78  -0.222 -18.206  -6.703
  581   3HZ   LYS  78          2HZ       LYS  78  -0.463 -18.584  -8.343
  582    H    ASP  79           H        ASP  79  -7.479 -20.428  -6.555
  583    HA   ASP  79           HA       ASP  79  -9.015 -19.742  -8.984
  584   1HB   ASP  79          2HB       ASP  79  -8.173 -22.280  -7.624
  585   2HB   ASP  79          1HB       ASP  79  -9.514 -22.314  -8.765
  586    H    VAL  80           H        VAL  80  -9.558 -21.096  -5.742
  587    HA   VAL  80           HA       VAL  80 -12.385 -21.382  -5.960
  588    HB   VAL  80           HB       VAL  80 -10.796 -22.226  -4.109
  589   1HG1  VAL  80          3HG1      VAL  80  -9.842 -19.998  -3.579
  590   2HG1  VAL  80          2HG1      VAL  80 -11.426 -19.474  -3.009
  591   3HG1  VAL  80          1HG1      VAL  80 -10.565 -20.760  -2.163
  592   1HG2  VAL  80          1HG2      VAL  80 -13.577 -21.264  -3.950
  593   2HG2  VAL  80          3HG2      VAL  80 -12.909 -22.842  -3.530
  594   3HG2  VAL  80          2HG2      VAL  80 -12.802 -21.504  -2.383
  595    H    ALA  81           H        ALA  81 -10.373 -18.712  -4.822
  596    HA   ALA  81           HA       ALA  81 -12.359 -16.919  -3.979
  597   1HB   ALA  81          2HB       ALA  81 -10.608 -15.219  -5.184
  598   2HB   ALA  81          3HB       ALA  81  -9.610 -16.667  -5.046
  599   3HB   ALA  81          1HB       ALA  81 -10.326 -15.950  -3.604
  600    H    LYS  82           H        LYS  82 -11.223 -17.580  -7.270
  601    HA   LYS  82           HA       LYS  82 -12.672 -15.532  -8.601
  602   1HB   LYS  82          2HB       LYS  82 -11.918 -18.312  -9.550
  603   2HB   LYS  82          1HB       LYS  82 -12.514 -17.027 -10.601
  604   1HG   LYS  82          2HG       LYS  82 -10.605 -15.591  -9.785
  605   2HG   LYS  82          1HG       LYS  82  -9.969 -17.011  -8.955
  606   1HD   LYS  82          2HD       LYS  82  -9.957 -18.218 -11.154
  607   2HD   LYS  82          1HD       LYS  82 -10.433 -16.710 -11.937
  608   1HE   LYS  82          2HE       LYS  82  -8.395 -15.642 -11.369
  609   2HE   LYS  82          1HE       LYS  82  -7.997 -16.863 -10.160
  610   1HZ   LYS  82          3HZ       LYS  82  -8.200 -17.398 -13.072
  611   2HZ   LYS  82          2HZ       LYS  82  -6.741 -17.101 -12.253
  612   3HZ   LYS  82          1HZ       LYS  82  -7.667 -18.475 -11.874
  613    H    ILE  83           H        ILE  83 -13.694 -18.658  -7.363
  614    HA   ILE  83           HA       ILE  83 -16.156 -18.906  -8.759
  615    HB   ILE  83           HB       ILE  83 -15.413 -19.769  -5.949
  616   1HG1  ILE  83          2HG1      ILE  83 -15.449 -21.209  -8.619
  617   2HG1  ILE  83          1HG1      ILE  83 -14.018 -20.780  -7.680
  618   1HG2  ILE  83          2HG2      ILE  83 -17.750 -20.571  -7.710
  619   2HG2  ILE  83          1HG2      ILE  83 -17.329 -21.331  -6.176
  620   3HG2  ILE  83          3HG2      ILE  83 -17.852 -19.648  -6.211
  621   1HD1  ILE  83          3HD1      ILE  83 -16.226 -22.569  -6.630
  622   2HD1  ILE  83          2HD1      ILE  83 -14.768 -23.182  -7.409
  623   3HD1  ILE  83          1HD1      ILE  83 -14.648 -22.279  -5.899
  624    H    PHE  84           H        PHE  84 -15.252 -16.972  -5.964
  625    HA   PHE  84           HA       PHE  84 -18.064 -15.997  -5.757
  626   1HB   PHE  84          2HB       PHE  84 -15.716 -15.712  -3.859
  627   2HB   PHE  84          1HB       PHE  84 -17.318 -15.028  -3.583
  628    HD1  PHE  84           HD1      PHE  84 -15.740 -18.306  -4.524
  629    HD2  PHE  84           HD2      PHE  84 -18.833 -16.283  -2.335
  630    HE1  PHE  84           HE1      PHE  84 -16.506 -20.476  -3.602
  631    HE2  PHE  84           HE2      PHE  84 -19.599 -18.454  -1.412
  632    HZ   PHE  84           HZ       PHE  84 -18.436 -20.551  -2.045

  No H/Q in entry =         632
  Start of MODEL   12
    1    H1   ALA   1          1H        ALA   1   9.850 -17.549   0.195
    2    H2   ALA   1          3H        ALA   1   8.340 -18.253   0.514
    3    H3   ALA   1          2H        ALA   1   9.464 -19.065  -0.468
    4    HA   ALA   1           HA       ALA   1   9.204 -17.570  -2.232
    5   1HB   ALA   1          1HB       ALA   1   7.187 -19.146  -1.461
    6   2HB   ALA   1          3HB       ALA   1   6.381 -17.590  -1.255
    7   3HB   ALA   1          2HB       ALA   1   7.025 -18.047  -2.832
    8    H    ASP   2           H        ASP   2   6.831 -15.847  -2.430
    9    HA   ASP   2           HA       ASP   2   7.924 -13.498  -0.944
   10   1HB   ASP   2          2HB       ASP   2   7.839 -13.484  -3.501
   11   2HB   ASP   2          1HB       ASP   2   6.083 -13.416  -3.343
   12    H    ASP   3           H        ASP   3   6.698 -14.002   0.990
   13    HA   ASP   3           HA       ASP   3   3.744 -13.934   0.732
   14   1HB   ASP   3          2HB       ASP   3   4.801 -15.626   2.227
   15   2HB   ASP   3          1HB       ASP   3   5.473 -14.315   3.196
   16    H    HIS   4           H        HIS   4   2.916 -11.894   0.627
   17    HA   HIS   4           HA       HIS   4   4.117  -9.829   2.431
   18   1HB   HIS   4          2HB       HIS   4   2.597  -8.509   0.456
   19   2HB   HIS   4          1HB       HIS   4   4.352  -8.542   0.593
   20    HD1  HIS   4           HD1      HIS   4   1.563  -9.742  -1.489
   21    HD2  HIS   4           HD2      HIS   4   5.583 -10.716  -0.965
   22    HE1  HIS   4           HE1      HIS   4   2.222 -11.164  -3.480
   23    HA   PRO   5           HA       PRO   5   0.175  -9.129   4.325
   24   1HB   PRO   5          2HB       PRO   5  -0.214  -6.457   4.164
   25   2HB   PRO   5          1HB       PRO   5   0.971  -7.189   5.250
   26   1HG   PRO   5          2HG       PRO   5   1.381  -5.935   2.559
   27   2HG   PRO   5          1HG       PRO   5   2.344  -5.748   4.029
   28   1HD   PRO   5          1HD       PRO   5   3.109  -7.388   2.026
   29   2HD   PRO   5          2HD       PRO   5   3.444  -7.764   3.718
   30    H    GLN   6           H        GLN   6   0.615  -7.925   1.080
   31    HA   GLN   6           HA       GLN   6  -2.086  -7.182   0.510
   32   1HB   GLN   6          2HB       GLN   6   0.315  -7.951  -1.102
   33   2HB   GLN   6          1HB       GLN   6  -1.255  -7.930  -1.906
   34   1HG   GLN   6          2HG       GLN   6  -1.584  -5.628  -1.455
   35   2HG   GLN   6          1HG       GLN   6  -0.325  -5.605  -0.221
   36   1HE2  GLN   6          1HE2      GLN   6   1.950  -6.375  -1.227
   37   2HE2  GLN   6          2HE2      GLN   6   2.342  -5.662  -2.716
   38    H    ASP   7           H        ASP   7  -0.363 -10.268   0.346
   39    HA   ASP   7           HA       ASP   7  -2.450 -11.754  -0.932
   40   1HB   ASP   7          2HB       ASP   7  -0.216 -12.588   0.932
   41   2HB   ASP   7          1HB       ASP   7  -1.313 -13.744   0.176
   42    H    LYS   8           H        LYS   8  -1.723 -11.128   2.485
   43    HA   LYS   8           HA       LYS   8  -3.654 -12.784   3.681
   44   1HB   LYS   8          2HB       LYS   8  -2.438 -10.146   4.435
   45   2HB   LYS   8          1HB       LYS   8  -3.772 -10.783   5.397
   46   1HG   LYS   8          2HG       LYS   8  -2.378 -13.003   5.374
   47   2HG   LYS   8          1HG       LYS   8  -1.030 -11.942   4.962
   48   1HD   LYS   8          2HD       LYS   8  -1.588 -10.546   6.968
   49   2HD   LYS   8          1HD       LYS   8  -2.815 -11.736   7.405
   50   1HE   LYS   8          2HE       LYS   8  -1.069 -12.620   8.609
   51   2HE   LYS   8          1HE       LYS   8  -0.717 -13.393   7.062
   52   1HZ   LYS   8          2HZ       LYS   8   0.552 -11.148   6.665
   53   2HZ   LYS   8          1HZ       LYS   8   0.619 -11.138   8.363
   54   3HZ   LYS   8          3HZ       LYS   8   1.284 -12.436   7.498
   55    H    ALA   9           H        ALA   9  -4.034  -9.625   2.155
   56    HA   ALA   9           HA       ALA   9  -6.712  -9.102   2.950
   57   1HB   ALA   9          3HB       ALA   9  -5.287  -8.404   0.363
   58   2HB   ALA   9          2HB       ALA   9  -6.837  -7.726   0.860
   59   3HB   ALA   9          1HB       ALA   9  -5.386  -7.397   1.808
   60    H    GLU  10           H        GLU  10  -5.426 -10.882   0.162
   61    HA   GLU  10           HA       GLU  10  -8.006 -11.587  -0.907
   62   1HB   GLU  10          2HB       GLU  10  -5.400 -13.107  -1.216
   63   2HB   GLU  10          1HB       GLU  10  -6.797 -13.174  -2.290
   64   1HG   GLU  10          2HG       GLU  10  -6.487 -10.680  -2.667
   65   2HG   GLU  10          1HG       GLU  10  -4.953 -10.820  -1.809
   66    H    ARG  11           H        ARG  11  -5.729 -13.238   1.255
   67    HA   ARG  11           HA       ARG  11  -7.288 -15.631   1.564
   68   1HB   ARG  11          2HB       ARG  11  -5.198 -14.312   3.313
   69   2HB   ARG  11          1HB       ARG  11  -5.919 -15.876   3.689
   70   1HG   ARG  11          2HG       ARG  11  -5.221 -16.556   1.293
   71   2HG   ARG  11          1HG       ARG  11  -4.197 -15.121   1.326
   72   1HD   ARG  11          2HD       ARG  11  -3.439 -16.127   3.661
   73   2HD   ARG  11          1HD       ARG  11  -3.997 -17.636   2.940
   74    HE   ARG  11           HE       ARG  11  -1.804 -15.938   1.839
   75   1HH1  ARG  11          1HH1      ARG  11  -3.117 -17.539  -0.274
   76   2HH1  ARG  11          2HH1      ARG  11  -2.236 -19.030  -0.230
   77   1HH2  ARG  11          1HH2      ARG  11  -0.866 -18.435   2.900
   78   2HH2  ARG  11          2HH2      ARG  11  -0.960 -19.535   1.567
   79    H    GLU  12           H        GLU  12  -7.170 -12.571   3.327
   80    HA   GLU  12           HA       GLU  12  -8.973 -13.352   5.424
   81   1HB   GLU  12          2HB       GLU  12  -7.880 -10.782   4.377
   82   2HB   GLU  12          1HB       GLU  12  -9.338 -10.697   5.364
   83   1HG   GLU  12          2HG       GLU  12  -8.049 -12.249   7.005
   84   2HG   GLU  12          1HG       GLU  12  -6.612 -11.740   6.117
   85    H    ARG  13           H        ARG  13  -9.451 -11.788   2.277
   86    HA   ARG  13           HA       ARG  13 -12.283 -11.381   2.624
   87   1HB   ARG  13          2HB       ARG  13 -10.643 -11.648   0.086
   88   2HB   ARG  13          1HB       ARG  13 -12.305 -11.060   0.162
   89   1HG   ARG  13          2HG       ARG  13 -11.694  -9.085   1.256
   90   2HG   ARG  13          1HG       ARG  13 -10.191  -9.775   1.871
   91   1HD   ARG  13          2HD       ARG  13  -9.048  -9.355  -0.071
   92   2HD   ARG  13          1HD       ARG  13 -10.461  -9.642  -1.087
   93    HE   ARG  13           HE       ARG  13 -11.233  -7.331  -0.109
   94   1HH1  ARG  13          1HH1      ARG  13  -8.873  -7.869  -2.260
   95   2HH1  ARG  13          2HH1      ARG  13  -7.898  -6.485  -1.890
   96   1HH2  ARG  13          1HH2      ARG  13  -9.602  -5.735   1.036
   97   2HH2  ARG  13          2HH2      ARG  13  -8.311  -5.278  -0.025
   98    H    ILE  14           H        ILE  14 -10.332 -13.981   1.216
   99    HA   ILE  14           HA       ILE  14 -12.603 -15.535   0.323
  100    HB   ILE  14           HB       ILE  14  -9.797 -16.468   1.000
  101   1HG1  ILE  14          2HG1      ILE  14 -10.783 -15.846  -1.765
  102   2HG1  ILE  14          1HG1      ILE  14 -10.204 -14.536  -0.741
  103   1HG2  ILE  14          3HG2      ILE  14 -11.887 -18.068   0.594
  104   2HG2  ILE  14          2HG2      ILE  14 -11.544 -17.692  -1.095
  105   3HG2  ILE  14          1HG2      ILE  14 -10.306 -18.444  -0.090
  106   1HD1  ILE  14          3HD1      ILE  14  -8.127 -16.004  -0.336
  107   2HD1  ILE  14          2HD1      ILE  14  -8.687 -16.965  -1.704
  108   3HD1  ILE  14          1HD1      ILE  14  -8.280 -15.264  -1.930
  109    H    PHE  15           H        PHE  15 -10.520 -15.626   3.218
  110    HA   PHE  15           HA       PHE  15 -11.868 -17.855   4.430
  111   1HB   PHE  15          2HB       PHE  15  -9.644 -17.097   5.190
  112   2HB   PHE  15          1HB       PHE  15 -10.353 -15.587   5.765
  113    HD1  PHE  15           HD1      PHE  15 -10.190 -19.248   6.273
  114    HD2  PHE  15           HD2      PHE  15 -11.712 -15.524   7.777
  115    HE1  PHE  15           HE1      PHE  15 -10.819 -20.365   8.396
  116    HE2  PHE  15           HE2      PHE  15 -12.339 -16.641   9.904
  117    HZ   PHE  15           HZ       PHE  15 -11.895 -19.064  10.212
  118    H    LYS  16           H        LYS  16 -12.408 -14.369   4.489
  119    HA   LYS  16           HA       LYS  16 -14.415 -14.386   6.546
  120   1HB   LYS  16          2HB       LYS  16 -13.685 -12.489   4.326
  121   2HB   LYS  16          1HB       LYS  16 -15.139 -12.213   5.284
  122   1HG   LYS  16          2HG       LYS  16 -12.436 -12.693   6.553
  123   2HG   LYS  16          1HG       LYS  16 -13.001 -11.078   6.125
  124   1HD   LYS  16          2HD       LYS  16 -15.003 -11.407   7.534
  125   2HD   LYS  16          1HD       LYS  16 -14.435 -13.020   7.964
  126   1HE   LYS  16          2HE       LYS  16 -12.403 -10.951   8.383
  127   2HE   LYS  16          1HE       LYS  16 -13.855 -10.690   9.350
  128   1HZ   LYS  16          3HZ       LYS  16 -13.323 -13.394   9.481
  129   2HZ   LYS  16          2HZ       LYS  16 -11.818 -12.630   9.676
  130   3HZ   LYS  16          1HZ       LYS  16 -13.108 -12.249  10.714
  131    H    ARG  17           H        ARG  17 -14.470 -15.067   3.106
  132    HA   ARG  17           HA       ARG  17 -17.341 -14.920   2.802
  133   1HB   ARG  17          2HB       ARG  17 -15.137 -16.238   1.209
  134   2HB   ARG  17          1HB       ARG  17 -16.835 -16.405   0.759
  135   1HG   ARG  17          2HG       ARG  17 -16.916 -13.821   0.910
  136   2HG   ARG  17          1HG       ARG  17 -15.156 -13.900   0.864
  137   1HD   ARG  17          2HD       ARG  17 -15.506 -15.430  -1.213
  138   2HD   ARG  17          1HD       ARG  17 -17.135 -14.753  -1.242
  139    HE   ARG  17           HE       ARG  17 -15.952 -12.476  -1.342
  140   1HH1  ARG  17          1HH1      ARG  17 -13.232 -13.964  -1.182
  141   2HH1  ARG  17          2HH1      ARG  17 -12.724 -13.849  -2.834
  142   1HH2  ARG  17          1HH2      ARG  17 -15.858 -12.947  -4.012
  143   2HH2  ARG  17          2HH2      ARG  17 -14.211 -13.271  -4.437
  144    H    PHE  18           H        PHE  18 -15.053 -17.504   3.587
  145    HA   PHE  18           HA       PHE  18 -17.009 -19.619   3.576
  146   1HB   PHE  18          2HB       PHE  18 -14.261 -19.315   4.779
  147   2HB   PHE  18          1HB       PHE  18 -15.232 -20.756   5.078
  148    HD1  PHE  18           HD1      PHE  18 -16.079 -22.099   3.092
  149    HD2  PHE  18           HD2      PHE  18 -13.124 -19.004   2.716
  150    HE1  PHE  18           HE1      PHE  18 -15.412 -23.004   0.882
  151    HE2  PHE  18           HE2      PHE  18 -12.457 -19.909   0.505
  152    HZ   PHE  18           HZ       PHE  18 -13.601 -21.909  -0.411
  153    H    ASP  19           H        ASP  19 -15.588 -17.678   6.210
  154    HA   ASP  19           HA       ASP  19 -17.067 -18.845   8.333
  155   1HB   ASP  19          2HB       ASP  19 -15.145 -17.073   8.395
  156   2HB   ASP  19          1HB       ASP  19 -16.452 -15.893   8.266
  157    H    ALA  20           H        ALA  20 -19.262 -19.145   8.039
  158    HA   ALA  20           HA       ALA  20 -20.962 -17.385   6.580
  159   1HB   ALA  20          3HB       ALA  20 -21.406 -19.808   7.148
  160   2HB   ALA  20          2HB       ALA  20 -21.820 -19.275   8.778
  161   3HB   ALA  20          1HB       ALA  20 -22.774 -18.725   7.401
  162    H    ASN  21           H        ASN  21 -20.667 -17.770  10.159
  163    HA   ASN  21           HA       ASN  21 -22.316 -15.341  10.459
  164   1HB   ASN  21          2HB       ASN  21 -22.257 -15.804  12.854
  165   2HB   ASN  21          1HB       ASN  21 -22.677 -17.273  11.979
  166   1HD2  ASN  21          1HD2      ASN  21 -21.453 -17.083  14.647
  167   2HD2  ASN  21          2HD2      ASN  21 -19.967 -17.891  14.555
  168    H    GLY  22           H        GLY  22 -18.984 -16.237  10.452
  169   1HA   GLY  22          1HA       GLY  22 -18.241 -13.413  10.730
  170   2HA   GLY  22          2HA       GLY  22 -17.140 -14.738  10.362
  171    H    ASP  23           H        ASP  23 -17.768 -16.413  12.575
  172    HA   ASP  23           HA       ASP  23 -17.201 -14.728  14.950
  173   1HB   ASP  23          2HB       ASP  23 -17.552 -16.772  16.267
  174   2HB   ASP  23          1HB       ASP  23 -18.916 -16.488  15.190
  175    H    GLY  24           H        GLY  24 -15.413 -15.958  12.545
  176   1HA   GLY  24          1HA       GLY  24 -13.031 -16.163  14.299
  177   2HA   GLY  24          2HA       GLY  24 -13.002 -15.864  12.563
  178    H    LYS  25           H        LYS  25 -15.179 -18.358  13.321
  179    HA   LYS  25           HA       LYS  25 -13.107 -20.362  12.548
  180   1HB   LYS  25          2HB       LYS  25 -14.005 -21.957  14.114
  181   2HB   LYS  25          1HB       LYS  25 -13.728 -20.460  15.004
  182   1HG   LYS  25          2HG       LYS  25 -16.059 -19.881  14.900
  183   2HG   LYS  25          1HG       LYS  25 -16.394 -21.195  13.771
  184   1HD   LYS  25          2HD       LYS  25 -15.525 -22.771  15.609
  185   2HD   LYS  25          1HD       LYS  25 -15.658 -21.387  16.697
  186   1HE   LYS  25          2HE       LYS  25 -18.085 -21.372  15.344
  187   2HE   LYS  25          1HE       LYS  25 -17.766 -23.089  15.589
  188   1HZ   LYS  25          2HZ       LYS  25 -17.069 -21.904  17.955
  189   2HZ   LYS  25          1HZ       LYS  25 -18.492 -21.097  17.494
  190   3HZ   LYS  25          3HZ       LYS  25 -18.489 -22.787  17.651
  191    H    ILE  26           H        ILE  26 -13.776 -21.922  11.103
  192    HA   ILE  26           HA       ILE  26 -16.533 -21.591   9.991
  193    HB   ILE  26           HB       ILE  26 -14.165 -22.783   8.540
  194   1HG1  ILE  26          2HG1      ILE  26 -15.052 -19.889   8.706
  195   2HG1  ILE  26          1HG1      ILE  26 -13.483 -20.547   9.167
  196   1HG2  ILE  26          3HG2      ILE  26 -16.818 -21.580   7.695
  197   2HG2  ILE  26          2HG2      ILE  26 -15.538 -22.024   6.566
  198   3HG2  ILE  26          1HG2      ILE  26 -16.320 -23.265   7.545
  199   1HD1  ILE  26          2HD1      ILE  26 -14.090 -21.312   6.454
  200   2HD1  ILE  26          1HD1      ILE  26 -14.256 -19.564   6.627
  201   3HD1  ILE  26          3HD1      ILE  26 -12.737 -20.352   7.052
  202    H    SER  27           H        SER  27 -17.835 -23.377   9.976
  203    HA   SER  27           HA       SER  27 -16.646 -25.931  10.959
  204   1HB   SER  27          2HB       SER  27 -18.744 -26.455  11.912
  205   2HB   SER  27          1HB       SER  27 -18.574 -24.726  12.217
  206    HG   SER  27           HG       SER  27 -20.176 -24.343  10.928
  207    H    ALA  28           H        ALA  28 -17.840 -27.920  10.023
  208    HA   ALA  28           HA       ALA  28 -17.502 -28.060   7.247
  209   1HB   ALA  28          1HB       ALA  28 -19.601 -29.844   7.802
  210   2HB   ALA  28          3HB       ALA  28 -17.876 -30.214   7.814
  211   3HB   ALA  28          2HB       ALA  28 -18.686 -29.734   9.305
  212    H    ALA  29           H        ALA  29 -20.509 -27.434   9.048
  213    HA   ALA  29           HA       ALA  29 -22.231 -27.179   6.827
  214   1HB   ALA  29          3HB       ALA  29 -23.145 -27.232   9.065
  215   2HB   ALA  29          2HB       ALA  29 -22.268 -25.766   9.505
  216   3HB   ALA  29          1HB       ALA  29 -23.590 -25.687   8.340
  217    H    GLU  30           H        GLU  30 -20.010 -24.830   8.273
  218    HA   GLU  30           HA       GLU  30 -20.948 -22.673   6.549
  219   1HB   GLU  30          2HB       GLU  30 -18.466 -22.915   8.275
  220   2HB   GLU  30          1HB       GLU  30 -18.980 -21.440   7.455
  221   1HG   GLU  30          2HG       GLU  30 -21.141 -21.544   8.696
  222   2HG   GLU  30          1HG       GLU  30 -20.549 -22.960   9.563
  223    H    LEU  31           H        LEU  31 -17.924 -24.581   6.704
  224    HA   LEU  31           HA       LEU  31 -16.868 -23.535   4.258
  225   1HB   LEU  31          2HB       LEU  31 -15.442 -24.735   5.850
  226   2HB   LEU  31          1HB       LEU  31 -16.376 -26.211   5.605
  227    HG   LEU  31           HG       LEU  31 -15.719 -26.255   3.237
  228   1HD1  LEU  31          1HD1      LEU  31 -14.586 -23.587   3.976
  229   2HD1  LEU  31          3HD1      LEU  31 -13.731 -24.544   2.767
  230   3HD1  LEU  31          2HD1      LEU  31 -15.412 -24.083   2.499
  231   1HD2  LEU  31          1HD2      LEU  31 -13.605 -26.081   5.365
  232   2HD2  LEU  31          3HD2      LEU  31 -14.189 -27.497   4.490
  233   3HD2  LEU  31          2HD2      LEU  31 -13.127 -26.340   3.687
  234    H    GLY  32           H        GLY  32 -18.899 -26.352   4.975
  235   1HA   GLY  32          1HA       GLY  32 -20.158 -27.721   3.544
  236   2HA   GLY  32          2HA       GLY  32 -18.934 -27.408   2.315
  237    H    GLU  33           H        GLU  33 -21.110 -25.142   4.002
  238    HA   GLU  33           HA       GLU  33 -22.963 -24.798   1.890
  239   1HB   GLU  33          2HB       GLU  33 -22.104 -23.160   4.239
  240   2HB   GLU  33          1HB       GLU  33 -23.085 -22.383   3.000
  241   1HG   GLU  33          2HG       GLU  33 -24.710 -24.312   3.206
  242   2HG   GLU  33          1HG       GLU  33 -23.780 -24.859   4.601
  243    H    ALA  34           H        ALA  34 -19.911 -23.082   2.550
  244    HA   ALA  34           HA       ALA  34 -20.215 -21.355   0.230
  245   1HB   ALA  34          2HB       ALA  34 -18.751 -20.363   1.719
  246   2HB   ALA  34          1HB       ALA  34 -18.088 -21.908   2.252
  247   3HB   ALA  34          3HB       ALA  34 -17.580 -21.215   0.712
  248    H    LEU  35           H        LEU  35 -18.490 -24.350   0.981
  249    HA   LEU  35           HA       LEU  35 -17.104 -24.620  -1.487
  250   1HB   LEU  35          2HB       LEU  35 -17.927 -26.443   0.714
  251   2HB   LEU  35          1HB       LEU  35 -17.530 -27.199  -0.828
  252    HG   LEU  35           HG       LEU  35 -15.763 -25.300   0.745
  253   1HD1  LEU  35          1HD1      LEU  35 -15.704 -28.276   0.209
  254   2HD1  LEU  35          3HD1      LEU  35 -14.272 -27.385   0.726
  255   3HD1  LEU  35          2HD1      LEU  35 -15.693 -27.452   1.769
  256   1HD2  LEU  35          2HD2      LEU  35 -15.566 -26.502  -2.008
  257   2HD2  LEU  35          1HD2      LEU  35 -15.242 -24.846  -1.499
  258   3HD2  LEU  35          3HD2      LEU  35 -14.104 -26.131  -1.097
  259    H    LYS  36           H        LYS  36 -20.438 -25.386  -0.570
  260    HA   LYS  36           HA       LYS  36 -21.236 -27.056  -2.645
  261   1HB   LYS  36          2HB       LYS  36 -22.529 -25.114  -0.901
  262   2HB   LYS  36          1HB       LYS  36 -23.298 -25.173  -2.487
  263   1HG   LYS  36          2HG       LYS  36 -23.572 -27.590  -2.309
  264   2HG   LYS  36          1HG       LYS  36 -22.687 -27.608  -0.784
  265   1HD   LYS  36          2HD       LYS  36 -24.616 -25.739  -0.258
  266   2HD   LYS  36          1HD       LYS  36 -25.485 -26.835  -1.332
  267   1HE   LYS  36          2HE       LYS  36 -25.475 -28.532   0.191
  268   2HE   LYS  36          1HE       LYS  36 -23.839 -28.163   0.736
  269   1HZ   LYS  36          2HZ       LYS  36 -25.097 -26.038   1.652
  270   2HZ   LYS  36          1HZ       LYS  36 -26.394 -27.134   1.689
  271   3HZ   LYS  36          3HZ       LYS  36 -24.973 -27.476   2.549
  272    H    THR  37           H        THR  37 -20.217 -23.732  -2.849
  273    HA   THR  37           HA       THR  37 -21.398 -22.894  -5.254
  274    HB   THR  37           HB       THR  37 -19.838 -21.561  -3.744
  275    HG1  THR  37           HG1      THR  37 -20.403 -20.652  -5.665
  276   1HG2  THR  37          3HG2      THR  37 -18.034 -23.249  -3.659
  277   2HG2  THR  37          2HG2      THR  37 -17.744 -23.016  -5.382
  278   3HG2  THR  37          1HG2      THR  37 -17.438 -21.699  -4.251
  279    H    LEU  38           H        LEU  38 -19.027 -25.359  -4.701
  280    HA   LEU  38           HA       LEU  38 -17.820 -25.465  -7.285
  281   1HB   LEU  38          2HB       LEU  38 -18.390 -27.669  -5.282
  282   2HB   LEU  38          1HB       LEU  38 -17.385 -27.875  -6.716
  283    HG   LEU  38           HG       LEU  38 -16.896 -25.973  -4.406
  284   1HD1  LEU  38          3HD1      LEU  38 -16.000 -28.654  -5.104
  285   2HD1  LEU  38          2HD1      LEU  38 -14.642 -27.541  -4.942
  286   3HD1  LEU  38          1HD1      LEU  38 -15.769 -27.757  -3.604
  287   1HD2  LEU  38          2HD2      LEU  38 -15.634 -26.213  -7.136
  288   2HD2  LEU  38          1HD2      LEU  38 -16.192 -24.760  -6.307
  289   3HD2  LEU  38          3HD2      LEU  38 -14.725 -25.574  -5.766
  290    H    GLY  39           H        GLY  39 -20.901 -26.640  -6.070
  291   1HA   GLY  39          1HA       GLY  39 -21.955 -26.890  -8.753
  292   2HA   GLY  39          2HA       GLY  39 -22.794 -27.351  -7.272
  293    H    SER  40           H        SER  40 -19.921 -28.892  -7.029
  294    HA   SER  40           HA       SER  40 -21.098 -31.438  -7.901
  295   1HB   SER  40          2HB       SER  40 -19.048 -30.010  -9.453
  296   2HB   SER  40          1HB       SER  40 -18.618 -31.677  -9.068
  297    HG   SER  40           HG       SER  40 -21.009 -31.960  -9.758
  298    H    ILE  41           H        ILE  41 -20.754 -31.184  -5.379
  299    HA   ILE  41           HA       ILE  41 -18.307 -32.716  -4.762
  300    HB   ILE  41           HB       ILE  41 -17.862 -30.188  -4.474
  301   1HG1  ILE  41          2HG1      ILE  41 -17.542 -31.799  -1.941
  302   2HG1  ILE  41          1HG1      ILE  41 -16.629 -32.183  -3.400
  303   1HG2  ILE  41          2HG2      ILE  41 -20.233 -30.106  -3.230
  304   2HG2  ILE  41          1HG2      ILE  41 -19.221 -30.451  -1.828
  305   3HG2  ILE  41          3HG2      ILE  41 -18.923 -29.008  -2.799
  306   1HD1  ILE  41          1HD1      ILE  41 -16.598 -29.324  -2.746
  307   2HD1  ILE  41          3HD1      ILE  41 -15.879 -30.328  -1.486
  308   3HD1  ILE  41          2HD1      ILE  41 -15.256 -30.401  -3.135
  309    H    THR  42           H        THR  42 -18.408 -33.421  -2.367
  310    HA   THR  42           HA       THR  42 -21.270 -33.873  -1.618
  311    HB   THR  42           HB       THR  42 -20.870 -36.095  -1.393
  312    HG1  THR  42           HG1      THR  42 -18.846 -36.771  -0.329
  313   1HG2  THR  42          3HG2      THR  42 -19.617 -35.606  -3.507
  314   2HG2  THR  42          2HG2      THR  42 -18.138 -35.489  -2.552
  315   3HG2  THR  42          1HG2      THR  42 -19.009 -37.021  -2.647
  316    HA   PRO  43           HA       PRO  43 -20.380 -32.136   2.352
  317   1HB   PRO  43          2HB       PRO  43 -21.677 -33.798   4.049
  318   2HB   PRO  43          1HB       PRO  43 -22.520 -32.650   3.007
  319   1HG   PRO  43          2HG       PRO  43 -22.062 -35.585   2.615
  320   2HG   PRO  43          1HG       PRO  43 -23.532 -34.643   2.340
  321   1HD   PRO  43          1HD       PRO  43 -21.898 -35.366   0.314
  322   2HD   PRO  43          2HD       PRO  43 -22.789 -33.844   0.297
  323    H    ASP  44           H        ASP  44 -19.852 -35.605   1.960
  324    HA   ASP  44           HA       ASP  44 -18.191 -35.959   4.270
  325   1HB   ASP  44          2HB       ASP  44 -19.283 -37.626   2.374
  326   2HB   ASP  44          1HB       ASP  44 -17.570 -37.665   1.955
  327    H    GLU  45           H        GLU  45 -17.559 -34.609   1.097
  328    HA   GLU  45           HA       GLU  45 -14.660 -34.936   1.332
  329   1HB   GLU  45          2HB       GLU  45 -16.364 -33.273  -0.552
  330   2HB   GLU  45          1HB       GLU  45 -14.614 -33.458  -0.683
  331   1HG   GLU  45          2HG       GLU  45 -15.013 -35.973  -0.775
  332   2HG   GLU  45          1HG       GLU  45 -16.729 -35.607  -0.961
  333    H    VAL  46           H        VAL  46 -17.081 -32.415   1.822
  334    HA   VAL  46           HA       VAL  46 -15.220 -30.310   2.417
  335    HB   VAL  46           HB       VAL  46 -18.112 -30.740   3.209
  336   1HG1  VAL  46          1HG1      VAL  46 -16.762 -29.265   4.801
  337   2HG1  VAL  46          3HG1      VAL  46 -16.534 -28.167   3.441
  338   3HG1  VAL  46          2HG1      VAL  46 -18.157 -28.496   4.045
  339   1HG2  VAL  46          1HG2      VAL  46 -16.801 -29.906   0.820
  340   2HG2  VAL  46          3HG2      VAL  46 -18.535 -29.946   1.147
  341   3HG2  VAL  46          2HG2      VAL  46 -17.603 -28.492   1.505
  342    H    LYS  47           H        LYS  47 -16.781 -32.812   4.336
  343    HA   LYS  47           HA       LYS  47 -15.859 -31.842   6.899
  344   1HB   LYS  47          2HB       LYS  47 -16.782 -34.569   5.952
  345   2HB   LYS  47          1HB       LYS  47 -16.343 -34.231   7.627
  346   1HG   LYS  47          2HG       LYS  47 -18.044 -32.404   7.662
  347   2HG   LYS  47          1HG       LYS  47 -18.524 -32.856   6.026
  348   1HD   LYS  47          2HD       LYS  47 -18.981 -35.183   6.896
  349   2HD   LYS  47          1HD       LYS  47 -18.706 -34.563   8.524
  350   1HE   LYS  47          2HE       LYS  47 -20.755 -33.433   6.594
  351   2HE   LYS  47          1HE       LYS  47 -21.129 -34.593   7.869
  352   1HZ   LYS  47          3HZ       LYS  47 -19.830 -32.788   9.281
  353   2HZ   LYS  47          2HZ       LYS  47 -20.439 -31.769   8.066
  354   3HZ   LYS  47          1HZ       LYS  47 -21.502 -32.697   9.012
  355    H    HIS  48           H        HIS  48 -14.609 -34.120   4.500
  356    HA   HIS  48           HA       HIS  48 -12.343 -34.989   6.044
  357   1HB   HIS  48          2HB       HIS  48 -13.115 -36.238   4.070
  358   2HB   HIS  48          1HB       HIS  48 -12.728 -34.864   3.035
  359    HD1  HIS  48           HD1      HIS  48 -10.755 -35.751   1.730
  360    HD2  HIS  48           HD2      HIS  48 -10.324 -36.341   5.834
  361    HE1  HIS  48           HE1      HIS  48  -8.399 -36.609   2.088
  362    H    MET  49           H        MET  49 -12.828 -32.364   3.684
  363    HA   MET  49           HA       MET  49 -10.135 -31.473   3.562
  364   1HB   MET  49          2HB       MET  49 -12.809 -30.170   3.152
  365   2HB   MET  49          1HB       MET  49 -11.356 -29.175   3.172
  366   1HG   MET  49          2HG       MET  49 -10.442 -31.002   1.504
  367   2HG   MET  49          1HG       MET  49 -12.155 -31.325   1.236
  368   1HE   MET  49          2HE       MET  49 -13.146 -30.628  -0.499
  369   2HE   MET  49          1HE       MET  49 -12.922 -29.186  -1.485
  370   3HE   MET  49          3HE       MET  49 -11.711 -30.475  -1.509
  371    H    MET  50           H        MET  50 -12.788 -30.591   5.746
  372    HA   MET  50           HA       MET  50 -11.366 -28.662   7.279
  373   1HB   MET  50          2HB       MET  50 -13.760 -30.394   7.729
  374   2HB   MET  50          1HB       MET  50 -13.035 -29.606   9.129
  375   1HG   MET  50          2HG       MET  50 -13.112 -27.441   7.755
  376   2HG   MET  50          1HG       MET  50 -14.169 -28.313   6.644
  377   1HE   MET  50          3HE       MET  50 -13.435 -26.747   9.805
  378   2HE   MET  50          2HE       MET  50 -14.915 -26.658  10.757
  379   3HE   MET  50          1HE       MET  50 -13.951 -28.132  10.778
  380    H    ALA  51           H        ALA  51 -11.760 -32.160   7.737
  381    HA   ALA  51           HA       ALA  51 -10.262 -32.406  10.136
  382   1HB   ALA  51          1HB       ALA  51 -11.244 -34.424   9.673
  383   2HB   ALA  51          2HB       ALA  51  -9.691 -34.749   8.903
  384   3HB   ALA  51          3HB       ALA  51 -11.064 -34.226   7.930
  385    H    GLU  52           H        GLU  52  -9.260 -31.822   6.867
  386    HA   GLU  52           HA       GLU  52  -6.435 -32.474   7.484
  387   1HB   GLU  52          2HB       GLU  52  -7.960 -31.754   4.995
  388   2HB   GLU  52          1HB       GLU  52  -6.209 -31.540   5.032
  389   1HG   GLU  52          2HG       GLU  52  -6.074 -33.951   5.871
  390   2HG   GLU  52          1HG       GLU  52  -7.776 -34.096   5.434
  391    H    ILE  53           H        ILE  53  -8.543 -29.723   6.861
  392    HA   ILE  53           HA       ILE  53  -6.367 -27.775   6.976
  393    HB   ILE  53           HB       ILE  53  -9.378 -27.449   7.092
  394   1HG1  ILE  53          2HG1      ILE  53  -7.427 -27.064   4.808
  395   2HG1  ILE  53          1HG1      ILE  53  -8.481 -28.462   4.999
  396   1HG2  ILE  53          2HG2      ILE  53  -7.850 -25.603   8.050
  397   2HG2  ILE  53          1HG2      ILE  53  -7.344 -25.340   6.380
  398   3HG2  ILE  53          3HG2      ILE  53  -9.036 -25.128   6.834
  399   1HD1  ILE  53          1HD1      ILE  53  -9.542 -25.631   4.920
  400   2HD1  ILE  53          3HD1      ILE  53  -9.358 -26.615   3.468
  401   3HD1  ILE  53          2HD1      ILE  53 -10.449 -27.134   4.752
  402    H    ASP  54           H        ASP  54  -8.674 -29.210   9.185
  403    HA   ASP  54           HA       ASP  54  -8.490 -27.317  11.310
  404   1HB   ASP  54          2HB       ASP  54 -10.064 -29.397  10.898
  405   2HB   ASP  54          1HB       ASP  54  -8.824 -30.258  11.798
  406    H    THR  55           H        THR  55  -6.404 -26.727  11.888
  407    HA   THR  55           HA       THR  55  -4.222 -28.622  12.044
  408    HB   THR  55           HB       THR  55  -2.974 -26.736  13.052
  409    HG1  THR  55           HG1      THR  55  -4.117 -24.772  13.303
  410   1HG2  THR  55          1HG2      THR  55  -4.706 -26.070  10.659
  411   2HG2  THR  55          3HG2      THR  55  -3.283 -25.146  11.137
  412   3HG2  THR  55          2HG2      THR  55  -3.115 -26.828  10.632
  413    H    ASP  56           H        ASP  56  -6.174 -26.965  14.531
  414    HA   ASP  56           HA       ASP  56  -4.837 -28.541  16.630
  415   1HB   ASP  56          2HB       ASP  56  -6.029 -27.213  18.204
  416   2HB   ASP  56          1HB       ASP  56  -5.584 -26.111  16.902
  417    H    GLY  57           H        GLY  57  -7.879 -28.544  14.879
  418   1HA   GLY  57          1HA       GLY  57  -8.424 -31.220  16.025
  419   2HA   GLY  57          2HA       GLY  57  -9.186 -30.548  14.590
  420    H    ASP  58           H        ASP  58  -9.783 -27.967  16.077
  421    HA   ASP  58           HA       ASP  58 -11.605 -28.839  18.211
  422   1HB   ASP  58          2HB       ASP  58 -12.097 -26.515  18.542
  423   2HB   ASP  58          1HB       ASP  58 -10.366 -26.622  18.233
  424    H    GLY  59           H        GLY  59 -11.760 -28.888  14.892
  425   1HA   GLY  59          1HA       GLY  59 -14.726 -28.990  15.003
  426   2HA   GLY  59          2HA       GLY  59 -13.726 -29.722  13.752
  427    H    PHE  60           H        PHE  60 -12.562 -26.638  14.404
  428    HA   PHE  60           HA       PHE  60 -14.053 -25.584  12.044
  429   1HB   PHE  60          2HB       PHE  60 -13.319 -23.899  14.443
  430   2HB   PHE  60          1HB       PHE  60 -14.336 -23.445  13.076
  431    HD1  PHE  60           HD1      PHE  60 -16.540 -24.620  12.730
  432    HD2  PHE  60           HD2      PHE  60 -14.215 -25.063  16.311
  433    HE1  PHE  60           HE1      PHE  60 -18.534 -25.485  13.916
  434    HE2  PHE  60           HE2      PHE  60 -16.209 -25.925  17.500
  435    HZ   PHE  60           HZ       PHE  60 -18.371 -26.139  16.304
  436    H    ILE  61           H        ILE  61 -12.931 -23.961  10.819
  437    HA   ILE  61           HA       ILE  61  -9.984 -24.097  11.156
  438    HB   ILE  61           HB       ILE  61 -11.548 -23.205   8.723
  439   1HG1  ILE  61          2HG1      ILE  61 -12.128 -25.531   9.222
  440   2HG1  ILE  61          1HG1      ILE  61 -11.055 -25.475   7.824
  441   1HG2  ILE  61          1HG2      ILE  61  -9.121 -22.523   9.019
  442   2HG2  ILE  61          3HG2      ILE  61  -8.712 -24.236   8.967
  443   3HG2  ILE  61          2HG2      ILE  61  -9.455 -23.465   7.567
  444   1HD1  ILE  61          1HD1      ILE  61  -9.123 -25.875   9.412
  445   2HD1  ILE  61          3HD1      ILE  61 -10.313 -26.165  10.680
  446   3HD1  ILE  61          2HD1      ILE  61 -10.249 -27.228   9.273
  447    H    SER  62           H        SER  62  -8.983 -22.230  11.802
  448    HA   SER  62           HA       SER  62 -10.619 -19.771  11.990
  449   1HB   SER  62          2HB       SER  62  -8.195 -19.131  13.089
  450   2HB   SER  62          1HB       SER  62  -9.539 -19.821  13.999
  451    HG   SER  62           HG       SER  62  -7.149 -20.927  13.302
  452    H    PHE  63           H        PHE  63  -9.415 -17.687  11.403
  453    HA   PHE  63           HA       PHE  63  -8.711 -17.703   8.669
  454   1HB   PHE  63          2HB       PHE  63  -9.326 -15.637   9.886
  455   2HB   PHE  63          1HB       PHE  63  -7.807 -15.722  10.783
  456    HD1  PHE  63           HD1      PHE  63  -8.802 -16.197   7.201
  457    HD2  PHE  63           HD2      PHE  63  -6.221 -14.204   9.994
  458    HE1  PHE  63           HE1      PHE  63  -7.635 -15.079   5.323
  459    HE2  PHE  63           HE2      PHE  63  -5.051 -13.086   8.116
  460    HZ   PHE  63           HZ       PHE  63  -5.763 -13.522   5.778
  461    H    GLN  64           H        GLN  64  -6.661 -17.833  11.556
  462    HA   GLN  64           HA       GLN  64  -4.144 -17.790  10.230
  463   1HB   GLN  64          2HB       GLN  64  -4.544 -17.570  12.713
  464   2HB   GLN  64          1HB       GLN  64  -4.845 -19.307  12.760
  465   1HG   GLN  64          2HG       GLN  64  -2.529 -18.992  13.334
  466   2HG   GLN  64          1HG       GLN  64  -2.564 -19.622  11.687
  467   1HE2  GLN  64          1HE2      GLN  64  -1.473 -18.392  10.128
  468   2HE2  GLN  64          2HE2      GLN  64  -0.960 -16.790  10.350
  469    H    GLU  65           H        GLU  65  -6.164 -20.553  11.276
  470    HA   GLU  65           HA       GLU  65  -4.496 -22.613  10.259
  471   1HB   GLU  65          2HB       GLU  65  -7.410 -22.365  10.888
  472   2HB   GLU  65          1HB       GLU  65  -6.867 -23.775   9.987
  473   1HG   GLU  65          2HG       GLU  65  -5.265 -24.325  11.754
  474   2HG   GLU  65          1HG       GLU  65  -5.711 -22.868  12.640
  475    H    PHE  66           H        PHE  66  -7.202 -20.872   8.742
  476    HA   PHE  66           HA       PHE  66  -7.065 -22.231   6.227
  477   1HB   PHE  66          2HB       PHE  66  -8.983 -20.813   6.986
  478   2HB   PHE  66          1HB       PHE  66  -7.971 -19.386   6.755
  479    HD1  PHE  66           HD1      PHE  66  -7.142 -18.791   4.479
  480    HD2  PHE  66           HD2      PHE  66  -9.952 -21.976   5.118
  481    HE1  PHE  66           HE1      PHE  66  -7.717 -18.769   2.065
  482    HE2  PHE  66           HE2      PHE  66 -10.527 -21.955   2.706
  483    HZ   PHE  66           HZ       PHE  66  -9.409 -20.351   1.180
  484    H    THR  67           H        THR  67  -5.413 -19.385   7.507
  485    HA   THR  67           HA       THR  67  -4.185 -18.585   5.035
  486    HB   THR  67           HB       THR  67  -3.310 -18.163   7.910
  487    HG1  THR  67           HG1      THR  67  -4.718 -16.626   7.860
  488   1HG2  THR  67          1HG2      THR  67  -2.358 -16.898   5.325
  489   2HG2  THR  67          3HG2      THR  67  -1.960 -16.294   6.934
  490   3HG2  THR  67          2HG2      THR  67  -1.402 -17.889   6.427
  491    H    ASP  68           H        ASP  68  -2.995 -20.568   7.762
  492    HA   ASP  68           HA       ASP  68  -0.459 -21.179   6.604
  493   1HB   ASP  68          2HB       ASP  68  -2.129 -22.864   8.496
  494   2HB   ASP  68          1HB       ASP  68  -0.401 -23.057   8.197
  495    H    PHE  69           H        PHE  69  -3.632 -22.712   6.298
  496    HA   PHE  69           HA       PHE  69  -2.664 -24.956   4.749
  497   1HB   PHE  69          2HB       PHE  69  -4.700 -25.530   5.625
  498   2HB   PHE  69          1HB       PHE  69  -5.274 -23.866   5.638
  499    HD1  PHE  69           HD1      PHE  69  -5.865 -22.794   3.385
  500    HD2  PHE  69           HD2      PHE  69  -5.413 -27.022   3.953
  501    HE1  PHE  69           HE1      PHE  69  -7.164 -23.210   1.310
  502    HE2  PHE  69           HE2      PHE  69  -6.706 -27.444   1.885
  503    HZ   PHE  69           HZ       PHE  69  -7.586 -25.539   0.559
  504    H    GLY  70           H        GLY  70  -4.063 -21.790   3.993
  505   1HA   GLY  70          1HA       GLY  70  -4.015 -20.556   1.994
  506   2HA   GLY  70          2HA       GLY  70  -4.338 -22.094   1.192
  507    H    ARG  71           H        ARG  71  -1.496 -21.606   3.178
  508    HA   ARG  71           HA       ARG  71   0.285 -20.880   1.013
  509   1HB   ARG  71          2HB       ARG  71   0.871 -22.112   3.725
  510   2HB   ARG  71          1HB       ARG  71   2.085 -21.443   2.634
  511   1HG   ARG  71          2HG       ARG  71   0.825 -19.256   2.711
  512   2HG   ARG  71          1HG       ARG  71  -0.191 -19.954   3.973
  513   1HD   ARG  71          2HD       ARG  71   2.820 -19.590   4.087
  514   2HD   ARG  71          1HD       ARG  71   1.623 -18.671   5.000
  515    HE   ARG  71           HE       ARG  71   1.762 -21.620   5.382
  516   1HH1  ARG  71          1HH1      ARG  71   0.652 -18.852   6.774
  517   2HH1  ARG  71          2HH1      ARG  71   1.400 -19.082   8.320
  518   1HH2  ARG  71          1HH2      ARG  71   3.373 -21.731   7.267
  519   2HH2  ARG  71          2HH2      ARG  71   2.941 -20.712   8.599
  520    H    ALA  72           H        ALA  72  -1.071 -23.842   2.163
  521    HA   ALA  72           HA       ALA  72   0.966 -25.562   0.955
  522   1HB   ALA  72          2HB       ALA  72   0.002 -27.042   2.350
  523   2HB   ALA  72          3HB       ALA  72  -1.458 -26.994   1.362
  524   3HB   ALA  72          1HB       ALA  72  -1.277 -25.886   2.722
  525    H    ASN  73           H        ASN  73  -1.997 -24.024  -0.031
  526    HA   ASN  73           HA       ASN  73  -1.607 -25.127  -2.756
  527   1HB   ASN  73          2HB       ASN  73  -4.390 -25.046  -1.618
  528   2HB   ASN  73          1HB       ASN  73  -3.775 -25.984  -2.979
  529   1HD2  ASN  73          1HD2      ASN  73  -4.515 -26.131   0.360
  530   2HD2  ASN  73          2HD2      ASN  73  -3.737 -27.599   0.706
  531    H    ARG  74           H        ARG  74  -0.859 -22.643  -2.292
  532    HA   ARG  74           HA       ARG  74  -2.721 -20.551  -2.163
  533   1HB   ARG  74          2HB       ARG  74  -0.214 -20.685  -3.869
  534   2HB   ARG  74          1HB       ARG  74  -1.073 -19.207  -3.434
  535   1HG   ARG  74          2HG       ARG  74  -0.684 -19.701  -1.036
  536   2HG   ARG  74          1HG       ARG  74   0.207 -21.154  -1.490
  537   1HD   ARG  74          2HD       ARG  74   1.871 -19.484  -1.140
  538   2HD   ARG  74          1HD       ARG  74   1.702 -19.606  -2.890
  539    HE   ARG  74           HE       ARG  74  -0.086 -17.595  -1.915
  540   1HH1  ARG  74          1HH1      ARG  74   2.879 -17.505  -0.686
  541   2HH1  ARG  74          2HH1      ARG  74   3.505 -16.203  -1.641
  542   1HH2  ARG  74          1HH2      ARG  74   0.874 -16.245  -3.899
  543   2HH2  ARG  74          2HH2      ARG  74   2.371 -15.491  -3.462
  544    H    GLY  75           H        GLY  75  -1.753 -22.528  -4.922
  545   1HA   GLY  75          1HA       GLY  75  -2.758 -22.829  -7.005
  546   2HA   GLY  75          2HA       GLY  75  -3.155 -21.112  -6.948
  547    H    LEU  76           H        LEU  76  -4.247 -23.308  -4.456
  548    HA   LEU  76           HA       LEU  76  -6.819 -23.907  -5.627
  549   1HB   LEU  76          2HB       LEU  76  -5.742 -24.027  -2.806
  550   2HB   LEU  76          1HB       LEU  76  -7.414 -24.442  -3.184
  551    HG   LEU  76           HG       LEU  76  -4.956 -25.727  -4.417
  552   1HD1  LEU  76          3HD1      LEU  76  -6.051 -26.163  -1.913
  553   2HD1  LEU  76          2HD1      LEU  76  -6.850 -27.383  -2.904
  554   3HD1  LEU  76          1HD1      LEU  76  -5.089 -27.330  -2.821
  555   1HD2  LEU  76          1HD2      LEU  76  -7.782 -25.664  -5.153
  556   2HD2  LEU  76          3HD2      LEU  76  -6.404 -26.280  -6.065
  557   3HD2  LEU  76          2HD2      LEU  76  -7.205 -27.308  -4.877
  558    H    LEU  77           H        LEU  77  -5.722 -21.500  -3.257
  559    HA   LEU  77           HA       LEU  77  -8.270 -20.326  -2.781
  560   1HB   LEU  77          2HB       LEU  77  -5.445 -19.301  -2.524
  561   2HB   LEU  77          1HB       LEU  77  -6.837 -18.298  -2.115
  562    HG   LEU  77           HG       LEU  77  -7.619 -20.058  -0.558
  563   1HD1  LEU  77          3HD1      LEU  77  -5.076 -21.412  -1.460
  564   2HD1  LEU  77          2HD1      LEU  77  -5.924 -21.860   0.020
  565   3HD1  LEU  77          1HD1      LEU  77  -6.722 -22.039  -1.543
  566   1HD2  LEU  77          2HD2      LEU  77  -4.807 -19.006  -0.191
  567   2HD2  LEU  77          1HD2      LEU  77  -6.305 -18.326   0.445
  568   3HD2  LEU  77          3HD2      LEU  77  -5.682 -19.845   1.090
  569    H    LYS  78           H        LYS  78  -5.762 -19.597  -5.190
  570    HA   LYS  78           HA       LYS  78  -7.062 -17.271  -6.255
  571   1HB   LYS  78          2HB       LYS  78  -5.168 -19.228  -7.593
  572   2HB   LYS  78          1HB       LYS  78  -5.608 -17.644  -8.232
  573   1HG   LYS  78          2HG       LYS  78  -4.793 -16.720  -5.956
  574   2HG   LYS  78          1HG       LYS  78  -4.016 -18.291  -5.751
  575   1HD   LYS  78          2HD       LYS  78  -3.609 -16.493  -8.159
  576   2HD   LYS  78          1HD       LYS  78  -2.512 -16.563  -6.781
  577   1HE   LYS  78          2HE       LYS  78  -1.645 -18.573  -7.417
  578   2HE   LYS  78          1HE       LYS  78  -3.213 -19.191  -7.938
  579   1HZ   LYS  78          1HZ       LYS  78  -2.797 -17.312  -9.766
  580   2HZ   LYS  78          3HZ       LYS  78  -1.190 -17.750  -9.446
  581   3HZ   LYS  78          2HZ       LYS  78  -2.304 -18.925  -9.963
  582    H    ASP  79           H        ASP  79  -7.701 -20.651  -6.549
  583    HA   ASP  79           HA       ASP  79  -9.327 -20.262  -8.994
  584   1HB   ASP  79          2HB       ASP  79  -8.222 -22.594  -7.518
  585   2HB   ASP  79          1HB       ASP  79  -9.762 -22.842  -8.340
  586    H    VAL  80           H        VAL  80  -9.787 -21.566  -5.699
  587    HA   VAL  80           HA       VAL  80 -12.648 -21.642  -5.875
  588    HB   VAL  80           HB       VAL  80 -11.080 -22.796  -4.175
  589   1HG1  VAL  80          1HG1      VAL  80  -9.950 -20.716  -3.446
  590   2HG1  VAL  80          3HG1      VAL  80 -11.477 -20.137  -2.781
  591   3HG1  VAL  80          2HG1      VAL  80 -10.700 -21.564  -2.095
  592   1HG2  VAL  80          2HG2      VAL  80 -13.688 -21.444  -3.489
  593   2HG2  VAL  80          1HG2      VAL  80 -13.412 -23.132  -3.916
  594   3HG2  VAL  80          3HG2      VAL  80 -12.888 -22.522  -2.346
  595    H    ALA  81           H        ALA  81 -10.392 -19.264  -4.532
  596    HA   ALA  81           HA       ALA  81 -12.253 -17.433  -3.472
  597   1HB   ALA  81          1HB       ALA  81  -9.811 -17.200  -3.190
  598   2HB   ALA  81          3HB       ALA  81  -9.654 -16.800  -4.899
  599   3HB   ALA  81          2HB       ALA  81 -10.520 -15.712  -3.816
  600    H    LYS  82           H        LYS  82 -11.202 -17.874  -6.825
  601    HA   LYS  82           HA       LYS  82 -12.499 -15.532  -7.866
  602   1HB   LYS  82          2HB       LYS  82 -11.516 -18.111  -9.066
  603   2HB   LYS  82          1HB       LYS  82 -12.450 -16.979 -10.043
  604   1HG   LYS  82          2HG       LYS  82 -10.754 -15.209  -9.063
  605   2HG   LYS  82          1HG       LYS  82  -9.739 -16.628  -8.804
  606   1HD   LYS  82          2HD       LYS  82 -10.350 -17.196 -11.286
  607   2HD   LYS  82          1HD       LYS  82 -10.769 -15.486 -11.391
  608   1HE   LYS  82          2HE       LYS  82  -8.594 -14.829 -11.311
  609   2HE   LYS  82          1HE       LYS  82  -8.191 -16.011 -10.066
  610   1HZ   LYS  82          3HZ       LYS  82  -8.812 -17.163 -12.634
  611   2HZ   LYS  82          2HZ       LYS  82  -7.432 -16.172 -12.642
  612   3HZ   LYS  82          1HZ       LYS  82  -7.526 -17.493 -11.578
  613    H    ILE  83           H        ILE  83 -13.654 -18.700  -6.976
  614    HA   ILE  83           HA       ILE  83 -16.036 -18.798  -8.521
  615    HB   ILE  83           HB       ILE  83 -15.661 -19.809  -5.690
  616   1HG1  ILE  83          2HG1      ILE  83 -14.857 -20.947  -8.374
  617   2HG1  ILE  83          1HG1      ILE  83 -13.843 -20.693  -6.956
  618   1HG2  ILE  83          1HG2      ILE  83 -17.487 -20.641  -7.964
  619   2HG2  ILE  83          3HG2      ILE  83 -17.330 -21.506  -6.434
  620   3HG2  ILE  83          2HG2      ILE  83 -17.979 -19.865  -6.458
  621   1HD1  ILE  83          3HD1      ILE  83 -15.316 -22.364  -5.736
  622   2HD1  ILE  83          2HD1      ILE  83 -16.057 -22.732  -7.294
  623   3HD1  ILE  83          1HD1      ILE  83 -14.340 -23.044  -7.037
  624    H    PHE  84           H        PHE  84 -15.377 -17.331  -5.364
  625    HA   PHE  84           HA       PHE  84 -18.125 -16.287  -5.188
  626   1HB   PHE  84          2HB       PHE  84 -15.698 -15.856  -3.419
  627   2HB   PHE  84          1HB       PHE  84 -17.324 -15.273  -3.063
  628    HD1  PHE  84           HD1      PHE  84 -15.257 -18.317  -3.566
  629    HD2  PHE  84           HD2      PHE  84 -19.025 -16.742  -2.234
  630    HE1  PHE  84           HE1      PHE  84 -15.834 -20.523  -2.590
  631    HE2  PHE  84           HE2      PHE  84 -19.602 -18.949  -1.259
  632    HZ   PHE  84           HZ       PHE  84 -18.006 -20.839  -1.438

  No H/Q in entry =         632
  Start of MODEL   13
    1    H1   ALA   1          3H        ALA   1  10.467 -12.435  -2.318
    2    H2   ALA   1          2H        ALA   1  11.187 -11.413  -1.167
    3    H3   ALA   1          1H        ALA   1  11.539 -13.077  -1.170
    4    HA   ALA   1           HA       ALA   1   9.876 -13.463   0.214
    5   1HB   ALA   1          2HB       ALA   1  10.389 -10.851   0.590
    6   2HB   ALA   1          1HB       ALA   1   8.725 -10.720   0.019
    7   3HB   ALA   1          3HB       ALA   1   9.093 -11.685   1.448
    8    H    ASP   2           H        ASP   2   8.957 -14.725  -1.646
    9    HA   ASP   2           HA       ASP   2   6.963 -13.677  -3.390
   10   1HB   ASP   2          2HB       ASP   2   7.327 -16.476  -2.282
   11   2HB   ASP   2          1HB       ASP   2   6.218 -16.064  -3.589
   12    H    ASP   3           H        ASP   3   6.831 -14.694  -0.041
   13    HA   ASP   3           HA       ASP   3   3.869 -14.551  -0.038
   14   1HB   ASP   3          2HB       ASP   3   5.140 -16.352   1.223
   15   2HB   ASP   3          1HB       ASP   3   5.714 -15.083   2.305
   16    H    HIS   4           H        HIS   4   3.118 -12.477   0.036
   17    HA   HIS   4           HA       HIS   4   4.470 -10.594   1.929
   18   1HB   HIS   4          2HB       HIS   4   2.980  -8.981   0.271
   19   2HB   HIS   4          1HB       HIS   4   4.697  -9.308   0.067
   20    HD1  HIS   4           HD1      HIS   4   1.319 -10.577  -1.124
   21    HD2  HIS   4           HD2      HIS   4   5.333 -10.741  -2.240
   22    HE1  HIS   4           HE1      HIS   4   1.385 -11.685  -3.401
   23    HA   PRO   5           HA       PRO   5   0.677  -9.986   4.134
   24   1HB   PRO   5          2HB       PRO   5   0.372  -7.300   4.248
   25   2HB   PRO   5          1HB       PRO   5   1.591  -8.168   5.187
   26   1HG   PRO   5          2HG       PRO   5   1.890  -6.679   2.602
   27   2HG   PRO   5          1HG       PRO   5   2.940  -6.658   4.023
   28   1HD   PRO   5          1HD       PRO   5   3.541  -8.125   1.842
   29   2HD   PRO   5          2HD       PRO   5   3.946  -8.673   3.470
   30    H    GLN   6           H        GLN   6   0.961  -8.486   0.992
   31    HA   GLN   6           HA       GLN   6  -1.739  -7.617   0.662
   32   1HB   GLN   6          2HB       GLN   6   0.502  -8.368  -1.186
   33   2HB   GLN   6          1HB       GLN   6  -1.116  -8.147  -1.851
   34   1HG   GLN   6          2HG       GLN   6  -1.225  -5.885  -1.100
   35   2HG   GLN   6          1HG       GLN   6   0.179  -6.091  -0.053
   36   1HE2  GLN   6          1HE2      GLN   6   2.142  -7.127  -1.588
   37   2HE2  GLN   6          2HE2      GLN   6   2.437  -6.192  -2.974
   38    H    ASP   7           H        ASP   7  -0.141 -10.724   0.075
   39    HA   ASP   7           HA       ASP   7  -2.335 -12.042  -1.172
   40   1HB   ASP   7          2HB       ASP   7  -0.074 -13.079   0.549
   41   2HB   ASP   7          1HB       ASP   7  -1.253 -14.145  -0.214
   42    H    LYS   8           H        LYS   8  -1.479 -11.674   2.252
   43    HA   LYS   8           HA       LYS   8  -3.449 -13.314   3.404
   44   1HB   LYS   8          2HB       LYS   8  -2.070 -10.798   4.273
   45   2HB   LYS   8          1HB       LYS   8  -3.420 -11.403   5.235
   46   1HG   LYS   8          2HG       LYS   8  -2.167 -13.702   5.039
   47   2HG   LYS   8          1HG       LYS   8  -0.765 -12.697   4.674
   48   1HD   LYS   8          2HD       LYS   8  -1.352 -11.370   6.784
   49   2HD   LYS   8          1HD       LYS   8  -2.463 -12.681   7.177
   50   1HE   LYS   8          2HE       LYS   8  -0.759 -14.191   7.569
   51   2HE   LYS   8          1HE       LYS   8   0.334 -13.414   6.424
   52   1HZ   LYS   8          3HZ       LYS   8  -0.473 -12.210   9.012
   53   2HZ   LYS   8          2HZ       LYS   8   0.951 -13.111   8.792
   54   3HZ   LYS   8          1HZ       LYS   8   0.726 -11.651   7.952
   55    H    ALA   9           H        ALA   9  -3.722 -10.055   2.078
   56    HA   ALA   9           HA       ALA   9  -6.334  -9.435   2.992
   57   1HB   ALA   9          3HB       ALA   9  -5.064  -8.715   0.331
   58   2HB   ALA   9          2HB       ALA   9  -6.460  -7.914   1.054
   59   3HB   ALA   9          1HB       ALA   9  -4.880  -7.801   1.827
   60    H    GLU  10           H        GLU  10  -5.256 -11.145   0.073
   61    HA   GLU  10           HA       GLU  10  -7.905 -11.670  -0.922
   62   1HB   GLU  10          2HB       GLU  10  -5.419 -13.343  -1.377
   63   2HB   GLU  10          1HB       GLU  10  -6.845 -13.258  -2.411
   64   1HG   GLU  10          2HG       GLU  10  -6.354 -10.760  -2.644
   65   2HG   GLU  10          1HG       GLU  10  -4.791 -11.095  -1.899
   66    H    ARG  11           H        ARG  11  -5.653 -13.558   1.066
   67    HA   ARG  11           HA       ARG  11  -7.333 -15.860   1.355
   68   1HB   ARG  11          2HB       ARG  11  -5.099 -14.721   3.042
   69   2HB   ARG  11          1HB       ARG  11  -5.924 -16.220   3.462
   70   1HG   ARG  11          2HG       ARG  11  -5.372 -17.050   1.130
   71   2HG   ARG  11          1HG       ARG  11  -4.353 -15.627   0.940
   72   1HD   ARG  11          2HD       ARG  11  -4.053 -17.581   3.234
   73   2HD   ARG  11          1HD       ARG  11  -3.143 -17.715   1.728
   74    HE   ARG  11           HE       ARG  11  -2.838 -15.068   2.710
   75   1HH1  ARG  11          1HH1      ARG  11  -2.223 -18.286   3.765
   76   2HH1  ARG  11          2HH1      ARG  11  -0.693 -17.903   4.480
   77   1HH2  ARG  11          1HH2      ARG  11  -0.771 -14.575   3.513
   78   2HH2  ARG  11          2HH2      ARG  11   0.128 -15.803   4.338
   79    H    GLU  12           H        GLU  12  -7.022 -12.872   3.215
   80    HA   GLU  12           HA       GLU  12  -8.786 -13.632   5.346
   81   1HB   GLU  12          2HB       GLU  12  -7.717 -11.042   4.279
   82   2HB   GLU  12          1HB       GLU  12  -9.053 -11.000   5.426
   83   1HG   GLU  12          2HG       GLU  12  -7.635 -12.577   6.881
   84   2HG   GLU  12          1HG       GLU  12  -6.290 -12.152   5.821
   85    H    ARG  13           H        ARG  13  -9.323 -11.949   2.265
   86    HA   ARG  13           HA       ARG  13 -12.124 -11.463   2.703
   87   1HB   ARG  13          2HB       ARG  13 -10.592 -11.768   0.103
   88   2HB   ARG  13          1HB       ARG  13 -12.215 -11.098   0.256
   89   1HG   ARG  13          2HG       ARG  13 -11.428  -9.228   1.510
   90   2HG   ARG  13          1HG       ARG  13  -9.853  -9.972   1.771
   91   1HD   ARG  13          2HD       ARG  13  -9.450  -8.424   0.033
   92   2HD   ARG  13          1HD       ARG  13  -9.652  -9.956  -0.817
   93    HE   ARG  13           HE       ARG  13 -12.104  -9.167  -1.118
   94   1HH1  ARG  13          1HH1      ARG  13  -9.784  -7.882  -2.784
   95   2HH1  ARG  13          2HH1      ARG  13 -10.310  -6.231  -2.788
   96   1HH2  ARG  13          1HH2      ARG  13 -12.625  -6.686  -0.247
   97   2HH2  ARG  13          2HH2      ARG  13 -11.918  -5.554  -1.352
   98    H    ILE  14           H        ILE  14 -10.320 -14.111   1.195
   99    HA   ILE  14           HA       ILE  14 -12.672 -15.565   0.348
  100    HB   ILE  14           HB       ILE  14  -9.892 -16.626   0.941
  101   1HG1  ILE  14          2HG1      ILE  14 -10.933 -15.891  -1.782
  102   2HG1  ILE  14          1HG1      ILE  14 -10.214 -14.655  -0.752
  103   1HG2  ILE  14          2HG2      ILE  14 -12.260 -17.968   0.331
  104   2HG2  ILE  14          1HG2      ILE  14 -11.428 -17.846  -1.219
  105   3HG2  ILE  14          3HG2      ILE  14 -10.628 -18.611   0.154
  106   1HD1  ILE  14          3HD1      ILE  14  -8.674 -17.170  -0.920
  107   2HD1  ILE  14          2HD1      ILE  14  -8.784 -16.273  -2.434
  108   3HD1  ILE  14          1HD1      ILE  14  -8.113 -15.501  -0.998
  109    H    PHE  15           H        PHE  15 -10.494 -15.819   3.167
  110    HA   PHE  15           HA       PHE  15 -11.881 -17.993   4.404
  111   1HB   PHE  15          2HB       PHE  15  -9.630 -17.275   5.128
  112   2HB   PHE  15          1HB       PHE  15 -10.302 -15.752   5.717
  113    HD1  PHE  15           HD1      PHE  15 -10.133 -19.402   6.243
  114    HD2  PHE  15           HD2      PHE  15 -11.685 -15.685   7.734
  115    HE1  PHE  15           HE1      PHE  15 -10.740 -20.513   8.375
  116    HE2  PHE  15           HE2      PHE  15 -12.292 -16.796   9.869
  117    HZ   PHE  15           HZ       PHE  15 -11.823 -19.213  10.189
  118    H    LYS  16           H        LYS  16 -12.367 -14.500   4.465
  119    HA   LYS  16           HA       LYS  16 -14.340 -14.486   6.559
  120   1HB   LYS  16          2HB       LYS  16 -13.641 -12.593   4.319
  121   2HB   LYS  16          1HB       LYS  16 -15.043 -12.294   5.345
  122   1HG   LYS  16          2HG       LYS  16 -13.554 -12.454   7.348
  123   2HG   LYS  16          1HG       LYS  16 -12.171 -12.616   6.265
  124   1HD   LYS  16          2HD       LYS  16 -12.825 -10.423   5.218
  125   2HD   LYS  16          1HD       LYS  16 -14.058 -10.253   6.468
  126   1HE   LYS  16          2HE       LYS  16 -11.066 -10.488   6.911
  127   2HE   LYS  16          1HE       LYS  16 -12.049  -9.044   7.154
  128   1HZ   LYS  16          3HZ       LYS  16 -13.373 -10.453   8.763
  129   2HZ   LYS  16          2HZ       LYS  16 -12.094 -11.570   8.692
  130   3HZ   LYS  16          1HZ       LYS  16 -11.818  -9.993   9.262
  131    H    ARG  17           H        ARG  17 -14.464 -15.140   3.111
  132    HA   ARG  17           HA       ARG  17 -17.330 -14.942   2.841
  133   1HB   ARG  17          2HB       ARG  17 -15.194 -16.373   1.246
  134   2HB   ARG  17          1HB       ARG  17 -16.900 -16.427   0.801
  135   1HG   ARG  17          2HG       ARG  17 -16.854 -13.870   0.883
  136   2HG   ARG  17          1HG       ARG  17 -15.098 -14.003   0.961
  137   1HD   ARG  17          2HD       ARG  17 -15.292 -15.497  -1.128
  138   2HD   ARG  17          1HD       ARG  17 -16.940 -14.887  -1.260
  139    HE   ARG  17           HE       ARG  17 -15.830 -12.561  -1.298
  140   1HH1  ARG  17          1HH1      ARG  17 -13.476 -14.930  -1.409
  141   2HH1  ARG  17          2HH1      ARG  17 -12.737 -14.385  -2.877
  142   1HH2  ARG  17          1HH2      ARG  17 -15.224 -12.075  -3.586
  143   2HH2  ARG  17          2HH2      ARG  17 -13.726 -12.769  -4.110
  144    H    PHE  18           H        PHE  18 -15.102 -17.558   3.676
  145    HA   PHE  18           HA       PHE  18 -17.098 -19.639   3.677
  146   1HB   PHE  18          2HB       PHE  18 -14.362 -19.376   4.921
  147   2HB   PHE  18          1HB       PHE  18 -15.364 -20.803   5.186
  148    HD1  PHE  18           HD1      PHE  18 -16.130 -22.170   3.217
  149    HD2  PHE  18           HD2      PHE  18 -13.241 -19.012   2.840
  150    HE1  PHE  18           HE1      PHE  18 -15.436 -23.067   1.012
  151    HE2  PHE  18           HE2      PHE  18 -12.547 -19.911   0.635
  152    HZ   PHE  18           HZ       PHE  18 -13.644 -21.938  -0.279
  153    H    ASP  19           H        ASP  19 -15.625 -17.746   6.321
  154    HA   ASP  19           HA       ASP  19 -17.134 -18.844   8.442
  155   1HB   ASP  19          2HB       ASP  19 -15.208 -17.063   8.465
  156   2HB   ASP  19          1HB       ASP  19 -16.525 -15.894   8.350
  157    H    ALA  20           H        ALA  20 -19.333 -19.143   8.143
  158    HA   ALA  20           HA       ALA  20 -21.015 -17.367   6.669
  159   1HB   ALA  20          2HB       ALA  20 -21.520 -19.765   7.133
  160   2HB   ALA  20          1HB       ALA  20 -21.824 -19.342   8.818
  161   3HB   ALA  20          3HB       ALA  20 -22.857 -18.691   7.545
  162    H    ASN  21           H        ASN  21 -20.740 -17.802  10.242
  163    HA   ASN  21           HA       ASN  21 -22.396 -15.385  10.579
  164   1HB   ASN  21          2HB       ASN  21 -22.337 -15.873  12.957
  165   2HB   ASN  21          1HB       ASN  21 -22.704 -17.354  12.079
  166   1HD2  ASN  21          1HD2      ASN  21 -21.482 -17.091  14.754
  167   2HD2  ASN  21          2HD2      ASN  21 -19.976 -17.864  14.667
  168    H    GLY  22           H        GLY  22 -19.054 -16.280  10.582
  169   1HA   GLY  22          1HA       GLY  22 -18.325 -13.447  10.849
  170   2HA   GLY  22          2HA       GLY  22 -17.223 -14.762  10.451
  171    H    ASP  23           H        ASP  23 -17.768 -16.461  12.661
  172    HA   ASP  23           HA       ASP  23 -17.158 -14.770  15.026
  173   1HB   ASP  23          2HB       ASP  23 -17.499 -16.810  16.357
  174   2HB   ASP  23          1HB       ASP  23 -18.888 -16.503  15.320
  175    H    GLY  24           H        GLY  24 -15.423 -15.970  12.592
  176   1HA   GLY  24          1HA       GLY  24 -13.009 -16.206  14.292
  177   2HA   GLY  24          2HA       GLY  24 -13.018 -15.929  12.553
  178    H    LYS  25           H        LYS  25 -15.199 -18.394  13.379
  179    HA   LYS  25           HA       LYS  25 -13.154 -20.427  12.608
  180   1HB   LYS  25          2HB       LYS  25 -14.089 -22.004  14.179
  181   2HB   LYS  25          1HB       LYS  25 -13.775 -20.510  15.062
  182   1HG   LYS  25          2HG       LYS  25 -16.097 -19.878  14.951
  183   2HG   LYS  25          1HG       LYS  25 -16.459 -21.202  13.842
  184   1HD   LYS  25          2HD       LYS  25 -15.667 -22.787  15.673
  185   2HD   LYS  25          1HD       LYS  25 -15.667 -21.395  16.758
  186   1HE   LYS  25          2HE       LYS  25 -17.805 -22.820  16.721
  187   2HE   LYS  25          1HE       LYS  25 -18.014 -21.081  16.522
  188   1HZ   LYS  25          3HZ       LYS  25 -17.649 -22.776  14.150
  189   2HZ   LYS  25          2HZ       LYS  25 -19.173 -22.711  14.900
  190   3HZ   LYS  25          1HZ       LYS  25 -18.458 -21.293  14.296
  191    H    ILE  26           H        ILE  26 -13.837 -21.964  11.149
  192    HA   ILE  26           HA       ILE  26 -16.598 -21.599  10.058
  193    HB   ILE  26           HB       ILE  26 -14.312 -22.858   8.552
  194   1HG1  ILE  26          2HG1      ILE  26 -14.983 -19.909   8.784
  195   2HG1  ILE  26          1HG1      ILE  26 -13.475 -20.685   9.270
  196   1HG2  ILE  26          1HG2      ILE  26 -16.852 -21.396   7.771
  197   2HG2  ILE  26          3HG2      ILE  26 -15.643 -21.973   6.626
  198   3HG2  ILE  26          2HG2      ILE  26 -16.543 -23.125   7.611
  199   1HD1  ILE  26          3HD1      ILE  26 -14.155 -21.325   6.515
  200   2HD1  ILE  26          2HD1      ILE  26 -14.042 -19.582   6.759
  201   3HD1  ILE  26          1HD1      ILE  26 -12.674 -20.620   7.161
  202    H    SER  27           H        SER  27 -17.917 -23.369  10.034
  203    HA   SER  27           HA       SER  27 -16.762 -25.935  11.022
  204   1HB   SER  27          2HB       SER  27 -18.859 -26.431  11.965
  205   2HB   SER  27          1HB       SER  27 -18.728 -24.691  12.216
  206    HG   SER  27           HG       SER  27 -20.575 -24.697  11.209
  207    H    ALA  28           H        ALA  28 -17.895 -27.920  10.042
  208    HA   ALA  28           HA       ALA  28 -17.524 -28.027   7.271
  209   1HB   ALA  28          1HB       ALA  28 -19.701 -29.677   8.523
  210   2HB   ALA  28          3HB       ALA  28 -18.488 -30.157   7.336
  211   3HB   ALA  28          2HB       ALA  28 -18.028 -29.929   9.024
  212    H    ALA  29           H        ALA  29 -20.543 -27.399   9.046
  213    HA   ALA  29           HA       ALA  29 -22.243 -27.155   6.797
  214   1HB   ALA  29          2HB       ALA  29 -22.724 -27.057   9.403
  215   2HB   ALA  29          1HB       ALA  29 -22.601 -25.317   9.135
  216   3HB   ALA  29          3HB       ALA  29 -23.808 -26.262   8.261
  217    H    GLU  30           H        GLU  30 -20.093 -24.783   8.323
  218    HA   GLU  30           HA       GLU  30 -20.975 -22.630   6.576
  219   1HB   GLU  30          2HB       GLU  30 -18.522 -22.887   8.340
  220   2HB   GLU  30          1HB       GLU  30 -19.010 -21.409   7.511
  221   1HG   GLU  30          2HG       GLU  30 -21.182 -21.474   8.722
  222   2HG   GLU  30          1HG       GLU  30 -20.638 -22.911   9.587
  223    H    LEU  31           H        LEU  31 -17.944 -24.524   6.787
  224    HA   LEU  31           HA       LEU  31 -16.852 -23.495   4.354
  225   1HB   LEU  31          2HB       LEU  31 -15.395 -24.650   5.893
  226   2HB   LEU  31          1HB       LEU  31 -16.387 -26.106   5.822
  227    HG   LEU  31           HG       LEU  31 -15.874 -26.207   3.338
  228   1HD1  LEU  31          2HD1      LEU  31 -14.380 -23.777   4.137
  229   2HD1  LEU  31          1HD1      LEU  31 -13.502 -24.892   3.089
  230   3HD1  LEU  31          3HD1      LEU  31 -15.048 -24.223   2.566
  231   1HD2  LEU  31          1HD2      LEU  31 -14.585 -27.331   5.379
  232   2HD2  LEU  31          3HD2      LEU  31 -13.979 -27.483   3.729
  233   3HD2  LEU  31          2HD2      LEU  31 -13.275 -26.290   4.820
  234    H    GLY  32           H        GLY  32 -18.852 -26.344   5.045
  235   1HA   GLY  32          1HA       GLY  32 -20.085 -27.723   3.600
  236   2HA   GLY  32          2HA       GLY  32 -18.864 -27.378   2.378
  237    H    GLU  33           H        GLU  33 -21.075 -25.160   4.078
  238    HA   GLU  33           HA       GLU  33 -22.941 -24.828   1.977
  239   1HB   GLU  33          2HB       GLU  33 -22.107 -23.236   4.351
  240   2HB   GLU  33          1HB       GLU  33 -23.016 -22.388   3.101
  241   1HG   GLU  33          2HG       GLU  33 -24.728 -24.234   3.198
  242   2HG   GLU  33          1HG       GLU  33 -23.860 -24.893   4.584
  243    H    ALA  34           H        ALA  34 -19.903 -23.083   2.624
  244    HA   ALA  34           HA       ALA  34 -20.228 -21.354   0.310
  245   1HB   ALA  34          2HB       ALA  34 -18.731 -20.340   1.727
  246   2HB   ALA  34          1HB       ALA  34 -18.127 -21.875   2.349
  247   3HB   ALA  34          3HB       ALA  34 -17.563 -21.272   0.791
  248    H    LEU  35           H        LEU  35 -18.513 -24.359   1.030
  249    HA   LEU  35           HA       LEU  35 -17.128 -24.622  -1.437
  250   1HB   LEU  35          2HB       LEU  35 -18.053 -26.516   0.689
  251   2HB   LEU  35          1HB       LEU  35 -17.467 -27.178  -0.835
  252    HG   LEU  35           HG       LEU  35 -15.963 -25.283   0.992
  253   1HD1  LEU  35          3HD1      LEU  35 -15.683 -28.218   0.312
  254   2HD1  LEU  35          2HD1      LEU  35 -14.375 -27.286   1.041
  255   3HD1  LEU  35          1HD1      LEU  35 -15.899 -27.492   1.905
  256   1HD2  LEU  35          3HD2      LEU  35 -15.416 -26.344  -1.774
  257   2HD2  LEU  35          2HD2      LEU  35 -15.268 -24.691  -1.179
  258   3HD2  LEU  35          1HD2      LEU  35 -14.087 -25.910  -0.699
  259    H    LYS  36           H        LYS  36 -20.471 -25.351  -0.536
  260    HA   LYS  36           HA       LYS  36 -21.292 -27.016  -2.600
  261   1HB   LYS  36          2HB       LYS  36 -22.558 -24.969  -0.928
  262   2HB   LYS  36          1HB       LYS  36 -23.337 -25.146  -2.502
  263   1HG   LYS  36          2HG       LYS  36 -23.596 -27.545  -2.149
  264   2HG   LYS  36          1HG       LYS  36 -22.704 -27.448  -0.630
  265   1HD   LYS  36          2HD       LYS  36 -24.680 -25.531  -0.312
  266   2HD   LYS  36          1HD       LYS  36 -25.514 -26.815  -1.189
  267   1HE   LYS  36          2HE       LYS  36 -25.258 -28.341   0.525
  268   2HE   LYS  36          1HE       LYS  36 -23.755 -27.611   1.092
  269   1HZ   LYS  36          1HZ       LYS  36 -25.987 -25.836   1.313
  270   2HZ   LYS  36          3HZ       LYS  36 -26.222 -27.265   2.197
  271   3HZ   LYS  36          2HZ       LYS  36 -24.853 -26.302   2.490
  272    H    THR  37           H        THR  37 -20.211 -23.713  -2.834
  273    HA   THR  37           HA       THR  37 -21.359 -22.874  -5.252
  274    HB   THR  37           HB       THR  37 -19.762 -21.574  -3.742
  275    HG1  THR  37           HG1      THR  37 -19.751 -20.293  -5.383
  276   1HG2  THR  37          2HG2      THR  37 -18.048 -23.604  -4.139
  277   2HG2  THR  37          1HG2      THR  37 -17.520 -22.541  -5.442
  278   3HG2  THR  37          3HG2      THR  37 -17.503 -21.968  -3.774
  279    H    LEU  38           H        LEU  38 -19.048 -25.389  -4.670
  280    HA   LEU  38           HA       LEU  38 -17.832 -25.557  -7.241
  281   1HB   LEU  38          2HB       LEU  38 -18.477 -27.682  -5.183
  282   2HB   LEU  38          1HB       LEU  38 -17.557 -28.015  -6.649
  283    HG   LEU  38           HG       LEU  38 -16.826 -26.111  -4.410
  284   1HD1  LEU  38          3HD1      LEU  38 -16.349 -28.626  -4.264
  285   2HD1  LEU  38          2HD1      LEU  38 -15.234 -28.386  -5.609
  286   3HD1  LEU  38          1HD1      LEU  38 -14.958 -27.557  -4.076
  287   1HD2  LEU  38          3HD2      LEU  38 -15.711 -26.422  -7.202
  288   2HD2  LEU  38          2HD2      LEU  38 -16.209 -24.941  -6.385
  289   3HD2  LEU  38          1HD2      LEU  38 -14.738 -25.775  -5.882
  290    H    GLY  39           H        GLY  39 -20.949 -26.669  -6.044
  291   1HA   GLY  39          1HA       GLY  39 -21.999 -26.872  -8.735
  292   2HA   GLY  39          2HA       GLY  39 -22.854 -27.324  -7.261
  293    H    SER  40           H        SER  40 -20.010 -28.923  -7.022
  294    HA   SER  40           HA       SER  40 -21.234 -31.441  -7.912
  295   1HB   SER  40          2HB       SER  40 -19.166 -30.041  -9.457
  296   2HB   SER  40          1HB       SER  40 -18.738 -31.706  -9.060
  297    HG   SER  40           HG       SER  40 -20.953 -32.198  -9.816
  298    H    ILE  41           H        ILE  41 -20.855 -31.097  -5.363
  299    HA   ILE  41           HA       ILE  41 -18.457 -32.721  -4.749
  300    HB   ILE  41           HB       ILE  41 -17.977 -30.195  -4.463
  301   1HG1  ILE  41          2HG1      ILE  41 -17.631 -31.723  -1.898
  302   2HG1  ILE  41          1HG1      ILE  41 -16.830 -32.282  -3.366
  303   1HG2  ILE  41          2HG2      ILE  41 -20.341 -30.129  -3.169
  304   2HG2  ILE  41          1HG2      ILE  41 -19.277 -30.426  -1.794
  305   3HG2  ILE  41          3HG2      ILE  41 -19.033 -29.002  -2.807
  306   1HD1  ILE  41          2HD1      ILE  41 -16.625 -29.395  -2.538
  307   2HD1  ILE  41          1HD1      ILE  41 -15.570 -30.604  -1.805
  308   3HD1  ILE  41          3HD1      ILE  41 -15.528 -30.338  -3.548
  309    H    THR  42           H        THR  42 -18.572 -33.299  -2.274
  310    HA   THR  42           HA       THR  42 -21.440 -33.734  -1.543
  311    HB   THR  42           HB       THR  42 -21.111 -35.971  -1.335
  312    HG1  THR  42           HG1      THR  42 -19.247 -36.780  -0.248
  313   1HG2  THR  42          2HG2      THR  42 -19.903 -35.497  -3.478
  314   2HG2  THR  42          1HG2      THR  42 -18.394 -35.445  -2.564
  315   3HG2  THR  42          3HG2      THR  42 -19.322 -36.943  -2.653
  316    HA   PRO  43           HA       PRO  43 -20.450 -32.107   2.452
  317   1HB   PRO  43          2HB       PRO  43 -21.753 -33.769   4.141
  318   2HB   PRO  43          1HB       PRO  43 -22.591 -32.591   3.128
  319   1HG   PRO  43          2HG       PRO  43 -22.193 -35.528   2.692
  320   2HG   PRO  43          1HG       PRO  43 -23.648 -34.555   2.446
  321   1HD   PRO  43          1HD       PRO  43 -22.047 -35.287   0.393
  322   2HD   PRO  43          2HD       PRO  43 -22.921 -33.754   0.401
  323    H    ASP  44           H        ASP  44 -20.007 -35.581   2.006
  324    HA   ASP  44           HA       ASP  44 -18.316 -35.997   4.285
  325   1HB   ASP  44          2HB       ASP  44 -18.491 -37.521   1.669
  326   2HB   ASP  44          1HB       ASP  44 -17.660 -38.090   3.117
  327    H    GLU  45           H        GLU  45 -17.702 -34.623   1.122
  328    HA   GLU  45           HA       GLU  45 -14.809 -35.044   1.305
  329   1HB   GLU  45          2HB       GLU  45 -16.548 -33.412  -0.567
  330   2HB   GLU  45          1HB       GLU  45 -14.791 -33.497  -0.698
  331   1HG   GLU  45          2HG       GLU  45 -15.046 -36.032  -0.792
  332   2HG   GLU  45          1HG       GLU  45 -16.779 -35.762  -0.980
  333    H    VAL  46           H        VAL  46 -17.144 -32.447   1.821
  334    HA   VAL  46           HA       VAL  46 -15.185 -30.414   2.389
  335    HB   VAL  46           HB       VAL  46 -18.112 -30.704   3.100
  336   1HG1  VAL  46          2HG1      VAL  46 -16.144 -28.999   4.315
  337   2HG1  VAL  46          1HG1      VAL  46 -17.237 -28.007   3.350
  338   3HG1  VAL  46          3HG1      VAL  46 -17.882 -29.054   4.615
  339   1HG2  VAL  46          1HG2      VAL  46 -16.620 -29.790   0.815
  340   2HG2  VAL  46          3HG2      VAL  46 -18.369 -29.896   1.014
  341   3HG2  VAL  46          2HG2      VAL  46 -17.514 -28.434   1.504
  342    H    LYS  47           H        LYS  47 -16.906 -32.791   4.340
  343    HA   LYS  47           HA       LYS  47 -16.011 -31.832   6.899
  344   1HB   LYS  47          2HB       LYS  47 -17.887 -33.408   6.708
  345   2HB   LYS  47          1HB       LYS  47 -16.807 -34.629   6.032
  346   1HG   LYS  47          2HG       LYS  47 -15.508 -34.665   8.111
  347   2HG   LYS  47          1HG       LYS  47 -16.521 -33.389   8.787
  348   1HD   LYS  47          2HD       LYS  47 -17.473 -35.346   9.682
  349   2HD   LYS  47          1HD       LYS  47 -18.495 -35.016   8.284
  350   1HE   LYS  47          2HE       LYS  47 -16.286 -36.544   7.354
  351   2HE   LYS  47          1HE       LYS  47 -16.883 -37.336   8.813
  352   1HZ   LYS  47          3HZ       LYS  47 -18.842 -36.404   6.850
  353   2HZ   LYS  47          2HZ       LYS  47 -17.947 -37.799   6.477
  354   3HZ   LYS  47          1HZ       LYS  47 -18.900 -37.748   7.882
  355    H    HIS  48           H        HIS  48 -14.705 -34.163   4.576
  356    HA   HIS  48           HA       HIS  48 -12.505 -35.039   6.192
  357   1HB   HIS  48          2HB       HIS  48 -13.195 -36.264   4.177
  358   2HB   HIS  48          1HB       HIS  48 -12.755 -34.883   3.171
  359    HD1  HIS  48           HD1      HIS  48 -11.431 -38.004   3.935
  360    HD2  HIS  48           HD2      HIS  48  -9.786 -34.175   4.077
  361    HE1  HIS  48           HE1      HIS  48  -8.916 -38.302   3.871
  362    H    MET  49           H        MET  49 -12.887 -32.351   3.893
  363    HA   MET  49           HA       MET  49 -10.193 -31.493   3.813
  364   1HB   MET  49          2HB       MET  49 -12.839 -30.083   3.551
  365   2HB   MET  49          1HB       MET  49 -11.341 -29.158   3.552
  366   1HG   MET  49          2HG       MET  49 -10.547 -30.864   1.757
  367   2HG   MET  49          1HG       MET  49 -12.259 -31.252   1.589
  368   1HE   MET  49          1HE       MET  49 -13.225 -30.529  -0.333
  369   2HE   MET  49          3HE       MET  49 -12.762 -29.147  -1.337
  370   3HE   MET  49          2HE       MET  49 -11.622 -30.462  -1.061
  371    H    MET  50           H        MET  50 -12.793 -30.752   6.104
  372    HA   MET  50           HA       MET  50 -11.329 -28.928   7.731
  373   1HB   MET  50          2HB       MET  50 -13.610 -30.818   8.344
  374   2HB   MET  50          1HB       MET  50 -12.981 -29.664   9.515
  375   1HG   MET  50          2HG       MET  50 -13.384 -27.846   7.802
  376   2HG   MET  50          1HG       MET  50 -14.227 -29.050   6.826
  377   1HE   MET  50          1HE       MET  50 -13.765 -27.259   9.966
  378   2HE   MET  50          3HE       MET  50 -15.337 -27.130  10.768
  379   3HE   MET  50          2HE       MET  50 -14.369 -28.591  10.948
  380    H    ALA  51           H        ALA  51 -11.806 -32.439   8.019
  381    HA   ALA  51           HA       ALA  51 -10.261 -32.873  10.341
  382   1HB   ALA  51          1HB       ALA  51 -10.892 -34.983   9.873
  383   2HB   ALA  51          2HB       ALA  51  -9.752 -35.017   8.529
  384   3HB   ALA  51          3HB       ALA  51 -11.411 -34.479   8.265
  385    H    GLU  52           H        GLU  52  -9.293 -32.000   7.135
  386    HA   GLU  52           HA       GLU  52  -6.453 -32.669   7.722
  387   1HB   GLU  52          2HB       GLU  52  -7.979 -31.968   5.226
  388   2HB   GLU  52          1HB       GLU  52  -6.228 -31.761   5.272
  389   1HG   GLU  52          2HG       GLU  52  -6.090 -34.166   6.103
  390   2HG   GLU  52          1HG       GLU  52  -7.801 -34.313   5.699
  391    H    ILE  53           H        ILE  53  -8.598 -29.946   7.060
  392    HA   ILE  53           HA       ILE  53  -6.440 -27.979   7.182
  393    HB   ILE  53           HB       ILE  53  -9.451 -27.653   7.271
  394   1HG1  ILE  53          2HG1      ILE  53  -7.496 -27.316   4.980
  395   2HG1  ILE  53          1HG1      ILE  53  -8.543 -28.716   5.202
  396   1HG2  ILE  53          3HG2      ILE  53  -7.872 -25.790   8.174
  397   2HG2  ILE  53          2HG2      ILE  53  -7.446 -25.552   6.478
  398   3HG2  ILE  53          1HG2      ILE  53  -9.116 -25.346   7.007
  399   1HD1  ILE  53          1HD1      ILE  53  -9.551 -25.867   4.976
  400   2HD1  ILE  53          3HD1      ILE  53  -9.487 -27.001   3.628
  401   3HD1  ILE  53          2HD1      ILE  53 -10.527 -27.336   5.012
  402    H    ASP  54           H        ASP  54  -8.858 -29.307   9.370
  403    HA   ASP  54           HA       ASP  54  -8.658 -27.423  11.479
  404   1HB   ASP  54          2HB       ASP  54 -10.228 -29.506  11.068
  405   2HB   ASP  54          1HB       ASP  54  -8.997 -30.361  11.987
  406    H    THR  55           H        THR  55  -6.574 -26.828  12.065
  407    HA   THR  55           HA       THR  55  -4.395 -28.721  12.257
  408    HB   THR  55           HB       THR  55  -3.141 -26.837  13.226
  409    HG1  THR  55           HG1      THR  55  -4.143 -25.104  13.951
  410   1HG2  THR  55          2HG2      THR  55  -4.912 -26.261  10.847
  411   2HG2  THR  55          1HG2      THR  55  -3.611 -25.176  11.341
  412   3HG2  THR  55          3HG2      THR  55  -3.241 -26.828  10.844
  413    H    ASP  56           H        ASP  56  -6.348 -27.026  14.716
  414    HA   ASP  56           HA       ASP  56  -5.042 -28.593  16.838
  415   1HB   ASP  56          2HB       ASP  56  -6.236 -27.243  18.388
  416   2HB   ASP  56          1HB       ASP  56  -5.784 -26.156  17.077
  417    H    GLY  57           H        GLY  57  -8.082 -28.581  15.073
  418   1HA   GLY  57          1HA       GLY  57  -8.648 -31.248  16.231
  419   2HA   GLY  57          2HA       GLY  57  -9.397 -30.580  14.785
  420    H    ASP  58           H        ASP  58  -9.986 -27.984  16.244
  421    HA   ASP  58           HA       ASP  58 -11.818 -28.814  18.384
  422   1HB   ASP  58          2HB       ASP  58 -12.315 -26.482  18.660
  423   2HB   ASP  58          1HB       ASP  58 -10.583 -26.597  18.369
  424    H    GLY  59           H        GLY  59 -11.961 -28.918  15.062
  425   1HA   GLY  59          1HA       GLY  59 -14.930 -29.015  15.166
  426   2HA   GLY  59          2HA       GLY  59 -13.927 -29.777  13.934
  427    H    PHE  60           H        PHE  60 -12.740 -26.699  14.527
  428    HA   PHE  60           HA       PHE  60 -14.217 -25.667  12.148
  429   1HB   PHE  60          2HB       PHE  60 -13.462 -23.966  14.532
  430   2HB   PHE  60          1HB       PHE  60 -14.445 -23.496  13.146
  431    HD1  PHE  60           HD1      PHE  60 -16.674 -24.615  12.772
  432    HD2  PHE  60           HD2      PHE  60 -14.418 -25.091  16.394
  433    HE1  PHE  60           HE1      PHE  60 -18.707 -25.421  13.932
  434    HE2  PHE  60           HE2      PHE  60 -16.453 -25.893  17.556
  435    HZ   PHE  60           HZ       PHE  60 -18.601 -26.061  16.326
  436    H    ILE  61           H        ILE  61 -13.072 -24.091  10.890
  437    HA   ILE  61           HA       ILE  61 -10.125 -24.267  11.222
  438    HB   ILE  61           HB       ILE  61 -11.699 -23.419   8.777
  439   1HG1  ILE  61          2HG1      ILE  61 -12.272 -25.729   9.294
  440   2HG1  ILE  61          1HG1      ILE  61 -11.160 -25.712   7.926
  441   1HG2  ILE  61          3HG2      ILE  61  -9.262 -22.726   9.069
  442   2HG2  ILE  61          2HG2      ILE  61  -8.861 -24.441   8.995
  443   3HG2  ILE  61          1HG2      ILE  61  -9.622 -23.652   7.613
  444   1HD1  ILE  61          2HD1      ILE  61  -9.272 -26.119   9.521
  445   2HD1  ILE  61          1HD1      ILE  61 -10.451 -26.267  10.824
  446   3HD1  ILE  61          3HD1      ILE  61 -10.449 -27.434   9.499
  447    H    SER  62           H        SER  62  -9.077 -22.393  11.784
  448    HA   SER  62           HA       SER  62 -10.678 -19.898  11.894
  449   1HB   SER  62          2HB       SER  62  -8.251 -19.305  13.043
  450   2HB   SER  62          1HB       SER  62  -9.662 -19.881  13.931
  451    HG   SER  62           HG       SER  62  -7.321 -21.079  13.602
  452    H    PHE  63           H        PHE  63  -9.450 -17.865  11.252
  453    HA   PHE  63           HA       PHE  63  -8.629 -17.988   8.558
  454   1HB   PHE  63          2HB       PHE  63  -9.254 -15.871   9.699
  455   2HB   PHE  63          1HB       PHE  63  -7.752 -15.945  10.623
  456    HD1  PHE  63           HD1      PHE  63  -8.739 -16.480   7.045
  457    HD2  PHE  63           HD2      PHE  63  -6.086 -14.538   9.804
  458    HE1  PHE  63           HE1      PHE  63  -7.524 -15.449   5.147
  459    HE2  PHE  63           HE2      PHE  63  -4.867 -13.509   7.908
  460    HZ   PHE  63           HZ       PHE  63  -5.591 -13.963   5.577
  461    H    GLN  64           H        GLN  64  -6.698 -18.035  11.528
  462    HA   GLN  64           HA       GLN  64  -4.127 -18.077  10.324
  463   1HB   GLN  64          2HB       GLN  64  -4.641 -17.806  12.780
  464   2HB   GLN  64          1HB       GLN  64  -4.976 -19.536  12.844
  465   1HG   GLN  64          2HG       GLN  64  -2.679 -19.218  13.529
  466   2HG   GLN  64          1HG       GLN  64  -2.657 -19.931  11.916
  467   1HE2  GLN  64          1HE2      GLN  64  -0.958 -18.959  10.789
  468   2HE2  GLN  64          2HE2      GLN  64  -0.637 -17.292  10.766
  469    H    GLU  65           H        GLU  65  -6.300 -20.767  11.244
  470    HA   GLU  65           HA       GLU  65  -4.581 -22.864  10.334
  471   1HB   GLU  65          2HB       GLU  65  -7.527 -22.616  10.855
  472   2HB   GLU  65          1HB       GLU  65  -6.900 -24.068  10.084
  473   1HG   GLU  65          2HG       GLU  65  -5.375 -24.441  11.965
  474   2HG   GLU  65          1HG       GLU  65  -5.917 -22.945  12.724
  475    H    PHE  66           H        PHE  66  -7.268 -21.147   8.759
  476    HA   PHE  66           HA       PHE  66  -7.059 -22.540   6.256
  477   1HB   PHE  66          2HB       PHE  66  -9.059 -21.238   6.902
  478   2HB   PHE  66          1HB       PHE  66  -8.111 -19.751   6.832
  479    HD1  PHE  66           HD1      PHE  66  -7.039 -19.081   4.624
  480    HD2  PHE  66           HD2      PHE  66  -9.985 -22.193   4.936
  481    HE1  PHE  66           HE1      PHE  66  -7.465 -18.922   2.186
  482    HE2  PHE  66           HE2      PHE  66 -10.409 -22.034   2.497
  483    HZ   PHE  66           HZ       PHE  66  -9.150 -20.399   1.124
  484    H    THR  67           H        THR  67  -5.369 -19.805   7.646
  485    HA   THR  67           HA       THR  67  -4.212 -18.842   5.181
  486    HB   THR  67           HB       THR  67  -3.278 -18.563   8.056
  487    HG1  THR  67           HG1      THR  67  -4.822 -16.955   6.312
  488   1HG2  THR  67          1HG2      THR  67  -1.585 -18.220   6.104
  489   2HG2  THR  67          3HG2      THR  67  -2.515 -16.757   5.774
  490   3HG2  THR  67          2HG2      THR  67  -1.721 -16.964   7.335
  491    H    ASP  68           H        ASP  68  -2.940 -20.924   7.802
  492    HA   ASP  68           HA       ASP  68  -0.443 -21.473   6.520
  493   1HB   ASP  68          2HB       ASP  68  -1.998 -23.192   8.477
  494   2HB   ASP  68          1HB       ASP  68  -0.287 -23.370   8.086
  495    H    PHE  69           H        PHE  69  -3.621 -23.010   6.311
  496    HA   PHE  69           HA       PHE  69  -2.675 -25.224   4.687
  497   1HB   PHE  69          2HB       PHE  69  -4.635 -25.864   5.701
  498   2HB   PHE  69          1HB       PHE  69  -5.270 -24.222   5.737
  499    HD1  PHE  69           HD1      PHE  69  -6.018 -23.187   3.514
  500    HD2  PHE  69           HD2      PHE  69  -5.385 -27.393   4.075
  501    HE1  PHE  69           HE1      PHE  69  -7.407 -23.664   1.509
  502    HE2  PHE  69           HE2      PHE  69  -6.765 -27.873   2.077
  503    HZ   PHE  69           HZ       PHE  69  -7.782 -26.009   0.791
  504    H    GLY  70           H        GLY  70  -4.249 -22.105   4.089
  505   1HA   GLY  70          1HA       GLY  70  -4.439 -20.853   2.112
  506   2HA   GLY  70          2HA       GLY  70  -4.602 -22.399   1.275
  507    H    ARG  71           H        ARG  71  -1.804 -21.607   3.230
  508    HA   ARG  71           HA       ARG  71  -0.141 -20.610   1.101
  509   1HB   ARG  71          2HB       ARG  71   0.501 -21.891   3.770
  510   2HB   ARG  71          1HB       ARG  71   1.743 -21.273   2.680
  511   1HG   ARG  71          2HG       ARG  71   0.771 -19.045   2.768
  512   2HG   ARG  71          1HG       ARG  71  -0.574 -19.632   3.737
  513   1HD   ARG  71          2HD       ARG  71   0.917 -18.676   5.313
  514   2HD   ARG  71          1HD       ARG  71   1.206 -20.414   5.424
  515    HE   ARG  71           HE       ARG  71   2.990 -19.441   3.486
  516   1HH1  ARG  71          1HH1      ARG  71   2.671 -20.021   6.790
  517   2HH1  ARG  71          2HH1      ARG  71   4.113 -19.180   7.252
  518   1HH2  ARG  71          1HH2      ARG  71   4.698 -17.902   4.082
  519   2HH2  ARG  71          2HH2      ARG  71   5.262 -17.981   5.718
  520    H    ALA  72           H        ALA  72  -0.798 -23.817   2.405
  521    HA   ALA  72           HA       ALA  72   1.201 -25.215   0.885
  522   1HB   ALA  72          2HB       ALA  72  -0.980 -26.958   1.271
  523   2HB   ALA  72          3HB       ALA  72  -0.988 -25.877   2.666
  524   3HB   ALA  72          1HB       ALA  72   0.456 -26.818   2.287
  525    H    ASN  73           H        ASN  73  -1.827 -23.803   0.053
  526    HA   ASN  73           HA       ASN  73  -1.517 -24.820  -2.713
  527   1HB   ASN  73          2HB       ASN  73  -4.209 -24.905  -1.337
  528   2HB   ASN  73          1HB       ASN  73  -3.762 -25.606  -2.892
  529   1HD2  ASN  73          1HD2      ASN  73  -4.088 -26.292   0.440
  530   2HD2  ASN  73          2HD2      ASN  73  -3.248 -27.766   0.461
  531    H    ARG  74           H        ARG  74  -0.847 -22.303  -2.046
  532    HA   ARG  74           HA       ARG  74  -2.781 -20.293  -1.862
  533   1HB   ARG  74          2HB       ARG  74  -1.179 -18.801  -2.877
  534   2HB   ARG  74          1HB       ARG  74  -0.266 -19.970  -1.924
  535   1HG   ARG  74          2HG       ARG  74   0.048 -21.331  -4.012
  536   2HG   ARG  74          1HG       ARG  74  -0.719 -20.028  -4.922
  537   1HD   ARG  74          2HD       ARG  74   1.813 -19.808  -3.264
  538   2HD   ARG  74          1HD       ARG  74   1.714 -19.776  -5.025
  539    HE   ARG  74           HE       ARG  74   0.076 -17.698  -4.317
  540   1HH1  ARG  74          1HH1      ARG  74   2.506 -18.391  -2.172
  541   2HH1  ARG  74          2HH1      ARG  74   3.388 -16.917  -2.390
  542   1HH2  ARG  74          1HH2      ARG  74   1.530 -15.901  -5.136
  543   2HH2  ARG  74          2HH2      ARG  74   2.835 -15.508  -4.068
  544    H    GLY  75           H        GLY  75  -1.778 -22.169  -4.665
  545   1HA   GLY  75          1HA       GLY  75  -2.749 -22.408  -6.769
  546   2HA   GLY  75          2HA       GLY  75  -3.179 -20.701  -6.664
  547    H    LEU  76           H        LEU  76  -4.294 -22.760  -4.134
  548    HA   LEU  76           HA       LEU  76  -6.833 -23.448  -5.397
  549   1HB   LEU  76          2HB       LEU  76  -5.724 -23.700  -2.604
  550   2HB   LEU  76          1HB       LEU  76  -7.419 -24.048  -2.944
  551    HG   LEU  76           HG       LEU  76  -5.037 -25.360  -4.290
  552   1HD1  LEU  76          2HD1      LEU  76  -6.278 -25.875  -1.803
  553   2HD1  LEU  76          1HD1      LEU  76  -6.871 -27.116  -2.908
  554   3HD1  LEU  76          3HD1      LEU  76  -5.137 -26.913  -2.660
  555   1HD2  LEU  76          2HD2      LEU  76  -7.782 -25.071  -5.089
  556   2HD2  LEU  76          1HD2      LEU  76  -6.488 -25.945  -5.908
  557   3HD2  LEU  76          3HD2      LEU  76  -7.476 -26.763  -4.698
  558    H    LEU  77           H        LEU  77  -5.757 -21.141  -2.924
  559    HA   LEU  77           HA       LEU  77  -8.380 -20.002  -2.529
  560   1HB   LEU  77          2HB       LEU  77  -5.825 -18.505  -1.998
  561   2HB   LEU  77          1HB       LEU  77  -7.334 -18.472  -1.088
  562    HG   LEU  77           HG       LEU  77  -5.239 -20.648  -1.159
  563   1HD1  LEU  77          3HD1      LEU  77  -6.259 -18.651   0.754
  564   2HD1  LEU  77          2HD1      LEU  77  -6.079 -20.271   1.426
  565   3HD1  LEU  77          1HD1      LEU  77  -4.691 -19.457   0.701
  566   1HD2  LEU  77          3HD2      LEU  77  -8.156 -20.813  -0.409
  567   2HD2  LEU  77          2HD2      LEU  77  -7.208 -21.931  -1.390
  568   3HD2  LEU  77          1HD2      LEU  77  -6.963 -21.862   0.356
  569    H    LYS  78           H        LYS  78  -5.851 -19.456  -4.878
  570    HA   LYS  78           HA       LYS  78  -6.874 -16.833  -5.675
  571   1HB   LYS  78          2HB       LYS  78  -5.202 -16.907  -7.397
  572   2HB   LYS  78          1HB       LYS  78  -4.467 -17.612  -5.957
  573   1HG   LYS  78          2HG       LYS  78  -4.854 -19.853  -6.780
  574   2HG   LYS  78          1HG       LYS  78  -5.798 -19.241  -8.139
  575   1HD   LYS  78          2HD       LYS  78  -3.486 -19.819  -8.824
  576   2HD   LYS  78          1HD       LYS  78  -3.809 -18.096  -9.022
  577   1HE   LYS  78          2HE       LYS  78  -2.291 -17.513  -7.435
  578   2HE   LYS  78          1HE       LYS  78  -2.781 -18.821  -6.359
  579   1HZ   LYS  78          3HZ       LYS  78  -1.224 -19.324  -8.822
  580   2HZ   LYS  78          2HZ       LYS  78  -0.469 -18.948  -7.347
  581   3HZ   LYS  78          1HZ       LYS  78  -1.431 -20.343  -7.481
  582    H    ASP  79           H        ASP  79  -7.364 -20.182  -6.553
  583    HA   ASP  79           HA       ASP  79  -8.885 -19.486  -8.976
  584   1HB   ASP  79          2HB       ASP  79  -8.072 -22.031  -7.604
  585   2HB   ASP  79          1HB       ASP  79  -9.351 -22.059  -8.814
  586    H    VAL  80           H        VAL  80  -9.491 -20.859  -5.758
  587    HA   VAL  80           HA       VAL  80 -12.296 -21.232  -6.023
  588    HB   VAL  80           HB       VAL  80 -10.741 -21.957  -4.103
  589   1HG1  VAL  80          1HG1      VAL  80  -9.841 -19.690  -3.650
  590   2HG1  VAL  80          3HG1      VAL  80 -11.447 -19.176  -3.131
  591   3HG1  VAL  80          2HG1      VAL  80 -10.576 -20.407  -2.216
  592   1HG2  VAL  80          3HG2      VAL  80 -13.539 -20.984  -3.981
  593   2HG2  VAL  80          2HG2      VAL  80 -12.889 -22.581  -3.610
  594   3HG2  VAL  80          1HG2      VAL  80 -12.763 -21.279  -2.425
  595    H    ALA  81           H        ALA  81 -10.415 -18.455  -4.923
  596    HA   ALA  81           HA       ALA  81 -12.477 -16.703  -4.197
  597   1HB   ALA  81          2HB       ALA  81 -10.080 -16.150  -3.967
  598   2HB   ALA  81          1HB       ALA  81  -9.951 -15.999  -5.719
  599   3HB   ALA  81          3HB       ALA  81 -10.949 -14.866  -4.808
  600    H    LYS  82           H        LYS  82 -11.238 -17.416  -7.443
  601    HA   LYS  82           HA       LYS  82 -12.775 -15.500  -8.868
  602   1HB   LYS  82          2HB       LYS  82 -11.795 -18.249  -9.685
  603   2HB   LYS  82          1HB       LYS  82 -12.520 -17.096 -10.806
  604   1HG   LYS  82          2HG       LYS  82 -10.761 -15.430 -10.102
  605   2HG   LYS  82          1HG       LYS  82  -9.988 -16.720  -9.183
  606   1HD   LYS  82          2HD       LYS  82  -9.892 -18.067 -11.317
  607   2HD   LYS  82          1HD       LYS  82 -10.453 -16.632 -12.176
  608   1HE   LYS  82          2HE       LYS  82  -8.355 -15.821 -12.219
  609   2HE   LYS  82          1HE       LYS  82  -8.286 -15.876 -10.457
  610   1HZ   LYS  82          2HZ       LYS  82  -8.034 -18.482 -11.254
  611   2HZ   LYS  82          1HZ       LYS  82  -7.085 -17.617 -12.365
  612   3HZ   LYS  82          3HZ       LYS  82  -6.785 -17.472 -10.702
  613    H    ILE  83           H        ILE  83 -13.621 -18.661  -7.579
  614    HA   ILE  83           HA       ILE  83 -16.043 -19.105  -8.981
  615    HB   ILE  83           HB       ILE  83 -15.241 -19.811  -6.146
  616   1HG1  ILE  83          2HG1      ILE  83 -15.329 -21.355  -8.754
  617   2HG1  ILE  83          1HG1      ILE  83 -13.884 -20.882  -7.859
  618   1HG2  ILE  83          2HG2      ILE  83 -17.817 -19.998  -7.495
  619   2HG2  ILE  83          1HG2      ILE  83 -17.215 -21.589  -7.026
  620   3HG2  ILE  83          3HG2      ILE  83 -17.413 -20.327  -5.809
  621   1HD1  ILE  83          1HD1      ILE  83 -14.711 -22.248  -5.923
  622   2HD1  ILE  83          3HD1      ILE  83 -16.040 -22.808  -6.938
  623   3HD1  ILE  83          2HD1      ILE  83 -14.375 -23.211  -7.362
  624    H    PHE  84           H        PHE  84 -15.305 -17.012  -6.256
  625    HA   PHE  84           HA       PHE  84 -18.169 -16.197  -6.119
  626   1HB   PHE  84          2HB       PHE  84 -15.849 -15.671  -4.237
  627   2HB   PHE  84          1HB       PHE  84 -17.488 -15.062  -4.000
  628    HD1  PHE  84           HD1      PHE  84 -15.748 -18.301  -4.783
  629    HD2  PHE  84           HD2      PHE  84 -18.916 -16.323  -2.660
  630    HE1  PHE  84           HE1      PHE  84 -16.395 -20.456  -3.740
  631    HE2  PHE  84           HE2      PHE  84 -19.563 -18.478  -1.618
  632    HZ   PHE  84           HZ       PHE  84 -18.302 -20.544  -2.158

  No H/Q in entry =         632
  Start of MODEL   14
    1    H1   ALA   1          3H        ALA   1   9.584 -12.229   1.942
    2    H2   ALA   1          2H        ALA   1  10.892 -13.207   2.409
    3    H3   ALA   1          1H        ALA   1  11.011 -12.230   1.024
    4    HA   ALA   1           HA       ALA   1  10.641 -14.380   0.206
    5   1HB   ALA   1          2HB       ALA   1   8.974 -15.867   1.099
    6   2HB   ALA   1          1HB       ALA   1   9.881 -15.233   2.473
    7   3HB   ALA   1          3HB       ALA   1   8.282 -14.588   2.096
    8    H    ASP   2           H        ASP   2   8.600 -15.139  -1.112
    9    HA   ASP   2           HA       ASP   2   7.588 -12.804  -2.496
   10   1HB   ASP   2          2HB       ASP   2   6.862 -15.742  -2.706
   11   2HB   ASP   2          1HB       ASP   2   6.266 -14.492  -3.800
   12    H    ASP   3           H        ASP   3   6.607 -14.412   0.316
   13    HA   ASP   3           HA       ASP   3   3.733 -13.969   0.006
   14   1HB   ASP   3          2HB       ASP   3   4.730 -15.774   1.458
   15   2HB   ASP   3          1HB       ASP   3   5.292 -14.508   2.550
   16    H    HIS   4           H        HIS   4   3.002 -11.892  -0.019
   17    HA   HIS   4           HA       HIS   4   4.316  -9.926   1.810
   18   1HB   HIS   4          2HB       HIS   4   2.770  -8.387   0.189
   19   2HB   HIS   4          1HB       HIS   4   4.445  -8.791  -0.172
   20    HD1  HIS   4           HD1      HIS   4   0.919  -9.592  -1.163
   21    HD2  HIS   4           HD2      HIS   4   4.782 -10.732  -2.234
   22    HE1  HIS   4           HE1      HIS   4   0.706 -10.896  -3.325
   23    HA   PRO   5           HA       PRO   5   0.620  -9.336   4.176
   24   1HB   PRO   5          2HB       PRO   5   0.250  -6.654   4.194
   25   2HB   PRO   5          1HB       PRO   5   1.529  -7.453   5.113
   26   1HG   PRO   5          2HG       PRO   5   1.681  -6.080   2.450
   27   2HG   PRO   5          1HG       PRO   5   2.783  -5.956   3.826
   28   1HD   PRO   5          1HD       PRO   5   3.359  -7.511   1.709
   29   2HD   PRO   5          2HD       PRO   5   3.813  -7.984   3.347
   30    H    GLN   6           H        GLN   6   0.731  -7.975   0.967
   31    HA   GLN   6           HA       GLN   6  -2.002  -7.179   0.717
   32   1HB   GLN   6          2HB       GLN   6   0.221  -7.861  -1.150
   33   2HB   GLN   6          1HB       GLN   6  -1.417  -7.893  -1.806
   34   1HG   GLN   6          2HG       GLN   6  -1.789  -5.610  -1.286
   35   2HG   GLN   6          1HG       GLN   6  -0.417  -5.553  -0.180
   36   1HE2  GLN   6          1HE2      GLN   6   1.690  -6.547  -1.608
   37   2HE2  GLN   6          2HE2      GLN   6   1.943  -5.668  -3.037
   38    H    ASP   7           H        ASP   7  -0.355 -10.266   0.126
   39    HA   ASP   7           HA       ASP   7  -2.526 -11.703  -0.972
   40   1HB   ASP   7          2HB       ASP   7  -0.269 -12.621   0.825
   41   2HB   ASP   7          1HB       ASP   7  -1.395 -13.728   0.041
   42    H    LYS   8           H        LYS   8  -1.599 -11.304   2.440
   43    HA   LYS   8           HA       LYS   8  -3.552 -12.861   3.676
   44   1HB   LYS   8          2HB       LYS   8  -2.156 -10.326   4.414
   45   2HB   LYS   8          1HB       LYS   8  -3.534 -10.821   5.396
   46   1HG   LYS   8          2HG       LYS   8  -2.318 -13.177   5.316
   47   2HG   LYS   8          1HG       LYS   8  -0.895 -12.182   5.007
   48   1HD   LYS   8          2HD       LYS   8  -1.536 -10.810   7.039
   49   2HD   LYS   8          1HD       LYS   8  -2.761 -12.029   7.389
   50   1HE   LYS   8          2HE       LYS   8  -0.454 -12.286   8.536
   51   2HE   LYS   8          1HE       LYS   8  -1.143 -13.713   7.762
   52   1HZ   LYS   8          3HZ       LYS   8   0.556 -11.939   6.165
   53   2HZ   LYS   8          2HZ       LYS   8   1.303 -12.975   7.286
   54   3HZ   LYS   8          1HZ       LYS   8   0.334 -13.617   6.047
   55    H    ALA   9           H        ALA   9  -3.896  -9.666   2.225
   56    HA   ALA   9           HA       ALA   9  -6.515  -9.070   3.159
   57   1HB   ALA   9          2HB       ALA   9  -5.385  -8.362   0.437
   58   2HB   ALA   9          1HB       ALA   9  -6.652  -7.505   1.314
   59   3HB   ALA   9          3HB       ALA   9  -4.994  -7.484   1.916
   60    H    GLU  10           H        GLU  10  -5.435 -10.785   0.242
   61    HA   GLU  10           HA       GLU  10  -8.090 -11.360  -0.713
   62   1HB   GLU  10          2HB       GLU  10  -5.599 -13.010  -1.215
   63   2HB   GLU  10          1HB       GLU  10  -7.027 -12.885  -2.244
   64   1HG   GLU  10          2HG       GLU  10  -6.543 -10.479  -2.599
   65   2HG   GLU  10          1HG       GLU  10  -5.097 -10.633  -1.601
   66    H    ARG  11           H        ARG  11  -5.796 -13.122   1.324
   67    HA   ARG  11           HA       ARG  11  -7.377 -15.505   1.604
   68   1HB   ARG  11          2HB       ARG  11  -5.302 -14.282   3.443
   69   2HB   ARG  11          1HB       ARG  11  -5.959 -15.905   3.616
   70   1HG   ARG  11          2HG       ARG  11  -5.223 -16.176   1.109
   71   2HG   ARG  11          1HG       ARG  11  -4.177 -14.801   1.459
   72   1HD   ARG  11          2HD       ARG  11  -3.506 -16.210   3.572
   73   2HD   ARG  11          1HD       ARG  11  -4.130 -17.566   2.631
   74    HE   ARG  11           HE       ARG  11  -1.779 -15.905   1.911
   75   1HH1  ARG  11          1HH1      ARG  11  -2.037 -18.984   2.315
   76   2HH1  ARG  11          2HH1      ARG  11  -1.877 -19.511   0.673
   77   1HH2  ARG  11          1HH2      ARG  11  -2.405 -16.361  -0.672
   78   2HH2  ARG  11          2HH2      ARG  11  -2.087 -18.028  -1.017
   79    H    GLU  12           H        GLU  12  -7.158 -12.522   3.483
   80    HA   GLU  12           HA       GLU  12  -8.936 -13.323   5.586
   81   1HB   GLU  12          2HB       GLU  12  -7.801 -10.763   4.591
   82   2HB   GLU  12          1HB       GLU  12  -9.288 -10.642   5.530
   83   1HG   GLU  12          2HG       GLU  12  -8.084 -12.253   7.194
   84   2HG   GLU  12          1HG       GLU  12  -6.612 -11.740   6.368
   85    H    ARG  13           H        ARG  13  -9.479 -11.679   2.489
   86    HA   ARG  13           HA       ARG  13 -12.293 -11.252   2.892
   87   1HB   ARG  13          2HB       ARG  13 -10.730 -11.550   0.311
   88   2HB   ARG  13          1HB       ARG  13 -12.366 -10.904   0.444
   89   1HG   ARG  13          2HG       ARG  13 -11.624  -9.008   1.675
   90   2HG   ARG  13          1HG       ARG  13 -10.048  -9.729   1.989
   91   1HD   ARG  13          2HD       ARG  13  -9.686  -8.145   0.239
   92   2HD   ARG  13          1HD       ARG  13  -9.707  -9.722  -0.551
   93    HE   ARG  13           HE       ARG  13 -12.285  -8.287  -0.457
   94   1HH1  ARG  13          1HH1      ARG  13  -9.335  -8.150  -2.106
   95   2HH1  ARG  13          2HH1      ARG  13 -10.028  -8.265  -3.689
   96   1HH2  ARG  13          1HH2      ARG  13 -13.238  -8.876  -2.529
   97   2HH2  ARG  13          2HH2      ARG  13 -12.238  -8.677  -3.929
   98    H    ILE  14           H        ILE  14 -10.422 -13.871   1.413
   99    HA   ILE  14           HA       ILE  14 -12.740 -15.379   0.569
  100    HB   ILE  14           HB       ILE  14  -9.934 -16.369   1.159
  101   1HG1  ILE  14          2HG1      ILE  14 -11.010 -15.681  -1.563
  102   2HG1  ILE  14          1HG1      ILE  14 -10.318 -14.421  -0.546
  103   1HG2  ILE  14          1HG2      ILE  14 -12.369 -17.526  -0.151
  104   2HG2  ILE  14          3HG2      ILE  14 -10.781 -17.971  -0.776
  105   3HG2  ILE  14          2HG2      ILE  14 -11.191 -18.307   0.905
  106   1HD1  ILE  14          2HD1      ILE  14  -8.628 -16.780  -0.547
  107   2HD1  ILE  14          1HD1      ILE  14  -8.911 -16.214  -2.193
  108   3HD1  ILE  14          3HD1      ILE  14  -8.221 -15.123  -0.992
  109    H    PHE  15           H        PHE  15 -10.589 -15.528   3.412
  110    HA   PHE  15           HA       PHE  15 -11.957 -17.742   4.637
  111   1HB   PHE  15          2HB       PHE  15  -9.679 -17.039   5.316
  112   2HB   PHE  15          1HB       PHE  15 -10.340 -15.535   5.960
  113    HD1  PHE  15           HD1      PHE  15 -11.800 -15.561   7.961
  114    HD2  PHE  15           HD2      PHE  15 -10.039 -19.165   6.426
  115    HE1  PHE  15           HE1      PHE  15 -12.363 -16.737  10.073
  116    HE2  PHE  15           HE2      PHE  15 -10.601 -20.341   8.535
  117    HZ   PHE  15           HZ       PHE  15 -11.767 -19.130  10.359
  118    H    LYS  16           H        LYS  16 -12.394 -14.238   4.756
  119    HA   LYS  16           HA       LYS  16 -14.323 -14.225   6.885
  120   1HB   LYS  16          2HB       LYS  16 -13.611 -12.329   4.661
  121   2HB   LYS  16          1HB       LYS  16 -15.054 -12.034   5.631
  122   1HG   LYS  16          2HG       LYS  16 -13.659 -12.155   7.690
  123   2HG   LYS  16          1HG       LYS  16 -12.227 -12.359   6.682
  124   1HD   LYS  16          2HD       LYS  16 -12.828 -10.175   5.551
  125   2HD   LYS  16          1HD       LYS  16 -14.076  -9.960   6.780
  126   1HE   LYS  16          2HE       LYS  16 -11.813 -10.615   8.259
  127   2HE   LYS  16          1HE       LYS  16 -11.183  -9.575   6.982
  128   1HZ   LYS  16          3HZ       LYS  16 -13.650  -8.633   8.113
  129   2HZ   LYS  16          2HZ       LYS  16 -12.389  -8.721   9.249
  130   3HZ   LYS  16          1HZ       LYS  16 -12.200  -7.800   7.834
  131    H    ARG  17           H        ARG  17 -14.528 -14.841   3.437
  132    HA   ARG  17           HA       ARG  17 -17.410 -14.666   3.263
  133   1HB   ARG  17          2HB       ARG  17 -15.285 -15.953   1.543
  134   2HB   ARG  17          1HB       ARG  17 -17.000 -16.104   1.165
  135   1HG   ARG  17          2HG       ARG  17 -17.050 -13.513   1.400
  136   2HG   ARG  17          1HG       ARG  17 -15.297 -13.618   1.230
  137   1HD   ARG  17          2HD       ARG  17 -15.652 -14.935  -0.884
  138   2HD   ARG  17          1HD       ARG  17 -17.380 -14.616  -0.736
  139    HE   ARG  17           HE       ARG  17 -16.893 -12.225  -1.066
  140   1HH1  ARG  17          1HH1      ARG  17 -15.536 -13.982  -3.278
  141   2HH1  ARG  17          2HH1      ARG  17 -14.049 -13.116  -3.463
  142   1HH2  ARG  17          1HH2      ARG  17 -14.440 -11.292  -0.541
  143   2HH2  ARG  17          2HH2      ARG  17 -13.428 -11.593  -1.914
  144    H    PHE  18           H        PHE  18 -15.108 -17.247   3.974
  145    HA   PHE  18           HA       PHE  18 -17.035 -19.386   3.935
  146   1HB   PHE  18          2HB       PHE  18 -14.292 -19.046   5.126
  147   2HB   PHE  18          1HB       PHE  18 -15.246 -20.489   5.470
  148    HD1  PHE  18           HD1      PHE  18 -16.266 -21.730   3.413
  149    HD2  PHE  18           HD2      PHE  18 -13.019 -18.929   3.162
  150    HE1  PHE  18           HE1      PHE  18 -15.614 -22.683   1.218
  151    HE2  PHE  18           HE2      PHE  18 -12.368 -19.882   0.967
  152    HZ   PHE  18           HZ       PHE  18 -13.665 -21.759  -0.006
  153    H    ASP  19           H        ASP  19 -15.640 -17.476   6.608
  154    HA   ASP  19           HA       ASP  19 -17.129 -18.687   8.698
  155   1HB   ASP  19          2HB       ASP  19 -15.213 -16.891   8.782
  156   2HB   ASP  19          1HB       ASP  19 -16.545 -15.733   8.723
  157    H    ALA  20           H        ALA  20 -19.322 -18.985   8.387
  158    HA   ALA  20           HA       ALA  20 -21.008 -17.148   6.983
  159   1HB   ALA  20          2HB       ALA  20 -21.299 -19.704   7.687
  160   2HB   ALA  20          1HB       ALA  20 -22.172 -18.974   9.034
  161   3HB   ALA  20          3HB       ALA  20 -22.692 -18.667   7.378
  162    H    ASN  21           H        ASN  21 -20.727 -17.763  10.530
  163    HA   ASN  21           HA       ASN  21 -22.427 -15.401  10.993
  164   1HB   ASN  21          2HB       ASN  21 -22.325 -15.996  13.350
  165   2HB   ASN  21          1HB       ASN  21 -22.690 -17.433  12.402
  166   1HD2  ASN  21          1HD2      ASN  21 -21.453 -17.328  15.066
  167   2HD2  ASN  21          2HD2      ASN  21 -19.935 -18.066  14.924
  168    H    GLY  22           H        GLY  22 -19.040 -16.280  11.160
  169   1HA   GLY  22          1HA       GLY  22 -18.410 -13.406  11.509
  170   2HA   GLY  22          2HA       GLY  22 -17.275 -14.648  10.985
  171    H    ASP  23           H        ASP  23 -17.894 -16.506  13.135
  172    HA   ASP  23           HA       ASP  23 -17.209 -14.997  15.585
  173   1HB   ASP  23          2HB       ASP  23 -17.440 -17.160  16.748
  174   2HB   ASP  23          1HB       ASP  23 -18.870 -16.801  15.785
  175    H    GLY  24           H        GLY  24 -15.497 -16.010  13.022
  176   1HA   GLY  24          1HA       GLY  24 -13.031 -16.234  14.645
  177   2HA   GLY  24          2HA       GLY  24 -13.097 -15.899  12.917
  178    H    LYS  25           H        LYS  25 -15.192 -18.442  13.632
  179    HA   LYS  25           HA       LYS  25 -13.104 -20.390  12.781
  180   1HB   LYS  25          2HB       LYS  25 -13.945 -22.046  14.315
  181   2HB   LYS  25          1HB       LYS  25 -13.671 -20.575  15.242
  182   1HG   LYS  25          2HG       LYS  25 -15.957 -20.117  15.433
  183   2HG   LYS  25          1HG       LYS  25 -16.375 -21.104  14.032
  184   1HD   LYS  25          2HD       LYS  25 -16.870 -22.763  15.477
  185   2HD   LYS  25          1HD       LYS  25 -15.139 -22.890  15.789
  186   1HE   LYS  25          2HE       LYS  25 -16.238 -22.597  17.918
  187   2HE   LYS  25          1HE       LYS  25 -15.409 -21.087  17.538
  188   1HZ   LYS  25          3HZ       LYS  25 -17.825 -20.755  16.379
  189   2HZ   LYS  25          2HZ       LYS  25 -18.224 -21.624  17.783
  190   3HZ   LYS  25          1HZ       LYS  25 -17.385 -20.151  17.901
  191    H    ILE  26           H        ILE  26 -13.768 -21.918  11.293
  192    HA   ILE  26           HA       ILE  26 -16.537 -21.560  10.215
  193    HB   ILE  26           HB       ILE  26 -14.220 -22.747   8.693
  194   1HG1  ILE  26          2HG1      ILE  26 -14.973 -19.824   8.983
  195   2HG1  ILE  26          1HG1      ILE  26 -13.442 -20.568   9.446
  196   1HG2  ILE  26          3HG2      ILE  26 -16.752 -21.289   7.876
  197   2HG2  ILE  26          2HG2      ILE  26 -15.549 -21.948   6.767
  198   3HG2  ILE  26          1HG2      ILE  26 -16.496 -23.032   7.788
  199   1HD1  ILE  26          1HD1      ILE  26 -14.049 -21.214   6.701
  200   2HD1  ILE  26          3HD1      ILE  26 -14.121 -19.467   6.930
  201   3HD1  ILE  26          2HD1      ILE  26 -12.654 -20.352   7.347
  202    H    SER  27           H        SER  27 -17.847 -23.333  10.165
  203    HA   SER  27           HA       SER  27 -16.683 -25.920  11.083
  204   1HB   SER  27          2HB       SER  27 -18.751 -26.427  12.040
  205   2HB   SER  27          1HB       SER  27 -18.697 -24.676  12.250
  206    HG   SER  27           HG       SER  27 -20.669 -25.537  11.306
  207    H    ALA  28           H        ALA  28 -17.752 -27.890  10.043
  208    HA   ALA  28           HA       ALA  28 -17.399 -27.916   7.267
  209   1HB   ALA  28          3HB       ALA  28 -19.452 -29.632   8.682
  210   2HB   ALA  28          1HB       ALA  28 -17.718 -29.925   8.819
  211   3HB   ALA  28          2HB       ALA  28 -18.512 -30.040   7.247
  212    H    ALA  29           H        ALA  29 -20.403 -27.384   9.093
  213    HA   ALA  29           HA       ALA  29 -22.139 -27.130   6.872
  214   1HB   ALA  29          2HB       ALA  29 -22.338 -26.808   9.650
  215   2HB   ALA  29          3HB       ALA  29 -23.656 -26.688   8.484
  216   3HB   ALA  29          1HB       ALA  29 -22.784 -25.238   8.982
  217    H    GLU  30           H        GLU  30 -20.043 -24.733   8.444
  218    HA   GLU  30           HA       GLU  30 -20.965 -22.563   6.753
  219   1HB   GLU  30          2HB       GLU  30 -18.492 -22.847   8.483
  220   2HB   GLU  30          1HB       GLU  30 -18.972 -21.356   7.674
  221   1HG   GLU  30          2HG       GLU  30 -21.141 -21.425   8.893
  222   2HG   GLU  30          1HG       GLU  30 -20.596 -22.871   9.742
  223    H    LEU  31           H        LEU  31 -17.904 -24.417   6.867
  224    HA   LEU  31           HA       LEU  31 -16.868 -23.319   4.439
  225   1HB   LEU  31          2HB       LEU  31 -15.388 -24.507   5.950
  226   2HB   LEU  31          1HB       LEU  31 -16.348 -25.980   5.802
  227    HG   LEU  31           HG       LEU  31 -15.767 -26.172   3.443
  228   1HD1  LEU  31          2HD1      LEU  31 -14.904 -23.388   3.885
  229   2HD1  LEU  31          1HD1      LEU  31 -13.783 -24.348   2.920
  230   3HD1  LEU  31          3HD1      LEU  31 -15.460 -24.171   2.407
  231   1HD2  LEU  31          3HD2      LEU  31 -13.559 -25.785   5.441
  232   2HD2  LEU  31          2HD2      LEU  31 -14.124 -27.272   4.680
  233   3HD2  LEU  31          1HD2      LEU  31 -13.148 -26.126   3.761
  234    H    GLY  32           H        GLY  32 -18.816 -26.211   5.100
  235   1HA   GLY  32          1HA       GLY  32 -20.061 -27.569   3.646
  236   2HA   GLY  32          2HA       GLY  32 -18.874 -27.174   2.405
  237    H    GLU  33           H        GLU  33 -21.073 -25.046   4.225
  238    HA   GLU  33           HA       GLU  33 -23.003 -24.659   2.201
  239   1HB   GLU  33          2HB       GLU  33 -22.113 -23.177   4.605
  240   2HB   GLU  33          1HB       GLU  33 -22.951 -22.212   3.389
  241   1HG   GLU  33          2HG       GLU  33 -24.730 -24.058   3.370
  242   2HG   GLU  33          1HG       GLU  33 -23.962 -24.667   4.836
  243    H    ALA  34           H        ALA  34 -19.961 -22.901   2.787
  244    HA   ALA  34           HA       ALA  34 -20.347 -21.146   0.507
  245   1HB   ALA  34          3HB       ALA  34 -18.822 -20.194   1.966
  246   2HB   ALA  34          2HB       ALA  34 -18.127 -21.751   2.416
  247   3HB   ALA  34          1HB       ALA  34 -17.698 -21.006   0.876
  248    H    LEU  35           H        LEU  35 -18.646 -24.180   1.118
  249    HA   LEU  35           HA       LEU  35 -17.316 -24.418  -1.378
  250   1HB   LEU  35          2HB       LEU  35 -18.122 -26.241   0.804
  251   2HB   LEU  35          1HB       LEU  35 -17.922 -27.012  -0.770
  252    HG   LEU  35           HG       LEU  35 -15.869 -25.234   0.584
  253   1HD1  LEU  35          3HD1      LEU  35 -16.042 -28.235   0.211
  254   2HD1  LEU  35          2HD1      LEU  35 -14.577 -27.393   0.713
  255   3HD1  LEU  35          1HD1      LEU  35 -16.011 -27.357   1.738
  256   1HD2  LEU  35          2HD2      LEU  35 -16.186 -26.308  -2.135
  257   2HD2  LEU  35          1HD2      LEU  35 -15.151 -25.002  -1.557
  258   3HD2  LEU  35          3HD2      LEU  35 -14.623 -26.679  -1.408
  259    H    LYS  36           H        LYS  36 -20.664 -25.084  -0.451
  260    HA   LYS  36           HA       LYS  36 -21.585 -26.649  -2.539
  261   1HB   LYS  36          2HB       LYS  36 -22.735 -24.802  -0.689
  262   2HB   LYS  36          1HB       LYS  36 -23.426 -24.475  -2.278
  263   1HG   LYS  36          2HG       LYS  36 -24.126 -26.769  -2.525
  264   2HG   LYS  36          1HG       LYS  36 -23.236 -27.251  -1.080
  265   1HD   LYS  36          2HD       LYS  36 -25.009 -25.085  -0.417
  266   2HD   LYS  36          1HD       LYS  36 -25.924 -26.349  -1.238
  267   1HE   LYS  36          2HE       LYS  36 -24.075 -27.550   0.620
  268   2HE   LYS  36          1HE       LYS  36 -25.044 -26.335   1.455
  269   1HZ   LYS  36          3HZ       LYS  36 -26.803 -27.662  -0.178
  270   2HZ   LYS  36          2HZ       LYS  36 -25.817 -28.888   0.464
  271   3HZ   LYS  36          1HZ       LYS  36 -26.657 -27.837   1.502
  272    H    THR  37           H        THR  37 -20.393 -23.373  -2.717
  273    HA   THR  37           HA       THR  37 -21.509 -22.476  -5.132
  274    HB   THR  37           HB       THR  37 -19.900 -21.237  -3.577
  275    HG1  THR  37           HG1      THR  37 -19.957 -19.941  -5.204
  276   1HG2  THR  37          1HG2      THR  37 -18.216 -23.308  -4.098
  277   2HG2  THR  37          3HG2      THR  37 -17.640 -22.122  -5.270
  278   3HG2  THR  37          2HG2      THR  37 -17.673 -21.720  -3.553
  279    H    LEU  38           H        LEU  38 -19.179 -24.997  -4.561
  280    HA   LEU  38           HA       LEU  38 -17.963 -25.165  -7.121
  281   1HB   LEU  38          2HB       LEU  38 -18.675 -27.326  -5.119
  282   2HB   LEU  38          1HB       LEU  38 -17.713 -27.625  -6.565
  283    HG   LEU  38           HG       LEU  38 -17.040 -25.784  -4.256
  284   1HD1  LEU  38          2HD1      LEU  38 -16.528 -28.477  -4.676
  285   2HD1  LEU  38          1HD1      LEU  38 -15.054 -27.698  -5.251
  286   3HD1  LEU  38          3HD1      LEU  38 -15.614 -27.418  -3.602
  287   1HD2  LEU  38          3HD2      LEU  38 -16.052 -25.881  -7.073
  288   2HD2  LEU  38          2HD2      LEU  38 -16.198 -24.504  -5.982
  289   3HD2  LEU  38          1HD2      LEU  38 -14.859 -25.636  -5.798
  290    H    GLY  39           H        GLY  39 -21.078 -26.331  -5.946
  291   1HA   GLY  39          1HA       GLY  39 -22.136 -26.431  -8.645
  292   2HA   GLY  39          2HA       GLY  39 -22.993 -26.919  -7.184
  293    H    SER  40           H        SER  40 -20.135 -28.529  -7.026
  294    HA   SER  40           HA       SER  40 -21.385 -31.022  -7.962
  295   1HB   SER  40          2HB       SER  40 -19.341 -29.584  -9.501
  296   2HB   SER  40          1HB       SER  40 -18.906 -31.258  -9.156
  297    HG   SER  40           HG       SER  40 -21.496 -30.657 -10.034
  298    H    ILE  41           H        ILE  41 -20.824 -30.475  -5.369
  299    HA   ILE  41           HA       ILE  41 -18.466 -32.222  -4.861
  300    HB   ILE  41           HB       ILE  41 -18.060 -29.665  -4.500
  301   1HG1  ILE  41          2HG1      ILE  41 -17.502 -31.440  -2.122
  302   2HG1  ILE  41          1HG1      ILE  41 -16.694 -31.685  -3.670
  303   1HG2  ILE  41          3HG2      ILE  41 -20.331 -29.806  -3.022
  304   2HG2  ILE  41          2HG2      ILE  41 -19.128 -30.082  -1.761
  305   3HG2  ILE  41          1HG2      ILE  41 -19.066 -28.610  -2.733
  306   1HD1  ILE  41          2HD1      ILE  41 -16.707 -28.885  -2.752
  307   2HD1  ILE  41          1HD1      ILE  41 -15.811 -29.983  -1.699
  308   3HD1  ILE  41          3HD1      ILE  41 -15.382 -29.849  -3.405
  309    H    THR  42           H        THR  42 -18.533 -32.956  -2.464
  310    HA   THR  42           HA       THR  42 -21.378 -33.367  -1.634
  311    HB   THR  42           HB       THR  42 -21.114 -35.623  -1.578
  312    HG1  THR  42           HG1      THR  42 -19.159 -36.540  -0.696
  313   1HG2  THR  42          2HG2      THR  42 -20.031 -35.065  -3.758
  314   2HG2  THR  42          1HG2      THR  42 -18.467 -35.069  -2.942
  315   3HG2  THR  42          3HG2      THR  42 -19.408 -36.556  -3.049
  316    HA   PRO  43           HA       PRO  43 -20.163 -32.073   2.420
  317   1HB   PRO  43          2HB       PRO  43 -21.366 -33.865   4.050
  318   2HB   PRO  43          1HB       PRO  43 -22.261 -32.614   3.184
  319   1HG   PRO  43          2HG       PRO  43 -21.889 -35.506   2.488
  320   2HG   PRO  43          1HG       PRO  43 -23.359 -34.529   2.420
  321   1HD   PRO  43          1HD       PRO  43 -21.907 -35.069   0.210
  322   2HD   PRO  43          2HD       PRO  43 -22.761 -33.539   0.411
  323    H    ASP  44           H        ASP  44 -19.777 -35.513   1.705
  324    HA   ASP  44           HA       ASP  44 -17.987 -36.152   3.824
  325   1HB   ASP  44          2HB       ASP  44 -18.300 -37.320   1.047
  326   2HB   ASP  44          1HB       ASP  44 -17.251 -38.020   2.281
  327    H    GLU  45           H        GLU  45 -17.450 -34.531   0.739
  328    HA   GLU  45           HA       GLU  45 -14.538 -34.784   0.951
  329   1HB   GLU  45          2HB       GLU  45 -16.335 -33.147  -0.864
  330   2HB   GLU  45          1HB       GLU  45 -14.575 -33.161  -0.982
  331   1HG   GLU  45          2HG       GLU  45 -14.761 -35.712  -1.166
  332   2HG   GLU  45          1HG       GLU  45 -16.488 -35.463  -1.419
  333    H    VAL  46           H        VAL  46 -17.048 -32.413   1.635
  334    HA   VAL  46           HA       VAL  46 -15.261 -30.249   2.286
  335    HB   VAL  46           HB       VAL  46 -18.120 -30.831   3.098
  336   1HG1  VAL  46          3HG1      VAL  46 -16.773 -29.348   4.712
  337   2HG1  VAL  46          2HG1      VAL  46 -16.677 -28.188   3.387
  338   3HG1  VAL  46          1HG1      VAL  46 -18.247 -28.646   4.046
  339   1HG2  VAL  46          2HG2      VAL  46 -16.865 -29.829   0.733
  340   2HG2  VAL  46          1HG2      VAL  46 -18.589 -30.009   1.057
  341   3HG2  VAL  46          3HG2      VAL  46 -17.765 -28.508   1.476
  342    H    LYS  47           H        LYS  47 -16.695 -32.896   4.123
  343    HA   LYS  47           HA       LYS  47 -15.793 -31.974   6.707
  344   1HB   LYS  47          2HB       LYS  47 -16.645 -34.673   5.645
  345   2HB   LYS  47          1HB       LYS  47 -16.102 -34.457   7.308
  346   1HG   LYS  47          2HG       LYS  47 -17.838 -32.658   7.570
  347   2HG   LYS  47          1HG       LYS  47 -18.439 -33.069   5.964
  348   1HD   LYS  47          2HD       LYS  47 -18.739 -35.442   6.778
  349   2HD   LYS  47          1HD       LYS  47 -18.348 -34.870   8.400
  350   1HE   LYS  47          2HE       LYS  47 -20.223 -33.098   7.945
  351   2HE   LYS  47          1HE       LYS  47 -20.743 -34.229   6.696
  352   1HZ   LYS  47          2HZ       LYS  47 -20.205 -35.144   9.450
  353   2HZ   LYS  47          1HZ       LYS  47 -21.713 -34.483   9.029
  354   3HZ   LYS  47          3HZ       LYS  47 -21.154 -35.882   8.249
  355    H    HIS  48           H        HIS  48 -14.429 -34.084   4.220
  356    HA   HIS  48           HA       HIS  48 -12.130 -34.909   5.729
  357   1HB   HIS  48          2HB       HIS  48 -12.812 -36.095   3.697
  358   2HB   HIS  48          1HB       HIS  48 -12.519 -34.648   2.732
  359    HD1  HIS  48           HD1      HIS  48 -10.479 -35.276   1.391
  360    HD2  HIS  48           HD2      HIS  48 -10.031 -36.164   5.438
  361    HE1  HIS  48           HE1      HIS  48  -8.075 -36.013   1.700
  362    H    MET  49           H        MET  49 -12.744 -32.156   3.554
  363    HA   MET  49           HA       MET  49 -10.086 -31.156   3.463
  364   1HB   MET  49          2HB       MET  49 -12.813 -29.959   3.140
  365   2HB   MET  49          1HB       MET  49 -11.430 -28.878   3.292
  366   1HG   MET  49          2HG       MET  49 -10.397 -30.562   1.490
  367   2HG   MET  49          1HG       MET  49 -12.103 -30.805   1.113
  368   1HE   MET  49          1HE       MET  49 -13.181 -29.761  -0.437
  369   2HE   MET  49          3HE       MET  49 -12.758 -28.288  -1.322
  370   3HE   MET  49          2HE       MET  49 -11.731 -29.715  -1.437
  371    H    MET  50           H        MET  50 -12.732 -30.539   5.745
  372    HA   MET  50           HA       MET  50 -11.327 -28.668   7.380
  373   1HB   MET  50          2HB       MET  50 -13.702 -30.448   7.728
  374   2HB   MET  50          1HB       MET  50 -12.980 -29.738   9.172
  375   1HG   MET  50          2HG       MET  50 -13.080 -27.496   7.930
  376   2HG   MET  50          1HG       MET  50 -14.131 -28.308   6.770
  377   1HE   MET  50          3HE       MET  50 -13.349 -26.978   9.977
  378   2HE   MET  50          2HE       MET  50 -14.854 -26.736  10.861
  379   3HE   MET  50          1HE       MET  50 -14.008 -28.277  10.981
  380    H    ALA  51           H        ALA  51 -11.725 -32.192   7.681
  381    HA   ALA  51           HA       ALA  51 -10.171 -32.536  10.029
  382   1HB   ALA  51          1HB       ALA  51 -10.842 -34.651   9.639
  383   2HB   ALA  51          2HB       ALA  51  -9.667 -34.754   8.328
  384   3HB   ALA  51          3HB       ALA  51 -11.316 -34.222   7.996
  385    H    GLU  52           H        GLU  52  -9.248 -31.713   6.813
  386    HA   GLU  52           HA       GLU  52  -6.405 -32.418   7.327
  387   1HB   GLU  52          2HB       GLU  52  -7.965 -31.607   4.882
  388   2HB   GLU  52          1HB       GLU  52  -6.207 -31.477   4.901
  389   1HG   GLU  52          2HG       GLU  52  -6.244 -33.928   5.748
  390   2HG   GLU  52          1HG       GLU  52  -7.913 -33.949   5.178
  391    H    ILE  53           H        ILE  53  -8.530 -29.656   6.791
  392    HA   ILE  53           HA       ILE  53  -6.340 -27.721   6.909
  393    HB   ILE  53           HB       ILE  53  -9.344 -27.360   7.056
  394   1HG1  ILE  53          2HG1      ILE  53  -7.415 -26.984   4.752
  395   2HG1  ILE  53          1HG1      ILE  53  -8.479 -28.374   4.947
  396   1HG2  ILE  53          2HG2      ILE  53  -7.749 -25.541   7.996
  397   2HG2  ILE  53          1HG2      ILE  53  -7.313 -25.266   6.309
  398   3HG2  ILE  53          3HG2      ILE  53  -8.983 -25.047   6.836
  399   1HD1  ILE  53          2HD1      ILE  53  -9.391 -25.489   4.734
  400   2HD1  ILE  53          1HD1      ILE  53  -9.473 -26.681   3.438
  401   3HD1  ILE  53          3HD1      ILE  53 -10.442 -26.897   4.895
  402    H    ASP  54           H        ASP  54  -8.699 -29.108   9.112
  403    HA   ASP  54           HA       ASP  54  -8.442 -27.265  11.262
  404   1HB   ASP  54          2HB       ASP  54 -10.056 -29.310  10.841
  405   2HB   ASP  54          1HB       ASP  54  -8.816 -30.209  11.706
  406    H    THR  55           H        THR  55  -6.338 -26.719  11.811
  407    HA   THR  55           HA       THR  55  -4.150 -28.576  11.859
  408    HB   THR  55           HB       THR  55  -2.982 -26.755  13.132
  409    HG1  THR  55           HG1      THR  55  -4.127 -25.230  13.997
  410   1HG2  THR  55          2HG2      THR  55  -4.536 -26.093  10.626
  411   2HG2  THR  55          1HG2      THR  55  -3.298 -25.023  11.287
  412   3HG2  THR  55          3HG2      THR  55  -2.866 -26.646  10.749
  413    H    ASP  56           H        ASP  56  -6.191 -27.251  14.462
  414    HA   ASP  56           HA       ASP  56  -4.845 -29.012  16.413
  415   1HB   ASP  56          2HB       ASP  56  -6.010 -27.826  18.092
  416   2HB   ASP  56          1HB       ASP  56  -5.657 -26.601  16.875
  417    H    GLY  57           H        GLY  57  -8.043 -28.640  14.937
  418   1HA   GLY  57          1HA       GLY  57  -8.580 -31.481  15.663
  419   2HA   GLY  57          2HA       GLY  57  -9.333 -30.632  14.317
  420    H    ASP  58           H        ASP  58  -9.862 -28.205  15.987
  421    HA   ASP  58           HA       ASP  58 -11.635 -29.155  18.123
  422   1HB   ASP  58          2HB       ASP  58 -12.104 -26.834  18.549
  423   2HB   ASP  58          1HB       ASP  58 -10.380 -26.953  18.215
  424    H    GLY  59           H        GLY  59 -11.877 -29.065  14.813
  425   1HA   GLY  59          1HA       GLY  59 -14.842 -29.129  14.991
  426   2HA   GLY  59          2HA       GLY  59 -13.882 -29.817  13.683
  427    H    PHE  60           H        PHE  60 -12.540 -26.863  14.357
  428    HA   PHE  60           HA       PHE  60 -14.091 -25.623  12.137
  429   1HB   PHE  60          2HB       PHE  60 -13.259 -24.106  14.615
  430   2HB   PHE  60          1HB       PHE  60 -14.237 -23.514  13.273
  431    HD1  PHE  60           HD1      PHE  60 -16.516 -24.480  12.869
  432    HD2  PHE  60           HD2      PHE  60 -14.229 -25.365  16.392
  433    HE1  PHE  60           HE1      PHE  60 -18.570 -25.273  14.003
  434    HE2  PHE  60           HE2      PHE  60 -16.283 -26.150  17.530
  435    HZ   PHE  60           HZ       PHE  60 -18.457 -26.110  16.336
  436    H    ILE  61           H        ILE  61 -12.971 -23.959  10.983
  437    HA   ILE  61           HA       ILE  61 -10.013 -24.131  11.238
  438    HB   ILE  61           HB       ILE  61 -11.609 -23.231   8.830
  439   1HG1  ILE  61          2HG1      ILE  61 -12.218 -25.551   9.349
  440   2HG1  ILE  61          1HG1      ILE  61 -11.186 -25.504   7.920
  441   1HG2  ILE  61          1HG2      ILE  61  -9.132 -22.631   9.145
  442   2HG2  ILE  61          3HG2      ILE  61  -8.804 -24.354   8.968
  443   3HG2  ILE  61          2HG2      ILE  61  -9.553 -23.459   7.646
  444   1HD1  ILE  61          1HD1      ILE  61  -9.216 -25.969   9.410
  445   2HD1  ILE  61          3HD1      ILE  61 -10.340 -26.179  10.753
  446   3HD1  ILE  61          2HD1      ILE  61 -10.396 -27.282   9.375
  447    H    SER  62           H        SER  62  -8.991 -22.228  11.800
  448    HA   SER  62           HA       SER  62 -10.661 -19.783  11.976
  449   1HB   SER  62          2HB       SER  62  -8.237 -19.131  13.093
  450   2HB   SER  62          1HB       SER  62  -9.612 -19.767  13.997
  451    HG   SER  62           HG       SER  62  -7.232 -20.947  13.355
  452    H    PHE  63           H        PHE  63  -9.439 -17.707  11.385
  453    HA   PHE  63           HA       PHE  63  -8.704 -17.753   8.660
  454   1HB   PHE  63          2HB       PHE  63  -9.336 -15.675   9.842
  455   2HB   PHE  63          1HB       PHE  63  -7.837 -15.751  10.770
  456    HD1  PHE  63           HD1      PHE  63  -8.708 -16.301   7.170
  457    HD2  PHE  63           HD2      PHE  63  -6.285 -14.183  10.008
  458    HE1  PHE  63           HE1      PHE  63  -7.509 -15.188   5.310
  459    HE2  PHE  63           HE2      PHE  63  -5.078 -13.073   8.149
  460    HZ   PHE  63           HZ       PHE  63  -5.697 -13.572   5.797
  461    H    GLN  64           H        GLN  64  -6.680 -17.833  11.568
  462    HA   GLN  64           HA       GLN  64  -4.155 -17.809  10.259
  463   1HB   GLN  64          2HB       GLN  64  -4.580 -17.531  12.732
  464   2HB   GLN  64          1HB       GLN  64  -4.864 -19.269  12.819
  465   1HG   GLN  64          2HG       GLN  64  -2.557 -18.912  13.404
  466   2HG   GLN  64          1HG       GLN  64  -2.570 -19.587  11.775
  467   1HE2  GLN  64          1HE2      GLN  64  -1.143 -18.496  10.427
  468   2HE2  GLN  64          2HE2      GLN  64  -0.790 -16.838  10.509
  469    H    GLU  65           H        GLU  65  -6.227 -20.542  11.285
  470    HA   GLU  65           HA       GLU  65  -4.507 -22.616  10.359
  471   1HB   GLU  65          2HB       GLU  65  -7.483 -22.434  10.801
  472   2HB   GLU  65          1HB       GLU  65  -6.740 -23.903  10.187
  473   1HG   GLU  65          2HG       GLU  65  -5.257 -23.980  12.166
  474   2HG   GLU  65          1HG       GLU  65  -6.024 -22.519  12.788
  475    H    PHE  66           H        PHE  66  -7.236 -20.965   8.771
  476    HA   PHE  66           HA       PHE  66  -7.075 -22.384   6.303
  477   1HB   PHE  66          2HB       PHE  66  -8.987 -20.929   6.961
  478   2HB   PHE  66          1HB       PHE  66  -7.954 -19.515   6.746
  479    HD1  PHE  66           HD1      PHE  66  -7.191 -18.832   4.512
  480    HD2  PHE  66           HD2      PHE  66  -9.774 -22.224   5.054
  481    HE1  PHE  66           HE1      PHE  66  -7.697 -18.839   2.084
  482    HE2  PHE  66           HE2      PHE  66 -10.279 -22.227   2.626
  483    HZ   PHE  66           HZ       PHE  66  -9.240 -20.535   1.141
  484    H    THR  67           H        THR  67  -5.391 -19.513   7.485
  485    HA   THR  67           HA       THR  67  -4.143 -18.814   4.998
  486    HB   THR  67           HB       THR  67  -3.327 -18.312   7.875
  487    HG1  THR  67           HG1      THR  67  -4.853 -16.907   7.621
  488   1HG2  THR  67          1HG2      THR  67  -2.187 -17.148   5.318
  489   2HG2  THR  67          3HG2      THR  67  -1.768 -16.639   6.954
  490   3HG2  THR  67          2HG2      THR  67  -1.351 -18.261   6.401
  491    H    ASP  68           H        ASP  68  -3.011 -20.778   7.762
  492    HA   ASP  68           HA       ASP  68  -0.467 -21.435   6.658
  493   1HB   ASP  68          2HB       ASP  68  -2.242 -22.989   8.562
  494   2HB   ASP  68          1HB       ASP  68  -0.565 -23.406   8.209
  495    H    PHE  69           H        PHE  69  -3.645 -22.969   6.294
  496    HA   PHE  69           HA       PHE  69  -2.585 -25.153   4.684
  497   1HB   PHE  69          2HB       PHE  69  -4.544 -25.894   5.613
  498   2HB   PHE  69          1HB       PHE  69  -5.232 -24.274   5.698
  499    HD1  PHE  69           HD1      PHE  69  -6.080 -23.198   3.576
  500    HD2  PHE  69           HD2      PHE  69  -5.098 -27.366   3.834
  501    HE1  PHE  69           HE1      PHE  69  -7.409 -23.637   1.525
  502    HE2  PHE  69           HE2      PHE  69  -6.421 -27.809   1.786
  503    HZ   PHE  69           HZ       PHE  69  -7.580 -25.945   0.629
  504    H    GLY  70           H        GLY  70  -4.175 -22.048   4.074
  505   1HA   GLY  70          1HA       GLY  70  -4.350 -20.801   2.091
  506   2HA   GLY  70          2HA       GLY  70  -4.525 -22.348   1.260
  507    H    ARG  71           H        ARG  71  -1.731 -21.501   3.217
  508    HA   ARG  71           HA       ARG  71  -0.069 -20.619   1.017
  509   1HB   ARG  71          2HB       ARG  71   0.650 -21.685   3.765
  510   2HB   ARG  71          1HB       ARG  71   1.795 -20.944   2.646
  511   1HG   ARG  71          2HG       ARG  71   0.699 -18.841   2.760
  512   2HG   ARG  71          1HG       ARG  71  -0.724 -19.533   3.525
  513   1HD   ARG  71          2HD       ARG  71   0.423 -18.524   5.321
  514   2HD   ARG  71          1HD       ARG  71   0.892 -20.222   5.433
  515    HE   ARG  71           HE       ARG  71   2.777 -18.910   3.772
  516   1HH1  ARG  71          1HH1      ARG  71   3.054 -20.509   6.460
  517   2HH1  ARG  71          2HH1      ARG  71   3.950 -19.354   7.388
  518   1HH2  ARG  71          1HH2      ARG  71   3.340 -16.729   5.207
  519   2HH2  ARG  71          2HH2      ARG  71   4.113 -17.214   6.679
  520    H    ALA  72           H        ALA  72  -0.729 -23.706   2.563
  521    HA   ALA  72           HA       ALA  72   1.351 -25.111   1.053
  522   1HB   ALA  72          3HB       ALA  72   0.538 -27.099   2.152
  523   2HB   ALA  72          2HB       ALA  72   0.542 -25.805   3.350
  524   3HB   ALA  72          1HB       ALA  72  -0.972 -26.301   2.593
  525    H    ASN  73           H        ASN  73  -1.655 -23.885   0.260
  526    HA   ASN  73           HA       ASN  73  -1.768 -25.581  -2.145
  527   1HB   ASN  73          2HB       ASN  73  -4.041 -25.339  -0.153
  528   2HB   ASN  73          1HB       ASN  73  -4.244 -25.948  -1.794
  529   1HD2  ASN  73          1HD2      ASN  73  -3.243 -26.788   1.415
  530   2HD2  ASN  73          2HD2      ASN  73  -2.709 -28.360   1.066
  531    H    ARG  74           H        ARG  74  -0.988 -22.948  -1.974
  532    HA   ARG  74           HA       ARG  74  -2.995 -20.974  -2.208
  533   1HB   ARG  74          2HB       ARG  74  -0.329 -21.176  -3.640
  534   2HB   ARG  74          1HB       ARG  74  -1.324 -19.721  -3.584
  535   1HG   ARG  74          2HG       ARG  74  -1.234 -19.919  -1.040
  536   2HG   ARG  74          1HG       ARG  74   0.018 -21.139  -1.273
  537   1HD   ARG  74          2HD       ARG  74   0.106 -18.264  -2.237
  538   2HD   ARG  74          1HD       ARG  74   1.070 -18.961  -0.935
  539    HE   ARG  74           HE       ARG  74   1.632 -20.535  -3.172
  540   1HH1  ARG  74          1HH1      ARG  74   1.162 -17.244  -3.459
  541   2HH1  ARG  74          2HH1      ARG  74   2.774 -16.870  -3.970
  542   1HH2  ARG  74          1HH2      ARG  74   3.998 -20.051  -3.331
  543   2HH2  ARG  74          2HH2      ARG  74   4.380 -18.460  -3.897
  544    H    GLY  75           H        GLY  75  -1.488 -22.970  -4.730
  545   1HA   GLY  75          1HA       GLY  75  -2.336 -23.675  -6.790
  546   2HA   GLY  75          2HA       GLY  75  -2.927 -22.021  -6.950
  547    H    LEU  76           H        LEU  76  -3.988 -23.989  -4.268
  548    HA   LEU  76           HA       LEU  76  -6.402 -24.936  -5.611
  549   1HB   LEU  76          2HB       LEU  76  -5.503 -24.933  -2.722
  550   2HB   LEU  76          1HB       LEU  76  -7.054 -25.589  -3.241
  551    HG   LEU  76           HG       LEU  76  -5.729 -27.010  -4.905
  552   1HD1  LEU  76          3HD1      LEU  76  -3.560 -25.601  -3.473
  553   2HD1  LEU  76          2HD1      LEU  76  -3.324 -27.336  -3.665
  554   3HD1  LEU  76          1HD1      LEU  76  -3.566 -26.319  -5.083
  555   1HD2  LEU  76          1HD2      LEU  76  -5.902 -27.291  -1.961
  556   2HD2  LEU  76          3HD2      LEU  76  -6.462 -28.380  -3.231
  557   3HD2  LEU  76          2HD2      LEU  76  -4.762 -28.376  -2.758
  558    H    LEU  77           H        LEU  77  -5.630 -22.440  -3.206
  559    HA   LEU  77           HA       LEU  77  -8.282 -21.495  -2.813
  560   1HB   LEU  77          2HB       LEU  77  -5.620 -20.061  -2.652
  561   2HB   LEU  77          1HB       LEU  77  -7.146 -19.336  -2.146
  562    HG   LEU  77           HG       LEU  77  -5.800 -21.796  -1.002
  563   1HD1  LEU  77          1HD1      LEU  77  -6.336 -18.993  -0.119
  564   2HD1  LEU  77          3HD1      LEU  77  -6.420 -20.264   1.101
  565   3HD1  LEU  77          2HD1      LEU  77  -4.933 -20.017   0.187
  566   1HD2  LEU  77          2HD2      LEU  77  -8.619 -20.749  -0.654
  567   2HD2  LEU  77          1HD2      LEU  77  -8.120 -22.370  -1.139
  568   3HD2  LEU  77          3HD2      LEU  77  -7.853 -21.823   0.516
  569    H    LYS  78           H        LYS  78  -5.845 -20.641  -5.238
  570    HA   LYS  78           HA       LYS  78  -7.173 -18.451  -6.432
  571   1HB   LYS  78          2HB       LYS  78  -5.456 -20.610  -7.690
  572   2HB   LYS  78          1HB       LYS  78  -5.948 -19.132  -8.518
  573   1HG   LYS  78          2HG       LYS  78  -4.885 -17.813  -6.665
  574   2HG   LYS  78          1HG       LYS  78  -4.280 -19.327  -5.993
  575   1HD   LYS  78          2HD       LYS  78  -2.657 -18.056  -7.505
  576   2HD   LYS  78          1HD       LYS  78  -2.926 -19.749  -7.920
  577   1HE   LYS  78          2HE       LYS  78  -4.261 -19.218  -9.770
  578   2HE   LYS  78          1HE       LYS  78  -4.642 -17.609  -9.156
  579   1HZ   LYS  78          3HZ       LYS  78  -2.100 -17.262  -9.389
  580   2HZ   LYS  78          2HZ       LYS  78  -2.196 -18.562 -10.479
  581   3HZ   LYS  78          1HZ       LYS  78  -3.091 -17.145 -10.761
  582    H    ASP  79           H        ASP  79  -7.815 -21.883  -6.613
  583    HA   ASP  79           HA       ASP  79  -9.572 -21.707  -8.923
  584   1HB   ASP  79          2HB       ASP  79  -8.448 -23.818  -8.314
  585   2HB   ASP  79          1HB       ASP  79  -9.345 -23.855  -6.796
  586    H    VAL  80           H        VAL  80 -10.029 -21.731  -5.408
  587    HA   VAL  80           HA       VAL  80 -12.892 -21.837  -5.470
  588    HB   VAL  80           HB       VAL  80 -11.125 -22.053  -3.488
  589   1HG1  VAL  80          3HG1      VAL  80 -10.603 -19.538  -3.760
  590   2HG1  VAL  80          2HG1      VAL  80 -12.160 -19.269  -2.979
  591   3HG1  VAL  80          1HG1      VAL  80 -10.885 -20.139  -2.127
  592   1HG2  VAL  80          1HG2      VAL  80 -13.976 -21.075  -3.399
  593   2HG2  VAL  80          3HG2      VAL  80 -13.367 -22.707  -3.121
  594   3HG2  VAL  80          2HG2      VAL  80 -13.091 -21.447  -1.918
  595    H    ALA  81           H        ALA  81 -10.587 -19.173  -5.587
  596    HA   ALA  81           HA       ALA  81 -12.598 -17.091  -5.427
  597   1HB   ALA  81          3HB       ALA  81  -9.950 -17.045  -5.087
  598   2HB   ALA  81          2HB       ALA  81  -9.987 -16.607  -6.795
  599   3HB   ALA  81          1HB       ALA  81 -10.834 -15.611  -5.610
  600    H    LYS  82           H        LYS  82 -11.938 -19.327  -7.818
  601    HA   LYS  82           HA       LYS  82 -12.224 -17.623 -10.152
  602   1HB   LYS  82          2HB       LYS  82 -12.430 -20.602  -9.701
  603   2HB   LYS  82          1HB       LYS  82 -12.749 -19.876 -11.274
  604   1HG   LYS  82          2HG       LYS  82 -10.441 -18.684 -10.884
  605   2HG   LYS  82          1HG       LYS  82 -10.173 -19.990  -9.730
  606   1HD   LYS  82          2HD       LYS  82 -10.900 -21.570 -11.643
  607   2HD   LYS  82          1HD       LYS  82 -10.646 -20.185 -12.705
  608   1HE   LYS  82          2HE       LYS  82  -8.422 -20.507 -10.865
  609   2HE   LYS  82          1HE       LYS  82  -8.688 -21.979 -11.799
  610   1HZ   LYS  82          3HZ       LYS  82  -8.548 -19.281 -13.018
  611   2HZ   LYS  82          2HZ       LYS  82  -7.201 -20.305 -12.865
  612   3HZ   LYS  82          1HZ       LYS  82  -8.527 -20.777 -13.815
  613    H    ILE  83           H        ILE  83 -14.411 -19.473  -8.095
  614    HA   ILE  83           HA       ILE  83 -16.726 -19.037  -9.806
  615    HB   ILE  83           HB       ILE  83 -16.477 -19.926  -6.920
  616   1HG1  ILE  83          2HG1      ILE  83 -16.981 -21.403  -9.518
  617   2HG1  ILE  83          1HG1      ILE  83 -15.543 -21.523  -8.504
  618   1HG2  ILE  83          1HG2      ILE  83 -18.839 -19.470  -8.718
  619   2HG2  ILE  83          3HG2      ILE  83 -18.895 -20.772  -7.530
  620   3HG2  ILE  83          2HG2      ILE  83 -18.659 -19.106  -7.002
  621   1HD1  ILE  83          2HD1      ILE  83 -18.212 -22.089  -7.266
  622   2HD1  ILE  83          1HD1      ILE  83 -17.491 -23.317  -8.307
  623   3HD1  ILE  83          3HD1      ILE  83 -16.630 -22.762  -6.871
  624    H    PHE  84           H        PHE  84 -15.257 -17.424  -7.050
  625    HA   PHE  84           HA       PHE  84 -17.501 -15.475  -6.974
  626   1HB   PHE  84          2HB       PHE  84 -15.103 -15.818  -5.146
  627   2HB   PHE  84          1HB       PHE  84 -16.404 -14.650  -4.909
  628    HD1  PHE  84           HD1      PHE  84 -16.009 -18.327  -5.614
  629    HD2  PHE  84           HD2      PHE  84 -18.121 -15.261  -3.468
  630    HE1  PHE  84           HE1      PHE  84 -17.358 -20.060  -4.467
  631    HE2  PHE  84           HE2      PHE  84 -19.473 -16.996  -2.322
  632    HZ   PHE  84           HZ       PHE  84 -19.091 -19.396  -2.821

  No H/Q in entry =         632
  Start of MODEL   15
    1    H1   ALA   1          1H        ALA   1  11.624 -14.302  -1.307
    2    H2   ALA   1          3H        ALA   1  12.267 -13.101  -0.295
    3    H3   ALA   1          2H        ALA   1  12.344 -14.732   0.172
    4    HA   ALA   1           HA       ALA   1   9.940 -14.834   0.343
    5   1HB   ALA   1          3HB       ALA   1  11.165 -12.493   1.837
    6   2HB   ALA   1          2HB       ALA   1   9.715 -13.376   2.315
    7   3HB   ALA   1          1HB       ALA   1  11.283 -14.185   2.321
    8    H    ASP   2           H        ASP   2   9.172 -14.087  -1.835
    9    HA   ASP   2           HA       ASP   2   8.697 -11.238  -2.233
   10   1HB   ASP   2          2HB       ASP   2   7.694 -13.709  -3.673
   11   2HB   ASP   2          1HB       ASP   2   7.297 -12.064  -4.172
   12    H    ASP   3           H        ASP   3   7.155 -13.698  -0.454
   13    HA   ASP   3           HA       ASP   3   4.420 -13.168  -0.682
   14   1HB   ASP   3          2HB       ASP   3   5.983 -13.668   1.870
   15   2HB   ASP   3          1HB       ASP   3   4.238 -13.845   1.693
   16    H    HIS   4           H        HIS   4   3.066 -11.521   0.004
   17    HA   HIS   4           HA       HIS   4   4.293  -9.297   1.567
   18   1HB   HIS   4          2HB       HIS   4   2.722  -7.835   0.014
   19   2HB   HIS   4          1HB       HIS   4   4.333  -8.291  -0.529
   20    HD1  HIS   4           HD1      HIS   4   3.862  -8.501  -3.018
   21    HD2  HIS   4           HD2      HIS   4   1.245 -10.763  -0.694
   22    HE1  HIS   4           HE1      HIS   4   2.549  -9.951  -4.626
   23    HA   PRO   5           HA       PRO   5   0.557  -9.235   3.950
   24   1HB   PRO   5          2HB       PRO   5  -0.061  -6.603   4.107
   25   2HB   PRO   5          1HB       PRO   5   1.279  -7.329   5.000
   26   1HG   PRO   5          2HG       PRO   5   1.324  -5.811   2.413
   27   2HG   PRO   5          1HG       PRO   5   2.396  -5.652   3.810
   28   1HD   PRO   5          1HD       PRO   5   3.147  -7.033   1.634
   29   2HD   PRO   5          2HD       PRO   5   3.611  -7.557   3.254
   30    H    GLN   6           H        GLN   6   0.573  -7.715   0.820
   31    HA   GLN   6           HA       GLN   6  -2.193  -7.111   0.536
   32   1HB   GLN   6          2HB       GLN   6   0.080  -7.680  -1.315
   33   2HB   GLN   6          1HB       GLN   6  -1.552  -7.762  -1.982
   34   1HG   GLN   6          2HG       GLN   6  -2.005  -5.502  -1.469
   35   2HG   GLN   6          1HG       GLN   6  -0.676  -5.408  -0.314
   36   1HE2  GLN   6          1HE2      GLN   6   1.556  -6.150  -1.576
   37   2HE2  GLN   6          2HE2      GLN   6   1.809  -5.306  -3.027
   38    H    ASP   7           H        ASP   7  -0.366 -10.095  -0.037
   39    HA   ASP   7           HA       ASP   7  -2.417 -11.657  -1.185
   40   1HB   ASP   7          2HB       ASP   7   0.020 -12.248   0.433
   41   2HB   ASP   7          1HB       ASP   7  -1.161 -13.543   0.233
   42    H    LYS   8           H        LYS   8  -1.538 -11.465   2.267
   43    HA   LYS   8           HA       LYS   8  -3.523 -13.038   3.386
   44   1HB   LYS   8          2HB       LYS   8  -2.199 -10.505   4.283
   45   2HB   LYS   8          1HB       LYS   8  -3.541 -11.142   5.232
   46   1HG   LYS   8          2HG       LYS   8  -2.272 -13.407   5.092
   47   2HG   LYS   8          1HG       LYS   8  -0.879 -12.426   4.637
   48   1HD   LYS   8          2HD       LYS   8  -1.309 -11.035   6.712
   49   2HD   LYS   8          1HD       LYS   8  -2.497 -12.247   7.191
   50   1HE   LYS   8          2HE       LYS   8  -0.303 -12.700   8.232
   51   2HE   LYS   8          1HE       LYS   8  -0.750 -13.990   7.117
   52   1HZ   LYS   8          3HZ       LYS   8   0.744 -11.776   5.977
   53   2HZ   LYS   8          2HZ       LYS   8   1.601 -12.763   7.061
   54   3HZ   LYS   8          1HZ       LYS   8   0.876 -13.442   5.683
   55    H    ALA   9           H        ALA   9  -3.865  -9.786   2.072
   56    HA   ALA   9           HA       ALA   9  -6.474  -9.205   3.013
   57   1HB   ALA   9          2HB       ALA   9  -4.678  -7.916   1.391
   58   2HB   ALA   9          3HB       ALA   9  -6.345  -7.394   1.631
   59   3HB   ALA   9          1HB       ALA   9  -5.924  -8.380   0.231
   60    H    GLU  10           H        GLU  10  -5.419 -10.912   0.086
   61    HA   GLU  10           HA       GLU  10  -8.086 -11.452  -0.864
   62   1HB   GLU  10          2HB       GLU  10  -5.602 -13.101  -1.399
   63   2HB   GLU  10          1HB       GLU  10  -7.043 -12.984  -2.409
   64   1HG   GLU  10          2HG       GLU  10  -6.570 -10.542  -2.707
   65   2HG   GLU  10          1HG       GLU  10  -5.067 -10.760  -1.810
   66    H    ARG  11           H        ARG  11  -5.781 -13.294   1.099
   67    HA   ARG  11           HA       ARG  11  -7.414 -15.639   1.376
   68   1HB   ARG  11          2HB       ARG  11  -5.187 -14.477   3.058
   69   2HB   ARG  11          1HB       ARG  11  -5.968 -16.006   3.449
   70   1HG   ARG  11          2HG       ARG  11  -5.413 -16.785   1.117
   71   2HG   ARG  11          1HG       ARG  11  -4.463 -15.320   0.908
   72   1HD   ARG  11          2HD       ARG  11  -4.004 -17.572   2.876
   73   2HD   ARG  11          1HD       ARG  11  -2.920 -17.011   1.603
   74    HE   ARG  11           HE       ARG  11  -3.616 -15.118   3.772
   75   1HH1  ARG  11          1HH1      ARG  11  -1.316 -16.087   1.537
   76   2HH1  ARG  11          2HH1      ARG  11   0.045 -15.892   2.589
   77   1HH2  ARG  11          1HH2      ARG  11  -1.874 -15.313   5.414
   78   2HH2  ARG  11          2HH2      ARG  11  -0.269 -15.453   4.779
   79    H    GLU  12           H        GLU  12  -7.123 -12.665   3.266
   80    HA   GLU  12           HA       GLU  12  -8.860 -13.471   5.401
   81   1HB   GLU  12          2HB       GLU  12  -7.980 -10.787   4.332
   82   2HB   GLU  12          1HB       GLU  12  -9.090 -10.929   5.692
   83   1HG   GLU  12          2HG       GLU  12  -7.366 -12.453   6.781
   84   2HG   GLU  12          1HG       GLU  12  -6.250 -11.953   5.512
   85    H    ARG  13           H        ARG  13  -9.417 -11.763   2.343
   86    HA   ARG  13           HA       ARG  13 -12.209 -11.262   2.809
   87   1HB   ARG  13          2HB       ARG  13 -10.491 -11.380   0.333
   88   2HB   ARG  13          1HB       ARG  13 -12.235 -11.143   0.218
   89   1HG   ARG  13          2HG       ARG  13 -12.155  -9.053   1.208
   90   2HG   ARG  13          1HG       ARG  13 -10.708  -9.434   2.141
   91   1HD   ARG  13          2HD       ARG  13  -9.523  -8.320   0.577
   92   2HD   ARG  13          1HD       ARG  13  -9.902  -9.635  -0.536
   93    HE   ARG  13           HE       ARG  13 -11.849  -7.402  -0.275
   94   1HH1  ARG  13          1HH1      ARG  13  -8.993  -8.154  -1.882
   95   2HH1  ARG  13          2HH1      ARG  13  -9.624  -7.917  -3.477
   96   1HH2  ARG  13          1HH2      ARG  13 -12.901  -7.537  -2.411
   97   2HH2  ARG  13          2HH2      ARG  13 -11.837  -7.567  -3.777
   98    H    ILE  14           H        ILE  14 -10.447 -13.912   1.249
   99    HA   ILE  14           HA       ILE  14 -12.827 -15.336   0.431
  100    HB   ILE  14           HB       ILE  14 -10.057 -16.449   0.964
  101   1HG1  ILE  14          2HG1      ILE  14 -11.078 -15.650  -1.744
  102   2HG1  ILE  14          1HG1      ILE  14 -10.394 -14.419  -0.684
  103   1HG2  ILE  14          3HG2      ILE  14 -12.543 -17.439  -0.387
  104   2HG2  ILE  14          2HG2      ILE  14 -10.975 -17.943  -1.019
  105   3HG2  ILE  14          1HG2      ILE  14 -11.414 -18.310   0.651
  106   1HD1  ILE  14          3HD1      ILE  14  -8.913 -16.997  -1.138
  107   2HD1  ILE  14          2HD1      ILE  14  -8.810 -15.702  -2.330
  108   3HD1  ILE  14          1HD1      ILE  14  -8.276 -15.421  -0.672
  109    H    PHE  15           H        PHE  15 -10.616 -15.610   3.216
  110    HA   PHE  15           HA       PHE  15 -12.009 -17.798   4.443
  111   1HB   PHE  15          2HB       PHE  15  -9.713 -17.138   5.096
  112   2HB   PHE  15          1HB       PHE  15 -10.342 -15.628   5.763
  113    HD1  PHE  15           HD1      PHE  15 -11.720 -15.633   7.802
  114    HD2  PHE  15           HD2      PHE  15 -10.147 -19.280   6.173
  115    HE1  PHE  15           HE1      PHE  15 -12.277 -16.817   9.912
  116    HE2  PHE  15           HE2      PHE  15 -10.699 -20.464   8.280
  117    HZ   PHE  15           HZ       PHE  15 -11.768 -19.236  10.150
  118    H    LYS  16           H        LYS  16 -12.402 -14.294   4.597
  119    HA   LYS  16           HA       LYS  16 -14.296 -14.274   6.759
  120   1HB   LYS  16          2HB       LYS  16 -13.583 -12.364   4.548
  121   2HB   LYS  16          1HB       LYS  16 -15.006 -12.055   5.544
  122   1HG   LYS  16          2HG       LYS  16 -13.582 -12.226   7.580
  123   2HG   LYS  16          1HG       LYS  16 -12.170 -12.443   6.546
  124   1HD   LYS  16          2HD       LYS  16 -12.726 -10.238   5.458
  125   2HD   LYS  16          1HD       LYS  16 -13.981 -10.016   6.676
  126   1HE   LYS  16          2HE       LYS  16 -11.727 -10.725   8.158
  127   2HE   LYS  16          1HE       LYS  16 -11.094  -9.653   6.909
  128   1HZ   LYS  16          1HZ       LYS  16 -13.480  -8.552   7.817
  129   2HZ   LYS  16          3HZ       LYS  16 -12.596  -8.993   9.195
  130   3HZ   LYS  16          2HZ       LYS  16 -11.907  -7.954   8.041
  131    H    ARG  17           H        ARG  17 -14.575 -14.855   3.306
  132    HA   ARG  17           HA       ARG  17 -17.459 -14.618   3.204
  133   1HB   ARG  17          2HB       ARG  17 -15.427 -15.956   1.404
  134   2HB   ARG  17          1HB       ARG  17 -17.157 -15.973   1.060
  135   1HG   ARG  17          2HG       ARG  17 -17.079 -13.426   1.302
  136   2HG   ARG  17          1HG       ARG  17 -15.323 -13.576   1.257
  137   1HD   ARG  17          2HD       ARG  17 -15.543 -14.806  -0.919
  138   2HD   ARG  17          1HD       ARG  17 -17.274 -14.469  -0.886
  139    HE   ARG  17           HE       ARG  17 -16.696 -12.048  -1.020
  140   1HH1  ARG  17          1HH1      ARG  17 -15.196 -14.176  -3.005
  141   2HH1  ARG  17          2HH1      ARG  17 -13.799 -13.211  -3.342
  142   1HH2  ARG  17          1HH2      ARG  17 -14.486 -10.878  -0.870
  143   2HH2  ARG  17          2HH2      ARG  17 -13.396 -11.344  -2.133
  144    H    PHE  18           H        PHE  18 -15.184 -17.233   3.851
  145    HA   PHE  18           HA       PHE  18 -17.123 -19.361   3.802
  146   1HB   PHE  18          2HB       PHE  18 -14.379 -19.039   4.998
  147   2HB   PHE  18          1HB       PHE  18 -15.340 -20.478   5.336
  148    HD1  PHE  18           HD1      PHE  18 -16.347 -21.725   3.284
  149    HD2  PHE  18           HD2      PHE  18 -13.117 -18.906   3.025
  150    HE1  PHE  18           HE1      PHE  18 -15.693 -22.677   1.089
  151    HE2  PHE  18           HE2      PHE  18 -12.463 -19.857   0.830
  152    HZ   PHE  18           HZ       PHE  18 -13.751 -21.743  -0.138
  153    H    ASP  19           H        ASP  19 -15.709 -17.485   6.487
  154    HA   ASP  19           HA       ASP  19 -17.188 -18.684   8.583
  155   1HB   ASP  19          2HB       ASP  19 -15.288 -16.861   8.629
  156   2HB   ASP  19          1HB       ASP  19 -16.638 -15.726   8.593
  157    H    ALA  20           H        ALA  20 -19.389 -19.002   8.271
  158    HA   ALA  20           HA       ALA  20 -21.089 -17.173   6.876
  159   1HB   ALA  20          1HB       ALA  20 -21.717 -19.391   8.840
  160   2HB   ALA  20          2HB       ALA  20 -21.706 -19.503   7.081
  161   3HB   ALA  20          3HB       ALA  20 -22.934 -18.534   7.895
  162    H    ASN  21           H        ASN  21 -20.773 -17.780  10.421
  163    HA   ASN  21           HA       ASN  21 -22.471 -15.417  10.894
  164   1HB   ASN  21          2HB       ASN  21 -22.388 -16.017  13.241
  165   2HB   ASN  21          1HB       ASN  21 -22.716 -17.467  12.298
  166   1HD2  ASN  21          1HD2      ASN  21 -21.489 -17.281  14.978
  167   2HD2  ASN  21          2HD2      ASN  21 -19.964 -18.009  14.853
  168    H    GLY  22           H        GLY  22 -19.088 -16.316  11.057
  169   1HA   GLY  22          1HA       GLY  22 -18.444 -13.442  11.391
  170   2HA   GLY  22          2HA       GLY  22 -17.322 -14.686  10.848
  171    H    ASP  23           H        ASP  23 -17.933 -16.539  13.023
  172    HA   ASP  23           HA       ASP  23 -17.190 -15.021  15.449
  173   1HB   ASP  23          2HB       ASP  23 -17.382 -17.199  16.619
  174   2HB   ASP  23          1HB       ASP  23 -18.846 -16.802  15.723
  175    H    GLY  24           H        GLY  24 -15.514 -15.997  12.868
  176   1HA   GLY  24          1HA       GLY  24 -13.025 -16.235  14.444
  177   2HA   GLY  24          2HA       GLY  24 -13.124 -15.922  12.712
  178    H    LYS  25           H        LYS  25 -15.220 -18.433  13.452
  179    HA   LYS  25           HA       LYS  25 -13.150 -20.416  12.633
  180   1HB   LYS  25          2HB       LYS  25 -14.016 -22.038  14.181
  181   2HB   LYS  25          1HB       LYS  25 -13.762 -20.555  15.094
  182   1HG   LYS  25          2HG       LYS  25 -16.066 -20.068  15.172
  183   2HG   LYS  25          1HG       LYS  25 -16.438 -21.160  13.838
  184   1HD   LYS  25          2HD       LYS  25 -16.879 -22.774  15.338
  185   2HD   LYS  25          1HD       LYS  25 -15.183 -22.737  15.822
  186   1HE   LYS  25          2HE       LYS  25 -17.367 -20.952  16.943
  187   2HE   LYS  25          1HE       LYS  25 -16.685 -22.362  17.757
  188   1HZ   LYS  25          1HZ       LYS  25 -14.459 -21.173  17.371
  189   2HZ   LYS  25          3HZ       LYS  25 -15.401 -19.782  17.138
  190   3HZ   LYS  25          2HZ       LYS  25 -15.470 -20.615  18.617
  191    H    ILE  26           H        ILE  26 -13.830 -21.948  11.148
  192    HA   ILE  26           HA       ILE  26 -16.592 -21.561  10.061
  193    HB   ILE  26           HB       ILE  26 -14.290 -22.814   8.565
  194   1HG1  ILE  26          2HG1      ILE  26 -15.027 -19.878   8.742
  195   2HG1  ILE  26          1HG1      ILE  26 -13.516 -20.609   9.282
  196   1HG2  ILE  26          1HG2      ILE  26 -16.906 -21.485   7.818
  197   2HG2  ILE  26          3HG2      ILE  26 -15.655 -21.874   6.636
  198   3HG2  ILE  26          2HG2      ILE  26 -16.439 -23.164   7.549
  199   1HD1  ILE  26          3HD1      ILE  26 -14.146 -21.296   6.513
  200   2HD1  ILE  26          2HD1      ILE  26 -14.007 -19.554   6.751
  201   3HD1  ILE  26          1HD1      ILE  26 -12.666 -20.613   7.187
  202    H    SER  27           H        SER  27 -17.927 -23.317  10.015
  203    HA   SER  27           HA       SER  27 -16.800 -25.906  10.977
  204   1HB   SER  27          2HB       SER  27 -18.870 -26.369  11.967
  205   2HB   SER  27          1HB       SER  27 -18.751 -24.622  12.185
  206    HG   SER  27           HG       SER  27 -20.348 -24.351  10.860
  207    H    ALA  28           H        ALA  28 -17.949 -27.865   9.996
  208    HA   ALA  28           HA       ALA  28 -17.635 -27.947   7.217
  209   1HB   ALA  28          3HB       ALA  28 -19.823 -29.620   8.362
  210   2HB   ALA  28          2HB       ALA  28 -18.478 -30.092   7.325
  211   3HB   ALA  28          1HB       ALA  28 -18.212 -29.830   9.049
  212    H    ALA  29           H        ALA  29 -20.615 -27.320   9.065
  213    HA   ALA  29           HA       ALA  29 -22.358 -27.048   6.857
  214   1HB   ALA  29          3HB       ALA  29 -22.963 -27.061   9.341
  215   2HB   ALA  29          2HB       ALA  29 -22.510 -25.357   9.359
  216   3HB   ALA  29          1HB       ALA  29 -23.843 -25.903   8.342
  217    H    GLU  30           H        GLU  30 -20.177 -24.683   8.357
  218    HA   GLU  30           HA       GLU  30 -21.072 -22.527   6.625
  219   1HB   GLU  30          2HB       GLU  30 -18.592 -22.806   8.346
  220   2HB   GLU  30          1HB       GLU  30 -19.081 -21.323   7.526
  221   1HG   GLU  30          2HG       GLU  30 -21.225 -21.359   8.772
  222   2HG   GLU  30          1HG       GLU  30 -20.700 -22.815   9.615
  223    H    LEU  31           H        LEU  31 -18.046 -24.435   6.780
  224    HA   LEU  31           HA       LEU  31 -16.989 -23.403   4.334
  225   1HB   LEU  31          2HB       LEU  31 -15.559 -24.608   5.905
  226   2HB   LEU  31          1HB       LEU  31 -16.522 -26.072   5.704
  227    HG   LEU  31           HG       LEU  31 -15.944 -25.750   3.154
  228   1HD1  LEU  31          2HD1      LEU  31 -13.858 -24.105   4.598
  229   2HD1  LEU  31          1HD1      LEU  31 -13.560 -24.816   3.012
  230   3HD1  LEU  31          3HD1      LEU  31 -14.851 -23.631   3.218
  231   1HD2  LEU  31          1HD2      LEU  31 -15.199 -27.591   4.741
  232   2HD2  LEU  31          3HD2      LEU  31 -14.081 -27.242   3.423
  233   3HD2  LEU  31          2HD2      LEU  31 -13.751 -26.632   5.045
  234    H    GLY  32           H        GLY  32 -18.993 -26.246   5.039
  235   1HA   GLY  32          1HA       GLY  32 -20.261 -27.604   3.605
  236   2HA   GLY  32          2HA       GLY  32 -19.069 -27.241   2.357
  237    H    GLU  33           H        GLU  33 -21.243 -25.067   4.159
  238    HA   GLU  33           HA       GLU  33 -23.159 -24.666   2.129
  239   1HB   GLU  33          2HB       GLU  33 -22.194 -23.081   4.469
  240   2HB   GLU  33          1HB       GLU  33 -23.182 -22.248   3.270
  241   1HG   GLU  33          2HG       GLU  33 -24.053 -24.924   4.331
  242   2HG   GLU  33          1HG       GLU  33 -24.360 -23.464   5.270
  243    H    ALA  34           H        ALA  34 -20.089 -22.953   2.707
  244    HA   ALA  34           HA       ALA  34 -20.443 -21.237   0.385
  245   1HB   ALA  34          3HB       ALA  34 -18.857 -20.171   1.612
  246   2HB   ALA  34          2HB       ALA  34 -18.431 -21.644   2.483
  247   3HB   ALA  34          1HB       ALA  34 -17.718 -21.315   0.903
  248    H    LEU  35           H        LEU  35 -18.738 -24.245   1.110
  249    HA   LEU  35           HA       LEU  35 -17.380 -24.554  -1.362
  250   1HB   LEU  35          2HB       LEU  35 -18.239 -26.345   0.845
  251   2HB   LEU  35          1HB       LEU  35 -17.902 -27.125  -0.700
  252    HG   LEU  35           HG       LEU  35 -15.990 -25.137   0.535
  253   1HD1  LEU  35          1HD1      LEU  35 -16.525 -27.180   2.020
  254   2HD1  LEU  35          3HD1      LEU  35 -15.733 -28.137   0.768
  255   3HD1  LEU  35          2HD1      LEU  35 -14.830 -26.892   1.629
  256   1HD2  LEU  35          1HD2      LEU  35 -15.715 -27.350  -1.522
  257   2HD2  LEU  35          3HD2      LEU  35 -15.687 -25.616  -1.843
  258   3HD2  LEU  35          2HD2      LEU  35 -14.381 -26.364  -0.923
  259    H    LYS  36           H        LYS  36 -20.751 -25.120  -0.476
  260    HA   LYS  36           HA       LYS  36 -21.655 -26.811  -2.473
  261   1HB   LYS  36          2HB       LYS  36 -22.813 -24.883  -0.748
  262   2HB   LYS  36          1HB       LYS  36 -23.421 -24.535  -2.367
  263   1HG   LYS  36          2HG       LYS  36 -24.369 -26.679  -2.602
  264   2HG   LYS  36          1HG       LYS  36 -23.373 -27.360  -1.316
  265   1HD   LYS  36          2HD       LYS  36 -24.797 -25.267  -0.099
  266   2HD   LYS  36          1HD       LYS  36 -25.973 -26.077  -1.134
  267   1HE   LYS  36          2HE       LYS  36 -26.164 -27.523   0.617
  268   2HE   LYS  36          1HE       LYS  36 -24.681 -28.221  -0.035
  269   1HZ   LYS  36          3HZ       LYS  36 -23.580 -26.370   1.398
  270   2HZ   LYS  36          2HZ       LYS  36 -25.043 -26.427   2.260
  271   3HZ   LYS  36          1HZ       LYS  36 -24.081 -27.820   2.122
  272    H    THR  37           H        THR  37 -20.348 -23.609  -2.855
  273    HA   THR  37           HA       THR  37 -21.408 -22.808  -5.325
  274    HB   THR  37           HB       THR  37 -19.730 -21.560  -3.855
  275    HG1  THR  37           HG1      THR  37 -19.182 -20.377  -5.561
  276   1HG2  THR  37          3HG2      THR  37 -18.165 -23.751  -4.228
  277   2HG2  THR  37          2HG2      THR  37 -17.527 -22.684  -5.479
  278   3HG2  THR  37          1HG2      THR  37 -17.532 -22.163  -3.794
  279    H    LEU  38           H        LEU  38 -19.241 -25.420  -4.590
  280    HA   LEU  38           HA       LEU  38 -18.084 -25.801  -7.173
  281   1HB   LEU  38          2HB       LEU  38 -18.711 -27.741  -4.936
  282   2HB   LEU  38          1HB       LEU  38 -17.847 -28.211  -6.399
  283    HG   LEU  38           HG       LEU  38 -16.857 -25.778  -5.004
  284   1HD1  LEU  38          1HD1      LEU  38 -17.053 -28.441  -3.730
  285   2HD1  LEU  38          3HD1      LEU  38 -15.447 -27.714  -3.690
  286   3HD1  LEU  38          2HD1      LEU  38 -16.821 -26.855  -2.994
  287   1HD2  LEU  38          2HD2      LEU  38 -16.006 -27.437  -7.056
  288   2HD2  LEU  38          1HD2      LEU  38 -15.001 -26.263  -6.206
  289   3HD2  LEU  38          3HD2      LEU  38 -15.014 -27.950  -5.690
  290    H    GLY  39           H        GLY  39 -21.031 -27.134  -5.701
  291   1HA   GLY  39          1HA       GLY  39 -22.214 -27.411  -8.388
  292   2HA   GLY  39          2HA       GLY  39 -23.059 -27.632  -6.858
  293    H    SER  40           H        SER  40 -20.000 -29.185  -7.694
  294    HA   SER  40           HA       SER  40 -21.462 -31.793  -7.786
  295   1HB   SER  40          2HB       SER  40 -19.946 -32.586  -9.383
  296   2HB   SER  40          1HB       SER  40 -20.133 -30.899  -9.862
  297    HG   SER  40           HG       SER  40 -18.029 -32.111  -8.425
  298    H    ILE  41           H        ILE  41 -20.903 -30.931  -5.280
  299    HA   ILE  41           HA       ILE  41 -18.509 -32.560  -4.540
  300    HB   ILE  41           HB       ILE  41 -18.343 -29.975  -4.253
  301   1HG1  ILE  41          2HG1      ILE  41 -17.038 -30.264  -2.199
  302   2HG1  ILE  41          1HG1      ILE  41 -17.852 -31.793  -1.875
  303   1HG2  ILE  41          1HG2      ILE  41 -20.717 -30.157  -3.036
  304   2HG2  ILE  41          3HG2      ILE  41 -19.693 -30.442  -1.627
  305   3HG2  ILE  41          2HG2      ILE  41 -19.526 -28.948  -2.553
  306   1HD1  ILE  41          2HD1      ILE  41 -16.332 -31.307  -4.441
  307   2HD1  ILE  41          1HD1      ILE  41 -15.542 -31.931  -2.993
  308   3HD1  ILE  41          3HD1      ILE  41 -16.843 -32.849  -3.752
  309    H    THR  42           H        THR  42 -18.680 -33.423  -2.271
  310    HA   THR  42           HA       THR  42 -21.538 -33.983  -1.584
  311    HB   THR  42           HB       THR  42 -21.068 -36.202  -1.393
  312    HG1  THR  42           HG1      THR  42 -18.976 -36.843  -0.448
  313   1HG2  THR  42          3HG2      THR  42 -19.978 -35.689  -3.548
  314   2HG2  THR  42          2HG2      THR  42 -18.461 -35.380  -2.703
  315   3HG2  THR  42          1HG2      THR  42 -19.149 -37.004  -2.716
  316    HA   PRO  43           HA       PRO  43 -20.763 -32.397   2.473
  317   1HB   PRO  43          2HB       PRO  43 -21.975 -34.200   4.089
  318   2HB   PRO  43          1HB       PRO  43 -22.876 -33.051   3.095
  319   1HG   PRO  43          2HG       PRO  43 -22.250 -35.936   2.565
  320   2HG   PRO  43          1HG       PRO  43 -23.774 -35.072   2.340
  321   1HD   PRO  43          1HD       PRO  43 -22.127 -35.589   0.270
  322   2HD   PRO  43          2HD       PRO  43 -23.082 -34.106   0.346
  323    H    ASP  44           H        ASP  44 -20.091 -35.830   1.976
  324    HA   ASP  44           HA       ASP  44 -18.381 -36.137   4.264
  325   1HB   ASP  44          2HB       ASP  44 -19.453 -37.815   2.314
  326   2HB   ASP  44          1HB       ASP  44 -17.714 -37.877   2.022
  327    H    GLU  45           H        GLU  45 -17.844 -34.697   1.120
  328    HA   GLU  45           HA       GLU  45 -14.938 -35.049   1.271
  329   1HB   GLU  45          2HB       GLU  45 -16.688 -33.368  -0.551
  330   2HB   GLU  45          1HB       GLU  45 -14.942 -33.545  -0.725
  331   1HG   GLU  45          2HG       GLU  45 -16.925 -35.839  -0.778
  332   2HG   GLU  45          1HG       GLU  45 -16.201 -35.104  -2.208
  333    H    VAL  46           H        VAL  46 -17.332 -32.503   1.798
  334    HA   VAL  46           HA       VAL  46 -15.448 -30.424   2.393
  335    HB   VAL  46           HB       VAL  46 -18.341 -30.847   3.166
  336   1HG1  VAL  46          3HG1      VAL  46 -17.115 -29.491   4.889
  337   2HG1  VAL  46          2HG1      VAL  46 -16.658 -28.363   3.613
  338   3HG1  VAL  46          1HG1      VAL  46 -18.357 -28.576   4.036
  339   1HG2  VAL  46          2HG2      VAL  46 -16.970 -29.876   0.853
  340   2HG2  VAL  46          1HG2      VAL  46 -18.710 -29.959   1.130
  341   3HG2  VAL  46          3HG2      VAL  46 -17.810 -28.516   1.598
  342    H    LYS  47           H        LYS  47 -17.016 -32.912   4.332
  343    HA   LYS  47           HA       LYS  47 -16.064 -31.955   6.884
  344   1HB   LYS  47          2HB       LYS  47 -16.973 -34.687   5.943
  345   2HB   LYS  47          1HB       LYS  47 -16.530 -34.343   7.614
  346   1HG   LYS  47          2HG       LYS  47 -18.242 -32.514   7.637
  347   2HG   LYS  47          1HG       LYS  47 -18.738 -33.009   6.018
  348   1HD   LYS  47          2HD       LYS  47 -19.054 -35.359   7.027
  349   2HD   LYS  47          1HD       LYS  47 -18.954 -34.565   8.599
  350   1HE   LYS  47          2HE       LYS  47 -20.938 -33.392   8.282
  351   2HE   LYS  47          1HE       LYS  47 -20.812 -33.449   6.524
  352   1HZ   LYS  47          3HZ       LYS  47 -21.201 -35.901   8.125
  353   2HZ   LYS  47          2HZ       LYS  47 -22.519 -34.950   7.629
  354   3HZ   LYS  47          1HZ       LYS  47 -21.496 -35.659   6.473
  355    H    HIS  48           H        HIS  48 -14.816 -34.230   4.480
  356    HA   HIS  48           HA       HIS  48 -12.546 -35.095   6.015
  357   1HB   HIS  48          2HB       HIS  48 -13.277 -36.360   4.063
  358   2HB   HIS  48          1HB       HIS  48 -12.984 -34.972   3.015
  359    HD1  HIS  48           HD1      HIS  48 -11.456 -38.019   3.687
  360    HD2  HIS  48           HD2      HIS  48  -9.990 -34.116   3.686
  361    HE1  HIS  48           HE1      HIS  48  -8.944 -38.197   3.418
  362    H    MET  49           H        MET  49 -13.051 -32.438   3.701
  363    HA   MET  49           HA       MET  49 -10.354 -31.552   3.555
  364   1HB   MET  49          2HB       MET  49 -13.032 -30.270   3.158
  365   2HB   MET  49          1HB       MET  49 -11.605 -29.239   3.241
  366   1HG   MET  49          2HG       MET  49 -10.646 -31.070   1.547
  367   2HG   MET  49          1HG       MET  49 -12.361 -31.275   1.190
  368   1HE   MET  49          1HE       MET  49 -13.851 -29.767   0.174
  369   2HE   MET  49          3HE       MET  49 -13.747 -28.545   1.447
  370   3HE   MET  49          2HE       MET  49 -13.597 -28.074  -0.244
  371    H    MET  50           H        MET  50 -12.976 -30.696   5.788
  372    HA   MET  50           HA       MET  50 -11.497 -28.792   7.317
  373   1HB   MET  50          2HB       MET  50 -13.957 -30.427   7.738
  374   2HB   MET  50          1HB       MET  50 -13.200 -29.717   9.163
  375   1HG   MET  50          2HG       MET  50 -13.190 -27.503   7.915
  376   2HG   MET  50          1HG       MET  50 -14.205 -28.275   6.697
  377   1HE   MET  50          1HE       MET  50 -13.457 -27.293  10.024
  378   2HE   MET  50          3HE       MET  50 -14.947 -26.577  10.652
  379   3HE   MET  50          2HE       MET  50 -14.558 -28.260  11.003
  380    H    ALA  51           H        ALA  51 -12.028 -32.279   7.802
  381    HA   ALA  51           HA       ALA  51 -10.502 -32.548  10.182
  382   1HB   ALA  51          1HB       ALA  51 -11.936 -34.353   9.274
  383   2HB   ALA  51          3HB       ALA  51 -10.819 -34.553   7.923
  384   3HB   ALA  51          2HB       ALA  51 -10.294 -34.927   9.565
  385    H    GLU  52           H        GLU  52  -9.549 -31.946   6.932
  386    HA   GLU  52           HA       GLU  52  -6.738 -32.751   7.456
  387   1HB   GLU  52          2HB       GLU  52  -8.284 -31.931   5.008
  388   2HB   GLU  52          1HB       GLU  52  -6.522 -31.855   5.006
  389   1HG   GLU  52          2HG       GLU  52  -6.656 -34.292   5.927
  390   2HG   GLU  52          1HG       GLU  52  -8.309 -34.263   5.313
  391    H    ILE  53           H        ILE  53  -8.740 -29.910   6.907
  392    HA   ILE  53           HA       ILE  53  -6.471 -28.063   6.970
  393    HB   ILE  53           HB       ILE  53  -9.457 -27.581   7.133
  394   1HG1  ILE  53          2HG1      ILE  53  -7.545 -27.332   4.800
  395   2HG1  ILE  53          1HG1      ILE  53  -8.662 -28.673   5.037
  396   1HG2  ILE  53          2HG2      ILE  53  -7.125 -25.706   6.653
  397   2HG2  ILE  53          1HG2      ILE  53  -8.825 -25.262   6.485
  398   3HG2  ILE  53          3HG2      ILE  53  -8.184 -25.721   8.063
  399   1HD1  ILE  53          2HD1      ILE  53  -9.605 -25.804   4.968
  400   2HD1  ILE  53          1HD1      ILE  53  -9.462 -26.777   3.503
  401   3HD1  ILE  53          3HD1      ILE  53 -10.565 -27.272   4.787
  402    H    ASP  54           H        ASP  54  -8.859 -29.336   9.204
  403    HA   ASP  54           HA       ASP  54  -8.558 -27.457  11.312
  404   1HB   ASP  54          2HB       ASP  54 -10.212 -29.486  10.912
  405   2HB   ASP  54          1HB       ASP  54  -9.007 -30.373  11.837
  406    H    THR  55           H        THR  55  -6.441 -26.953  11.854
  407    HA   THR  55           HA       THR  55  -4.310 -28.877  11.972
  408    HB   THR  55           HB       THR  55  -3.113 -27.040  13.227
  409    HG1  THR  55           HG1      THR  55  -4.196 -25.192  13.628
  410   1HG2  THR  55          2HG2      THR  55  -4.515 -26.548  10.603
  411   2HG2  THR  55          1HG2      THR  55  -3.366 -25.384  11.263
  412   3HG2  THR  55          3HG2      THR  55  -2.838 -27.022  10.879
  413    H    ASP  56           H        ASP  56  -6.365 -27.434  14.494
  414    HA   ASP  56           HA       ASP  56  -5.070 -29.139  16.529
  415   1HB   ASP  56          2HB       ASP  56  -6.238 -27.872  18.149
  416   2HB   ASP  56          1HB       ASP  56  -5.832 -26.699  16.897
  417    H    GLY  57           H        GLY  57  -8.303 -28.701  15.123
  418   1HA   GLY  57          1HA       GLY  57  -8.888 -31.522  15.916
  419   2HA   GLY  57          2HA       GLY  57  -9.614 -30.713  14.531
  420    H    ASP  58           H        ASP  58 -10.105 -28.205  16.049
  421    HA   ASP  58           HA       ASP  58 -11.898 -28.997  18.237
  422   1HB   ASP  58          2HB       ASP  58 -12.288 -26.643  18.550
  423   2HB   ASP  58          1HB       ASP  58 -10.568 -26.836  18.224
  424    H    GLY  59           H        GLY  59 -12.114 -28.986  14.905
  425   1HA   GLY  59          1HA       GLY  59 -15.081 -28.993  15.074
  426   2HA   GLY  59          2HA       GLY  59 -14.132 -29.753  13.798
  427    H    PHE  60           H        PHE  60 -12.706 -26.821  14.350
  428    HA   PHE  60           HA       PHE  60 -14.210 -25.633  12.075
  429   1HB   PHE  60          2HB       PHE  60 -13.405 -24.021  14.501
  430   2HB   PHE  60          1HB       PHE  60 -14.383 -23.493  13.133
  431    HD1  PHE  60           HD1      PHE  60 -16.637 -24.573  12.738
  432    HD2  PHE  60           HD2      PHE  60 -14.386 -25.138  16.349
  433    HE1  PHE  60           HE1      PHE  60 -18.687 -25.348  13.897
  434    HE2  PHE  60           HE2      PHE  60 -16.435 -25.906  17.508
  435    HZ   PHE  60           HZ       PHE  60 -18.588 -26.015  16.283
  436    H    ILE  61           H        ILE  61 -13.057 -24.017  10.896
  437    HA   ILE  61           HA       ILE  61 -10.104 -24.226  11.180
  438    HB   ILE  61           HB       ILE  61 -11.671 -23.355   8.742
  439   1HG1  ILE  61          2HG1      ILE  61 -12.313 -25.652   9.292
  440   2HG1  ILE  61          1HG1      ILE  61 -11.249 -25.656   7.885
  441   1HG2  ILE  61          3HG2      ILE  61  -8.820 -24.310   9.161
  442   2HG2  ILE  61          2HG2      ILE  61  -9.538 -23.932   7.595
  443   3HG2  ILE  61          1HG2      ILE  61  -9.320 -22.658   8.795
  444   1HD1  ILE  61          1HD1      ILE  61  -9.321 -26.037   9.520
  445   2HD1  ILE  61          3HD1      ILE  61 -10.549 -26.355  10.745
  446   3HD1  ILE  61          2HD1      ILE  61 -10.438 -27.389   9.319
  447    H    SER  62           H        SER  62  -9.055 -22.334  11.725
  448    HA   SER  62           HA       SER  62 -10.689 -19.857  11.839
  449   1HB   SER  62          2HB       SER  62  -8.096 -19.423  12.913
  450   2HB   SER  62          1HB       SER  62  -9.613 -19.575  13.799
  451    HG   SER  62           HG       SER  62  -7.758 -21.589  13.111
  452    H    PHE  63           H        PHE  63  -9.447 -17.809  11.210
  453    HA   PHE  63           HA       PHE  63  -8.672 -17.915   8.503
  454   1HB   PHE  63          2HB       PHE  63  -9.246 -15.797   9.664
  455   2HB   PHE  63          1HB       PHE  63  -7.734 -15.900  10.571
  456    HD1  PHE  63           HD1      PHE  63  -8.745 -16.442   7.003
  457    HD2  PHE  63           HD2      PHE  63  -6.082 -14.478   9.737
  458    HE1  PHE  63           HE1      PHE  63  -7.540 -15.423   5.092
  459    HE2  PHE  63           HE2      PHE  63  -4.868 -13.465   7.827
  460    HZ   PHE  63           HZ       PHE  63  -5.601 -13.935   5.503
  461    H    GLN  64           H        GLN  64  -6.695 -18.026  11.439
  462    HA   GLN  64           HA       GLN  64  -4.145 -18.078  10.192
  463   1HB   GLN  64          2HB       GLN  64  -4.615 -17.832  12.661
  464   2HB   GLN  64          1HB       GLN  64  -4.964 -19.559  12.709
  465   1HG   GLN  64          2HG       GLN  64  -2.678 -19.403  13.330
  466   2HG   GLN  64          1HG       GLN  64  -2.637 -19.871  11.630
  467   1HE2  GLN  64          1HE2      GLN  64  -1.182 -18.642  10.438
  468   2HE2  GLN  64          2HE2      GLN  64  -0.766 -17.029  10.762
  469    H    GLU  65           H        GLU  65  -6.245 -20.799  11.219
  470    HA   GLU  65           HA       GLU  65  -4.586 -22.874  10.212
  471   1HB   GLU  65          2HB       GLU  65  -7.556 -22.663  10.701
  472   2HB   GLU  65          1HB       GLU  65  -6.832 -24.135  10.070
  473   1HG   GLU  65          2HG       GLU  65  -5.358 -24.281  12.025
  474   2HG   GLU  65          1HG       GLU  65  -6.010 -22.769  12.650
  475    H    PHE  66           H        PHE  66  -7.290 -21.121   8.705
  476    HA   PHE  66           HA       PHE  66  -7.176 -22.490   6.192
  477   1HB   PHE  66          2HB       PHE  66  -9.115 -21.133   6.872
  478   2HB   PHE  66          1HB       PHE  66  -8.120 -19.677   6.825
  479    HD1  PHE  66           HD1      PHE  66  -9.634 -22.370   4.779
  480    HD2  PHE  66           HD2      PHE  66  -7.523 -18.626   4.737
  481    HE1  PHE  66           HE1      PHE  66 -10.099 -22.134   2.354
  482    HE2  PHE  66           HE2      PHE  66  -7.990 -18.394   2.311
  483    HZ   PHE  66           HZ       PHE  66  -9.276 -20.148   1.121
  484    H    THR  67           H        THR  67  -5.498 -19.653   7.455
  485    HA   THR  67           HA       THR  67  -4.313 -18.849   4.959
  486    HB   THR  67           HB       THR  67  -3.489 -18.389   7.838
  487    HG1  THR  67           HG1      THR  67  -5.180 -17.147   7.515
  488   1HG2  THR  67          3HG2      THR  67  -2.336 -17.292   5.262
  489   2HG2  THR  67          2HG2      THR  67  -2.031 -16.587   6.851
  490   3HG2  THR  67          1HG2      THR  67  -1.489 -18.227   6.494
  491    H    ASP  68           H        ASP  68  -3.059 -20.800   7.683
  492    HA   ASP  68           HA       ASP  68  -0.536 -21.383   6.484
  493   1HB   ASP  68          2HB       ASP  68  -2.159 -23.033   8.444
  494   2HB   ASP  68          1HB       ASP  68  -0.450 -23.278   8.081
  495    H    PHE  69           H        PHE  69  -3.698 -22.941   6.219
  496    HA   PHE  69           HA       PHE  69  -2.709 -25.190   4.680
  497   1HB   PHE  69          2HB       PHE  69  -4.709 -25.798   5.621
  498   2HB   PHE  69          1HB       PHE  69  -5.326 -24.149   5.616
  499    HD1  PHE  69           HD1      PHE  69  -5.976 -23.136   3.344
  500    HD2  PHE  69           HD2      PHE  69  -5.440 -27.342   4.005
  501    HE1  PHE  69           HE1      PHE  69  -7.308 -23.624   1.306
  502    HE2  PHE  69           HE2      PHE  69  -6.764 -27.833   1.971
  503    HZ   PHE  69           HZ       PHE  69  -7.703 -25.977   0.619
  504    H    GLY  70           H        GLY  70  -4.185 -22.058   3.932
  505   1HA   GLY  70          1HA       GLY  70  -4.270 -20.862   1.914
  506   2HA   GLY  70          2HA       GLY  70  -4.499 -22.426   1.130
  507    H    ARG  71           H        ARG  71  -1.666 -21.735   3.078
  508    HA   ARG  71           HA       ARG  71   0.024 -20.917   0.872
  509   1HB   ARG  71          2HB       ARG  71   0.715 -22.028   3.609
  510   2HB   ARG  71          1HB       ARG  71   1.886 -21.343   2.481
  511   1HG   ARG  71          2HG       ARG  71   0.617 -19.204   2.502
  512   2HG   ARG  71          1HG       ARG  71  -0.489 -19.893   3.690
  513   1HD   ARG  71          2HD       ARG  71   2.501 -19.525   4.055
  514   2HD   ARG  71          1HD       ARG  71   1.244 -18.541   4.803
  515    HE   ARG  71           HE       ARG  71   0.982 -21.393   5.382
  516   1HH1  ARG  71          1HH1      ARG  71   0.880 -18.432   6.783
  517   2HH1  ARG  71          2HH1      ARG  71   1.802 -18.830   8.195
  518   1HH2  ARG  71          1HH2      ARG  71   2.843 -21.904   6.974
  519   2HH2  ARG  71          2HH2      ARG  71   2.912 -20.795   8.303
  520    H    ALA  72           H        ALA  72  -0.832 -23.986   2.351
  521    HA   ALA  72           HA       ALA  72   1.216 -25.546   1.037
  522   1HB   ALA  72          3HB       ALA  72   0.398 -27.073   2.474
  523   2HB   ALA  72          1HB       ALA  72  -1.079 -27.158   1.514
  524   3HB   ALA  72          2HB       ALA  72  -0.962 -26.013   2.850
  525    H    ASN  73           H        ASN  73  -1.807 -24.201   0.029
  526    HA   ASN  73           HA       ASN  73  -1.440 -25.485  -2.626
  527   1HB   ASN  73          2HB       ASN  73  -4.152 -25.270  -1.294
  528   2HB   ASN  73          1HB       ASN  73  -3.756 -26.104  -2.798
  529   1HD2  ASN  73          1HD2      ASN  73  -4.207 -26.588   0.530
  530   2HD2  ASN  73          2HD2      ASN  73  -3.430 -28.090   0.671
  531    H    ARG  74           H        ARG  74  -0.578 -23.045  -2.462
  532    HA   ARG  74           HA       ARG  74  -2.332 -20.848  -2.429
  533   1HB   ARG  74          2HB       ARG  74   0.117 -21.282  -4.168
  534   2HB   ARG  74          1HB       ARG  74  -0.672 -19.725  -3.918
  535   1HG   ARG  74          2HG       ARG  74  -0.293 -19.999  -1.450
  536   2HG   ARG  74          1HG       ARG  74   0.633 -21.458  -1.800
  537   1HD   ARG  74          2HD       ARG  74   2.231 -19.682  -1.612
  538   2HD   ARG  74          1HD       ARG  74   2.076 -20.023  -3.335
  539    HE   ARG  74           HE       ARG  74   0.779 -17.698  -1.972
  540   1HH1  ARG  74          1HH1      ARG  74   1.062 -19.444  -4.855
  541   2HH1  ARG  74          2HH1      ARG  74   1.327 -18.058  -5.861
  542   1HH2  ARG  74          1HH2      ARG  74   1.555 -15.843  -3.201
  543   2HH2  ARG  74          2HH2      ARG  74   1.607 -16.020  -4.924
  544    H    GLY  75           H        GLY  75  -1.482 -23.009  -5.101
  545   1HA   GLY  75          1HA       GLY  75  -2.623 -23.478  -7.083
  546   2HA   GLY  75          2HA       GLY  75  -2.910 -21.741  -7.173
  547    H    LEU  76           H        LEU  76  -4.064 -23.467  -4.392
  548    HA   LEU  76           HA       LEU  76  -6.727 -23.973  -5.493
  549   1HB   LEU  76          2HB       LEU  76  -5.541 -24.176  -2.718
  550   2HB   LEU  76          1HB       LEU  76  -7.251 -24.469  -3.035
  551    HG   LEU  76           HG       LEU  76  -4.940 -25.927  -4.357
  552   1HD1  LEU  76          3HD1      LEU  76  -5.869 -26.290  -1.811
  553   2HD1  LEU  76          2HD1      LEU  76  -6.922 -27.379  -2.714
  554   3HD1  LEU  76          1HD1      LEU  76  -5.171 -27.574  -2.798
  555   1HD2  LEU  76          3HD2      LEU  76  -7.790 -25.675  -4.967
  556   2HD2  LEU  76          2HD2      LEU  76  -6.494 -26.361  -5.945
  557   3HD2  LEU  76          1HD2      LEU  76  -7.299 -27.353  -4.730
  558    H    LEU  77           H        LEU  77  -5.271 -21.656  -3.235
  559    HA   LEU  77           HA       LEU  77  -7.659 -20.246  -2.587
  560   1HB   LEU  77          2HB       LEU  77  -4.743 -19.472  -2.630
  561   2HB   LEU  77          1HB       LEU  77  -5.990 -18.310  -2.181
  562    HG   LEU  77           HG       LEU  77  -4.844 -19.746  -0.309
  563   1HD1  LEU  77          3HD1      LEU  77  -7.544 -18.733  -0.693
  564   2HD1  LEU  77          2HD1      LEU  77  -7.517 -20.081   0.444
  565   3HD1  LEU  77          1HD1      LEU  77  -6.518 -18.659   0.740
  566   1HD2  LEU  77          3HD2      LEU  77  -6.907 -21.675  -1.417
  567   2HD2  LEU  77          2HD2      LEU  77  -5.161 -21.929  -1.376
  568   3HD2  LEU  77          1HD2      LEU  77  -6.077 -21.861   0.130
  569    H    LYS  78           H        LYS  78  -5.394 -19.911  -5.287
  570    HA   LYS  78           HA       LYS  78  -6.659 -17.515  -6.327
  571   1HB   LYS  78          2HB       LYS  78  -4.916 -19.535  -7.771
  572   2HB   LYS  78          1HB       LYS  78  -5.263 -17.888  -8.296
  573   1HG   LYS  78          2HG       LYS  78  -4.232 -17.083  -6.129
  574   2HG   LYS  78          1HG       LYS  78  -3.715 -18.743  -5.835
  575   1HD   LYS  78          2HD       LYS  78  -3.003 -17.133  -8.305
  576   2HD   LYS  78          1HD       LYS  78  -1.938 -17.359  -6.918
  577   1HE   LYS  78          2HE       LYS  78  -3.040 -19.885  -7.897
  578   2HE   LYS  78          1HE       LYS  78  -2.105 -19.039  -9.130
  579   1HZ   LYS  78          1HZ       LYS  78  -1.018 -19.226  -6.412
  580   2HZ   LYS  78          3HZ       LYS  78  -0.942 -20.595  -7.409
  581   3HZ   LYS  78          2HZ       LYS  78  -0.202 -19.147  -7.900
  582    H    ASP  79           H        ASP  79  -7.154 -20.963  -6.652
  583    HA   ASP  79           HA       ASP  79  -8.906 -20.706  -8.979
  584   1HB   ASP  79          2HB       ASP  79  -7.570 -22.778  -8.475
  585   2HB   ASP  79          1HB       ASP  79  -8.612 -23.048  -7.078
  586    H    VAL  80           H        VAL  80  -9.318 -21.301  -5.495
  587    HA   VAL  80           HA       VAL  80 -12.194 -21.391  -5.602
  588    HB   VAL  80           HB       VAL  80 -10.405 -20.657  -3.267
  589   1HG1  VAL  80          3HG1      VAL  80 -12.884 -20.140  -3.104
  590   2HG1  VAL  80          2HG1      VAL  80 -13.179 -21.871  -3.273
  591   3HG1  VAL  80          1HG1      VAL  80 -12.279 -21.262  -1.885
  592   1HG2  VAL  80          2HG2      VAL  80 -11.137 -23.246  -4.561
  593   2HG2  VAL  80          1HG2      VAL  80  -9.644 -22.782  -3.746
  594   3HG2  VAL  80          3HG2      VAL  80 -11.071 -23.207  -2.799
  595    H    ALA  81           H        ALA  81  -9.851 -18.807  -4.944
  596    HA   ALA  81           HA       ALA  81 -11.604 -16.756  -4.174
  597   1HB   ALA  81          1HB       ALA  81  -9.885 -15.315  -5.626
  598   2HB   ALA  81          2HB       ALA  81  -8.989 -16.834  -5.614
  599   3HB   ALA  81          3HB       ALA  81  -9.409 -16.044  -4.093
  600    H    LYS  82           H        LYS  82 -10.696 -17.735  -7.474
  601    HA   LYS  82           HA       LYS  82 -12.274 -15.812  -8.854
  602   1HB   LYS  82          2HB       LYS  82 -11.576 -18.647  -9.685
  603   2HB   LYS  82          1HB       LYS  82 -12.161 -17.382 -10.765
  604   1HG   LYS  82          2HG       LYS  82 -10.195 -16.002 -10.227
  605   2HG   LYS  82          1HG       LYS  82  -9.611 -17.250  -9.127
  606   1HD   LYS  82          2HD       LYS  82  -9.651 -18.847 -11.106
  607   2HD   LYS  82          1HD       LYS  82  -9.932 -17.439 -12.132
  608   1HE   LYS  82          2HE       LYS  82  -7.734 -16.995 -10.269
  609   2HE   LYS  82          1HE       LYS  82  -7.445 -18.400 -11.294
  610   1HZ   LYS  82          2HZ       LYS  82  -8.427 -15.872 -12.451
  611   2HZ   LYS  82          1HZ       LYS  82  -6.770 -16.095 -12.151
  612   3HZ   LYS  82          3HZ       LYS  82  -7.586 -17.139 -13.209
  613    H    ILE  83           H        ILE  83 -13.125 -18.829  -7.288
  614    HA   ILE  83           HA       ILE  83 -15.705 -19.165  -8.511
  615    HB   ILE  83           HB       ILE  83 -14.651 -20.061  -5.813
  616   1HG1  ILE  83          2HG1      ILE  83 -14.975 -21.500  -8.464
  617   2HG1  ILE  83          1HG1      ILE  83 -13.445 -20.987  -7.753
  618   1HG2  ILE  83          2HG2      ILE  83 -17.304 -19.936  -6.604
  619   2HG2  ILE  83          1HG2      ILE  83 -16.839 -21.582  -7.034
  620   3HG2  ILE  83          3HG2      ILE  83 -16.656 -21.019  -5.373
  621   1HD1  ILE  83          3HD1      ILE  83 -14.291 -22.379  -5.677
  622   2HD1  ILE  83          2HD1      ILE  83 -15.299 -23.181  -6.883
  623   3HD1  ILE  83          1HD1      ILE  83 -13.542 -23.204  -7.045
  624    H    PHE  84           H        PHE  84 -14.567 -17.355  -5.703
  625    HA   PHE  84           HA       PHE  84 -17.347 -16.361  -5.269
  626   1HB   PHE  84          2HB       PHE  84 -14.904 -16.171  -3.479
  627   2HB   PHE  84          1HB       PHE  84 -16.523 -15.601  -3.070
  628    HD1  PHE  84           HD1      PHE  84 -14.768 -18.698  -4.276
  629    HD2  PHE  84           HD2      PHE  84 -17.966 -17.038  -1.935
  630    HE1  PHE  84           HE1      PHE  84 -15.377 -20.971  -3.495
  631    HE2  PHE  84           HE2      PHE  84 -18.574 -19.312  -1.154
  632    HZ   PHE  84           HZ       PHE  84 -17.279 -21.279  -1.934

  No H/Q in entry =         632
  Start of MODEL   16
    1    H1   ALA   1          2H        ALA   1   9.820 -13.840   0.691
    2    H2   ALA   1          1H        ALA   1  11.497 -13.585   0.600
    3    H3   ALA   1          3H        ALA   1  10.723 -13.595   2.108
    4    HA   ALA   1           HA       ALA   1   9.930 -11.503   1.904
    5   1HB   ALA   1          1HB       ALA   1  12.221 -11.020   1.756
    6   2HB   ALA   1          3HB       ALA   1  12.367 -11.746   0.155
    7   3HB   ALA   1          2HB       ALA   1  11.568 -10.186   0.347
    8    H    ASP   2           H        ASP   2  10.005 -13.267  -1.095
    9    HA   ASP   2           HA       ASP   2   8.873 -11.317  -2.834
   10   1HB   ASP   2          2HB       ASP   2   8.658 -14.336  -2.778
   11   2HB   ASP   2          1HB       ASP   2   7.973 -13.353  -4.071
   12    H    ASP   3           H        ASP   3   7.446 -13.319  -0.334
   13    HA   ASP   3           HA       ASP   3   4.697 -12.852  -1.174
   14   1HB   ASP   3          2HB       ASP   3   5.859 -13.804   1.462
   15   2HB   ASP   3          1HB       ASP   3   4.139 -13.786   1.075
   16    H    HIS   4           H        HIS   4   3.334 -11.207  -0.513
   17    HA   HIS   4           HA       HIS   4   4.509  -9.177   1.346
   18   1HB   HIS   4          2HB       HIS   4   2.655  -7.747  -0.029
   19   2HB   HIS   4          1HB       HIS   4   4.341  -7.859  -0.517
   20    HD1  HIS   4           HD1      HIS   4   0.941  -9.308  -1.300
   21    HD2  HIS   4           HD2      HIS   4   4.795  -9.303  -2.884
   22    HE1  HIS   4           HE1      HIS   4   0.772 -10.365  -3.595
   23    HA   PRO   5           HA       PRO   5   0.909  -9.412   3.915
   24   1HB   PRO   5          2HB       PRO   5   0.191  -6.829   4.283
   25   2HB   PRO   5          1HB       PRO   5   1.618  -7.544   5.038
   26   1HG   PRO   5          2HG       PRO   5   1.420  -5.849   2.573
   27   2HG   PRO   5          1HG       PRO   5   2.586  -5.750   3.897
   28   1HD   PRO   5          1HD       PRO   5   3.198  -6.939   1.555
   29   2HD   PRO   5          2HD       PRO   5   3.844  -7.524   3.090
   30    H    GLN   6           H        GLN   6   0.661  -7.675   0.902
   31    HA   GLN   6           HA       GLN   6  -2.151  -7.216   0.844
   32   1HB   GLN   6          2HB       GLN   6   0.018  -7.483  -1.197
   33   2HB   GLN   6          1HB       GLN   6  -1.654  -7.564  -1.752
   34   1HG   GLN   6          2HG       GLN   6  -2.151  -5.397  -0.868
   35   2HG   GLN   6          1HG       GLN   6  -0.644  -5.350   0.047
   36   1HE2  GLN   6          1HE2      GLN   6   1.413  -5.288  -1.306
   37   2HE2  GLN   6          2HE2      GLN   6   1.357  -4.536  -2.827
   38    H    ASP   7           H        ASP   7  -0.187 -10.038   0.014
   39    HA   ASP   7           HA       ASP   7  -2.136 -11.634  -1.239
   40   1HB   ASP   7          2HB       ASP   7   0.181 -12.311   0.565
   41   2HB   ASP   7          1HB       ASP   7  -0.872 -13.576  -0.071
   42    H    LYS   8           H        LYS   8  -1.398 -11.466   2.245
   43    HA   LYS   8           HA       LYS   8  -3.355 -13.206   3.216
   44   1HB   LYS   8          2HB       LYS   8  -2.126 -10.694   4.301
   45   2HB   LYS   8          1HB       LYS   8  -3.467 -11.436   5.173
   46   1HG   LYS   8          2HG       LYS   8  -2.100 -13.646   4.892
   47   2HG   LYS   8          1HG       LYS   8  -0.739 -12.567   4.589
   48   1HD   LYS   8          2HD       LYS   8  -1.350 -11.376   6.751
   49   2HD   LYS   8          1HD       LYS   8  -2.470 -12.701   7.069
   50   1HE   LYS   8          2HE       LYS   8  -0.162 -12.959   8.111
   51   2HE   LYS   8          1HE       LYS   8  -0.688 -14.311   7.108
   52   1HZ   LYS   8          3HZ       LYS   8   0.838 -12.104   5.903
   53   2HZ   LYS   8          2HZ       LYS   8   1.656 -13.311   6.774
   54   3HZ   LYS   8          1HZ       LYS   8   0.726 -13.725   5.414
   55    H    ALA   9           H        ALA   9  -3.728  -9.884   2.092
   56    HA   ALA   9           HA       ALA   9  -6.350  -9.358   2.971
   57   1HB   ALA   9          3HB       ALA   9  -4.605  -7.976   1.455
   58   2HB   ALA   9          1HB       ALA   9  -6.324  -7.589   1.495
   59   3HB   ALA   9          2HB       ALA   9  -5.671  -8.566   0.180
   60    H    GLU  10           H        GLU  10  -5.231 -11.104   0.103
   61    HA   GLU  10           HA       GLU  10  -7.879 -11.674  -0.902
   62   1HB   GLU  10          2HB       GLU  10  -5.363 -13.301  -1.356
   63   2HB   GLU  10          1HB       GLU  10  -6.787 -13.229  -2.394
   64   1HG   GLU  10          2HG       GLU  10  -6.355 -10.819  -2.792
   65   2HG   GLU  10          1HG       GLU  10  -4.906 -10.925  -1.792
   66    H    ARG  11           H        ARG  11  -5.627 -13.393   1.210
   67    HA   ARG  11           HA       ARG  11  -7.198 -15.791   1.465
   68   1HB   ARG  11          2HB       ARG  11  -5.150 -14.545   3.320
   69   2HB   ARG  11          1HB       ARG  11  -5.812 -16.164   3.511
   70   1HG   ARG  11          2HG       ARG  11  -5.050 -16.420   0.984
   71   2HG   ARG  11          1HG       ARG  11  -3.957 -15.104   1.408
   72   1HD   ARG  11          2HD       ARG  11  -3.458 -16.620   3.516
   73   2HD   ARG  11          1HD       ARG  11  -4.057 -17.907   2.470
   74    HE   ARG  11           HE       ARG  11  -1.648 -16.244   1.934
   75   1HH1  ARG  11          1HH1      ARG  11  -1.661 -19.264   2.382
   76   2HH1  ARG  11          2HH1      ARG  11  -1.502 -19.840   0.757
   77   1HH2  ARG  11          1HH2      ARG  11  -2.346 -16.800  -0.685
   78   2HH2  ARG  11          2HH2      ARG  11  -1.893 -18.445  -0.981
   79    H    GLU  12           H        GLU  12  -7.015 -12.798   3.328
   80    HA   GLU  12           HA       GLU  12  -8.833 -13.578   5.401
   81   1HB   GLU  12          2HB       GLU  12  -7.851 -10.944   4.329
   82   2HB   GLU  12          1HB       GLU  12  -9.142 -10.984   5.524
   83   1HG   GLU  12          2HG       GLU  12  -7.637 -12.455   6.945
   84   2HG   GLU  12          1HG       GLU  12  -6.341 -12.093   5.804
   85    H    ARG  13           H        ARG  13  -9.289 -11.996   2.262
   86    HA   ARG  13           HA       ARG  13 -12.105 -11.508   2.602
   87   1HB   ARG  13          2HB       ARG  13 -10.424 -11.827   0.099
   88   2HB   ARG  13          1HB       ARG  13 -12.105 -11.298   0.099
   89   1HG   ARG  13          2HG       ARG  13 -11.551  -9.345   1.428
   90   2HG   ARG  13          1HG       ARG  13  -9.894  -9.910   1.641
   91   1HD   ARG  13          2HD       ARG  13  -9.509  -8.529  -0.148
   92   2HD   ARG  13          1HD       ARG  13 -10.038  -9.944  -1.060
   93    HE   ARG  13           HE       ARG  13 -12.045  -7.892  -0.259
   94   1HH1  ARG  13          1HH1      ARG  13 -11.892 -10.453  -2.224
   95   2HH1  ARG  13          2HH1      ARG  13 -12.170  -9.623  -3.719
   96   1HH2  ARG  13          1HH2      ARG  13 -11.708  -6.467  -2.360
   97   2HH2  ARG  13          2HH2      ARG  13 -12.066  -7.367  -3.796
   98    H    ILE  14           H        ILE  14 -10.243 -14.187   1.221
   99    HA   ILE  14           HA       ILE  14 -12.566 -15.677   0.358
  100    HB   ILE  14           HB       ILE  14  -9.794 -16.705   1.039
  101   1HG1  ILE  14          2HG1      ILE  14 -10.752 -16.057  -1.731
  102   2HG1  ILE  14          1HG1      ILE  14 -10.120 -14.767  -0.712
  103   1HG2  ILE  14          1HG2      ILE  14 -12.245 -17.865  -0.156
  104   2HG2  ILE  14          3HG2      ILE  14 -10.742 -18.232  -1.003
  105   3HG2  ILE  14          2HG2      ILE  14 -10.924 -18.662   0.698
  106   1HD1  ILE  14          1HD1      ILE  14  -8.434 -17.144  -0.615
  107   2HD1  ILE  14          3HD1      ILE  14  -8.609 -16.536  -2.260
  108   3HD1  ILE  14          2HD1      ILE  14  -7.994 -15.478  -0.991
  109    H    PHE  15           H        PHE  15 -10.459 -15.827   3.240
  110    HA   PHE  15           HA       PHE  15 -11.884 -17.981   4.486
  111   1HB   PHE  15          2HB       PHE  15  -9.627 -17.288   5.221
  112   2HB   PHE  15          1HB       PHE  15 -10.285 -15.752   5.791
  113    HD1  PHE  15           HD1      PHE  15 -10.149 -19.395   6.351
  114    HD2  PHE  15           HD2      PHE  15 -11.722 -15.661   7.779
  115    HE1  PHE  15           HE1      PHE  15 -10.812 -20.488   8.476
  116    HE2  PHE  15           HE2      PHE  15 -12.383 -16.754   9.907
  117    HZ   PHE  15           HZ       PHE  15 -11.931 -19.172  10.254
  118    H    LYS  16           H        LYS  16 -12.307 -14.475   4.500
  119    HA   LYS  16           HA       LYS  16 -14.296 -14.401   6.574
  120   1HB   LYS  16          2HB       LYS  16 -13.530 -12.558   4.319
  121   2HB   LYS  16          1HB       LYS  16 -14.969 -12.228   5.283
  122   1HG   LYS  16          2HG       LYS  16 -13.525 -12.409   7.346
  123   2HG   LYS  16          1HG       LYS  16 -12.121 -12.502   6.284
  124   1HD   LYS  16          2HD       LYS  16 -13.050 -10.318   5.227
  125   2HD   LYS  16          1HD       LYS  16 -14.023 -10.198   6.694
  126   1HE   LYS  16          2HE       LYS  16 -12.166  -9.903   8.064
  127   2HE   LYS  16          1HE       LYS  16 -11.083 -10.735   6.947
  128   1HZ   LYS  16          3HZ       LYS  16 -12.360  -8.149   6.280
  129   2HZ   LYS  16          2HZ       LYS  16 -10.865  -8.241   7.080
  130   3HZ   LYS  16          1HZ       LYS  16 -11.039  -8.891   5.521
  131    H    ARG  17           H        ARG  17 -14.401 -15.109   3.141
  132    HA   ARG  17           HA       ARG  17 -17.269 -14.903   2.861
  133   1HB   ARG  17          2HB       ARG  17 -15.111 -16.292   1.268
  134   2HB   ARG  17          1HB       ARG  17 -16.815 -16.425   0.834
  135   1HG   ARG  17          2HG       ARG  17 -16.832 -13.833   0.962
  136   2HG   ARG  17          1HG       ARG  17 -15.075 -13.962   0.886
  137   1HD   ARG  17          2HD       ARG  17 -15.503 -15.504  -1.165
  138   2HD   ARG  17          1HD       ARG  17 -17.114 -14.787  -1.173
  139    HE   ARG  17           HE       ARG  17 -15.918 -12.548  -1.360
  140   1HH1  ARG  17          1HH1      ARG  17 -13.398 -14.598  -1.185
  141   2HH1  ARG  17          2HH1      ARG  17 -12.737 -14.282  -2.755
  142   1HH2  ARG  17          1HH2      ARG  17 -15.514 -12.525  -3.861
  143   2HH2  ARG  17          2HH2      ARG  17 -13.935 -13.108  -4.270
  144    H    PHE  18           H        PHE  18 -15.033 -17.482   3.753
  145    HA   PHE  18           HA       PHE  18 -17.016 -19.583   3.752
  146   1HB   PHE  18          2HB       PHE  18 -14.280 -19.292   4.986
  147   2HB   PHE  18          1HB       PHE  18 -15.273 -20.720   5.277
  148    HD1  PHE  18           HD1      PHE  18 -16.194 -21.975   3.220
  149    HD2  PHE  18           HD2      PHE  18 -13.008 -19.102   3.010
  150    HE1  PHE  18           HE1      PHE  18 -15.497 -22.907   1.029
  151    HE2  PHE  18           HE2      PHE  18 -12.312 -20.033   0.821
  152    HZ   PHE  18           HZ       PHE  18 -13.556 -21.935  -0.170
  153    H    ASP  19           H        ASP  19 -15.531 -17.685   6.390
  154    HA   ASP  19           HA       ASP  19 -17.080 -18.771   8.499
  155   1HB   ASP  19          2HB       ASP  19 -15.095 -17.059   8.556
  156   2HB   ASP  19          1HB       ASP  19 -16.370 -15.844   8.445
  157    H    ALA  20           H        ALA  20 -19.280 -18.990   8.194
  158    HA   ALA  20           HA       ALA  20 -20.900 -17.145   6.733
  159   1HB   ALA  20          2HB       ALA  20 -21.228 -19.664   7.930
  160   2HB   ALA  20          1HB       ALA  20 -22.408 -18.616   8.716
  161   3HB   ALA  20          3HB       ALA  20 -22.413 -18.789   6.961
  162    H    ASN  21           H        ASN  21 -20.652 -17.633  10.301
  163    HA   ASN  21           HA       ASN  21 -22.237 -15.176  10.668
  164   1HB   ASN  21          2HB       ASN  21 -22.191 -15.693  13.039
  165   2HB   ASN  21          1HB       ASN  21 -22.595 -17.154  12.144
  166   1HD2  ASN  21          1HD2      ASN  21 -21.363 -16.952  14.823
  167   2HD2  ASN  21          2HD2      ASN  21 -19.879 -17.761  14.724
  168    H    GLY  22           H        GLY  22 -18.920 -16.147  10.651
  169   1HA   GLY  22          1HA       GLY  22 -18.122 -13.336  10.944
  170   2HA   GLY  22          2HA       GLY  22 -17.051 -14.676  10.545
  171    H    ASP  23           H        ASP  23 -17.642 -16.372  12.739
  172    HA   ASP  23           HA       ASP  23 -17.003 -14.713  15.119
  173   1HB   ASP  23          2HB       ASP  23 -17.403 -16.745  16.437
  174   2HB   ASP  23          1HB       ASP  23 -18.774 -16.416  15.382
  175    H    GLY  24           H        GLY  24 -15.298 -15.948  12.676
  176   1HA   GLY  24          1HA       GLY  24 -12.889 -16.245  14.372
  177   2HA   GLY  24          2HA       GLY  24 -12.894 -15.959  12.634
  178    H    LYS  25           H        LYS  25 -15.123 -18.386  13.472
  179    HA   LYS  25           HA       LYS  25 -13.124 -20.453  12.671
  180   1HB   LYS  25          2HB       LYS  25 -14.065 -22.015  14.253
  181   2HB   LYS  25          1HB       LYS  25 -13.704 -20.530  15.130
  182   1HG   LYS  25          2HG       LYS  25 -15.998 -19.859  15.112
  183   2HG   LYS  25          1HG       LYS  25 -16.427 -21.114  13.948
  184   1HD   LYS  25          2HD       LYS  25 -15.634 -22.803  15.702
  185   2HD   LYS  25          1HD       LYS  25 -15.617 -21.458  16.844
  186   1HE   LYS  25          2HE       LYS  25 -18.079 -21.794  15.201
  187   2HE   LYS  25          1HE       LYS  25 -17.797 -22.992  16.464
  188   1HZ   LYS  25          2HZ       LYS  25 -17.319 -20.937  17.913
  189   2HZ   LYS  25          1HZ       LYS  25 -18.178 -20.084  16.721
  190   3HZ   LYS  25          3HZ       LYS  25 -18.933 -21.341  17.572
  191    H    ILE  26           H        ILE  26 -13.849 -21.987  11.227
  192    HA   ILE  26           HA       ILE  26 -16.615 -21.587  10.161
  193    HB   ILE  26           HB       ILE  26 -14.331 -22.863   8.658
  194   1HG1  ILE  26          2HG1      ILE  26 -15.083 -19.925   8.754
  195   2HG1  ILE  26          1HG1      ILE  26 -13.585 -20.628   9.364
  196   1HG2  ILE  26          3HG2      ILE  26 -17.052 -21.764   8.039
  197   2HG2  ILE  26          2HG2      ILE  26 -15.809 -21.715   6.790
  198   3HG2  ILE  26          1HG2      ILE  26 -16.301 -23.259   7.486
  199   1HD1  ILE  26          1HD1      ILE  26 -14.148 -21.405   6.601
  200   2HD1  ILE  26          3HD1      ILE  26 -13.985 -19.659   6.794
  201   3HD1  ILE  26          2HD1      ILE  26 -12.675 -20.728   7.295
  202    H    SER  27           H        SER  27 -17.959 -23.334  10.185
  203    HA   SER  27           HA       SER  27 -16.823 -25.918  11.150
  204   1HB   SER  27          2HB       SER  27 -18.922 -26.391  12.114
  205   2HB   SER  27          1HB       SER  27 -18.736 -24.659  12.391
  206    HG   SER  27           HG       SER  27 -20.715 -24.866  11.513
  207    H    ALA  28           H        ALA  28 -18.057 -27.885  10.213
  208    HA   ALA  28           HA       ALA  28 -17.718 -28.041   7.440
  209   1HB   ALA  28          2HB       ALA  28 -19.747 -29.568   9.101
  210   2HB   ALA  28          3HB       ALA  28 -18.054 -30.022   8.898
  211   3HB   ALA  28          1HB       ALA  28 -19.146 -30.047   7.514
  212    H    ALA  29           H        ALA  29 -20.705 -27.319   9.238
  213    HA   ALA  29           HA       ALA  29 -22.421 -27.039   7.011
  214   1HB   ALA  29          3HB       ALA  29 -23.405 -27.024   9.190
  215   2HB   ALA  29          2HB       ALA  29 -22.400 -25.670   9.707
  216   3HB   ALA  29          1HB       ALA  29 -23.685 -25.414   8.526
  217    H    GLU  30           H        GLU  30 -20.204 -24.700   8.494
  218    HA   GLU  30           HA       GLU  30 -21.025 -22.555   6.712
  219   1HB   GLU  30          2HB       GLU  30 -18.576 -22.858   8.476
  220   2HB   GLU  30          1HB       GLU  30 -19.020 -21.379   7.623
  221   1HG   GLU  30          2HG       GLU  30 -21.192 -21.360   8.836
  222   2HG   GLU  30          1HG       GLU  30 -20.689 -22.799   9.723
  223    H    LEU  31           H        LEU  31 -18.053 -24.540   6.942
  224    HA   LEU  31           HA       LEU  31 -16.909 -23.579   4.515
  225   1HB   LEU  31          2HB       LEU  31 -15.783 -24.973   6.346
  226   2HB   LEU  31          1HB       LEU  31 -16.557 -26.377   5.616
  227    HG   LEU  31           HG       LEU  31 -14.903 -24.464   3.967
  228   1HD1  LEU  31          3HD1      LEU  31 -13.640 -25.452   5.986
  229   2HD1  LEU  31          2HD1      LEU  31 -13.840 -27.015   5.191
  230   3HD1  LEU  31          1HD1      LEU  31 -12.937 -25.727   4.392
  231   1HD2  LEU  31          3HD2      LEU  31 -16.437 -26.840   3.491
  232   2HD2  LEU  31          2HD2      LEU  31 -15.530 -25.873   2.329
  233   3HD2  LEU  31          1HD2      LEU  31 -14.738 -27.197   3.180
  234    H    GLY  32           H        GLY  32 -18.983 -26.392   5.180
  235   1HA   GLY  32          1HA       GLY  32 -20.284 -27.689   3.724
  236   2HA   GLY  32          2HA       GLY  32 -19.047 -27.384   2.507
  237    H    GLU  33           H        GLU  33 -21.142 -25.071   4.215
  238    HA   GLU  33           HA       GLU  33 -23.032 -24.648   2.162
  239   1HB   GLU  33          2HB       GLU  33 -22.057 -23.124   4.506
  240   2HB   GLU  33          1HB       GLU  33 -22.845 -22.166   3.252
  241   1HG   GLU  33          2HG       GLU  33 -24.740 -23.864   3.314
  242   2HG   GLU  33          1HG       GLU  33 -23.987 -24.528   4.764
  243    H    ALA  34           H        ALA  34 -19.893 -23.047   2.692
  244    HA   ALA  34           HA       ALA  34 -20.168 -21.326   0.383
  245   1HB   ALA  34          1HB       ALA  34 -18.565 -20.534   1.889
  246   2HB   ALA  34          2HB       ALA  34 -17.548 -21.306   0.672
  247   3HB   ALA  34          3HB       ALA  34 -17.904 -22.142   2.184
  248    H    LEU  35           H        LEU  35 -18.742 -24.498   0.985
  249    HA   LEU  35           HA       LEU  35 -17.451 -24.862  -1.511
  250   1HB   LEU  35          2HB       LEU  35 -18.489 -26.637   0.632
  251   2HB   LEU  35          1HB       LEU  35 -18.225 -27.385  -0.944
  252    HG   LEU  35           HG       LEU  35 -16.170 -25.752   0.579
  253   1HD1  LEU  35          1HD1      LEU  35 -16.513 -28.733   0.162
  254   2HD1  LEU  35          3HD1      LEU  35 -15.022 -27.997   0.752
  255   3HD1  LEU  35          2HD1      LEU  35 -16.505 -27.866   1.698
  256   1HD2  LEU  35          1HD2      LEU  35 -16.232 -27.092  -2.111
  257   2HD2  LEU  35          3HD2      LEU  35 -15.593 -25.509  -1.672
  258   3HD2  LEU  35          2HD2      LEU  35 -14.707 -26.970  -1.233
  259    H    LYS  36           H        LYS  36 -20.852 -25.288  -0.589
  260    HA   LYS  36           HA       LYS  36 -21.876 -26.747  -2.699
  261   1HB   LYS  36          2HB       LYS  36 -22.882 -24.639  -0.945
  262   2HB   LYS  36          1HB       LYS  36 -23.664 -24.619  -2.526
  263   1HG   LYS  36          2HG       LYS  36 -24.352 -26.904  -2.313
  264   2HG   LYS  36          1HG       LYS  36 -23.324 -27.150  -0.902
  265   1HD   LYS  36          2HD       LYS  36 -25.019 -24.933  -0.336
  266   2HD   LYS  36          1HD       LYS  36 -26.037 -26.216  -0.989
  267   1HE   LYS  36          2HE       LYS  36 -24.011 -26.631   1.228
  268   2HE   LYS  36          1HE       LYS  36 -25.726 -26.337   1.507
  269   1HZ   LYS  36          2HZ       LYS  36 -25.722 -28.315  -0.344
  270   2HZ   LYS  36          1HZ       LYS  36 -24.401 -28.729   0.642
  271   3HZ   LYS  36          3HZ       LYS  36 -25.940 -28.531   1.327
  272    H    THR  37           H        THR  37 -20.484 -23.544  -2.835
  273    HA   THR  37           HA       THR  37 -21.514 -22.592  -5.271
  274    HB   THR  37           HB       THR  37 -19.900 -21.427  -3.660
  275    HG1  THR  37           HG1      THR  37 -19.276 -20.117  -5.271
  276   1HG2  THR  37          2HG2      THR  37 -18.261 -23.411  -3.837
  277   2HG2  THR  37          1HG2      THR  37 -17.769 -22.699  -5.373
  278   3HG2  THR  37          3HG2      THR  37 -17.576 -21.787  -3.876
  279    H    LEU  38           H        LEU  38 -19.250 -25.172  -4.655
  280    HA   LEU  38           HA       LEU  38 -18.088 -25.347  -7.267
  281   1HB   LEU  38          2HB       LEU  38 -18.603 -27.506  -5.200
  282   2HB   LEU  38          1HB       LEU  38 -17.599 -27.715  -6.634
  283    HG   LEU  38           HG       LEU  38 -17.130 -25.846  -4.299
  284   1HD1  LEU  38          1HD1      LEU  38 -15.778 -28.259  -5.480
  285   2HD1  LEU  38          3HD1      LEU  38 -14.831 -27.080  -4.571
  286   3HD1  LEU  38          2HD1      LEU  38 -16.172 -27.922  -3.794
  287   1HD2  LEU  38          3HD2      LEU  38 -15.819 -25.917  -7.031
  288   2HD2  LEU  38          2HD2      LEU  38 -16.654 -24.555  -6.282
  289   3HD2  LEU  38          1HD2      LEU  38 -15.111 -25.108  -5.632
  290    H    GLY  39           H        GLY  39 -21.101 -26.553  -5.904
  291   1HA   GLY  39          1HA       GLY  39 -22.303 -26.828  -8.509
  292   2HA   GLY  39          2HA       GLY  39 -23.013 -27.377  -6.992
  293    H    SER  40           H        SER  40 -20.105 -28.791  -6.893
  294    HA   SER  40           HA       SER  40 -21.177 -31.346  -7.882
  295   1HB   SER  40          2HB       SER  40 -20.206 -30.599  -9.932
  296   2HB   SER  40          1HB       SER  40 -18.775 -29.979  -9.109
  297    HG   SER  40           HG       SER  40 -19.490 -32.603  -9.738
  298    H    ILE  41           H        ILE  41 -20.691 -30.747  -5.274
  299    HA   ILE  41           HA       ILE  41 -18.273 -32.393  -4.708
  300    HB   ILE  41           HB       ILE  41 -17.943 -29.842  -4.348
  301   1HG1  ILE  41          2HG1      ILE  41 -16.922 -30.406  -1.982
  302   2HG1  ILE  41          1HG1      ILE  41 -17.383 -32.055  -2.403
  303   1HG2  ILE  41          3HG2      ILE  41 -20.295 -29.947  -3.049
  304   2HG2  ILE  41          2HG2      ILE  41 -19.219 -30.263  -1.687
  305   3HG2  ILE  41          1HG2      ILE  41 -19.041 -28.779  -2.625
  306   1HD1  ILE  41          1HD1      ILE  41 -16.207 -31.220  -4.728
  307   2HD1  ILE  41          3HD1      ILE  41 -15.254 -30.347  -3.530
  308   3HD1  ILE  41          2HD1      ILE  41 -15.365 -32.105  -3.457
  309    H    THR  42           H        THR  42 -18.441 -33.587  -2.690
  310    HA   THR  42           HA       THR  42 -21.276 -33.964  -1.850
  311    HB   THR  42           HB       THR  42 -20.829 -36.185  -1.743
  312    HG1  THR  42           HG1      THR  42 -19.372 -36.946  -0.348
  313   1HG2  THR  42          1HG2      THR  42 -19.508 -35.570  -3.782
  314   2HG2  THR  42          3HG2      THR  42 -18.070 -35.465  -2.765
  315   3HG2  THR  42          2HG2      THR  42 -18.898 -37.010  -2.966
  316    HA   PRO  43           HA       PRO  43 -20.463 -32.445   2.227
  317   1HB   PRO  43          2HB       PRO  43 -21.650 -34.271   3.832
  318   2HB   PRO  43          1HB       PRO  43 -22.566 -33.119   2.859
  319   1HG   PRO  43          2HG       PRO  43 -21.944 -35.996   2.306
  320   2HG   PRO  43          1HG       PRO  43 -23.465 -35.126   2.083
  321   1HD   PRO  43          1HD       PRO  43 -21.796 -35.647   0.020
  322   2HD   PRO  43          2HD       PRO  43 -22.782 -34.185   0.081
  323    H    ASP  44           H        ASP  44 -19.751 -35.852   1.630
  324    HA   ASP  44           HA       ASP  44 -18.092 -36.305   3.900
  325   1HB   ASP  44          2HB       ASP  44 -17.971 -37.556   1.140
  326   2HB   ASP  44          1HB       ASP  44 -17.162 -38.187   2.574
  327    H    GLU  45           H        GLU  45 -17.446 -34.673   0.843
  328    HA   GLU  45           HA       GLU  45 -14.548 -34.732   1.245
  329   1HB   GLU  45          2HB       GLU  45 -16.241 -33.053  -0.636
  330   2HB   GLU  45          1HB       GLU  45 -14.488 -33.234  -0.708
  331   1HG   GLU  45          2HG       GLU  45 -16.415 -35.565  -0.901
  332   2HG   GLU  45          1HG       GLU  45 -15.764 -34.725  -2.309
  333    H    VAL  46           H        VAL  46 -17.242 -32.526   1.776
  334    HA   VAL  46           HA       VAL  46 -15.679 -30.245   2.532
  335    HB   VAL  46           HB       VAL  46 -18.480 -31.095   3.320
  336   1HG1  VAL  46          3HG1      VAL  46 -16.990 -29.284   4.710
  337   2HG1  VAL  46          2HG1      VAL  46 -17.679 -28.245   3.464
  338   3HG1  VAL  46          1HG1      VAL  46 -18.740 -29.170   4.526
  339   1HG2  VAL  46          3HG2      VAL  46 -17.415 -30.196   0.900
  340   2HG2  VAL  46          2HG2      VAL  46 -19.121 -30.206   1.347
  341   3HG2  VAL  46          1HG2      VAL  46 -18.149 -28.759   1.612
  342    H    LYS  47           H        LYS  47 -16.945 -33.014   4.314
  343    HA   LYS  47           HA       LYS  47 -16.047 -32.062   6.908
  344   1HB   LYS  47          2HB       LYS  47 -16.868 -34.791   5.875
  345   2HB   LYS  47          1HB       LYS  47 -16.373 -34.514   7.545
  346   1HG   LYS  47          2HG       LYS  47 -18.156 -32.787   7.755
  347   2HG   LYS  47          1HG       LYS  47 -18.675 -33.153   6.109
  348   1HD   LYS  47          2HD       LYS  47 -20.105 -34.442   7.511
  349   2HD   LYS  47          1HD       LYS  47 -18.913 -35.587   6.897
  350   1HE   LYS  47          2HE       LYS  47 -18.256 -36.059   8.998
  351   2HE   LYS  47          1HE       LYS  47 -17.873 -34.361   9.276
  352   1HZ   LYS  47          3HZ       LYS  47 -20.530 -34.311   9.428
  353   2HZ   LYS  47          2HZ       LYS  47 -20.232 -35.876  10.019
  354   3HZ   LYS  47          1HZ       LYS  47 -19.521 -34.530  10.772
  355    H    HIS  48           H        HIS  48 -14.726 -34.104   4.355
  356    HA   HIS  48           HA       HIS  48 -12.392 -34.959   5.812
  357   1HB   HIS  48          2HB       HIS  48 -13.128 -36.127   3.783
  358   2HB   HIS  48          1HB       HIS  48 -12.853 -34.671   2.826
  359    HD1  HIS  48           HD1      HIS  48 -11.270 -37.727   3.357
  360    HD2  HIS  48           HD2      HIS  48  -9.884 -33.800   3.546
  361    HE1  HIS  48           HE1      HIS  48  -8.752 -37.843   3.103
  362    H    MET  49           H        MET  49 -13.120 -32.158   3.751
  363    HA   MET  49           HA       MET  49 -10.469 -31.139   3.553
  364   1HB   MET  49          2HB       MET  49 -13.217 -29.935   3.418
  365   2HB   MET  49          1HB       MET  49 -11.812 -28.874   3.477
  366   1HG   MET  49          2HG       MET  49 -10.920 -30.508   1.584
  367   2HG   MET  49          1HG       MET  49 -12.641 -30.808   1.348
  368   1HE   MET  49          3HE       MET  49 -13.094 -30.262  -0.493
  369   2HE   MET  49          2HE       MET  49 -13.861 -28.698  -0.755
  370   3HE   MET  49          1HE       MET  49 -12.309 -29.046  -1.511
  371    H    MET  50           H        MET  50 -13.049 -30.500   5.912
  372    HA   MET  50           HA       MET  50 -11.549 -28.733   7.568
  373   1HB   MET  50          2HB       MET  50 -13.868 -30.591   8.126
  374   2HB   MET  50          1HB       MET  50 -13.201 -29.515   9.350
  375   1HG   MET  50          2HG       MET  50 -13.501 -27.664   7.530
  376   2HG   MET  50          1HG       MET  50 -14.615 -28.814   6.789
  377   1HE   MET  50          2HE       MET  50 -13.384 -27.127   9.744
  378   2HE   MET  50          1HE       MET  50 -14.776 -26.503  10.625
  379   3HE   MET  50          3HE       MET  50 -14.189 -28.142  10.937
  380    H    ALA  51           H        ALA  51 -12.079 -32.244   7.778
  381    HA   ALA  51           HA       ALA  51 -10.511 -32.735  10.081
  382   1HB   ALA  51          1HB       ALA  51 -11.912 -34.481   9.115
  383   2HB   ALA  51          2HB       ALA  51 -10.241 -35.044   9.142
  384   3HB   ALA  51          3HB       ALA  51 -10.955 -34.474   7.634
  385    H    GLU  52           H        GLU  52  -9.574 -31.807   6.893
  386    HA   GLU  52           HA       GLU  52  -6.756 -32.623   7.399
  387   1HB   GLU  52          2HB       GLU  52  -8.302 -31.824   4.948
  388   2HB   GLU  52          1HB       GLU  52  -6.545 -31.673   4.961
  389   1HG   GLU  52          2HG       GLU  52  -6.552 -34.117   5.832
  390   2HG   GLU  52          1HG       GLU  52  -8.220 -34.163   5.264
  391    H    ILE  53           H        ILE  53  -8.796 -29.800   6.832
  392    HA   ILE  53           HA       ILE  53  -6.548 -27.937   6.952
  393    HB   ILE  53           HB       ILE  53  -9.538 -27.472   7.091
  394   1HG1  ILE  53          2HG1      ILE  53  -7.598 -27.191   4.779
  395   2HG1  ILE  53          1HG1      ILE  53  -8.711 -28.540   4.992
  396   1HG2  ILE  53          1HG2      ILE  53  -7.194 -25.592   6.705
  397   2HG2  ILE  53          3HG2      ILE  53  -8.876 -25.142   6.421
  398   3HG2  ILE  53          2HG2      ILE  53  -8.345 -25.592   8.041
  399   1HD1  ILE  53          3HD1      ILE  53 -10.595 -26.857   5.053
  400   2HD1  ILE  53          2HD1      ILE  53  -9.423 -25.626   4.581
  401   3HD1  ILE  53          1HD1      ILE  53  -9.770 -26.974   3.499
  402    H    ASP  54           H        ASP  54  -9.004 -29.186   9.151
  403    HA   ASP  54           HA       ASP  54  -8.685 -27.364  11.295
  404   1HB   ASP  54          2HB       ASP  54 -10.342 -29.370  10.893
  405   2HB   ASP  54          1HB       ASP  54  -9.117 -30.302  11.743
  406    H    THR  55           H        THR  55  -6.575 -26.848  11.850
  407    HA   THR  55           HA       THR  55  -4.422 -28.758  11.923
  408    HB   THR  55           HB       THR  55  -3.157 -26.951  13.028
  409    HG1  THR  55           HG1      THR  55  -4.199 -25.504  14.105
  410   1HG2  THR  55          3HG2      THR  55  -4.931 -26.230  10.693
  411   2HG2  THR  55          2HG2      THR  55  -3.654 -25.156  11.265
  412   3HG2  THR  55          1HG2      THR  55  -3.250 -26.763  10.660
  413    H    ASP  56           H        ASP  56  -6.337 -27.250  14.532
  414    HA   ASP  56           HA       ASP  56  -5.026 -29.003  16.505
  415   1HB   ASP  56          2HB       ASP  56  -6.104 -27.722  18.173
  416   2HB   ASP  56          1HB       ASP  56  -5.744 -26.551  16.906
  417    H    GLY  57           H        GLY  57  -8.167 -28.655  14.940
  418   1HA   GLY  57          1HA       GLY  57  -8.792 -31.425  15.826
  419   2HA   GLY  57          2HA       GLY  57  -9.533 -30.611  14.454
  420    H    ASP  58           H        ASP  58  -9.989 -28.119  16.118
  421    HA   ASP  58           HA       ASP  58 -11.796 -29.014  18.245
  422   1HB   ASP  58          2HB       ASP  58 -12.261 -26.669  18.609
  423   2HB   ASP  58          1HB       ASP  58 -10.529 -26.832  18.339
  424    H    GLY  59           H        GLY  59 -12.025 -29.010  14.943
  425   1HA   GLY  59          1HA       GLY  59 -14.992 -29.007  15.103
  426   2HA   GLY  59          2HA       GLY  59 -14.038 -29.775  13.836
  427    H    PHE  60           H        PHE  60 -12.746 -26.745  14.500
  428    HA   PHE  60           HA       PHE  60 -14.202 -25.619  12.158
  429   1HB   PHE  60          2HB       PHE  60 -13.409 -23.973  14.560
  430   2HB   PHE  60          1HB       PHE  60 -14.434 -23.493  13.208
  431    HD1  PHE  60           HD1      PHE  60 -16.685 -24.521  12.914
  432    HD2  PHE  60           HD2      PHE  60 -14.279 -25.239  16.397
  433    HE1  PHE  60           HE1      PHE  60 -18.678 -25.362  14.118
  434    HE2  PHE  60           HE2      PHE  60 -16.274 -26.076  17.603
  435    HZ   PHE  60           HZ       PHE  60 -18.477 -26.141  16.465
  436    H    ILE  61           H        ILE  61 -13.048 -23.991  10.969
  437    HA   ILE  61           HA       ILE  61 -10.100 -24.209  11.285
  438    HB   ILE  61           HB       ILE  61 -11.621 -23.289   8.839
  439   1HG1  ILE  61          2HG1      ILE  61 -12.320 -25.585   9.394
  440   2HG1  ILE  61          1HG1      ILE  61 -11.293 -25.580   7.961
  441   1HG2  ILE  61          1HG2      ILE  61  -8.802 -24.302   9.317
  442   2HG2  ILE  61          3HG2      ILE  61  -9.479 -23.951   7.727
  443   3HG2  ILE  61          2HG2      ILE  61  -9.268 -22.653   8.902
  444   1HD1  ILE  61          1HD1      ILE  61  -9.334 -26.007   9.583
  445   2HD1  ILE  61          3HD1      ILE  61 -10.570 -26.400  10.778
  446   3HD1  ILE  61          2HD1      ILE  61 -10.443 -27.350   9.297
  447    H    SER  62           H        SER  62  -9.036 -22.335  11.831
  448    HA   SER  62           HA       SER  62 -10.640 -19.849  12.001
  449   1HB   SER  62          2HB       SER  62  -7.868 -20.438  13.086
  450   2HB   SER  62          1HB       SER  62  -8.856 -19.025  13.453
  451    HG   SER  62           HG       SER  62  -9.166 -21.689  14.260
  452    H    PHE  63           H        PHE  63  -9.399 -17.805  11.359
  453    HA   PHE  63           HA       PHE  63  -8.680 -17.910   8.631
  454   1HB   PHE  63          2HB       PHE  63  -9.260 -15.796   9.782
  455   2HB   PHE  63          1HB       PHE  63  -7.749 -15.885  10.693
  456    HD1  PHE  63           HD1      PHE  63  -8.725 -16.445   7.113
  457    HD2  PHE  63           HD2      PHE  63  -6.131 -14.422   9.872
  458    HE1  PHE  63           HE1      PHE  63  -7.519 -15.405   5.214
  459    HE2  PHE  63           HE2      PHE  63  -4.922 -13.383   7.974
  460    HZ   PHE  63           HZ       PHE  63  -5.621 -13.873   5.643
  461    H    GLN  64           H        GLN  64  -6.652 -18.015  11.535
  462    HA   GLN  64           HA       GLN  64  -4.129 -18.052  10.217
  463   1HB   GLN  64          2HB       GLN  64  -4.543 -17.757  12.693
  464   2HB   GLN  64          1HB       GLN  64  -4.854 -19.490  12.784
  465   1HG   GLN  64          2HG       GLN  64  -2.531 -19.142  13.358
  466   2HG   GLN  64          1HG       GLN  64  -2.574 -19.861  11.748
  467   1HE2  GLN  64          1HE2      GLN  64  -1.152 -18.826  10.348
  468   2HE2  GLN  64          2HE2      GLN  64  -0.770 -17.172  10.385
  469    H    GLU  65           H        GLU  65  -6.235 -20.744  11.289
  470    HA   GLU  65           HA       GLU  65  -4.574 -22.853  10.344
  471   1HB   GLU  65          2HB       GLU  65  -7.525 -22.587  10.858
  472   2HB   GLU  65          1HB       GLU  65  -6.878 -24.060  10.151
  473   1HG   GLU  65          2HG       GLU  65  -5.354 -24.331  12.059
  474   2HG   GLU  65          1HG       GLU  65  -5.953 -22.830  12.764
  475    H    PHE  66           H        PHE  66  -7.261 -21.118   8.782
  476    HA   PHE  66           HA       PHE  66  -7.196 -22.519   6.309
  477   1HB   PHE  66          2HB       PHE  66  -8.985 -20.905   7.029
  478   2HB   PHE  66          1HB       PHE  66  -7.856 -19.588   6.711
  479    HD1  PHE  66           HD1      PHE  66  -9.899 -22.255   5.200
  480    HD2  PHE  66           HD2      PHE  66  -7.187 -19.012   4.436
  481    HE1  PHE  66           HE1      PHE  66 -10.504 -22.316   2.796
  482    HE2  PHE  66           HE2      PHE  66  -7.793 -19.074   2.031
  483    HZ   PHE  66           HZ       PHE  66  -9.451 -20.725   1.212
  484    H    THR  67           H        THR  67  -5.408 -19.680   7.435
  485    HA   THR  67           HA       THR  67  -4.071 -19.124   4.965
  486    HB   THR  67           HB       THR  67  -3.323 -18.563   7.847
  487    HG1  THR  67           HG1      THR  67  -4.817 -17.145   7.442
  488   1HG2  THR  67          3HG2      THR  67  -1.996 -17.621   5.289
  489   2HG2  THR  67          2HG2      THR  67  -1.660 -16.974   6.894
  490   3HG2  THR  67          1HG2      THR  67  -1.273 -18.655   6.521
  491    H    ASP  68           H        ASP  68  -3.105 -21.064   7.803
  492    HA   ASP  68           HA       ASP  68  -0.557 -21.857   6.835
  493   1HB   ASP  68          2HB       ASP  68  -2.519 -23.316   8.626
  494   2HB   ASP  68          1HB       ASP  68  -0.858 -23.845   8.352
  495    H    PHE  69           H        PHE  69  -3.774 -23.243   6.295
  496    HA   PHE  69           HA       PHE  69  -2.713 -25.429   4.674
  497   1HB   PHE  69          2HB       PHE  69  -4.692 -26.145   5.598
  498   2HB   PHE  69          1HB       PHE  69  -5.372 -24.523   5.651
  499    HD1  PHE  69           HD1      PHE  69  -6.102 -23.452   3.459
  500    HD2  PHE  69           HD2      PHE  69  -5.278 -27.641   3.866
  501    HE1  PHE  69           HE1      PHE  69  -7.392 -23.906   1.385
  502    HE2  PHE  69           HE2      PHE  69  -6.561 -28.100   1.797
  503    HZ   PHE  69           HZ       PHE  69  -7.622 -26.232   0.554
  504    H    GLY  70           H        GLY  70  -4.183 -22.262   4.149
  505   1HA   GLY  70          1HA       GLY  70  -4.308 -20.944   2.210
  506   2HA   GLY  70          2HA       GLY  70  -4.559 -22.453   1.330
  507    H    ARG  71           H        ARG  71  -1.713 -21.823   3.293
  508    HA   ARG  71           HA       ARG  71  -0.029 -20.928   1.118
  509   1HB   ARG  71          2HB       ARG  71   0.619 -22.124   3.827
  510   2HB   ARG  71          1HB       ARG  71   1.840 -21.506   2.714
  511   1HG   ARG  71          2HG       ARG  71   0.714 -19.296   2.733
  512   2HG   ARG  71          1HG       ARG  71  -0.464 -19.919   3.887
  513   1HD   ARG  71          2HD       ARG  71   2.531 -19.730   4.330
  514   2HD   ARG  71          1HD       ARG  71   1.310 -18.691   5.064
  515    HE   ARG  71           HE       ARG  71   0.861 -21.523   5.597
  516   1HH1  ARG  71          1HH1      ARG  71   0.386 -19.029   7.365
  517   2HH1  ARG  71          2HH1      ARG  71   1.523 -19.329   8.637
  518   1HH2  ARG  71          1HH2      ARG  71   3.257 -21.760   6.873
  519   2HH2  ARG  71          2HH2      ARG  71   3.148 -20.875   8.359
  520    H    ALA  72           H        ALA  72  -0.812 -24.062   2.527
  521    HA   ALA  72           HA       ALA  72   1.150 -25.478   0.875
  522   1HB   ALA  72          3HB       ALA  72  -0.642 -27.374   1.810
  523   2HB   ALA  72          1HB       ALA  72  -0.696 -26.129   3.058
  524   3HB   ALA  72          2HB       ALA  72   0.841 -26.880   2.627
  525    H    ASN  73           H        ASN  73  -1.769 -24.037   0.215
  526    HA   ASN  73           HA       ASN  73  -2.083 -25.647  -2.234
  527   1HB   ASN  73          2HB       ASN  73  -4.325 -25.208  -0.236
  528   2HB   ASN  73          1HB       ASN  73  -4.538 -25.872  -1.854
  529   1HD2  ASN  73          1HD2      ASN  73  -3.750 -26.669   1.403
  530   2HD2  ASN  73          2HD2      ASN  73  -3.277 -28.275   1.131
  531    H    ARG  74           H        ARG  74  -1.065 -23.101  -2.039
  532    HA   ARG  74           HA       ARG  74  -2.901 -20.953  -2.164
  533   1HB   ARG  74          2HB       ARG  74  -0.312 -21.323  -3.704
  534   2HB   ARG  74          1HB       ARG  74  -1.164 -19.790  -3.507
  535   1HG   ARG  74          2HG       ARG  74  -0.945 -20.051  -1.024
  536   2HG   ARG  74          1HG       ARG  74   0.037 -21.490  -1.302
  537   1HD   ARG  74          2HD       ARG  74   1.638 -20.121  -2.616
  538   2HD   ARG  74          1HD       ARG  74   0.670 -18.686  -2.274
  539    HE   ARG  74           HE       ARG  74   1.270 -19.828   0.223
  540   1HH1  ARG  74          1HH1      ARG  74   3.420 -19.562  -2.353
  541   2HH1  ARG  74          2HH1      ARG  74   4.560 -18.557  -1.523
  542   1HH2  ARG  74          1HH2      ARG  74   2.528 -18.084   1.247
  543   2HH2  ARG  74          2HH2      ARG  74   4.054 -17.720   0.515
  544    H    GLY  75           H        GLY  75  -1.633 -23.012  -4.767
  545   1HA   GLY  75          1HA       GLY  75  -2.578 -23.576  -6.831
  546   2HA   GLY  75          2HA       GLY  75  -3.047 -21.877  -6.923
  547    H    LEU  76           H        LEU  76  -4.168 -23.833  -4.266
  548    HA   LEU  76           HA       LEU  76  -6.693 -24.554  -5.552
  549   1HB   LEU  76          2HB       LEU  76  -5.735 -24.705  -2.683
  550   2HB   LEU  76          1HB       LEU  76  -7.308 -25.293  -3.222
  551    HG   LEU  76           HG       LEU  76  -6.097 -26.735  -4.901
  552   1HD1  LEU  76          2HD1      LEU  76  -3.774 -25.476  -3.491
  553   2HD1  LEU  76          1HD1      LEU  76  -3.622 -27.141  -4.052
  554   3HD1  LEU  76          3HD1      LEU  76  -3.973 -25.851  -5.202
  555   1HD2  LEU  76          1HD2      LEU  76  -6.164 -27.025  -1.983
  556   2HD2  LEU  76          3HD2      LEU  76  -6.620 -28.180  -3.236
  557   3HD2  LEU  76          2HD2      LEU  76  -4.933 -28.030  -2.748
  558    H    LEU  77           H        LEU  77  -5.648 -22.231  -3.078
  559    HA   LEU  77           HA       LEU  77  -8.223 -21.100  -2.587
  560   1HB   LEU  77          2HB       LEU  77  -5.459 -19.881  -2.355
  561   2HB   LEU  77          1HB       LEU  77  -6.928 -19.122  -1.742
  562    HG   LEU  77           HG       LEU  77  -5.689 -21.740  -0.862
  563   1HD1  LEU  77          1HD1      LEU  77  -6.337 -19.102   0.472
  564   2HD1  LEU  77          3HD1      LEU  77  -5.941 -20.558   1.385
  565   3HD1  LEU  77          2HD1      LEU  77  -4.754 -19.857   0.285
  566   1HD2  LEU  77          1HD2      LEU  77  -8.455 -20.614  -0.368
  567   2HD2  LEU  77          3HD2      LEU  77  -8.033 -22.204  -1.004
  568   3HD2  LEU  77          2HD2      LEU  77  -7.718 -21.820   0.688
  569    H    LYS  78           H        LYS  78  -5.753 -20.365  -5.015
  570    HA   LYS  78           HA       LYS  78  -7.002 -17.973  -6.003
  571   1HB   LYS  78          2HB       LYS  78  -5.131 -19.952  -7.335
  572   2HB   LYS  78          1HB       LYS  78  -5.604 -18.409  -8.046
  573   1HG   LYS  78          2HG       LYS  78  -4.768 -17.327  -5.879
  574   2HG   LYS  78          1HG       LYS  78  -4.031 -18.885  -5.506
  575   1HD   LYS  78          2HD       LYS  78  -3.521 -17.280  -8.030
  576   2HD   LYS  78          1HD       LYS  78  -2.436 -17.354  -6.643
  577   1HE   LYS  78          2HE       LYS  78  -2.135 -19.749  -6.945
  578   2HE   LYS  78          1HE       LYS  78  -3.337 -19.772  -8.235
  579   1HZ   LYS  78          1HZ       LYS  78  -1.136 -17.900  -8.555
  580   2HZ   LYS  78          3HZ       LYS  78  -0.737 -19.543  -8.682
  581   3HZ   LYS  78          2HZ       LYS  78  -1.914 -18.874  -9.710
  582    H    ASP  79           H        ASP  79  -7.704 -21.341  -6.408
  583    HA   ASP  79           HA       ASP  79  -9.225 -20.968  -8.886
  584   1HB   ASP  79          2HB       ASP  79  -8.084 -23.127  -8.285
  585   2HB   ASP  79          1HB       ASP  79  -9.253 -23.325  -6.980
  586    H    VAL  80           H        VAL  80  -9.888 -21.175  -5.428
  587    HA   VAL  80           HA       VAL  80 -12.783 -21.233  -5.786
  588    HB   VAL  80           HB       VAL  80 -11.199 -20.523  -3.303
  589   1HG1  VAL  80          1HG1      VAL  80 -13.849 -20.219  -3.707
  590   2HG1  VAL  80          3HG1      VAL  80 -13.825 -21.920  -3.241
  591   3HG1  VAL  80          2HG1      VAL  80 -13.176 -20.698  -2.149
  592   1HG2  VAL  80          3HG2      VAL  80 -12.008 -23.176  -4.500
  593   2HG2  VAL  80          2HG2      VAL  80 -10.415 -22.672  -3.939
  594   3HG2  VAL  80          1HG2      VAL  80 -11.698 -22.997  -2.773
  595    H    ALA  81           H        ALA  81 -10.324 -18.775  -5.238
  596    HA   ALA  81           HA       ALA  81 -11.889 -16.597  -4.446
  597   1HB   ALA  81          1HB       ALA  81  -9.686 -15.973  -4.516
  598   2HB   ALA  81          2HB       ALA  81 -10.159 -15.349  -6.096
  599   3HB   ALA  81          3HB       ALA  81  -9.360 -16.915  -5.971
  600    H    LYS  82           H        LYS  82 -11.280 -17.715  -7.777
  601    HA   LYS  82           HA       LYS  82 -12.832 -15.680  -9.050
  602   1HB   LYS  82          2HB       LYS  82 -12.280 -18.517  -9.972
  603   2HB   LYS  82          1HB       LYS  82 -12.848 -17.197 -10.995
  604   1HG   LYS  82          2HG       LYS  82 -10.789 -15.912 -10.416
  605   2HG   LYS  82          1HG       LYS  82 -10.213 -17.302  -9.495
  606   1HD   LYS  82          2HD       LYS  82 -10.302 -18.688 -11.542
  607   2HD   LYS  82          1HD       LYS  82 -10.862 -17.290 -12.459
  608   1HE   LYS  82          2HE       LYS  82  -8.562 -16.420 -11.083
  609   2HE   LYS  82          1HE       LYS  82  -8.159 -18.015 -11.717
  610   1HZ   LYS  82          1HZ       LYS  82  -9.123 -17.203 -13.881
  611   2HZ   LYS  82          3HZ       LYS  82  -9.106 -15.643 -13.214
  612   3HZ   LYS  82          2HZ       LYS  82  -7.651 -16.497 -13.412
  613    H    ILE  83           H        ILE  83 -13.716 -18.597  -7.381
  614    HA   ILE  83           HA       ILE  83 -16.317 -18.960  -8.536
  615    HB   ILE  83           HB       ILE  83 -15.432 -19.649  -5.725
  616   1HG1  ILE  83          2HG1      ILE  83 -15.004 -21.054  -8.370
  617   2HG1  ILE  83          1HG1      ILE  83 -13.785 -20.572  -7.194
  618   1HG2  ILE  83          3HG2      ILE  83 -17.872 -19.987  -7.163
  619   2HG2  ILE  83          2HG2      ILE  83 -17.130 -21.578  -6.990
  620   3HG2  ILE  83          1HG2      ILE  83 -17.463 -20.600  -5.560
  621   1HD1  ILE  83          1HD1      ILE  83 -15.302 -22.136  -5.610
  622   2HD1  ILE  83          3HD1      ILE  83 -15.629 -22.909  -7.161
  623   3HD1  ILE  83          2HD1      ILE  83 -13.972 -22.777  -6.574
  624    H    PHE  84           H        PHE  84 -15.240 -17.265  -5.599
  625    HA   PHE  84           HA       PHE  84 -17.951 -16.145  -5.237
  626   1HB   PHE  84          2HB       PHE  84 -15.406 -15.791  -3.623
  627   2HB   PHE  84          1HB       PHE  84 -16.983 -15.137  -3.179
  628    HD1  PHE  84           HD1      PHE  84 -15.014 -18.235  -3.641
  629    HD2  PHE  84           HD2      PHE  84 -18.749 -16.562  -2.336
  630    HE1  PHE  84           HE1      PHE  84 -15.618 -20.400  -2.594
  631    HE2  PHE  84           HE2      PHE  84 -19.354 -18.728  -1.289
  632    HZ   PHE  84           HZ       PHE  84 -17.788 -20.647  -1.419

  No H/Q in entry =         632
  Start of MODEL   17
    1    H1   ALA   1          1H        ALA   1  10.466 -16.490   1.786
    2    H2   ALA   1          3H        ALA   1  11.381 -15.524   2.836
    3    H3   ALA   1          2H        ALA   1  10.717 -16.986   3.391
    4    HA   ALA   1           HA       ALA   1   8.485 -16.119   3.124
    5   1HB   ALA   1          1HB       ALA   1  10.096 -14.062   4.635
    6   2HB   ALA   1          3HB       ALA   1   8.512 -14.726   5.034
    7   3HB   ALA   1          2HB       ALA   1   9.956 -15.721   5.219
    8    H    ASP   2           H        ASP   2   9.016 -15.416   0.651
    9    HA   ASP   2           HA       ASP   2   9.242 -12.489   0.387
   10   1HB   ASP   2          2HB       ASP   2   9.173 -12.919  -2.022
   11   2HB   ASP   2          1HB       ASP   2  10.327 -14.014  -1.262
   12    H    ASP   3           H        ASP   3   6.848 -14.160   1.555
   13    HA   ASP   3           HA       ASP   3   4.623 -13.619  -0.199
   14   1HB   ASP   3          2HB       ASP   3   4.801 -14.194   2.768
   15   2HB   ASP   3          1HB       ASP   3   3.268 -13.976   1.925
   16    H    HIS   4           H        HIS   4   3.125 -11.899  -0.113
   17    HA   HIS   4           HA       HIS   4   4.102  -9.474   1.340
   18   1HB   HIS   4          2HB       HIS   4   3.561  -9.832  -1.355
   19   2HB   HIS   4          1HB       HIS   4   2.075  -9.097  -0.755
   20    HD1  HIS   4           HD1      HIS   4   2.116  -6.619  -0.612
   21    HD2  HIS   4           HD2      HIS   4   5.960  -8.222  -0.419
   22    HE1  HIS   4           HE1      HIS   4   3.706  -4.653  -0.539
   23    HA   PRO   5           HA       PRO   5   0.404  -9.508   3.825
   24   1HB   PRO   5          2HB       PRO   5  -0.135  -6.855   4.002
   25   2HB   PRO   5          1HB       PRO   5   1.162  -7.637   4.912
   26   1HG   PRO   5          2HG       PRO   5   1.308  -6.108   2.331
   27   2HG   PRO   5          1HG       PRO   5   2.349  -5.977   3.754
   28   1HD   PRO   5          1HD       PRO   5   3.139  -7.376   1.621
   29   2HD   PRO   5          2HD       PRO   5   3.497  -7.949   3.250
   30    H    GLN   6           H        GLN   6   0.533  -8.026   0.711
   31    HA   GLN   6           HA       GLN   6  -2.185  -7.291   0.332
   32   1HB   GLN   6          2HB       GLN   6   0.107  -8.045  -1.435
   33   2HB   GLN   6          1HB       GLN   6  -1.509  -8.031  -2.148
   34   1HG   GLN   6          2HG       GLN   6  -1.844  -5.722  -1.508
   35   2HG   GLN   6          1HG       GLN   6  -0.348  -5.716  -0.574
   36   1HE2  GLN   6          1HE2      GLN   6   1.452  -6.944  -2.327
   37   2HE2  GLN   6          2HE2      GLN   6   1.602  -6.021  -3.744
   38    H    ASP   7           H        ASP   7  -0.507 -10.385  -0.038
   39    HA   ASP   7           HA       ASP   7  -2.641 -11.854  -1.211
   40   1HB   ASP   7          2HB       ASP   7  -0.410 -12.746   0.635
   41   2HB   ASP   7          1HB       ASP   7  -1.489 -13.855  -0.210
   42    H    LYS   8           H        LYS   8  -1.830 -11.239   2.190
   43    HA   LYS   8           HA       LYS   8  -3.741 -12.886   3.427
   44   1HB   LYS   8          2HB       LYS   8  -2.479 -10.266   4.152
   45   2HB   LYS   8          1HB       LYS   8  -3.816 -10.864   5.135
   46   1HG   LYS   8          2HG       LYS   8  -2.465 -13.118   5.092
   47   2HG   LYS   8          1HG       LYS   8  -1.102 -12.073   4.693
   48   1HD   LYS   8          2HD       LYS   8  -1.686 -10.673   6.708
   49   2HD   LYS   8          1HD       LYS   8  -2.880 -11.897   7.142
   50   1HE   LYS   8          2HE       LYS   8  -1.290 -13.265   7.980
   51   2HE   LYS   8          1HE       LYS   8  -0.293 -13.092   6.536
   52   1HZ   LYS   8          1HZ       LYS   8  -0.462 -11.050   8.681
   53   2HZ   LYS   8          3HZ       LYS   8   0.747 -12.237   8.603
   54   3HZ   LYS   8          2HZ       LYS   8   0.617 -11.075   7.370
   55    H    ALA   9           H        ALA   9  -4.144  -9.710   1.935
   56    HA   ALA   9           HA       ALA   9  -6.806  -9.193   2.777
   57   1HB   ALA   9          1HB       ALA   9  -5.495  -8.490   0.132
   58   2HB   ALA   9          3HB       ALA   9  -6.969  -7.759   0.766
   59   3HB   ALA   9          2HB       ALA   9  -5.435  -7.512   1.598
   60    H    GLU  10           H        GLU  10  -5.572 -10.957  -0.044
   61    HA   GLU  10           HA       GLU  10  -8.165 -11.645  -1.085
   62   1HB   GLU  10          2HB       GLU  10  -5.583 -13.199  -1.413
   63   2HB   GLU  10          1HB       GLU  10  -6.984 -13.234  -2.484
   64   1HG   GLU  10          2HG       GLU  10  -6.641 -10.778  -2.899
   65   2HG   GLU  10          1HG       GLU  10  -5.147 -10.877  -1.968
   66    H    ARG  11           H        ARG  11  -5.866 -13.370   1.006
   67    HA   ARG  11           HA       ARG  11  -7.461 -15.722   1.349
   68   1HB   ARG  11          2HB       ARG  11  -5.324 -14.434   3.060
   69   2HB   ARG  11          1HB       ARG  11  -6.070 -15.978   3.465
   70   1HG   ARG  11          2HG       ARG  11  -5.438 -16.682   1.051
   71   2HG   ARG  11          1HG       ARG  11  -4.365 -15.281   1.075
   72   1HD   ARG  11          2HD       ARG  11  -3.721 -16.396   3.457
   73   2HD   ARG  11          1HD       ARG  11  -4.169 -17.844   2.558
   74    HE   ARG  11           HE       ARG  11  -2.065 -15.929   1.631
   75   1HH1  ARG  11          1HH1      ARG  11  -1.262 -18.443   3.081
   76   2HH1  ARG  11          2HH1      ARG  11  -0.947 -19.526   1.767
   77   1HH2  ARG  11          1HH2      ARG  11  -2.614 -17.589  -0.577
   78   2HH2  ARG  11          2HH2      ARG  11  -1.712 -19.043  -0.304
   79    H    GLU  12           H        GLU  12  -7.285 -12.666   3.113
   80    HA   GLU  12           HA       GLU  12  -9.069 -13.413   5.234
   81   1HB   GLU  12          2HB       GLU  12  -7.974 -10.865   4.143
   82   2HB   GLU  12          1HB       GLU  12  -9.439 -10.752   5.120
   83   1HG   GLU  12          2HG       GLU  12  -8.206 -12.232   6.828
   84   2HG   GLU  12          1HG       GLU  12  -6.743 -11.863   5.913
   85    H    ARG  13           H        ARG  13  -9.573 -11.891   2.071
   86    HA   ARG  13           HA       ARG  13 -12.401 -11.474   2.414
   87   1HB   ARG  13          2HB       ARG  13 -10.608 -11.674  -0.011
   88   2HB   ARG  13          1HB       ARG  13 -12.349 -11.443  -0.163
   89   1HG   ARG  13          2HG       ARG  13 -12.284  -9.345   0.921
   90   2HG   ARG  13          1HG       ARG  13 -10.692  -9.655   1.615
   91   1HD   ARG  13          2HD       ARG  13  -9.899  -8.444  -0.134
   92   2HD   ARG  13          1HD       ARG  13 -10.213  -9.891  -1.093
   93    HE   ARG  13           HE       ARG  13 -12.541  -8.143  -0.824
   94   1HH1  ARG  13          1HH1      ARG  13 -10.263  -6.541  -2.047
   95   2HH1  ARG  13          2HH1      ARG  13 -10.515  -6.829  -3.736
   96   1HH2  ARG  13          1HH2      ARG  13 -12.619  -9.539  -3.231
   97   2HH2  ARG  13          2HH2      ARG  13 -11.849  -8.526  -4.407
   98    H    ILE  14           H        ILE  14 -10.466 -14.116   1.063
   99    HA   ILE  14           HA       ILE  14 -12.736 -15.694   0.223
  100    HB   ILE  14           HB       ILE  14  -9.932 -16.610   0.933
  101   1HG1  ILE  14          2HG1      ILE  14 -10.926 -16.055  -1.848
  102   2HG1  ILE  14          1HG1      ILE  14 -10.310 -14.734  -0.860
  103   1HG2  ILE  14          3HG2      ILE  14 -12.320 -17.981   0.072
  104   2HG2  ILE  14          2HG2      ILE  14 -11.083 -18.100  -1.180
  105   3HG2  ILE  14          1HG2      ILE  14 -10.738 -18.658   0.457
  106   1HD1  ILE  14          1HD1      ILE  14  -8.436 -16.775  -0.513
  107   2HD1  ILE  14          3HD1      ILE  14  -8.847 -16.855  -2.226
  108   3HD1  ILE  14          2HD1      ILE  14  -8.243 -15.350  -1.533
  109    H    PHE  15           H        PHE  15 -10.635 -15.737   3.108
  110    HA   PHE  15           HA       PHE  15 -12.020 -17.901   4.394
  111   1HB   PHE  15          2HB       PHE  15  -9.752 -17.154   5.078
  112   2HB   PHE  15          1HB       PHE  15 -10.442 -15.641   5.670
  113    HD1  PHE  15           HD1      PHE  15 -11.926 -15.625   7.646
  114    HD2  PHE  15           HD2      PHE  15 -10.111 -19.255   6.240
  115    HE1  PHE  15           HE1      PHE  15 -12.509 -16.746   9.783
  116    HE2  PHE  15           HE2      PHE  15 -10.690 -20.375   8.375
  117    HZ   PHE  15           HZ       PHE  15 -11.893 -19.124  10.146
  118    H    LYS  16           H        LYS  16 -12.473 -14.401   4.371
  119    HA   LYS  16           HA       LYS  16 -14.418 -14.293   6.474
  120   1HB   LYS  16          2HB       LYS  16 -13.711 -12.516   4.154
  121   2HB   LYS  16          1HB       LYS  16 -15.160 -12.178   5.103
  122   1HG   LYS  16          2HG       LYS  16 -13.700 -12.281   7.174
  123   2HG   LYS  16          1HG       LYS  16 -12.304 -12.334   6.099
  124   1HD   LYS  16          2HD       LYS  16 -13.077 -10.201   5.055
  125   2HD   LYS  16          1HD       LYS  16 -14.387 -10.133   6.236
  126   1HE   LYS  16          2HE       LYS  16 -13.007  -9.346   7.841
  127   2HE   LYS  16          1HE       LYS  16 -11.806 -10.596   7.511
  128   1HZ   LYS  16          1HZ       LYS  16 -11.490  -9.075   5.373
  129   2HZ   LYS  16          3HZ       LYS  16 -12.002  -7.886   6.469
  130   3HZ   LYS  16          2HZ       LYS  16 -10.628  -8.823   6.815
  131    H    ARG  17           H        ARG  17 -14.622 -15.079   3.055
  132    HA   ARG  17           HA       ARG  17 -17.518 -14.954   2.925
  133   1HB   ARG  17          2HB       ARG  17 -15.418 -16.241   1.165
  134   2HB   ARG  17          1HB       ARG  17 -17.144 -16.339   0.813
  135   1HG   ARG  17          2HG       ARG  17 -17.174 -13.785   1.008
  136   2HG   ARG  17          1HG       ARG  17 -15.414 -13.863   0.966
  137   1HD   ARG  17          2HD       ARG  17 -15.942 -15.429  -1.153
  138   2HD   ARG  17          1HD       ARG  17 -17.390 -14.422  -1.195
  139    HE   ARG  17           HE       ARG  17 -15.144 -12.710  -0.882
  140   1HH1  ARG  17          1HH1      ARG  17 -17.424 -13.013  -3.063
  141   2HH1  ARG  17          2HH1      ARG  17 -16.438 -13.022  -4.486
  142   1HH2  ARG  17          1HH2      ARG  17 -13.478 -13.531  -2.753
  143   2HH2  ARG  17          2HH2      ARG  17 -14.203 -13.313  -4.311
  144    H    PHE  18           H        PHE  18 -15.136 -17.428   3.707
  145    HA   PHE  18           HA       PHE  18 -17.010 -19.634   3.679
  146   1HB   PHE  18          2HB       PHE  18 -14.252 -19.220   4.818
  147   2HB   PHE  18          1HB       PHE  18 -15.165 -20.684   5.184
  148    HD1  PHE  18           HD1      PHE  18 -16.181 -21.969   3.160
  149    HD2  PHE  18           HD2      PHE  18 -13.028 -19.072   2.819
  150    HE1  PHE  18           HE1      PHE  18 -15.547 -22.917   0.958
  151    HE2  PHE  18           HE2      PHE  18 -12.395 -20.021   0.617
  152    HZ   PHE  18           HZ       PHE  18 -13.654 -21.944  -0.314
  153    H    ASP  19           H        ASP  19 -15.691 -17.556   6.250
  154    HA   ASP  19           HA       ASP  19 -17.100 -18.821   8.400
  155   1HB   ASP  19          2HB       ASP  19 -15.178 -17.039   8.456
  156   2HB   ASP  19          1HB       ASP  19 -16.497 -15.868   8.384
  157    H    ALA  20           H        ALA  20 -19.304 -19.116   8.118
  158    HA   ALA  20           HA       ALA  20 -21.015 -17.319   6.717
  159   1HB   ALA  20          3HB       ALA  20 -21.356 -19.813   7.436
  160   2HB   ALA  20          2HB       ALA  20 -22.034 -19.107   8.903
  161   3HB   ALA  20          1HB       ALA  20 -22.755 -18.744   7.335
  162    H    ASN  21           H        ASN  21 -20.658 -17.775  10.282
  163    HA   ASN  21           HA       ASN  21 -22.291 -15.349  10.664
  164   1HB   ASN  21          2HB       ASN  21 -22.208 -15.850  13.032
  165   2HB   ASN  21          1HB       ASN  21 -22.578 -17.332  12.157
  166   1HD2  ASN  21          1HD2      ASN  21 -21.297 -17.002  14.824
  167   2HD2  ASN  21          2HD2      ASN  21 -19.804 -17.796  14.720
  168    H    GLY  22           H        GLY  22 -18.963 -16.252  10.558
  169   1HA   GLY  22          1HA       GLY  22 -18.206 -13.432  10.818
  170   2HA   GLY  22          2HA       GLY  22 -17.120 -14.758  10.415
  171    H    ASP  23           H        ASP  23 -17.596 -16.438  12.634
  172    HA   ASP  23           HA       ASP  23 -16.951 -14.726  14.978
  173   1HB   ASP  23          2HB       ASP  23 -17.278 -16.753  16.335
  174   2HB   ASP  23          1HB       ASP  23 -18.686 -16.438  15.327
  175    H    GLY  24           H        GLY  24 -15.270 -15.965  12.525
  176   1HA   GLY  24          1HA       GLY  24 -12.831 -16.215  14.185
  177   2HA   GLY  24          2HA       GLY  24 -12.866 -15.945  12.445
  178    H    LYS  25           H        LYS  25 -15.051 -18.391  13.360
  179    HA   LYS  25           HA       LYS  25 -13.041 -20.444  12.547
  180   1HB   LYS  25          2HB       LYS  25 -13.896 -21.988  14.162
  181   2HB   LYS  25          1HB       LYS  25 -13.658 -20.470  15.026
  182   1HG   LYS  25          2HG       LYS  25 -16.009 -19.946  14.880
  183   2HG   LYS  25          1HG       LYS  25 -16.300 -21.312  13.804
  184   1HD   LYS  25          2HD       LYS  25 -15.444 -22.812  15.679
  185   2HD   LYS  25          1HD       LYS  25 -15.520 -21.395  16.727
  186   1HE   LYS  25          2HE       LYS  25 -17.588 -22.875  16.766
  187   2HE   LYS  25          1HE       LYS  25 -17.889 -21.176  16.402
  188   1HZ   LYS  25          1HZ       LYS  25 -17.323 -22.858  14.112
  189   2HZ   LYS  25          3HZ       LYS  25 -18.780 -23.199  14.911
  190   3HZ   LYS  25          2HZ       LYS  25 -18.490 -21.637  14.306
  191    H    ILE  26           H        ILE  26 -13.759 -21.977  11.105
  192    HA   ILE  26           HA       ILE  26 -16.551 -21.630  10.092
  193    HB   ILE  26           HB       ILE  26 -14.303 -22.852   8.502
  194   1HG1  ILE  26          2HG1      ILE  26 -14.975 -19.910   8.807
  195   2HG1  ILE  26          1HG1      ILE  26 -13.445 -20.690   9.211
  196   1HG2  ILE  26          2HG2      ILE  26 -16.646 -23.068   7.713
  197   2HG2  ILE  26          1HG2      ILE  26 -16.806 -21.312   7.746
  198   3HG2  ILE  26          3HG2      ILE  26 -15.682 -22.074   6.622
  199   1HD1  ILE  26          1HD1      ILE  26 -14.067 -21.382   6.520
  200   2HD1  ILE  26          3HD1      ILE  26 -14.295 -19.641   6.680
  201   3HD1  ILE  26          2HD1      ILE  26 -12.743 -20.370   7.097
  202    H    SER  27           H        SER  27 -17.844 -23.413  10.089
  203    HA   SER  27           HA       SER  27 -16.625 -25.975  11.014
  204   1HB   SER  27          2HB       SER  27 -18.697 -26.509  12.025
  205   2HB   SER  27          1HB       SER  27 -18.504 -24.785  12.350
  206    HG   SER  27           HG       SER  27 -20.207 -26.093  10.562
  207    H    ALA  28           H        ALA  28 -17.872 -27.955  10.110
  208    HA   ALA  28           HA       ALA  28 -17.612 -28.083   7.325
  209   1HB   ALA  28          1HB       ALA  28 -19.155 -29.685   9.332
  210   2HB   ALA  28          2HB       ALA  28 -17.831 -30.189   8.281
  211   3HB   ALA  28          3HB       ALA  28 -19.451 -29.974   7.617
  212    H    ALA  29           H        ALA  29 -20.570 -27.464   9.215
  213    HA   ALA  29           HA       ALA  29 -22.345 -27.177   7.042
  214   1HB   ALA  29          2HB       ALA  29 -23.283 -27.231   9.233
  215   2HB   ALA  29          1HB       ALA  29 -22.285 -25.880   9.770
  216   3HB   ALA  29          3HB       ALA  29 -23.601 -25.605   8.628
  217    H    GLU  30           H        GLU  30 -20.073 -24.849   8.443
  218    HA   GLU  30           HA       GLU  30 -21.038 -22.679   6.746
  219   1HB   GLU  30          2HB       GLU  30 -18.520 -22.934   8.417
  220   2HB   GLU  30          1HB       GLU  30 -19.051 -21.455   7.617
  221   1HG   GLU  30          2HG       GLU  30 -21.180 -21.559   8.910
  222   2HG   GLU  30          1HG       GLU  30 -20.571 -22.981   9.756
  223    H    LEU  31           H        LEU  31 -18.022 -24.601   6.851
  224    HA   LEU  31           HA       LEU  31 -16.973 -23.573   4.402
  225   1HB   LEU  31          2HB       LEU  31 -15.773 -24.974   6.198
  226   2HB   LEU  31          1HB       LEU  31 -16.510 -26.379   5.433
  227    HG   LEU  31           HG       LEU  31 -14.786 -24.343   3.988
  228   1HD1  LEU  31          1HD1      LEU  31 -13.635 -25.815   5.743
  229   2HD1  LEU  31          3HD1      LEU  31 -14.054 -27.187   4.717
  230   3HD1  LEU  31          2HD1      LEU  31 -12.995 -25.917   4.104
  231   1HD2  LEU  31          1HD2      LEU  31 -16.358 -26.742   3.190
  232   2HD2  LEU  31          3HD2      LEU  31 -15.981 -25.287   2.267
  233   3HD2  LEU  31          2HD2      LEU  31 -14.768 -26.555   2.449
  234    H    GLY  32           H        GLY  32 -19.016 -26.389   5.111
  235   1HA   GLY  32          1HA       GLY  32 -20.318 -27.722   3.683
  236   2HA   GLY  32          2HA       GLY  32 -19.125 -27.384   2.431
  237    H    GLU  33           H        GLU  33 -21.253 -25.166   4.230
  238    HA   GLU  33           HA       GLU  33 -23.174 -24.742   2.204
  239   1HB   GLU  33          2HB       GLU  33 -22.219 -23.246   4.580
  240   2HB   GLU  33          1HB       GLU  33 -23.055 -22.287   3.358
  241   1HG   GLU  33          2HG       GLU  33 -24.893 -24.041   3.400
  242   2HG   GLU  33          1HG       GLU  33 -24.099 -24.726   4.818
  243    H    ALA  34           H        ALA  34 -20.059 -23.113   2.756
  244    HA   ALA  34           HA       ALA  34 -20.380 -21.344   0.479
  245   1HB   ALA  34          3HB       ALA  34 -18.282 -20.525   1.041
  246   2HB   ALA  34          2HB       ALA  34 -18.751 -21.231   2.588
  247   3HB   ALA  34          1HB       ALA  34 -17.675 -22.114   1.507
  248    H    LEU  35           H        LEU  35 -18.806 -24.447   1.087
  249    HA   LEU  35           HA       LEU  35 -17.514 -24.751  -1.420
  250   1HB   LEU  35          2HB       LEU  35 -18.197 -26.439   0.841
  251   2HB   LEU  35          1HB       LEU  35 -18.389 -27.311  -0.681
  252    HG   LEU  35           HG       LEU  35 -15.920 -25.723   0.080
  253   1HD1  LEU  35          2HD1      LEU  35 -16.313 -27.753   1.506
  254   2HD1  LEU  35          1HD1      LEU  35 -16.315 -28.728   0.037
  255   3HD1  LEU  35          3HD1      LEU  35 -14.856 -27.862   0.517
  256   1HD2  LEU  35          1HD2      LEU  35 -16.651 -26.198  -2.400
  257   2HD2  LEU  35          3HD2      LEU  35 -14.979 -26.486  -1.920
  258   3HD2  LEU  35          2HD2      LEU  35 -16.105 -27.838  -2.049
  259    H    LYS  36           H        LYS  36 -20.881 -25.300  -0.466
  260    HA   LYS  36           HA       LYS  36 -21.869 -26.834  -2.540
  261   1HB   LYS  36          2HB       LYS  36 -22.937 -24.833  -0.749
  262   2HB   LYS  36          1HB       LYS  36 -23.683 -24.677  -2.341
  263   1HG   LYS  36          2HG       LYS  36 -24.326 -27.015  -2.332
  264   2HG   LYS  36          1HG       LYS  36 -23.431 -27.298  -0.838
  265   1HD   LYS  36          2HD       LYS  36 -25.154 -25.130  -0.300
  266   2HD   LYS  36          1HD       LYS  36 -26.128 -26.309  -1.178
  267   1HE   LYS  36          2HE       LYS  36 -24.353 -27.096   1.141
  268   2HE   LYS  36          1HE       LYS  36 -26.029 -26.593   1.369
  269   1HZ   LYS  36          3HZ       LYS  36 -26.241 -28.375  -0.628
  270   2HZ   LYS  36          2HZ       LYS  36 -24.972 -29.047   0.279
  271   3HZ   LYS  36          1HZ       LYS  36 -26.473 -28.740   1.013
  272    H    THR  37           H        THR  37 -20.567 -23.598  -2.749
  273    HA   THR  37           HA       THR  37 -21.645 -22.642  -5.136
  274    HB   THR  37           HB       THR  37 -19.881 -21.542  -3.641
  275    HG1  THR  37           HG1      THR  37 -19.764 -20.226  -5.252
  276   1HG2  THR  37          3HG2      THR  37 -18.057 -23.209  -5.397
  277   2HG2  THR  37          2HG2      THR  37 -17.534 -21.944  -4.285
  278   3HG2  THR  37          1HG2      THR  37 -18.280 -23.415  -3.660
  279    H    LEU  38           H        LEU  38 -19.543 -25.351  -4.620
  280    HA   LEU  38           HA       LEU  38 -18.529 -25.604  -7.301
  281   1HB   LEU  38          2HB       LEU  38 -18.943 -27.595  -5.061
  282   2HB   LEU  38          1HB       LEU  38 -18.245 -28.054  -6.614
  283    HG   LEU  38           HG       LEU  38 -17.166 -26.006  -4.657
  284   1HD1  LEU  38          2HD1      LEU  38 -16.718 -28.803  -5.076
  285   2HD1  LEU  38          1HD1      LEU  38 -15.262 -27.933  -5.557
  286   3HD1  LEU  38          3HD1      LEU  38 -15.914 -27.730  -3.931
  287   1HD2  LEU  38          3HD2      LEU  38 -16.454 -26.615  -7.527
  288   2HD2  LEU  38          2HD2      LEU  38 -16.761 -25.045  -6.784
  289   3HD2  LEU  38          1HD2      LEU  38 -15.274 -25.921  -6.414
  290    H    GLY  39           H        GLY  39 -21.523 -26.565  -5.735
  291   1HA   GLY  39          1HA       GLY  39 -22.904 -26.850  -8.234
  292   2HA   GLY  39          2HA       GLY  39 -23.529 -27.353  -6.664
  293    H    SER  40           H        SER  40 -20.725 -28.910  -6.675
  294    HA   SER  40           HA       SER  40 -21.947 -31.415  -7.592
  295   1HB   SER  40          2HB       SER  40 -21.067 -30.773  -9.703
  296   2HB   SER  40          1HB       SER  40 -19.591 -30.135  -8.978
  297    HG   SER  40           HG       SER  40 -18.792 -32.032  -9.295
  298    H    ILE  41           H        ILE  41 -21.268 -30.761  -5.022
  299    HA   ILE  41           HA       ILE  41 -18.942 -32.559  -4.562
  300    HB   ILE  41           HB       ILE  41 -18.419 -30.007  -4.327
  301   1HG1  ILE  41          2HG1      ILE  41 -17.813 -31.783  -1.953
  302   2HG1  ILE  41          1HG1      ILE  41 -17.046 -31.997  -3.525
  303   1HG2  ILE  41          2HG2      ILE  41 -20.602 -29.933  -2.771
  304   2HG2  ILE  41          1HG2      ILE  41 -19.411 -30.331  -1.531
  305   3HG2  ILE  41          3HG2      ILE  41 -19.227 -28.864  -2.495
  306   1HD1  ILE  41          1HD1      ILE  41 -16.653 -29.347  -3.203
  307   2HD1  ILE  41          3HD1      ILE  41 -16.678 -29.840  -1.510
  308   3HD1  ILE  41          2HD1      ILE  41 -15.508 -30.554  -2.618
  309    H    THR  42           H        THR  42 -18.923 -33.259  -2.174
  310    HA   THR  42           HA       THR  42 -21.740 -33.503  -1.190
  311    HB   THR  42           HB       THR  42 -21.552 -35.762  -1.106
  312    HG1  THR  42           HG1      THR  42 -19.560 -36.703  -0.242
  313   1HG2  THR  42          2HG2      THR  42 -20.463 -35.324  -3.303
  314   2HG2  THR  42          1HG2      THR  42 -18.895 -35.335  -2.496
  315   3HG2  THR  42          3HG2      THR  42 -19.872 -36.802  -2.543
  316    HA   PRO  43           HA       PRO  43 -20.308 -32.141   2.774
  317   1HB   PRO  43          2HB       PRO  43 -21.521 -33.834   4.501
  318   2HB   PRO  43          1HB       PRO  43 -22.397 -32.573   3.629
  319   1HG   PRO  43          2HG       PRO  43 -22.179 -35.498   3.023
  320   2HG   PRO  43          1HG       PRO  43 -23.601 -34.452   2.958
  321   1HD   PRO  43          1HD       PRO  43 -22.227 -35.152   0.735
  322   2HD   PRO  43          2HD       PRO  43 -23.032 -33.590   0.889
  323    H    ASP  44           H        ASP  44 -20.064 -35.602   2.114
  324    HA   ASP  44           HA       ASP  44 -18.246 -36.282   4.195
  325   1HB   ASP  44          2HB       ASP  44 -18.596 -37.464   1.427
  326   2HB   ASP  44          1HB       ASP  44 -17.632 -38.202   2.706
  327    H    GLU  45           H        GLU  45 -17.719 -34.701   1.083
  328    HA   GLU  45           HA       GLU  45 -14.814 -35.044   1.241
  329   1HB   GLU  45          2HB       GLU  45 -16.506 -33.244  -0.525
  330   2HB   GLU  45          1HB       GLU  45 -14.782 -33.551  -0.729
  331   1HG   GLU  45          2HG       GLU  45 -15.326 -36.004  -0.947
  332   2HG   GLU  45          1HG       GLU  45 -17.034 -35.566  -0.954
  333    H    VAL  46           H        VAL  46 -17.233 -32.585   1.937
  334    HA   VAL  46           HA       VAL  46 -15.408 -30.454   2.537
  335    HB   VAL  46           HB       VAL  46 -18.223 -31.034   3.491
  336   1HG1  VAL  46          2HG1      VAL  46 -16.986 -29.602   5.107
  337   2HG1  VAL  46          1HG1      VAL  46 -16.594 -28.493   3.794
  338   3HG1  VAL  46          3HG1      VAL  46 -18.272 -28.716   4.286
  339   1HG2  VAL  46          2HG2      VAL  46 -17.122 -30.077   1.051
  340   2HG2  VAL  46          1HG2      VAL  46 -18.824 -30.162   1.504
  341   3HG2  VAL  46          3HG2      VAL  46 -17.893 -28.702   1.843
  342    H    LYS  47           H        LYS  47 -16.723 -33.124   4.406
  343    HA   LYS  47           HA       LYS  47 -15.737 -32.213   6.967
  344   1HB   LYS  47          2HB       LYS  47 -16.590 -34.917   5.918
  345   2HB   LYS  47          1HB       LYS  47 -15.998 -34.699   7.564
  346   1HG   LYS  47          2HG       LYS  47 -17.756 -33.001   7.962
  347   2HG   LYS  47          1HG       LYS  47 -18.356 -33.248   6.322
  348   1HD   LYS  47          2HD       LYS  47 -19.734 -34.595   7.747
  349   2HD   LYS  47          1HD       LYS  47 -18.635 -35.707   6.930
  350   1HE   LYS  47          2HE       LYS  47 -18.109 -36.454   9.004
  351   2HE   LYS  47          1HE       LYS  47 -17.197 -34.954   9.175
  352   1HZ   LYS  47          3HZ       LYS  47 -20.081 -35.189   9.822
  353   2HZ   LYS  47          2HZ       LYS  47 -18.849 -35.401  10.971
  354   3HZ   LYS  47          1HZ       LYS  47 -19.039 -33.903  10.193
  355    H    HIS  48           H        HIS  48 -14.434 -34.269   4.403
  356    HA   HIS  48           HA       HIS  48 -12.063 -35.049   5.847
  357   1HB   HIS  48          2HB       HIS  48 -12.836 -36.278   3.855
  358   2HB   HIS  48          1HB       HIS  48 -12.542 -34.853   2.858
  359    HD1  HIS  48           HD1      HIS  48 -10.607 -35.779   1.468
  360    HD2  HIS  48           HD2      HIS  48  -9.951 -36.107   5.573
  361    HE1  HIS  48           HE1      HIS  48  -8.189 -36.476   1.755
  362    H    MET  49           H        MET  49 -12.855 -32.353   3.670
  363    HA   MET  49           HA       MET  49 -10.212 -31.299   3.459
  364   1HB   MET  49          2HB       MET  49 -12.977 -30.179   3.155
  365   2HB   MET  49          1HB       MET  49 -11.604 -29.075   3.190
  366   1HG   MET  49          2HG       MET  49 -10.607 -30.826   1.451
  367   2HG   MET  49          1HG       MET  49 -12.314 -31.159   1.165
  368   1HE   MET  49          3HE       MET  49 -13.094 -30.516  -0.656
  369   2HE   MET  49          2HE       MET  49 -13.013 -28.978  -1.513
  370   3HE   MET  49          1HE       MET  49 -11.648 -30.089  -1.582
  371    H    MET  50           H        MET  50 -12.865 -30.566   5.712
  372    HA   MET  50           HA       MET  50 -11.438 -28.644   7.263
  373   1HB   MET  50          2HB       MET  50 -13.838 -30.371   7.684
  374   2HB   MET  50          1HB       MET  50 -13.102 -29.630   9.104
  375   1HG   MET  50          2HG       MET  50 -13.159 -27.428   7.778
  376   2HG   MET  50          1HG       MET  50 -14.246 -28.261   6.665
  377   1HE   MET  50          1HE       MET  50 -13.417 -26.791   9.826
  378   2HE   MET  50          3HE       MET  50 -14.893 -26.635  10.790
  379   3HE   MET  50          2HE       MET  50 -13.976 -28.138  10.815
  380    H    ALA  51           H        ALA  51 -11.836 -32.156   7.685
  381    HA   ALA  51           HA       ALA  51 -10.284 -32.393  10.060
  382   1HB   ALA  51          3HB       ALA  51 -11.316 -34.398   9.671
  383   2HB   ALA  51          1HB       ALA  51  -9.808 -34.768   8.835
  384   3HB   ALA  51          2HB       ALA  51 -11.214 -34.225   7.919
  385    H    GLU  52           H        GLU  52  -9.372 -31.757   6.800
  386    HA   GLU  52           HA       GLU  52  -6.551 -32.540   7.294
  387   1HB   GLU  52          2HB       GLU  52  -8.127 -31.709   4.870
  388   2HB   GLU  52          1HB       GLU  52  -6.368 -31.580   4.856
  389   1HG   GLU  52          2HG       GLU  52  -6.418 -34.036   5.731
  390   2HG   GLU  52          1HG       GLU  52  -8.077 -34.046   5.131
  391    H    ILE  53           H        ILE  53  -8.587 -29.712   6.805
  392    HA   ILE  53           HA       ILE  53  -6.330 -27.850   6.892
  393    HB   ILE  53           HB       ILE  53  -9.321 -27.395   7.047
  394   1HG1  ILE  53          2HG1      ILE  53  -7.390 -27.102   4.733
  395   2HG1  ILE  53          1HG1      ILE  53  -8.505 -28.449   4.943
  396   1HG2  ILE  53          1HG2      ILE  53  -7.731 -25.611   7.989
  397   2HG2  ILE  53          3HG2      ILE  53  -7.181 -25.391   6.327
  398   3HG2  ILE  53          2HG2      ILE  53  -8.867 -25.087   6.746
  399   1HD1  ILE  53          1HD1      ILE  53  -9.561 -25.641   5.014
  400   2HD1  ILE  53          3HD1      ILE  53  -9.215 -26.396   3.459
  401   3HD1  ILE  53          2HD1      ILE  53 -10.386 -27.131   4.555
  402    H    ASP  54           H        ASP  54  -8.713 -29.171   9.116
  403    HA   ASP  54           HA       ASP  54  -8.450 -27.318  11.244
  404   1HB   ASP  54          2HB       ASP  54 -10.026 -29.400  10.854
  405   2HB   ASP  54          1HB       ASP  54  -8.767 -30.262  11.726
  406    H    THR  55           H        THR  55  -6.348 -26.721  11.775
  407    HA   THR  55           HA       THR  55  -4.156 -28.603  11.876
  408    HB   THR  55           HB       THR  55  -2.905 -26.720  12.900
  409    HG1  THR  55           HG1      THR  55  -3.978 -24.842  13.362
  410   1HG2  THR  55          1HG2      THR  55  -3.172 -26.842  10.451
  411   2HG2  THR  55          3HG2      THR  55  -4.673 -25.923  10.571
  412   3HG2  THR  55          2HG2      THR  55  -3.138 -25.167  11.003
  413    H    ASP  56           H        ASP  56  -6.071 -26.985  14.413
  414    HA   ASP  56           HA       ASP  56  -4.710 -28.583  16.479
  415   1HB   ASP  56          2HB       ASP  56  -6.567 -27.435  17.943
  416   2HB   ASP  56          1HB       ASP  56  -5.217 -26.476  17.338
  417    H    GLY  57           H        GLY  57  -7.737 -28.619  14.710
  418   1HA   GLY  57          1HA       GLY  57  -8.258 -31.311  15.816
  419   2HA   GLY  57          2HA       GLY  57  -9.054 -30.605  14.414
  420    H    ASP  58           H        ASP  58  -9.608 -28.062  15.946
  421    HA   ASP  58           HA       ASP  58 -11.363 -28.946  18.127
  422   1HB   ASP  58          2HB       ASP  58 -11.742 -26.645  18.573
  423   2HB   ASP  58          1HB       ASP  58 -10.055 -26.735  18.069
  424    H    GLY  59           H        GLY  59 -11.641 -28.951  14.817
  425   1HA   GLY  59          1HA       GLY  59 -14.603 -29.012  15.044
  426   2HA   GLY  59          2HA       GLY  59 -13.663 -29.754  13.752
  427    H    PHE  60           H        PHE  60 -12.469 -26.667  14.395
  428    HA   PHE  60           HA       PHE  60 -14.013 -25.606  12.071
  429   1HB   PHE  60          2HB       PHE  60 -13.225 -23.928  14.457
  430   2HB   PHE  60          1HB       PHE  60 -14.269 -23.467  13.114
  431    HD1  PHE  60           HD1      PHE  60 -16.456 -24.753  12.782
  432    HD2  PHE  60           HD2      PHE  60 -14.112 -24.979  16.372
  433    HE1  PHE  60           HE1      PHE  60 -18.425 -25.617  14.014
  434    HE2  PHE  60           HE2      PHE  60 -16.080 -25.838  17.604
  435    HZ   PHE  60           HZ       PHE  60 -18.239 -26.160  16.427
  436    H    ILE  61           H        ILE  61 -12.915 -23.969  10.824
  437    HA   ILE  61           HA       ILE  61  -9.962 -24.118  11.109
  438    HB   ILE  61           HB       ILE  61 -11.553 -23.242   8.689
  439   1HG1  ILE  61          2HG1      ILE  61 -12.133 -25.563   9.238
  440   2HG1  ILE  61          1HG1      ILE  61 -11.109 -25.518   7.803
  441   1HG2  ILE  61          3HG2      ILE  61  -9.104 -22.585   8.969
  442   2HG2  ILE  61          2HG2      ILE  61  -8.725 -24.305   8.882
  443   3HG2  ILE  61          1HG2      ILE  61  -9.483 -23.498   7.510
  444   1HD1  ILE  61          3HD1      ILE  61  -9.129 -25.993   9.234
  445   2HD1  ILE  61          2HD1      ILE  61 -10.191 -26.106  10.637
  446   3HD1  ILE  61          1HD1      ILE  61 -10.333 -27.280   9.327
  447    H    SER  62           H        SER  62  -8.938 -22.256  11.701
  448    HA   SER  62           HA       SER  62 -10.553 -19.783  11.914
  449   1HB   SER  62          2HB       SER  62  -7.726 -20.306  12.886
  450   2HB   SER  62          1HB       SER  62  -8.769 -18.958  13.339
  451    HG   SER  62           HG       SER  62  -9.773 -21.518  13.714
  452    H    PHE  63           H        PHE  63  -9.389 -17.718  11.233
  453    HA   PHE  63           HA       PHE  63  -8.733 -17.801   8.489
  454   1HB   PHE  63          2HB       PHE  63  -9.346 -15.706   9.649
  455   2HB   PHE  63          1HB       PHE  63  -7.822 -15.756  10.540
  456    HD1  PHE  63           HD1      PHE  63  -8.806 -16.351   6.970
  457    HD2  PHE  63           HD2      PHE  63  -6.278 -14.219   9.709
  458    HE1  PHE  63           HE1      PHE  63  -7.655 -15.267   5.062
  459    HE2  PHE  63           HE2      PHE  63  -5.122 -13.139   7.801
  460    HZ   PHE  63           HZ       PHE  63  -5.817 -13.660   5.475
  461    H    GLN  64           H        GLN  64  -6.634 -17.852  11.341
  462    HA   GLN  64           HA       GLN  64  -4.139 -17.822   9.969
  463   1HB   GLN  64          2HB       GLN  64  -4.489 -17.540  12.451
  464   2HB   GLN  64          1HB       GLN  64  -4.790 -19.275  12.550
  465   1HG   GLN  64          2HG       GLN  64  -2.466 -18.956  13.073
  466   2HG   GLN  64          1HG       GLN  64  -2.528 -19.616  11.438
  467   1HE2  GLN  64          1HE2      GLN  64  -1.401 -18.439   9.874
  468   2HE2  GLN  64          2HE2      GLN  64  -0.907 -16.824  10.043
  469    H    GLU  65           H        GLU  65  -6.122 -20.566  11.125
  470    HA   GLU  65           HA       GLU  65  -4.465 -22.651  10.147
  471   1HB   GLU  65          2HB       GLU  65  -7.353 -22.373  10.836
  472   2HB   GLU  65          1HB       GLU  65  -6.881 -23.781   9.893
  473   1HG   GLU  65          2HG       GLU  65  -5.242 -24.412  11.589
  474   2HG   GLU  65          1HG       GLU  65  -5.595 -22.952  12.512
  475    H    PHE  66           H        PHE  66  -7.195 -20.970   8.601
  476    HA   PHE  66           HA       PHE  66  -7.093 -22.392   6.131
  477   1HB   PHE  66          2HB       PHE  66  -8.972 -20.909   6.870
  478   2HB   PHE  66          1HB       PHE  66  -7.938 -19.514   6.567
  479    HD1  PHE  66           HD1      PHE  66  -9.779 -22.310   5.014
  480    HD2  PHE  66           HD2      PHE  66  -7.355 -18.836   4.308
  481    HE1  PHE  66           HE1      PHE  66 -10.397 -22.366   2.613
  482    HE2  PHE  66           HE2      PHE  66  -7.973 -18.892   1.908
  483    HZ   PHE  66           HZ       PHE  66  -9.495 -20.657   1.060
  484    H    THR  67           H        THR  67  -5.451 -19.452   7.234
  485    HA   THR  67           HA       THR  67  -4.200 -18.821   4.734
  486    HB   THR  67           HB       THR  67  -3.447 -18.212   7.604
  487    HG1  THR  67           HG1      THR  67  -4.389 -16.563   5.502
  488   1HG2  THR  67          1HG2      THR  67  -1.420 -18.264   6.175
  489   2HG2  THR  67          3HG2      THR  67  -2.193 -17.135   5.062
  490   3HG2  THR  67          2HG2      THR  67  -1.807 -16.628   6.706
  491    H    ASP  68           H        ASP  68  -3.057 -20.678   7.563
  492    HA   ASP  68           HA       ASP  68  -0.498 -21.348   6.522
  493   1HB   ASP  68          2HB       ASP  68  -2.306 -22.904   8.395
  494   2HB   ASP  68          1HB       ASP  68  -0.608 -23.283   8.105
  495    H    PHE  69           H        PHE  69  -3.664 -22.874   6.088
  496    HA   PHE  69           HA       PHE  69  -2.595 -25.108   4.568
  497   1HB   PHE  69          2HB       PHE  69  -4.607 -25.743   5.479
  498   2HB   PHE  69          1HB       PHE  69  -5.260 -24.108   5.434
  499    HD1  PHE  69           HD1      PHE  69  -5.879 -23.139   3.146
  500    HD2  PHE  69           HD2      PHE  69  -5.232 -27.320   3.848
  501    HE1  PHE  69           HE1      PHE  69  -7.139 -23.681   1.073
  502    HE2  PHE  69           HE2      PHE  69  -6.484 -27.867   1.783
  503    HZ   PHE  69           HZ       PHE  69  -7.442 -26.048   0.393
  504    H    GLY  70           H        GLY  70  -4.022 -21.957   3.846
  505   1HA   GLY  70          1HA       GLY  70  -4.046 -20.722   1.850
  506   2HA   GLY  70          2HA       GLY  70  -4.347 -22.260   1.042
  507    H    ARG  71           H        ARG  71  -1.486 -21.672   2.992
  508    HA   ARG  71           HA       ARG  71   0.244 -20.910   0.806
  509   1HB   ARG  71          2HB       ARG  71   0.938 -22.183   3.473
  510   2HB   ARG  71          1HB       ARG  71   2.080 -21.398   2.382
  511   1HG   ARG  71          2HG       ARG  71   0.867 -19.273   2.616
  512   2HG   ARG  71          1HG       ARG  71  -0.314 -20.049   3.671
  513   1HD   ARG  71          2HD       ARG  71   2.654 -19.754   4.228
  514   2HD   ARG  71          1HD       ARG  71   1.355 -18.862   5.020
  515    HE   ARG  71           HE       ARG  71   0.985 -21.722   5.284
  516   1HH1  ARG  71          1HH1      ARG  71   3.042 -19.161   6.306
  517   2HH1  ARG  71          2HH1      ARG  71   3.171 -19.733   7.935
  518   1HH2  ARG  71          1HH2      ARG  71   1.004 -22.396   7.455
  519   2HH2  ARG  71          2HH2      ARG  71   2.018 -21.563   8.587
  520    H    ALA  72           H        ALA  72  -0.818 -23.963   2.161
  521    HA   ALA  72           HA       ALA  72   1.156 -25.627   0.880
  522   1HB   ALA  72          1HB       ALA  72   0.122 -27.172   2.149
  523   2HB   ALA  72          2HB       ALA  72  -1.332 -27.016   1.165
  524   3HB   ALA  72          3HB       ALA  72  -1.108 -25.983   2.577
  525    H    ASN  73           H        ASN  73  -1.695 -24.011  -0.229
  526    HA   ASN  73           HA       ASN  73  -1.207 -25.044  -2.951
  527   1HB   ASN  73          2HB       ASN  73  -4.040 -25.094  -1.946
  528   2HB   ASN  73          1HB       ASN  73  -3.322 -25.977  -3.295
  529   1HD2  ASN  73          1HD2      ASN  73  -4.155 -26.182   0.042
  530   2HD2  ASN  73          2HD2      ASN  73  -3.378 -27.653   0.375
  531    H    ARG  74           H        ARG  74  -0.541 -22.585  -2.429
  532    HA   ARG  74           HA       ARG  74  -2.428 -20.525  -2.231
  533   1HB   ARG  74          2HB       ARG  74  -0.809 -19.121  -3.472
  534   2HB   ARG  74          1HB       ARG  74   0.004 -20.114  -2.263
  535   1HG   ARG  74          2HG       ARG  74   0.468 -21.804  -4.070
  536   2HG   ARG  74          1HG       ARG  74  -0.180 -20.655  -5.240
  537   1HD   ARG  74          2HD       ARG  74   2.205 -20.354  -5.224
  538   2HD   ARG  74          1HD       ARG  74   1.515 -18.977  -4.366
  539    HE   ARG  74           HE       ARG  74   2.376 -21.291  -2.728
  540   1HH1  ARG  74          1HH1      ARG  74   3.416 -18.424  -4.268
  541   2HH1  ARG  74          2HH1      ARG  74   4.333 -17.854  -2.914
  542   1HH2  ARG  74          1HH2      ARG  74   3.332 -20.425  -0.814
  543   2HH2  ARG  74          2HH2      ARG  74   4.285 -18.987  -0.959
  544    H    GLY  75           H        GLY  75  -1.460 -22.411  -5.051
  545   1HA   GLY  75          1HA       GLY  75  -2.499 -22.685  -7.122
  546   2HA   GLY  75          2HA       GLY  75  -2.868 -20.962  -7.039
  547    H    LEU  76           H        LEU  76  -3.954 -23.308  -4.657
  548    HA   LEU  76           HA       LEU  76  -6.547 -23.808  -5.771
  549   1HB   LEU  76          2HB       LEU  76  -5.401 -23.995  -2.991
  550   2HB   LEU  76          1HB       LEU  76  -7.113 -24.296  -3.282
  551    HG   LEU  76           HG       LEU  76  -4.836 -25.717  -4.694
  552   1HD1  LEU  76          2HD1      LEU  76  -5.861 -26.099  -2.093
  553   2HD1  LEU  76          1HD1      LEU  76  -6.574 -27.374  -3.080
  554   3HD1  LEU  76          3HD1      LEU  76  -4.822 -27.200  -2.997
  555   1HD2  LEU  76          2HD2      LEU  76  -7.849 -25.965  -4.791
  556   2HD2  LEU  76          1HD2      LEU  76  -6.742 -25.670  -6.133
  557   3HD2  LEU  76          3HD2      LEU  76  -6.777 -27.249  -5.349
  558    H    LEU  77           H        LEU  77  -5.391 -21.405  -3.424
  559    HA   LEU  77           HA       LEU  77  -7.910 -20.209  -2.875
  560   1HB   LEU  77          2HB       LEU  77  -5.072 -19.189  -2.785
  561   2HB   LEU  77          1HB       LEU  77  -6.434 -18.152  -2.364
  562    HG   LEU  77           HG       LEU  77  -5.283 -19.451  -0.448
  563   1HD1  LEU  77          2HD1      LEU  77  -8.200 -19.231  -1.048
  564   2HD1  LEU  77          1HD1      LEU  77  -7.723 -20.154   0.376
  565   3HD1  LEU  77          3HD1      LEU  77  -7.257 -18.460   0.227
  566   1HD2  LEU  77          2HD2      LEU  77  -6.909 -21.678  -1.709
  567   2HD2  LEU  77          1HD2      LEU  77  -5.151 -21.624  -1.585
  568   3HD2  LEU  77          3HD2      LEU  77  -6.133 -21.753  -0.127
  569    H    LYS  78           H        LYS  78  -5.492 -19.507  -5.382
  570    HA   LYS  78           HA       LYS  78  -6.847 -17.228  -6.471
  571   1HB   LYS  78          2HB       LYS  78  -4.943 -19.205  -7.759
  572   2HB   LYS  78          1HB       LYS  78  -5.466 -17.698  -8.509
  573   1HG   LYS  78          2HG       LYS  78  -4.615 -16.519  -6.406
  574   2HG   LYS  78          1HG       LYS  78  -3.847 -18.047  -5.977
  575   1HD   LYS  78          2HD       LYS  78  -3.395 -16.555  -8.579
  576   2HD   LYS  78          1HD       LYS  78  -2.300 -16.523  -7.199
  577   1HE   LYS  78          2HE       LYS  78  -3.106 -19.218  -8.145
  578   2HE   LYS  78          1HE       LYS  78  -2.069 -18.300  -9.236
  579   1HZ   LYS  78          3HZ       LYS  78  -1.505 -18.779  -6.361
  580   2HZ   LYS  78          2HZ       LYS  78  -0.808 -19.647  -7.644
  581   3HZ   LYS  78          1HZ       LYS  78  -0.491 -17.987  -7.466
  582    H    ASP  79           H        ASP  79  -7.295 -20.676  -6.856
  583    HA   ASP  79           HA       ASP  79  -9.034 -20.358  -9.203
  584   1HB   ASP  79          2HB       ASP  79  -7.983 -22.635  -7.587
  585   2HB   ASP  79          1HB       ASP  79  -9.487 -22.890  -8.473
  586    H    VAL  80           H        VAL  80  -9.439 -21.378  -5.811
  587    HA   VAL  80           HA       VAL  80 -12.293 -21.553  -5.915
  588    HB   VAL  80           HB       VAL  80 -10.641 -22.423  -4.115
  589   1HG1  VAL  80          3HG1      VAL  80  -9.617 -20.218  -3.641
  590   2HG1  VAL  80          2HG1      VAL  80 -11.173 -19.637  -3.048
  591   3HG1  VAL  80          1HG1      VAL  80 -10.331 -20.930  -2.194
  592   1HG2  VAL  80          1HG2      VAL  80 -13.376 -21.290  -3.776
  593   2HG2  VAL  80          3HG2      VAL  80 -12.819 -22.954  -3.591
  594   3HG2  VAL  80          2HG2      VAL  80 -12.523 -21.778  -2.310
  595    H    ALA  81           H        ALA  81 -10.105 -18.952  -4.933
  596    HA   ALA  81           HA       ALA  81 -11.936 -17.050  -4.022
  597   1HB   ALA  81          2HB       ALA  81  -9.493 -16.684  -4.037
  598   2HB   ALA  81          1HB       ALA  81  -9.528 -16.538  -5.794
  599   3HB   ALA  81          3HB       ALA  81 -10.338 -15.334  -4.792
  600    H    LYS  82           H        LYS  82 -11.108 -17.855  -7.374
  601    HA   LYS  82           HA       LYS  82 -12.696 -15.797  -8.587
  602   1HB   LYS  82          2HB       LYS  82 -11.804 -18.506  -9.619
  603   2HB   LYS  82          1HB       LYS  82 -12.594 -17.285 -10.616
  604   1HG   LYS  82          2HG       LYS  82 -10.756 -15.678  -9.885
  605   2HG   LYS  82          1HG       LYS  82  -9.921 -17.078  -9.210
  606   1HD   LYS  82          2HD       LYS  82 -10.154 -18.159 -11.512
  607   2HD   LYS  82          1HD       LYS  82 -10.653 -16.574 -12.103
  608   1HE   LYS  82          2HE       LYS  82  -8.413 -16.275 -12.433
  609   2HE   LYS  82          1HE       LYS  82  -8.410 -15.904 -10.709
  610   1HZ   LYS  82          3HZ       LYS  82  -8.019 -18.308 -10.309
  611   2HZ   LYS  82          2HZ       LYS  82  -7.823 -18.518 -11.984
  612   3HZ   LYS  82          1HZ       LYS  82  -6.746 -17.530 -11.116
  613    H    ILE  83           H        ILE  83 -13.484 -18.915  -7.222
  614    HA   ILE  83           HA       ILE  83 -15.990 -19.346  -8.519
  615    HB   ILE  83           HB       ILE  83 -15.028 -20.138  -5.756
  616   1HG1  ILE  83          2HG1      ILE  83 -15.195 -21.598  -8.410
  617   2HG1  ILE  83          1HG1      ILE  83 -13.722 -21.119  -7.565
  618   1HG2  ILE  83          2HG2      ILE  83 -17.578 -20.668  -7.249
  619   2HG2  ILE  83          1HG2      ILE  83 -16.918 -21.928  -6.207
  620   3HG2  ILE  83          3HG2      ILE  83 -17.337 -20.355  -5.529
  621   1HD1  ILE  83          1HD1      ILE  83 -14.949 -22.530  -5.602
  622   2HD1  ILE  83          3HD1      ILE  83 -15.570 -23.377  -7.018
  623   3HD1  ILE  83          2HD1      ILE  83 -13.831 -23.257  -6.755
  624    H    PHE  84           H        PHE  84 -15.058 -17.339  -5.784
  625    HA   PHE  84           HA       PHE  84 -17.907 -16.529  -5.432
  626   1HB   PHE  84          2HB       PHE  84 -15.488 -16.002  -3.678
  627   2HB   PHE  84          1HB       PHE  84 -17.145 -15.524  -3.308
  628    HD1  PHE  84           HD1      PHE  84 -15.261 -18.592  -4.386
  629    HD2  PHE  84           HD2      PHE  84 -18.377 -16.940  -1.933
  630    HE1  PHE  84           HE1      PHE  84 -15.692 -20.837  -3.421
  631    HE2  PHE  84           HE2      PHE  84 -18.807 -19.185  -0.968
  632    HZ   PHE  84           HZ       PHE  84 -17.465 -21.133  -1.712

  No H/Q in entry =         632
  Start of MODEL   18
    1    H1   ALA   1          3H        ALA   1   8.536 -15.430   2.139
    2    H2   ALA   1          2H        ALA   1  10.178 -15.815   2.354
    3    H3   ALA   1          1H        ALA   1   9.370 -14.852   3.498
    4    HA   ALA   1           HA       ALA   1   9.753 -12.995   2.372
    5   1HB   ALA   1          2HB       ALA   1  11.691 -14.933   1.593
    6   2HB   ALA   1          3HB       ALA   1  11.874 -13.180   1.644
    7   3HB   ALA   1          1HB       ALA   1  11.308 -13.966   0.169
    8    H    ASP   2           H        ASP   2   8.763 -15.652   0.281
    9    HA   ASP   2           HA       ASP   2   7.947 -13.918  -1.912
   10   1HB   ASP   2          2HB       ASP   2   7.407 -16.823  -1.256
   11   2HB   ASP   2          1HB       ASP   2   6.768 -16.034  -2.698
   12    H    ASP   3           H        ASP   3   6.458 -15.157   1.001
   13    HA   ASP   3           HA       ASP   3   3.735 -14.525   0.134
   14   1HB   ASP   3          2HB       ASP   3   4.284 -16.316   1.819
   15   2HB   ASP   3          1HB       ASP   3   4.751 -15.040   2.943
   16    H    HIS   4           H        HIS   4   3.018 -12.457   0.030
   17    HA   HIS   4           HA       HIS   4   4.282 -10.443   1.840
   18   1HB   HIS   4          2HB       HIS   4   2.853  -8.969   0.023
   19   2HB   HIS   4          1HB       HIS   4   4.558  -9.370  -0.151
   20    HD1  HIS   4           HD1      HIS   4   1.135 -10.452  -1.321
   21    HD2  HIS   4           HD2      HIS   4   5.137 -11.220  -2.196
   22    HE1  HIS   4           HE1      HIS   4   1.152 -11.812  -3.457
   23    HA   PRO   5           HA       PRO   5   0.482  -9.589   3.940
   24   1HB   PRO   5          2HB       PRO   5   0.195  -6.902   3.782
   25   2HB   PRO   5          1HB       PRO   5   1.400  -7.681   4.812
   26   1HG   PRO   5          2HG       PRO   5   1.731  -6.469   2.090
   27   2HG   PRO   5          1HG       PRO   5   2.766  -6.300   3.513
   28   1HD   PRO   5          1HD       PRO   5   3.392  -7.989   1.514
   29   2HD   PRO   5          2HD       PRO   5   3.758  -8.375   3.196
   30    H    GLN   6           H        GLN   6   0.786  -8.388   0.665
   31    HA   GLN   6           HA       GLN   6  -1.918  -7.569   0.252
   32   1HB   GLN   6          2HB       GLN   6   0.216  -8.624  -1.615
   33   2HB   GLN   6          1HB       GLN   6  -1.359  -8.081  -2.183
   34   1HG   GLN   6          2HG       GLN   6   0.754  -6.451  -0.757
   35   2HG   GLN   6          1HG       GLN   6   0.115  -6.198  -2.381
   36   1HE2  GLN   6          1HE2      GLN   6  -0.653  -5.880   1.077
   37   2HE2  GLN   6          2HE2      GLN   6  -1.994  -4.862   0.859
   38    H    ASP   7           H        ASP   7  -0.289 -10.699  -0.108
   39    HA   ASP   7           HA       ASP   7  -2.442 -12.148  -1.249
   40   1HB   ASP   7          2HB       ASP   7  -0.228 -13.003   0.628
   41   2HB   ASP   7          1HB       ASP   7  -1.375 -14.144  -0.076
   42    H    LYS   8           H        LYS   8  -1.674 -11.485   2.153
   43    HA   LYS   8           HA       LYS   8  -3.652 -13.029   3.403
   44   1HB   LYS   8          2HB       LYS   8  -2.319 -10.432   4.063
   45   2HB   LYS   8          1HB       LYS   8  -3.707 -10.929   5.031
   46   1HG   LYS   8          2HG       LYS   8  -2.431 -13.246   5.087
   47   2HG   LYS   8          1HG       LYS   8  -1.024 -12.237   4.747
   48   1HD   LYS   8          2HD       LYS   8  -1.859 -10.759   6.699
   49   2HD   LYS   8          1HD       LYS   8  -2.873 -12.135   7.130
   50   1HE   LYS   8          2HE       LYS   8  -0.829 -12.357   8.380
   51   2HE   LYS   8          1HE       LYS   8  -0.773 -13.559   7.090
   52   1HZ   LYS   8          1HZ       LYS   8   0.329 -11.480   5.865
   53   2HZ   LYS   8          3HZ       LYS   8   0.815 -11.155   7.456
   54   3HZ   LYS   8          2HZ       LYS   8   1.229 -12.633   6.729
   55    H    ALA   9           H        ALA   9  -3.954  -9.906   1.784
   56    HA   ALA   9           HA       ALA   9  -6.612  -9.293   2.583
   57   1HB   ALA   9          1HB       ALA   9  -4.718  -8.285   0.698
   58   2HB   ALA   9          2HB       ALA   9  -6.184  -7.501   1.285
   59   3HB   ALA   9          3HB       ALA   9  -6.246  -8.522  -0.151
   60    H    GLU  10           H        GLU  10  -5.395 -11.153  -0.187
   61    HA   GLU  10           HA       GLU  10  -8.000 -11.818  -1.216
   62   1HB   GLU  10          2HB       GLU  10  -5.420 -13.388  -1.506
   63   2HB   GLU  10          1HB       GLU  10  -6.837 -13.500  -2.549
   64   1HG   GLU  10          2HG       GLU  10  -5.134 -11.020  -2.155
   65   2HG   GLU  10          1HG       GLU  10  -5.096 -12.072  -3.568
   66    H    ARG  11           H        ARG  11  -5.753 -13.492   0.961
   67    HA   ARG  11           HA       ARG  11  -7.356 -15.837   1.336
   68   1HB   ARG  11          2HB       ARG  11  -5.260 -14.507   3.065
   69   2HB   ARG  11          1HB       ARG  11  -6.012 -16.044   3.483
   70   1HG   ARG  11          2HG       ARG  11  -5.309 -16.830   1.135
   71   2HG   ARG  11          1HG       ARG  11  -4.285 -15.397   1.088
   72   1HD   ARG  11          2HD       ARG  11  -3.541 -16.312   3.485
   73   2HD   ARG  11          1HD       ARG  11  -4.050 -17.847   2.779
   74    HE   ARG  11           HE       ARG  11  -1.897 -16.105   1.666
   75   1HH1  ARG  11          1HH1      ARG  11  -3.191 -17.857  -0.369
   76   2HH1  ARG  11          2HH1      ARG  11  -2.228 -19.294  -0.287
   77   1HH2  ARG  11          1HH2      ARG  11  -0.814 -18.491   2.776
   78   2HH2  ARG  11          2HH2      ARG  11  -0.883 -19.653   1.493
   79    H    GLU  12           H        GLU  12  -7.217 -12.736   3.025
   80    HA   GLU  12           HA       GLU  12  -9.023 -13.417   5.140
   81   1HB   GLU  12          2HB       GLU  12  -7.936 -10.911   3.970
   82   2HB   GLU  12          1HB       GLU  12  -9.442 -10.759   4.874
   83   1HG   GLU  12          2HG       GLU  12  -8.291 -12.118   6.720
   84   2HG   GLU  12          1HG       GLU  12  -6.785 -11.827   5.848
   85    H    ARG  13           H        ARG  13  -9.542 -12.078   1.898
   86    HA   ARG  13           HA       ARG  13 -12.388 -11.710   2.239
   87   1HB   ARG  13          2HB       ARG  13 -10.783 -12.090  -0.308
   88   2HB   ARG  13          1HB       ARG  13 -12.433 -11.475  -0.213
   89   1HG   ARG  13          2HG       ARG  13 -11.734  -9.508   0.943
   90   2HG   ARG  13          1HG       ARG  13 -10.132 -10.173   1.255
   91   1HD   ARG  13          2HD       ARG  13  -9.750  -8.734  -0.565
   92   2HD   ARG  13          1HD       ARG  13  -9.944 -10.304  -1.344
   93    HE   ARG  13           HE       ARG  13 -11.995  -8.142  -1.312
   94   1HH1  ARG  13          1HH1      ARG  13 -10.289  -9.998  -3.398
   95   2HH1  ARG  13          2HH1      ARG  13 -11.641 -10.689  -4.232
   96   1HH2  ARG  13          1HH2      ARG  13 -13.978  -9.546  -1.939
   97   2HH2  ARG  13          2HH2      ARG  13 -13.729 -10.433  -3.405
   98    H    ILE  14           H        ILE  14 -10.358 -14.335   1.023
   99    HA   ILE  14           HA       ILE  14 -12.577 -15.992   0.177
  100    HB   ILE  14           HB       ILE  14  -9.763 -16.827   0.948
  101   1HG1  ILE  14          2HG1      ILE  14 -10.708 -16.348  -1.862
  102   2HG1  ILE  14          1HG1      ILE  14 -10.156 -14.988  -0.888
  103   1HG2  ILE  14          3HG2      ILE  14 -11.987 -18.122  -0.645
  104   2HG2  ILE  14          2HG2      ILE  14 -10.310 -18.656  -0.748
  105   3HG2  ILE  14          1HG2      ILE  14 -11.173 -18.755   0.786
  106   1HD1  ILE  14          3HD1      ILE  14  -8.233 -16.971  -0.455
  107   2HD1  ILE  14          2HD1      ILE  14  -8.597 -17.087  -2.178
  108   3HD1  ILE  14          1HD1      ILE  14  -8.055 -15.555  -1.491
  109    H    PHE  15           H        PHE  15 -10.530 -15.866   3.104
  110    HA   PHE  15           HA       PHE  15 -11.904 -18.036   4.416
  111   1HB   PHE  15          2HB       PHE  15  -9.639 -17.313   5.092
  112   2HB   PHE  15          1HB       PHE  15 -10.294 -15.763   5.627
  113    HD1  PHE  15           HD1      PHE  15 -10.153 -19.392   6.284
  114    HD2  PHE  15           HD2      PHE  15 -11.672 -15.612   7.644
  115    HE1  PHE  15           HE1      PHE  15 -10.764 -20.422   8.454
  116    HE2  PHE  15           HE2      PHE  15 -12.287 -16.643   9.817
  117    HZ   PHE  15           HZ       PHE  15 -11.835 -19.050  10.221
  118    H    LYS  16           H        LYS  16 -12.336 -14.533   4.336
  119    HA   LYS  16           HA       LYS  16 -14.293 -14.392   6.431
  120   1HB   LYS  16          2HB       LYS  16 -13.573 -12.636   4.093
  121   2HB   LYS  16          1HB       LYS  16 -15.005 -12.276   5.058
  122   1HG   LYS  16          2HG       LYS  16 -13.577 -12.303   7.108
  123   2HG   LYS  16          1HG       LYS  16 -12.161 -12.540   6.083
  124   1HD   LYS  16          2HD       LYS  16 -12.802 -10.419   4.865
  125   2HD   LYS  16          1HD       LYS  16 -14.036 -10.158   6.098
  126   1HE   LYS  16          2HE       LYS  16 -11.873 -10.643   7.672
  127   2HE   LYS  16          1HE       LYS  16 -11.088  -9.890   6.283
  128   1HZ   LYS  16          3HZ       LYS  16 -13.452  -8.731   7.646
  129   2HZ   LYS  16          2HZ       LYS  16 -11.852  -8.320   8.044
  130   3HZ   LYS  16          1HZ       LYS  16 -12.457  -7.988   6.491
  131    H    ARG  17           H        ARG  17 -14.458 -15.226   3.027
  132    HA   ARG  17           HA       ARG  17 -17.335 -15.056   2.806
  133   1HB   ARG  17          2HB       ARG  17 -15.242 -16.543   1.197
  134   2HB   ARG  17          1HB       ARG  17 -16.956 -16.542   0.782
  135   1HG   ARG  17          2HG       ARG  17 -15.609 -13.911   1.270
  136   2HG   ARG  17          1HG       ARG  17 -15.304 -14.738  -0.257
  137   1HD   ARG  17          2HD       ARG  17 -17.768 -14.912  -0.612
  138   2HD   ARG  17          1HD       ARG  17 -18.020 -13.990   0.869
  139    HE   ARG  17           HE       ARG  17 -17.071 -12.911  -1.695
  140   1HH1  ARG  17          1HH1      ARG  17 -15.196 -11.854   0.347
  141   2HH1  ARG  17          2HH1      ARG  17 -16.013 -10.438   0.917
  142   1HH2  ARG  17          1HH2      ARG  17 -19.092 -11.373  -0.376
  143   2HH2  ARG  17          2HH2      ARG  17 -18.220 -10.166   0.508
  144    H    PHE  18           H        PHE  18 -15.048 -17.634   3.620
  145    HA   PHE  18           HA       PHE  18 -16.997 -19.743   3.737
  146   1HB   PHE  18          2HB       PHE  18 -14.256 -19.366   4.934
  147   2HB   PHE  18          1HB       PHE  18 -15.225 -20.792   5.308
  148    HD1  PHE  18           HD1      PHE  18 -16.171 -22.142   3.313
  149    HD2  PHE  18           HD2      PHE  18 -13.001 -19.267   2.947
  150    HE1  PHE  18           HE1      PHE  18 -15.491 -23.166   1.159
  151    HE2  PHE  18           HE2      PHE  18 -12.321 -20.291   0.793
  152    HZ   PHE  18           HZ       PHE  18 -13.565 -22.241  -0.100
  153    H    ASP  19           H        ASP  19 -15.602 -17.648   6.259
  154    HA   ASP  19           HA       ASP  19 -17.101 -18.722   8.433
  155   1HB   ASP  19          2HB       ASP  19 -15.133 -16.967   8.382
  156   2HB   ASP  19          1HB       ASP  19 -16.445 -15.790   8.298
  157    H    ALA  20           H        ALA  20 -19.302 -18.974   8.129
  158    HA   ALA  20           HA       ALA  20 -20.923 -17.122   6.641
  159   1HB   ALA  20          3HB       ALA  20 -21.325 -19.637   7.251
  160   2HB   ALA  20          2HB       ALA  20 -22.061 -18.976   8.711
  161   3HB   ALA  20          1HB       ALA  20 -22.706 -18.546   7.126
  162    H    ASN  21           H        ASN  21 -20.684 -17.704  10.192
  163    HA   ASN  21           HA       ASN  21 -22.344 -15.309  10.630
  164   1HB   ASN  21          2HB       ASN  21 -22.236 -15.886  12.999
  165   2HB   ASN  21          1HB       ASN  21 -22.648 -17.317  12.060
  166   1HD2  ASN  21          1HD2      ASN  21 -21.410 -17.297  14.701
  167   2HD2  ASN  21          2HD2      ASN  21 -19.900 -18.049  14.546
  168    H    GLY  22           H        GLY  22 -18.979 -16.256  10.806
  169   1HA   GLY  22          1HA       GLY  22 -18.281 -13.396  11.128
  170   2HA   GLY  22          2HA       GLY  22 -17.174 -14.671  10.625
  171    H    ASP  23           H        ASP  23 -17.917 -16.473  12.821
  172    HA   ASP  23           HA       ASP  23 -17.205 -14.960  15.252
  173   1HB   ASP  23          2HB       ASP  23 -17.456 -17.106  16.431
  174   2HB   ASP  23          1HB       ASP  23 -18.868 -16.777  15.429
  175    H    GLY  24           H        GLY  24 -15.471 -15.932  12.709
  176   1HA   GLY  24          1HA       GLY  24 -13.014 -16.159  14.335
  177   2HA   GLY  24          2HA       GLY  24 -13.079 -15.847  12.602
  178    H    LYS  25           H        LYS  25 -15.184 -18.371  13.264
  179    HA   LYS  25           HA       LYS  25 -13.082 -20.332  12.484
  180   1HB   LYS  25          2HB       LYS  25 -14.073 -21.992  13.998
  181   2HB   LYS  25          1HB       LYS  25 -13.562 -20.568  14.901
  182   1HG   LYS  25          2HG       LYS  25 -15.775 -19.797  15.162
  183   2HG   LYS  25          1HG       LYS  25 -16.381 -20.824  13.860
  184   1HD   LYS  25          2HD       LYS  25 -15.522 -22.786  15.389
  185   2HD   LYS  25          1HD       LYS  25 -15.622 -21.576  16.671
  186   1HE   LYS  25          2HE       LYS  25 -17.985 -21.606  14.929
  187   2HE   LYS  25          1HE       LYS  25 -17.729 -23.131  15.777
  188   1HZ   LYS  25          1HZ       LYS  25 -17.600 -20.527  17.171
  189   2HZ   LYS  25          3HZ       LYS  25 -19.063 -21.360  16.971
  190   3HZ   LYS  25          2HZ       LYS  25 -17.792 -22.075  17.843
  191    H    ILE  26           H        ILE  26 -13.742 -21.919  11.056
  192    HA   ILE  26           HA       ILE  26 -16.478 -21.569   9.907
  193    HB   ILE  26           HB       ILE  26 -14.177 -22.911   8.502
  194   1HG1  ILE  26          2HG1      ILE  26 -14.808 -19.945   8.573
  195   2HG1  ILE  26          1HG1      ILE  26 -13.358 -20.710   9.224
  196   1HG2  ILE  26          1HG2      ILE  26 -16.569 -23.029   7.664
  197   2HG2  ILE  26          3HG2      ILE  26 -16.499 -21.281   7.441
  198   3HG2  ILE  26          2HG2      ILE  26 -15.419 -22.330   6.524
  199   1HD1  ILE  26          3HD1      ILE  26 -13.893 -21.446   6.438
  200   2HD1  ILE  26          2HD1      ILE  26 -13.628 -19.716   6.655
  201   3HD1  ILE  26          1HD1      ILE  26 -12.401 -20.868   7.178
  202    H    SER  27           H        SER  27 -17.830 -23.288   9.955
  203    HA   SER  27           HA       SER  27 -16.766 -25.867  11.000
  204   1HB   SER  27          2HB       SER  27 -18.863 -26.259  11.969
  205   2HB   SER  27          1HB       SER  27 -18.697 -24.512  12.146
  206    HG   SER  27           HG       SER  27 -20.171 -24.191  10.654
  207    H    ALA  28           H        ALA  28 -17.935 -27.838  10.072
  208    HA   ALA  28           HA       ALA  28 -17.595 -28.028   7.303
  209   1HB   ALA  28          2HB       ALA  28 -19.694 -29.571   8.847
  210   2HB   ALA  28          3HB       ALA  28 -17.972 -29.946   8.925
  211   3HB   ALA  28          1HB       ALA  28 -18.837 -30.089   7.394
  212    H    ALA  29           H        ALA  29 -20.580 -27.274   9.091
  213    HA   ALA  29           HA       ALA  29 -22.306 -27.080   6.865
  214   1HB   ALA  29          1HB       ALA  29 -22.932 -26.955   9.336
  215   2HB   ALA  29          3HB       ALA  29 -22.433 -25.264   9.281
  216   3HB   ALA  29          2HB       ALA  29 -23.773 -25.822   8.278
  217    H    GLU  30           H        GLU  30 -20.104 -24.672   8.263
  218    HA   GLU  30           HA       GLU  30 -20.943 -22.597   6.409
  219   1HB   GLU  30          2HB       GLU  30 -18.489 -22.825   8.176
  220   2HB   GLU  30          1HB       GLU  30 -18.946 -21.377   7.276
  221   1HG   GLU  30          2HG       GLU  30 -21.097 -21.307   8.495
  222   2HG   GLU  30          1HG       GLU  30 -20.625 -22.742   9.404
  223    H    LEU  31           H        LEU  31 -17.953 -24.549   6.699
  224    HA   LEU  31           HA       LEU  31 -16.836 -23.662   4.230
  225   1HB   LEU  31          2HB       LEU  31 -15.684 -24.975   6.110
  226   2HB   LEU  31          1HB       LEU  31 -16.430 -26.414   5.418
  227    HG   LEU  31           HG       LEU  31 -14.781 -24.501   3.755
  228   1HD1  LEU  31          3HD1      LEU  31 -13.691 -25.793   5.860
  229   2HD1  LEU  31          2HD1      LEU  31 -13.619 -27.085   4.662
  230   3HD1  LEU  31          1HD1      LEU  31 -12.823 -25.544   4.345
  231   1HD2  LEU  31          2HD2      LEU  31 -16.003 -27.215   3.426
  232   2HD2  LEU  31          1HD2      LEU  31 -15.942 -25.872   2.285
  233   3HD2  LEU  31          3HD2      LEU  31 -14.506 -26.857   2.566
  234    H    GLY  32           H        GLY  32 -18.896 -26.446   5.026
  235   1HA   GLY  32          1HA       GLY  32 -20.175 -27.836   3.636
  236   2HA   GLY  32          2HA       GLY  32 -18.967 -27.545   2.385
  237    H    GLU  33           H        GLU  33 -21.101 -25.246   4.069
  238    HA   GLU  33           HA       GLU  33 -22.997 -24.916   1.994
  239   1HB   GLU  33          2HB       GLU  33 -22.075 -23.271   4.308
  240   2HB   GLU  33          1HB       GLU  33 -23.045 -22.473   3.073
  241   1HG   GLU  33          2HG       GLU  33 -24.704 -24.390   3.304
  242   2HG   GLU  33          1HG       GLU  33 -23.793 -24.895   4.728
  243    H    ALA  34           H        ALA  34 -19.907 -23.240   2.559
  244    HA   ALA  34           HA       ALA  34 -20.224 -21.507   0.254
  245   1HB   ALA  34          3HB       ALA  34 -18.649 -20.580   1.659
  246   2HB   ALA  34          2HB       ALA  34 -18.056 -22.152   2.197
  247   3HB   ALA  34          1HB       ALA  34 -17.556 -21.510   0.632
  248    H    LEU  35           H        LEU  35 -18.629 -24.589   0.911
  249    HA   LEU  35           HA       LEU  35 -17.304 -24.925  -1.570
  250   1HB   LEU  35          2HB       LEU  35 -18.076 -26.604   0.684
  251   2HB   LEU  35          1HB       LEU  35 -18.183 -27.475  -0.845
  252    HG   LEU  35           HG       LEU  35 -15.773 -25.939   0.169
  253   1HD1  LEU  35          2HD1      LEU  35 -16.426 -28.880  -0.100
  254   2HD1  LEU  35          1HD1      LEU  35 -14.770 -28.291   0.047
  255   3HD1  LEU  35          3HD1      LEU  35 -15.925 -28.009   1.350
  256   1HD2  LEU  35          2HD2      LEU  35 -16.556 -26.967  -2.482
  257   2HD2  LEU  35          1HD2      LEU  35 -15.350 -25.752  -2.059
  258   3HD2  LEU  35          3HD2      LEU  35 -14.949 -27.467  -1.956
  259    H    LYS  36           H        LYS  36 -20.686 -25.388  -0.678
  260    HA   LYS  36           HA       LYS  36 -21.663 -26.960  -2.738
  261   1HB   LYS  36          2HB       LYS  36 -22.733 -24.953  -0.975
  262   2HB   LYS  36          1HB       LYS  36 -23.429 -24.742  -2.582
  263   1HG   LYS  36          2HG       LYS  36 -24.236 -26.990  -2.632
  264   2HG   LYS  36          1HG       LYS  36 -23.269 -27.442  -1.228
  265   1HD   LYS  36          2HD       LYS  36 -24.906 -25.208  -0.505
  266   2HD   LYS  36          1HD       LYS  36 -25.933 -26.420  -1.270
  267   1HE   LYS  36          2HE       LYS  36 -25.452 -28.036   0.340
  268   2HE   LYS  36          1HE       LYS  36 -23.914 -27.291   0.775
  269   1HZ   LYS  36          1HZ       LYS  36 -26.199 -25.602   1.229
  270   2HZ   LYS  36          3HZ       LYS  36 -26.215 -27.020   2.157
  271   3HZ   LYS  36          2HZ       LYS  36 -24.892 -25.959   2.252
  272    H    THR  37           H        THR  37 -20.297 -23.757  -2.982
  273    HA   THR  37           HA       THR  37 -21.340 -22.863  -5.430
  274    HB   THR  37           HB       THR  37 -19.700 -21.655  -3.899
  275    HG1  THR  37           HG1      THR  37 -19.996 -20.588  -5.725
  276   1HG2  THR  37          1HG2      THR  37 -18.077 -23.565  -3.815
  277   2HG2  THR  37          3HG2      THR  37 -17.670 -23.235  -5.500
  278   3HG2  THR  37          2HG2      THR  37 -17.331 -22.030  -4.258
  279    H    LEU  38           H        LEU  38 -19.107 -25.460  -4.774
  280    HA   LEU  38           HA       LEU  38 -18.000 -25.714  -7.412
  281   1HB   LEU  38          2HB       LEU  38 -18.435 -27.761  -5.218
  282   2HB   LEU  38          1HB       LEU  38 -17.534 -28.086  -6.700
  283    HG   LEU  38           HG       LEU  38 -16.874 -26.051  -4.554
  284   1HD1  LEU  38          3HD1      LEU  38 -15.701 -28.635  -5.537
  285   2HD1  LEU  38          2HD1      LEU  38 -14.635 -27.410  -4.849
  286   3HD1  LEU  38          1HD1      LEU  38 -15.946 -28.082  -3.881
  287   1HD2  LEU  38          1HD2      LEU  38 -15.915 -26.346  -7.392
  288   2HD2  LEU  38          3HD2      LEU  38 -16.332 -24.877  -6.510
  289   3HD2  LEU  38          2HD2      LEU  38 -14.826 -25.723  -6.152
  290    H    GLY  39           H        GLY  39 -21.018 -26.757  -5.959
  291   1HA   GLY  39          1HA       GLY  39 -22.265 -27.166  -8.510
  292   2HA   GLY  39          2HA       GLY  39 -22.948 -27.641  -6.956
  293    H    SER  40           H        SER  40 -20.094 -29.113  -6.797
  294    HA   SER  40           HA       SER  40 -21.212 -31.676  -7.694
  295   1HB   SER  40          2HB       SER  40 -19.170 -30.199  -9.219
  296   2HB   SER  40          1HB       SER  40 -18.732 -31.869  -8.858
  297    HG   SER  40           HG       SER  40 -20.935 -30.870 -10.291
  298    H    ILE  41           H        ILE  41 -20.679 -30.957  -5.114
  299    HA   ILE  41           HA       ILE  41 -18.281 -32.622  -4.507
  300    HB   ILE  41           HB       ILE  41 -17.962 -30.063  -4.197
  301   1HG1  ILE  41          2HG1      ILE  41 -16.602 -30.434  -2.214
  302   2HG1  ILE  41          1HG1      ILE  41 -17.517 -31.888  -1.818
  303   1HG2  ILE  41          3HG2      ILE  41 -20.288 -30.009  -2.983
  304   2HG2  ILE  41          2HG2      ILE  41 -19.363 -30.543  -1.578
  305   3HG2  ILE  41          1HG2      ILE  41 -18.970 -29.012  -2.364
  306   1HD1  ILE  41          2HD1      ILE  41 -16.161 -31.637  -4.493
  307   2HD1  ILE  41          1HD1      ILE  41 -15.237 -32.136  -3.075
  308   3HD1  ILE  41          3HD1      ILE  41 -16.614 -33.098  -3.615
  309    H    THR  42           H        THR  42 -18.402 -33.490  -2.215
  310    HA   THR  42           HA       THR  42 -21.260 -33.961  -1.470
  311    HB   THR  42           HB       THR  42 -20.836 -36.186  -1.301
  312    HG1  THR  42           HG1      THR  42 -18.813 -36.880  -0.270
  313   1HG2  THR  42          2HG2      THR  42 -19.617 -35.626  -3.412
  314   2HG2  THR  42          1HG2      THR  42 -18.128 -35.500  -2.474
  315   3HG2  THR  42          3HG2      THR  42 -18.967 -37.048  -2.597
  316    HA   PRO  43           HA       PRO  43 -20.413 -32.374   2.573
  317   1HB   PRO  43          2HB       PRO  43 -21.627 -34.153   4.213
  318   2HB   PRO  43          1HB       PRO  43 -22.526 -32.999   3.224
  319   1HG   PRO  43          2HG       PRO  43 -21.950 -35.895   2.711
  320   2HG   PRO  43          1HG       PRO  43 -23.460 -35.007   2.487
  321   1HD   PRO  43          1HD       PRO  43 -21.825 -35.577   0.416
  322   2HD   PRO  43          2HD       PRO  43 -22.773 -34.090   0.472
  323    H    ASP  44           H        ASP  44 -19.785 -35.815   2.069
  324    HA   ASP  44           HA       ASP  44 -18.097 -36.215   4.336
  325   1HB   ASP  44          2HB       ASP  44 -19.086 -37.804   2.304
  326   2HB   ASP  44          1HB       ASP  44 -17.359 -37.755   1.949
  327    H    GLU  45           H        GLU  45 -17.490 -34.714   1.215
  328    HA   GLU  45           HA       GLU  45 -14.583 -34.875   1.519
  329   1HB   GLU  45          2HB       GLU  45 -16.291 -33.219  -0.367
  330   2HB   GLU  45          1HB       GLU  45 -14.545 -33.430  -0.485
  331   1HG   GLU  45          2HG       GLU  45 -16.534 -35.717  -0.563
  332   2HG   GLU  45          1HG       GLU  45 -15.857 -34.954  -2.001
  333    H    VAL  46           H        VAL  46 -17.165 -32.517   1.996
  334    HA   VAL  46           HA       VAL  46 -15.479 -30.296   2.644
  335    HB   VAL  46           HB       VAL  46 -18.315 -30.970   3.465
  336   1HG1  VAL  46          3HG1      VAL  46 -16.594 -29.100   4.667
  337   2HG1  VAL  46          2HG1      VAL  46 -17.600 -28.159   3.567
  338   3HG1  VAL  46          1HG1      VAL  46 -18.352 -29.160   4.810
  339   1HG2  VAL  46          1HG2      VAL  46 -17.320 -30.300   1.015
  340   2HG2  VAL  46          3HG2      VAL  46 -18.956 -29.912   1.549
  341   3HG2  VAL  46          2HG2      VAL  46 -17.677 -28.704   1.675
  342    H    LYS  47           H        LYS  47 -16.809 -32.952   4.534
  343    HA   LYS  47           HA       LYS  47 -15.871 -31.924   7.087
  344   1HB   LYS  47          2HB       LYS  47 -16.758 -34.677   6.178
  345   2HB   LYS  47          1HB       LYS  47 -16.279 -34.320   7.838
  346   1HG   LYS  47          2HG       LYS  47 -18.019 -32.526   7.905
  347   2HG   LYS  47          1HG       LYS  47 -18.541 -33.015   6.293
  348   1HD   LYS  47          2HD       LYS  47 -18.899 -35.344   7.220
  349   2HD   LYS  47          1HD       LYS  47 -18.610 -34.675   8.827
  350   1HE   LYS  47          2HE       LYS  47 -20.445 -32.967   8.271
  351   2HE   LYS  47          1HE       LYS  47 -20.847 -34.010   6.906
  352   1HZ   LYS  47          3HZ       LYS  47 -20.688 -35.776   8.911
  353   2HZ   LYS  47          2HZ       LYS  47 -21.284 -34.415   9.735
  354   3HZ   LYS  47          1HZ       LYS  47 -22.131 -35.042   8.402
  355    H    HIS  48           H        HIS  48 -14.630 -34.119   4.618
  356    HA   HIS  48           HA       HIS  48 -12.300 -34.954   6.097
  357   1HB   HIS  48          2HB       HIS  48 -13.078 -36.226   4.152
  358   2HB   HIS  48          1HB       HIS  48 -12.812 -34.831   3.107
  359    HD1  HIS  48           HD1      HIS  48 -10.935 -35.831   1.689
  360    HD2  HIS  48           HD2      HIS  48 -10.133 -35.984   5.777
  361    HE1  HIS  48           HE1      HIS  48  -8.509 -36.523   1.917
  362    H    MET  49           H        MET  49 -12.975 -32.284   3.848
  363    HA   MET  49           HA       MET  49 -10.299 -31.330   3.608
  364   1HB   MET  49          2HB       MET  49 -13.025 -30.127   3.298
  365   2HB   MET  49          1HB       MET  49 -11.635 -29.047   3.364
  366   1HG   MET  49          2HG       MET  49 -10.682 -30.874   1.623
  367   2HG   MET  49          1HG       MET  49 -12.404 -31.021   1.276
  368   1HE   MET  49          3HE       MET  49 -13.306 -30.010  -0.459
  369   2HE   MET  49          2HE       MET  49 -12.715 -28.631  -1.381
  370   3HE   MET  49          1HE       MET  49 -11.758 -30.109  -1.309
  371    H    MET  50           H        MET  50 -12.893 -30.482   5.885
  372    HA   MET  50           HA       MET  50 -11.405 -28.597   7.411
  373   1HB   MET  50          2HB       MET  50 -13.778 -30.354   7.985
  374   2HB   MET  50          1HB       MET  50 -13.057 -29.388   9.269
  375   1HG   MET  50          2HG       MET  50 -13.249 -27.394   7.672
  376   2HG   MET  50          1HG       MET  50 -14.283 -28.422   6.682
  377   1HE   MET  50          1HE       MET  50 -13.666 -26.411   9.688
  378   2HE   MET  50          3HE       MET  50 -15.064 -26.576  10.760
  379   3HE   MET  50          2HE       MET  50 -13.869 -27.866  10.661
  380    H    ALA  51           H        ALA  51 -11.863 -32.096   7.843
  381    HA   ALA  51           HA       ALA  51 -10.312 -32.375  10.207
  382   1HB   ALA  51          3HB       ALA  51 -11.350 -34.372   9.783
  383   2HB   ALA  51          1HB       ALA  51  -9.841 -34.735   8.947
  384   3HB   ALA  51          2HB       ALA  51 -11.241 -34.172   8.035
  385    H    GLU  52           H        GLU  52  -9.384 -31.735   6.942
  386    HA   GLU  52           HA       GLU  52  -6.561 -32.494   7.476
  387   1HB   GLU  52          2HB       GLU  52  -8.116 -31.731   5.015
  388   2HB   GLU  52          1HB       GLU  52  -6.356 -31.613   5.018
  389   1HG   GLU  52          2HG       GLU  52  -6.403 -34.037   5.937
  390   2HG   GLU  52          1HG       GLU  52  -8.075 -34.065   5.378
  391    H    ILE  53           H        ILE  53  -8.604 -29.686   6.863
  392    HA   ILE  53           HA       ILE  53  -6.360 -27.812   6.920
  393    HB   ILE  53           HB       ILE  53  -9.351 -27.357   7.072
  394   1HG1  ILE  53          2HG1      ILE  53  -7.444 -27.121   4.731
  395   2HG1  ILE  53          1HG1      ILE  53  -8.535 -28.481   4.995
  396   1HG2  ILE  53          2HG2      ILE  53  -7.837 -25.526   7.959
  397   2HG2  ILE  53          1HG2      ILE  53  -7.167 -25.399   6.332
  398   3HG2  ILE  53          3HG2      ILE  53  -8.875 -25.054   6.614
  399   1HD1  ILE  53          1HD1      ILE  53 -10.363 -26.593   5.177
  400   2HD1  ILE  53          3HD1      ILE  53  -9.187 -25.644   4.267
  401   3HD1  ILE  53          2HD1      ILE  53  -9.823 -27.144   3.591
  402    H    ASP  54           H        ASP  54  -8.764 -29.055   9.167
  403    HA   ASP  54           HA       ASP  54  -8.463 -27.161  11.262
  404   1HB   ASP  54          2HB       ASP  54 -10.123 -29.168  10.933
  405   2HB   ASP  54          1HB       ASP  54  -8.886 -30.095  11.771
  406    H    THR  55           H        THR  55  -6.339 -26.622  11.765
  407    HA   THR  55           HA       THR  55  -4.182 -28.513  11.890
  408    HB   THR  55           HB       THR  55  -2.955 -26.668  13.029
  409    HG1  THR  55           HG1      THR  55  -4.009 -24.939  13.718
  410   1HG2  THR  55          1HG2      THR  55  -4.635 -25.896  10.628
  411   2HG2  THR  55          3HG2      THR  55  -3.199 -25.024  11.167
  412   3HG2  THR  55          2HG2      THR  55  -3.058 -26.686  10.595
  413    H    ASP  56           H        ASP  56  -6.150 -27.008  14.453
  414    HA   ASP  56           HA       ASP  56  -4.828 -28.689  16.476
  415   1HB   ASP  56          2HB       ASP  56  -5.952 -27.400  18.091
  416   2HB   ASP  56          1HB       ASP  56  -5.666 -26.245  16.790
  417    H    GLY  57           H        GLY  57  -7.948 -28.459  14.848
  418   1HA   GLY  57          1HA       GLY  57  -8.512 -31.237  15.744
  419   2HA   GLY  57          2HA       GLY  57  -9.254 -30.449  14.356
  420    H    ASP  58           H        ASP  58  -9.770 -27.957  16.017
  421    HA   ASP  58           HA       ASP  58 -11.592 -28.868  18.119
  422   1HB   ASP  58          2HB       ASP  58 -12.065 -26.560  18.511
  423   2HB   ASP  58          1HB       ASP  58 -10.350 -26.630  18.119
  424    H    GLY  59           H        GLY  59 -11.778 -28.931  14.819
  425   1HA   GLY  59          1HA       GLY  59 -14.742 -28.995  14.941
  426   2HA   GLY  59          2HA       GLY  59 -13.755 -29.744  13.689
  427    H    PHE  60           H        PHE  60 -12.530 -26.684  14.307
  428    HA   PHE  60           HA       PHE  60 -14.009 -25.624  11.949
  429   1HB   PHE  60          2HB       PHE  60 -13.329 -23.943  14.365
  430   2HB   PHE  60          1HB       PHE  60 -14.323 -23.491  12.979
  431    HD1  PHE  60           HD1      PHE  60 -14.152 -25.623  16.002
  432    HD2  PHE  60           HD2      PHE  60 -16.609 -24.196  12.785
  433    HE1  PHE  60           HE1      PHE  60 -16.161 -26.520  17.141
  434    HE2  PHE  60           HE2      PHE  60 -18.618 -25.093  13.919
  435    HZ   PHE  60           HZ       PHE  60 -18.398 -26.257  16.099
  436    H    ILE  61           H        ILE  61 -12.908 -23.923  10.788
  437    HA   ILE  61           HA       ILE  61  -9.956 -24.048  11.121
  438    HB   ILE  61           HB       ILE  61 -11.502 -23.193   8.666
  439   1HG1  ILE  61          2HG1      ILE  61 -12.087 -25.519   9.206
  440   2HG1  ILE  61          1HG1      ILE  61 -11.035 -25.467   7.792
  441   1HG2  ILE  61          3HG2      ILE  61  -9.095 -22.498   8.940
  442   2HG2  ILE  61          2HG2      ILE  61  -8.664 -24.206   8.987
  443   3HG2  ILE  61          1HG2      ILE  61  -9.388 -23.520   7.534
  444   1HD1  ILE  61          3HD1      ILE  61  -9.082 -25.832   9.385
  445   2HD1  ILE  61          2HD1      ILE  61 -10.276 -26.172  10.636
  446   3HD1  ILE  61          1HD1      ILE  61 -10.178 -27.204   9.208
  447    H    SER  62           H        SER  62  -8.956 -22.141  11.679
  448    HA   SER  62           HA       SER  62 -10.633 -19.702  11.818
  449   1HB   SER  62          2HB       SER  62  -7.845 -20.187  12.916
  450   2HB   SER  62          1HB       SER  62  -8.893 -18.815  13.278
  451    HG   SER  62           HG       SER  62  -8.964 -21.408  14.218
  452    H    PHE  63           H        PHE  63  -9.363 -17.620  11.226
  453    HA   PHE  63           HA       PHE  63  -8.676 -17.706   8.481
  454   1HB   PHE  63          2HB       PHE  63  -9.285 -15.611   9.654
  455   2HB   PHE  63          1HB       PHE  63  -7.762 -15.676  10.545
  456    HD1  PHE  63           HD1      PHE  63  -8.772 -16.241   6.979
  457    HD2  PHE  63           HD2      PHE  63  -6.184 -14.175   9.713
  458    HE1  PHE  63           HE1      PHE  63  -7.615 -15.166   5.070
  459    HE2  PHE  63           HE2      PHE  63  -5.020 -13.105   7.802
  460    HZ   PHE  63           HZ       PHE  63  -5.742 -13.598   5.479
  461    H    GLN  64           H        GLN  64  -6.608 -17.735  11.366
  462    HA   GLN  64           HA       GLN  64  -4.104 -17.751  10.019
  463   1HB   GLN  64          2HB       GLN  64  -4.489 -17.437  12.497
  464   2HB   GLN  64          1HB       GLN  64  -4.770 -19.174  12.610
  465   1HG   GLN  64          2HG       GLN  64  -2.445 -18.772  13.150
  466   2HG   GLN  64          1HG       GLN  64  -2.501 -19.526  11.557
  467   1HE2  GLN  64          1HE2      GLN  64  -1.067 -18.512  10.153
  468   2HE2  GLN  64          2HE2      GLN  64  -0.728 -16.848  10.131
  469    H    GLU  65           H        GLU  65  -6.119 -20.477  11.182
  470    HA   GLU  65           HA       GLU  65  -4.455 -22.570  10.241
  471   1HB   GLU  65          2HB       GLU  65  -7.421 -22.340  10.709
  472   2HB   GLU  65          1HB       GLU  65  -6.715 -23.825  10.086
  473   1HG   GLU  65          2HG       GLU  65  -5.213 -23.935  12.046
  474   2HG   GLU  65          1HG       GLU  65  -5.928 -22.450  12.672
  475    H    PHE  66           H        PHE  66  -7.145 -20.872   8.641
  476    HA   PHE  66           HA       PHE  66  -7.011 -22.340   6.190
  477   1HB   PHE  66          2HB       PHE  66  -8.922 -20.880   6.839
  478   2HB   PHE  66          1HB       PHE  66  -7.892 -19.468   6.607
  479    HD1  PHE  66           HD1      PHE  66  -7.024 -18.902   4.346
  480    HD2  PHE  66           HD2      PHE  66  -9.825 -22.097   4.967
  481    HE1  PHE  66           HE1      PHE  66  -7.534 -18.926   1.919
  482    HE2  PHE  66           HE2      PHE  66 -10.336 -22.121   2.540
  483    HZ   PHE  66           HZ       PHE  66  -9.190 -20.535   1.016
  484    H    THR  67           H        THR  67  -5.295 -19.491   7.364
  485    HA   THR  67           HA       THR  67  -4.061 -18.793   4.865
  486    HB   THR  67           HB       THR  67  -3.206 -18.306   7.734
  487    HG1  THR  67           HG1      THR  67  -4.610 -16.778   7.572
  488   1HG2  THR  67          2HG2      THR  67  -2.121 -17.157   5.146
  489   2HG2  THR  67          1HG2      THR  67  -1.706 -16.580   6.761
  490   3HG2  THR  67          3HG2      THR  67  -1.252 -18.210   6.264
  491    H    ASP  68           H        ASP  68  -2.910 -20.737   7.636
  492    HA   ASP  68           HA       ASP  68  -0.388 -21.434   6.526
  493   1HB   ASP  68          2HB       ASP  68  -2.173 -23.005   8.407
  494   2HB   ASP  68          1HB       ASP  68  -0.481 -23.380   8.085
  495    H    PHE  69           H        PHE  69  -3.595 -22.862   6.104
  496    HA   PHE  69           HA       PHE  69  -2.594 -25.098   4.533
  497   1HB   PHE  69          2HB       PHE  69  -4.597 -25.715   5.484
  498   2HB   PHE  69          1HB       PHE  69  -5.230 -24.072   5.462
  499    HD1  PHE  69           HD1      PHE  69  -5.846 -23.075   3.174
  500    HD2  PHE  69           HD2      PHE  69  -5.295 -27.272   3.869
  501    HE1  PHE  69           HE1      PHE  69  -7.144 -23.584   1.117
  502    HE2  PHE  69           HE2      PHE  69  -6.587 -27.786   1.818
  503    HZ   PHE  69           HZ       PHE  69  -7.514 -25.943   0.439
  504    H    GLY  70           H        GLY  70  -3.996 -21.913   3.913
  505   1HA   GLY  70          1HA       GLY  70  -4.012 -20.622   1.951
  506   2HA   GLY  70          2HA       GLY  70  -4.396 -22.130   1.118
  507    H    ARG  71           H        ARG  71  -1.469 -21.796   3.000
  508    HA   ARG  71           HA       ARG  71   0.244 -21.017   0.797
  509   1HB   ARG  71          2HB       ARG  71   0.912 -22.386   3.423
  510   2HB   ARG  71          1HB       ARG  71   2.089 -21.674   2.320
  511   1HG   ARG  71          2HG       ARG  71   0.943 -19.473   2.578
  512   2HG   ARG  71          1HG       ARG  71  -0.147 -20.206   3.753
  513   1HD   ARG  71          2HD       ARG  71   2.869 -19.981   3.998
  514   2HD   ARG  71          1HD       ARG  71   1.675 -19.076   4.929
  515    HE   ARG  71           HE       ARG  71   1.103 -21.803   5.347
  516   1HH1  ARG  71          1HH1      ARG  71   2.657 -19.228   6.762
  517   2HH1  ARG  71          2HH1      ARG  71   3.716 -20.167   7.761
  518   1HH2  ARG  71          1HH2      ARG  71   2.909 -23.180   6.244
  519   2HH2  ARG  71          2HH2      ARG  71   3.858 -22.404   7.468
  520    H    ALA  72           H        ALA  72  -1.018 -24.026   2.025
  521    HA   ALA  72           HA       ALA  72   0.861 -25.752   0.643
  522   1HB   ALA  72          1HB       ALA  72  -0.156 -27.264   1.967
  523   2HB   ALA  72          2HB       ALA  72  -1.642 -27.069   1.038
  524   3HB   ALA  72          3HB       ALA  72  -1.344 -26.050   2.447
  525    H    ASN  73           H        ASN  73  -2.042 -24.050  -0.238
  526    HA   ASN  73           HA       ASN  73  -1.746 -25.072  -3.008
  527   1HB   ASN  73          2HB       ASN  73  -4.504 -24.875  -1.824
  528   2HB   ASN  73          1HB       ASN  73  -3.962 -25.801  -3.224
  529   1HD2  ASN  73          1HD2      ASN  73  -4.593 -25.982   0.155
  530   2HD2  ASN  73          2HD2      ASN  73  -3.920 -27.515   0.427
  531    H    ARG  74           H        ARG  74  -0.839 -22.675  -2.539
  532    HA   ARG  74           HA       ARG  74  -2.549 -20.462  -2.267
  533   1HB   ARG  74          2HB       ARG  74  -0.159 -20.639  -4.127
  534   2HB   ARG  74          1HB       ARG  74  -0.844 -19.169  -3.434
  535   1HG   ARG  74          2HG       ARG  74  -0.311 -20.006  -1.164
  536   2HG   ARG  74          1HG       ARG  74   0.404 -21.452  -1.874
  537   1HD   ARG  74          2HD       ARG  74   2.026 -20.024  -3.098
  538   2HD   ARG  74          1HD       ARG  74   1.332 -18.599  -2.324
  539    HE   ARG  74           HE       ARG  74   2.016 -20.275  -0.211
  540   1HH1  ARG  74          1HH1      ARG  74   3.615 -18.961  -2.975
  541   2HH1  ARG  74          2HH1      ARG  74   5.148 -18.823  -2.183
  542   1HH2  ARG  74          1HH2      ARG  74   4.002 -20.063   0.843
  543   2HH2  ARG  74          2HH2      ARG  74   5.368 -19.446  -0.025
  544    H    GLY  75           H        GLY  75  -2.244 -22.703  -4.877
  545   1HA   GLY  75          1HA       GLY  75  -3.164 -22.715  -7.042
  546   2HA   GLY  75          2HA       GLY  75  -3.445 -20.979  -6.899
  547    H    LEU  76           H        LEU  76  -4.578 -23.181  -4.440
  548    HA   LEU  76           HA       LEU  76  -7.237 -23.534  -5.541
  549   1HB   LEU  76          2HB       LEU  76  -6.064 -23.957  -2.787
  550   2HB   LEU  76          1HB       LEU  76  -7.761 -24.270  -3.150
  551    HG   LEU  76           HG       LEU  76  -5.443 -25.507  -4.664
  552   1HD1  LEU  76          1HD1      LEU  76  -6.181 -26.097  -2.076
  553   2HD1  LEU  76          3HD1      LEU  76  -7.159 -27.231  -3.008
  554   3HD1  LEU  76          2HD1      LEU  76  -5.405 -27.229  -3.183
  555   1HD2  LEU  76          2HD2      LEU  76  -8.377 -25.476  -4.954
  556   2HD2  LEU  76          1HD2      LEU  76  -7.133 -25.849  -6.147
  557   3HD2  LEU  76          3HD2      LEU  76  -7.663 -27.087  -5.006
  558    H    LEU  77           H        LEU  77  -5.863 -21.410  -3.036
  559    HA   LEU  77           HA       LEU  77  -8.319 -20.109  -2.378
  560   1HB   LEU  77          2HB       LEU  77  -5.580 -18.835  -2.248
  561   2HB   LEU  77          1HB       LEU  77  -6.981 -18.483  -1.241
  562    HG   LEU  77           HG       LEU  77  -5.869 -19.854   0.219
  563   1HD1  LEU  77          3HD1      LEU  77  -7.990 -21.075  -0.810
  564   2HD1  LEU  77          2HD1      LEU  77  -6.769 -22.225  -1.356
  565   3HD1  LEU  77          1HD1      LEU  77  -6.953 -21.884   0.364
  566   1HD2  LEU  77          2HD2      LEU  77  -4.414 -20.591  -2.188
  567   2HD2  LEU  77          1HD2      LEU  77  -3.851 -20.511  -0.519
  568   3HD2  LEU  77          3HD2      LEU  77  -4.650 -21.967  -1.110
  569    H    LYS  78           H        LYS  78  -5.771 -19.299  -4.726
  570    HA   LYS  78           HA       LYS  78  -6.958 -16.835  -5.588
  571   1HB   LYS  78          2HB       LYS  78  -5.103 -18.762  -7.016
  572   2HB   LYS  78          1HB       LYS  78  -5.535 -17.168  -7.636
  573   1HG   LYS  78          2HG       LYS  78  -4.700 -16.215  -5.430
  574   2HG   LYS  78          1HG       LYS  78  -4.047 -17.814  -5.079
  575   1HD   LYS  78          2HD       LYS  78  -3.372 -16.150  -7.526
  576   2HD   LYS  78          1HD       LYS  78  -2.340 -16.337  -6.108
  577   1HE   LYS  78          2HE       LYS  78  -1.554 -18.304  -6.873
  578   2HE   LYS  78          1HE       LYS  78  -3.192 -18.930  -7.065
  579   1HZ   LYS  78          1HZ       LYS  78  -3.293 -17.614  -9.171
  580   2HZ   LYS  78          3HZ       LYS  78  -1.630 -17.326  -9.007
  581   3HZ   LYS  78          2HZ       LYS  78  -2.200 -18.915  -9.193
  582    H    ASP  79           H        ASP  79  -7.427 -20.195  -6.543
  583    HA   ASP  79           HA       ASP  79  -9.120 -19.511  -8.821
  584   1HB   ASP  79          2HB       ASP  79  -8.272 -22.025  -7.437
  585   2HB   ASP  79          1HB       ASP  79  -9.690 -22.075  -8.483
  586    H    VAL  80           H        VAL  80  -9.647 -20.804  -5.551
  587    HA   VAL  80           HA       VAL  80 -12.502 -20.942  -5.745
  588    HB   VAL  80           HB       VAL  80 -10.889 -21.934  -3.955
  589   1HG1  VAL  80          3HG1      VAL  80  -9.917 -19.758  -3.281
  590   2HG1  VAL  80          2HG1      VAL  80 -11.505 -19.237  -2.718
  591   3HG1  VAL  80          1HG1      VAL  80 -10.683 -20.578  -1.920
  592   1HG2  VAL  80          1HG2      VAL  80 -13.631 -20.787  -3.537
  593   2HG2  VAL  80          3HG2      VAL  80 -13.142 -22.476  -3.670
  594   3HG2  VAL  80          2HG2      VAL  80 -12.809 -21.575  -2.191
  595    H    ALA  81           H        ALA  81 -10.308 -18.437  -4.558
  596    HA   ALA  81           HA       ALA  81 -12.149 -16.568  -3.577
  597   1HB   ALA  81          1HB       ALA  81  -9.643 -16.327  -3.558
  598   2HB   ALA  81          3HB       ALA  81  -9.727 -15.878  -5.262
  599   3HB   ALA  81          2HB       ALA  81 -10.495 -14.861  -4.042
  600    H    LYS  82           H        LYS  82 -11.259 -17.233  -6.939
  601    HA   LYS  82           HA       LYS  82 -12.793 -15.049  -8.047
  602   1HB   LYS  82          2HB       LYS  82 -11.877 -17.647  -9.320
  603   2HB   LYS  82          1HB       LYS  82 -12.514 -16.255 -10.196
  604   1HG   LYS  82          2HG       LYS  82 -10.666 -14.869  -9.197
  605   2HG   LYS  82          1HG       LYS  82  -9.990 -16.350  -8.519
  606   1HD   LYS  82          2HD       LYS  82  -9.766 -17.301 -10.773
  607   2HD   LYS  82          1HD       LYS  82 -10.498 -15.856 -11.469
  608   1HE   LYS  82          2HE       LYS  82  -8.131 -15.573 -11.698
  609   2HE   LYS  82          1HE       LYS  82  -8.617 -14.532 -10.361
  610   1HZ   LYS  82          2HZ       LYS  82  -7.903 -17.268  -9.681
  611   2HZ   LYS  82          1HZ       LYS  82  -6.628 -16.267 -10.190
  612   3HZ   LYS  82          3HZ       LYS  82  -7.574 -15.821  -8.855
  613    H    ILE  83           H        ILE  83 -13.561 -18.292  -6.999
  614    HA   ILE  83           HA       ILE  83 -16.007 -18.648  -8.439
  615    HB   ILE  83           HB       ILE  83 -15.064 -19.693  -5.758
  616   1HG1  ILE  83          2HG1      ILE  83 -15.315 -20.912  -8.521
  617   2HG1  ILE  83          1HG1      ILE  83 -13.813 -20.510  -7.689
  618   1HG2  ILE  83          1HG2      ILE  83 -17.690 -19.880  -7.113
  619   2HG2  ILE  83          3HG2      ILE  83 -17.025 -21.411  -6.545
  620   3HG2  ILE  83          2HG2      ILE  83 -17.286 -20.087  -5.410
  621   1HD1  ILE  83          2HD1      ILE  83 -15.301 -22.116  -5.897
  622   2HD1  ILE  83          1HD1      ILE  83 -15.411 -22.903  -7.472
  623   3HD1  ILE  83          3HD1      ILE  83 -13.832 -22.563  -6.765
  624    H    PHE  84           H        PHE  84 -15.195 -16.869  -5.528
  625    HA   PHE  84           HA       PHE  84 -18.068 -16.119  -5.213
  626   1HB   PHE  84          2HB       PHE  84 -15.768 -15.809  -3.259
  627   2HB   PHE  84          1HB       PHE  84 -17.458 -15.421  -2.936
  628    HD1  PHE  84           HD1      PHE  84 -15.380 -18.269  -4.231
  629    HD2  PHE  84           HD2      PHE  84 -18.767 -17.043  -1.891
  630    HE1  PHE  84           HE1      PHE  84 -15.798 -20.631  -3.599
  631    HE2  PHE  84           HE2      PHE  84 -19.185 -19.404  -1.259
  632    HZ   PHE  84           HZ       PHE  84 -17.700 -21.198  -2.113

  No H/Q in entry =         632
  Start of MODEL   19
    1    H1   ALA   1          1H        ALA   1   7.063 -12.603   4.378
    2    H2   ALA   1          3H        ALA   1   5.735 -13.650   4.503
    3    H3   ALA   1          2H        ALA   1   6.854 -13.546   5.777
    4    HA   ALA   1           HA       ALA   1   8.513 -14.655   4.597
    5   1HB   ALA   1          3HB       ALA   1   5.933 -15.974   3.709
    6   2HB   ALA   1          1HB       ALA   1   6.545 -16.060   5.361
    7   3HB   ALA   1          2HB       ALA   1   7.478 -16.757   4.037
    8    H    ASP   2           H        ASP   2   8.152 -16.241   2.256
    9    HA   ASP   2           HA       ASP   2   9.070 -14.521   0.226
   10   1HB   ASP   2          2HB       ASP   2   7.556 -17.130  -0.105
   11   2HB   ASP   2          1HB       ASP   2   8.546 -16.356  -1.342
   12    H    ASP   3           H        ASP   3   5.803 -15.217   1.253
   13    HA   ASP   3           HA       ASP   3   4.584 -14.060  -1.149
   14   1HB   ASP   3          2HB       ASP   3   2.463 -14.342   0.092
   15   2HB   ASP   3          1HB       ASP   3   3.416 -15.826   0.117
   16    H    HIS   4           H        HIS   4   3.109 -12.133  -0.931
   17    HA   HIS   4           HA       HIS   4   4.406 -10.093   0.819
   18   1HB   HIS   4          2HB       HIS   4   2.517  -8.974  -1.063
   19   2HB   HIS   4          1HB       HIS   4   4.247  -8.681  -0.932
   20    HD1  HIS   4           HD1      HIS   4   1.788 -10.121  -3.148
   21    HD2  HIS   4           HD2      HIS   4   5.797 -10.893  -2.301
   22    HE1  HIS   4           HE1      HIS   4   2.675 -11.496  -5.080
   23    HA   PRO   5           HA       PRO   5   0.746  -9.358   3.209
   24   1HB   PRO   5          2HB       PRO   5   0.282  -6.701   3.020
   25   2HB   PRO   5          1HB       PRO   5   1.622  -7.377   3.953
   26   1HG   PRO   5          2HG       PRO   5   1.629  -6.206   1.195
   27   2HG   PRO   5          1HG       PRO   5   2.784  -5.958   2.508
   28   1HD   PRO   5          1HD       PRO   5   3.288  -7.647   0.465
   29   2HD   PRO   5          2HD       PRO   5   3.872  -7.962   2.099
   30    H    GLN   6           H        GLN   6   0.699  -8.254  -0.105
   31    HA   GLN   6           HA       GLN   6  -2.062  -7.560  -0.315
   32   1HB   GLN   6          2HB       GLN   6   0.122  -8.298  -2.190
   33   2HB   GLN   6          1HB       GLN   6  -1.522  -8.525  -2.788
   34   1HG   GLN   6          2HG       GLN   6  -2.057  -6.242  -2.545
   35   2HG   GLN   6          1HG       GLN   6  -0.720  -5.954  -1.432
   36   1HE2  GLN   6          1HE2      GLN   6   1.478  -6.972  -2.753
   37   2HE2  GLN   6          2HE2      GLN   6   1.695  -6.200  -4.248
   38    H    ASP   7           H        ASP   7  -0.363 -10.651  -0.556
   39    HA   ASP   7           HA       ASP   7  -2.493 -12.244  -1.529
   40   1HB   ASP   7          2HB       ASP   7  -0.244 -12.924   0.383
   41   2HB   ASP   7          1HB       ASP   7  -1.333 -14.127  -0.308
   42    H    LYS   8           H        LYS   8  -1.536 -11.724   1.870
   43    HA   LYS   8           HA       LYS   8  -3.527 -13.102   3.194
   44   1HB   LYS   8          2HB       LYS   8  -2.196 -10.473   3.775
   45   2HB   LYS   8          1HB       LYS   8  -3.484 -11.052   4.833
   46   1HG   LYS   8          2HG       LYS   8  -2.200 -13.259   4.950
   47   2HG   LYS   8          1HG       LYS   8  -0.855 -12.405   4.195
   48   1HD   LYS   8          2HD       LYS   8  -0.890 -10.746   6.035
   49   2HD   LYS   8          1HD       LYS   8  -2.212 -11.630   6.796
   50   1HE   LYS   8          2HE       LYS   8  -0.763 -13.071   7.738
   51   2HE   LYS   8          1HE       LYS   8  -0.063 -13.449   6.164
   52   1HZ   LYS   8          3HZ       LYS   8   0.642 -11.094   7.829
   53   2HZ   LYS   8          2HZ       LYS   8   1.572 -12.510   7.691
   54   3HZ   LYS   8          1HZ       LYS   8   1.338 -11.506   6.340
   55    H    ALA   9           H        ALA   9  -3.857 -10.008   1.528
   56    HA   ALA   9           HA       ALA   9  -6.479  -9.361   2.442
   57   1HB   ALA   9          1HB       ALA   9  -5.585  -8.759  -0.368
   58   2HB   ALA   9          3HB       ALA   9  -6.529  -7.754   0.730
   59   3HB   ALA   9          2HB       ALA   9  -4.799  -7.964   0.996
   60    H    GLU  10           H        GLU  10  -5.392 -11.214  -0.385
   61    HA   GLU  10           HA       GLU  10  -8.078 -11.837  -1.267
   62   1HB   GLU  10          2HB       GLU  10  -5.545 -13.403  -1.837
   63   2HB   GLU  10          1HB       GLU  10  -7.022 -13.379  -2.801
   64   1HG   GLU  10          2HG       GLU  10  -6.669 -10.935  -3.197
   65   2HG   GLU  10          1HG       GLU  10  -5.135 -11.050  -2.334
   66    H    ARG  11           H        ARG  11  -5.734 -13.378   0.863
   67    HA   ARG  11           HA       ARG  11  -7.224 -15.842   1.161
   68   1HB   ARG  11          2HB       ARG  11  -5.044 -14.536   2.802
   69   2HB   ARG  11          1HB       ARG  11  -5.750 -16.095   3.223
   70   1HG   ARG  11          2HG       ARG  11  -5.180 -16.839   0.850
   71   2HG   ARG  11          1HG       ARG  11  -4.225 -15.367   0.713
   72   1HD   ARG  11          2HD       ARG  11  -3.855 -17.383   2.942
   73   2HD   ARG  11          1HD       ARG  11  -2.923 -17.417   1.444
   74    HE   ARG  11           HE       ARG  11  -2.788 -14.798   2.573
   75   1HH1  ARG  11          1HH1      ARG  11  -1.836 -18.050   3.219
   76   2HH1  ARG  11          2HH1      ARG  11  -0.343 -17.603   3.974
   77   1HH2  ARG  11          1HH2      ARG  11  -0.803 -14.201   3.484
   78   2HH2  ARG  11          2HH2      ARG  11   0.241 -15.426   4.125
   79    H    GLU  12           H        GLU  12  -7.039 -12.817   2.999
   80    HA   GLU  12           HA       GLU  12  -8.780 -13.698   5.112
   81   1HB   GLU  12          2HB       GLU  12  -8.871 -11.353   5.742
   82   2HB   GLU  12          1HB       GLU  12  -7.219 -11.748   5.287
   83   1HG   GLU  12          2HG       GLU  12  -7.544 -10.767   3.087
   84   2HG   GLU  12          1HG       GLU  12  -9.254 -10.493   3.422
   85    H    ARG  13           H        ARG  13  -9.298 -12.029   2.030
   86    HA   ARG  13           HA       ARG  13 -12.091 -11.505   2.454
   87   1HB   ARG  13          2HB       ARG  13 -10.339 -11.694   0.009
   88   2HB   ARG  13          1HB       ARG  13 -12.083 -11.484  -0.148
   89   1HG   ARG  13          2HG       ARG  13 -12.048  -9.359   0.768
   90   2HG   ARG  13          1HG       ARG  13 -10.618  -9.690   1.745
   91   1HD   ARG  13          2HD       ARG  13  -9.441  -8.578   0.167
   92   2HD   ARG  13          1HD       ARG  13  -9.714  -9.973  -0.876
   93    HE   ARG  13           HE       ARG  13 -11.778  -7.838  -0.834
   94   1HH1  ARG  13          1HH1      ARG  13  -9.215  -7.078  -2.280
   95   2HH1  ARG  13          2HH1      ARG  13  -9.583  -7.564  -3.902
   96   1HH2  ARG  13          1HH2      ARG  13 -12.275  -9.544  -2.980
   97   2HH2  ARG  13          2HH2      ARG  13 -11.316  -8.959  -4.298
   98    H    ILE  14           H        ILE  14 -10.336 -14.210   0.960
   99    HA   ILE  14           HA       ILE  14 -12.729 -15.639   0.194
  100    HB   ILE  14           HB       ILE  14  -9.951 -16.730   0.739
  101   1HG1  ILE  14          2HG1      ILE  14 -11.042 -16.058  -1.976
  102   2HG1  ILE  14          1HG1      ILE  14 -10.322 -14.787  -0.992
  103   1HG2  ILE  14          2HG2      ILE  14 -12.362 -18.044   0.203
  104   2HG2  ILE  14          1HG2      ILE  14 -11.540 -17.981  -1.355
  105   3HG2  ILE  14          3HG2      ILE  14 -10.743 -18.722   0.033
  106   1HD1  ILE  14          3HD1      ILE  14  -8.571 -16.997  -0.811
  107   2HD1  ILE  14          2HD1      ILE  14  -9.006 -16.861  -2.514
  108   3HD1  ILE  14          1HD1      ILE  14  -8.292 -15.485  -1.673
  109    H    PHE  15           H        PHE  15 -10.499 -15.880   2.971
  110    HA   PHE  15           HA       PHE  15 -11.916 -18.007   4.266
  111   1HB   PHE  15          2HB       PHE  15  -9.605 -17.357   4.883
  112   2HB   PHE  15          1HB       PHE  15 -10.213 -15.824   5.517
  113    HD1  PHE  15           HD1      PHE  15 -11.613 -15.774   7.552
  114    HD2  PHE  15           HD2      PHE  15 -10.015 -19.458   6.030
  115    HE1  PHE  15           HE1      PHE  15 -12.167 -16.901   9.693
  116    HE2  PHE  15           HE2      PHE  15 -10.565 -20.584   8.170
  117    HZ   PHE  15           HZ       PHE  15 -11.646 -19.309  10.002
  118    H    LYS  16           H        LYS  16 -12.268 -14.497   4.316
  119    HA   LYS  16           HA       LYS  16 -14.125 -14.381   6.502
  120   1HB   LYS  16          2HB       LYS  16 -13.441 -12.559   4.212
  121   2HB   LYS  16          1HB       LYS  16 -14.838 -12.200   5.226
  122   1HG   LYS  16          2HG       LYS  16 -13.311 -12.416   7.236
  123   2HG   LYS  16          1HG       LYS  16 -11.956 -12.501   6.111
  124   1HD   LYS  16          2HD       LYS  16 -12.770 -10.309   5.128
  125   2HD   LYS  16          1HD       LYS  16 -13.901 -10.208   6.477
  126   1HE   LYS  16          2HE       LYS  16 -11.732 -10.649   7.922
  127   2HE   LYS  16          1HE       LYS  16 -10.906 -10.028   6.493
  128   1HZ   LYS  16          1HZ       LYS  16 -13.216  -8.533   7.463
  129   2HZ   LYS  16          3HZ       LYS  16 -11.802  -8.451   8.393
  130   3HZ   LYS  16          2HZ       LYS  16 -11.774  -7.972   6.764
  131    H    ARG  17           H        ARG  17 -14.490 -15.044   3.065
  132    HA   ARG  17           HA       ARG  17 -17.371 -14.798   3.026
  133   1HB   ARG  17          2HB       ARG  17 -15.410 -16.238   1.221
  134   2HB   ARG  17          1HB       ARG  17 -17.145 -16.184   0.908
  135   1HG   ARG  17          2HG       ARG  17 -16.991 -13.661   1.023
  136   2HG   ARG  17          1HG       ARG  17 -15.238 -13.835   1.076
  137   1HD   ARG  17          2HD       ARG  17 -15.598 -15.330  -1.053
  138   2HD   ARG  17          1HD       ARG  17 -17.137 -14.475  -1.163
  139    HE   ARG  17           HE       ARG  17 -15.320 -12.430  -0.859
  140   1HH1  ARG  17          1HH1      ARG  17 -13.354 -14.387  -2.096
  141   2HH1  ARG  17          2HH1      ARG  17 -13.500 -14.001  -3.778
  142   1HH2  ARG  17          1HH2      ARG  17 -16.473 -12.260  -3.391
  143   2HH2  ARG  17          2HH2      ARG  17 -15.266 -12.797  -4.511
  144    H    PHE  18           H        PHE  18 -15.103 -17.430   3.654
  145    HA   PHE  18           HA       PHE  18 -17.051 -19.539   3.704
  146   1HB   PHE  18          2HB       PHE  18 -14.298 -19.211   4.888
  147   2HB   PHE  18          1HB       PHE  18 -15.262 -20.652   5.211
  148    HD1  PHE  18           HD1      PHE  18 -16.251 -21.892   3.148
  149    HD2  PHE  18           HD2      PHE  18 -13.035 -19.054   2.919
  150    HE1  PHE  18           HE1      PHE  18 -15.585 -22.824   0.947
  151    HE2  PHE  18           HE2      PHE  18 -12.369 -19.986   0.719
  152    HZ   PHE  18           HZ       PHE  18 -13.645 -21.871  -0.266
  153    H    ASP  19           H        ASP  19 -15.641 -17.544   6.299
  154    HA   ASP  19           HA       ASP  19 -17.106 -18.726   8.438
  155   1HB   ASP  19          2HB       ASP  19 -15.163 -16.962   8.479
  156   2HB   ASP  19          1HB       ASP  19 -16.474 -15.782   8.408
  157    H    ALA  20           H        ALA  20 -19.308 -18.995   8.162
  158    HA   ALA  20           HA       ALA  20 -20.984 -17.163   6.745
  159   1HB   ALA  20          1HB       ALA  20 -21.431 -19.621   7.249
  160   2HB   ALA  20          3HB       ALA  20 -21.906 -19.104   8.868
  161   3HB   ALA  20          2HB       ALA  20 -22.801 -18.530   7.461
  162    H    ASN  21           H        ASN  21 -20.666 -17.701  10.300
  163    HA   ASN  21           HA       ASN  21 -22.317 -15.301  10.735
  164   1HB   ASN  21          2HB       ASN  21 -22.209 -15.845  13.093
  165   2HB   ASN  21          1HB       ASN  21 -22.559 -17.316  12.193
  166   1HD2  ASN  21          1HD2      ASN  21 -21.270 -17.017  14.858
  167   2HD2  ASN  21          2HD2      ASN  21 -19.763 -17.781  14.731
  168    H    GLY  22           H        GLY  22 -18.947 -16.207  10.782
  169   1HA   GLY  22          1HA       GLY  22 -18.259 -13.345  11.044
  170   2HA   GLY  22          2HA       GLY  22 -17.155 -14.626  10.557
  171    H    ASP  23           H        ASP  23 -17.653 -16.397  12.758
  172    HA   ASP  23           HA       ASP  23 -16.920 -14.773  15.133
  173   1HB   ASP  23          2HB       ASP  23 -17.193 -16.858  16.420
  174   2HB   ASP  23          1HB       ASP  23 -18.635 -16.504  15.473
  175    H    GLY  24           H        GLY  24 -15.293 -15.919  12.595
  176   1HA   GLY  24          1HA       GLY  24 -12.804 -16.167  14.170
  177   2HA   GLY  24          2HA       GLY  24 -12.901 -15.913  12.429
  178    H    LYS  25           H        LYS  25 -15.047 -18.358  13.368
  179    HA   LYS  25           HA       LYS  25 -13.034 -20.410  12.565
  180   1HB   LYS  25          2HB       LYS  25 -13.992 -21.977  14.153
  181   2HB   LYS  25          1HB       LYS  25 -13.567 -20.501  15.018
  182   1HG   LYS  25          2HG       LYS  25 -15.819 -19.799  15.154
  183   2HG   LYS  25          1HG       LYS  25 -16.334 -20.918  13.892
  184   1HD   LYS  25          2HD       LYS  25 -15.426 -22.746  15.575
  185   2HD   LYS  25          1HD       LYS  25 -15.690 -21.472  16.769
  186   1HE   LYS  25          2HE       LYS  25 -18.027 -21.260  15.515
  187   2HE   LYS  25          1HE       LYS  25 -17.684 -22.936  15.084
  188   1HZ   LYS  25          1HZ       LYS  25 -17.619 -21.868  17.852
  189   2HZ   LYS  25          3HZ       LYS  25 -18.934 -22.699  17.177
  190   3HZ   LYS  25          2HZ       LYS  25 -17.445 -23.492  17.384
  191    H    ILE  26           H        ILE  26 -13.748 -21.949  11.122
  192    HA   ILE  26           HA       ILE  26 -16.532 -21.581  10.089
  193    HB   ILE  26           HB       ILE  26 -14.272 -22.844   8.545
  194   1HG1  ILE  26          2HG1      ILE  26 -14.958 -19.900   8.783
  195   2HG1  ILE  26          1HG1      ILE  26 -13.431 -20.665   9.222
  196   1HG2  ILE  26          2HG2      ILE  26 -16.883 -21.471   7.856
  197   2HG2  ILE  26          1HG2      ILE  26 -15.667 -21.888   6.649
  198   3HG2  ILE  26          3HG2      ILE  26 -16.455 -23.160   7.584
  199   1HD1  ILE  26          3HD1      ILE  26 -14.127 -21.360   6.510
  200   2HD1  ILE  26          2HD1      ILE  26 -14.157 -19.607   6.701
  201   3HD1  ILE  26          1HD1      ILE  26 -12.697 -20.513   7.099
  202    H    SER  27           H        SER  27 -17.859 -23.336  10.134
  203    HA   SER  27           HA       SER  27 -16.710 -25.902  11.116
  204   1HB   SER  27          2HB       SER  27 -18.787 -26.365  12.084
  205   2HB   SER  27          1HB       SER  27 -18.713 -24.610  12.245
  206    HG   SER  27           HG       SER  27 -20.303 -24.432  10.902
  207    H    ALA  28           H        ALA  28 -17.794 -27.897  10.132
  208    HA   ALA  28           HA       ALA  28 -17.431 -28.000   7.359
  209   1HB   ALA  28          2HB       ALA  28 -18.914 -29.682   9.327
  210   2HB   ALA  28          3HB       ALA  28 -17.621 -30.135   8.216
  211   3HB   ALA  28          1HB       ALA  28 -19.270 -29.942   7.620
  212    H    ALA  29           H        ALA  29 -20.436 -27.392   9.157
  213    HA   ALA  29           HA       ALA  29 -22.160 -27.191   6.917
  214   1HB   ALA  29          3HB       ALA  29 -23.221 -27.240   9.029
  215   2HB   ALA  29          2HB       ALA  29 -22.204 -25.946   9.662
  216   3HB   ALA  29          1HB       ALA  29 -23.458 -25.581   8.477
  217    H    GLU  30           H        GLU  30 -20.067 -24.771   8.452
  218    HA   GLU  30           HA       GLU  30 -20.967 -22.628   6.715
  219   1HB   GLU  30          2HB       GLU  30 -18.495 -22.897   8.449
  220   2HB   GLU  30          1HB       GLU  30 -18.961 -21.420   7.608
  221   1HG   GLU  30          2HG       GLU  30 -21.130 -21.440   8.830
  222   2HG   GLU  30          1HG       GLU  30 -20.597 -22.867   9.714
  223    H    LEU  31           H        LEU  31 -17.918 -24.502   6.869
  224    HA   LEU  31           HA       LEU  31 -16.868 -23.461   4.425
  225   1HB   LEU  31          2HB       LEU  31 -15.421 -24.650   5.980
  226   2HB   LEU  31          1HB       LEU  31 -16.385 -26.116   5.813
  227    HG   LEU  31           HG       LEU  31 -15.827 -26.089   3.344
  228   1HD1  LEU  31          1HD1      LEU  31 -14.376 -23.670   4.281
  229   2HD1  LEU  31          3HD1      LEU  31 -13.513 -24.701   3.140
  230   3HD1  LEU  31          2HD1      LEU  31 -15.079 -24.020   2.701
  231   1HD2  LEU  31          2HD2      LEU  31 -14.591 -27.396   5.191
  232   2HD2  LEU  31          1HD2      LEU  31 -13.742 -27.177   3.660
  233   3HD2  LEU  31          3HD2      LEU  31 -13.335 -26.168   5.049
  234    H    GLY  32           H        GLY  32 -18.817 -26.351   5.121
  235   1HA   GLY  32          1HA       GLY  32 -20.087 -27.705   3.687
  236   2HA   GLY  32          2HA       GLY  32 -18.885 -27.350   2.448
  237    H    GLU  33           H        GLU  33 -21.043 -25.124   4.197
  238    HA   GLU  33           HA       GLU  33 -22.974 -24.775   2.164
  239   1HB   GLU  33          2HB       GLU  33 -22.039 -23.211   4.504
  240   2HB   GLU  33          1HB       GLU  33 -22.887 -22.293   3.260
  241   1HG   GLU  33          2HG       GLU  33 -24.694 -24.091   3.345
  242   2HG   GLU  33          1HG       GLU  33 -23.897 -24.696   4.797
  243    H    ALA  34           H        ALA  34 -19.894 -23.065   2.676
  244    HA   ALA  34           HA       ALA  34 -20.253 -21.374   0.344
  245   1HB   ALA  34          1HB       ALA  34 -18.583 -20.326   1.457
  246   2HB   ALA  34          3HB       ALA  34 -18.257 -21.758   2.432
  247   3HB   ALA  34          2HB       ALA  34 -17.502 -21.579   0.849
  248    H    LEU  35           H        LEU  35 -18.611 -24.423   1.045
  249    HA   LEU  35           HA       LEU  35 -17.300 -24.761  -1.449
  250   1HB   LEU  35          2HB       LEU  35 -18.206 -26.561   0.746
  251   2HB   LEU  35          1HB       LEU  35 -17.825 -27.313  -0.802
  252    HG   LEU  35           HG       LEU  35 -15.939 -25.327   0.460
  253   1HD1  LEU  35          2HD1      LEU  35 -16.514 -27.252   2.043
  254   2HD1  LEU  35          1HD1      LEU  35 -15.788 -28.324   0.846
  255   3HD1  LEU  35          3HD1      LEU  35 -14.809 -27.081   1.626
  256   1HD2  LEU  35          1HD2      LEU  35 -15.702 -26.040  -1.941
  257   2HD2  LEU  35          3HD2      LEU  35 -14.307 -26.446  -0.942
  258   3HD2  LEU  35          2HD2      LEU  35 -15.473 -27.695  -1.375
  259    H    LYS  36           H        LYS  36 -20.654 -25.338  -0.483
  260    HA   LYS  36           HA       LYS  36 -21.586 -26.966  -2.532
  261   1HB   LYS  36          2HB       LYS  36 -22.729 -25.074  -0.710
  262   2HB   LYS  36          1HB       LYS  36 -23.449 -24.820  -2.300
  263   1HG   LYS  36          2HG       LYS  36 -24.028 -27.192  -2.452
  264   2HG   LYS  36          1HG       LYS  36 -23.226 -27.510  -0.914
  265   1HD   LYS  36          2HD       LYS  36 -25.101 -25.345  -0.589
  266   2HD   LYS  36          1HD       LYS  36 -25.919 -26.724  -1.324
  267   1HE   LYS  36          2HE       LYS  36 -24.217 -27.755   0.705
  268   2HE   LYS  36          1HE       LYS  36 -25.081 -26.388   1.405
  269   1HZ   LYS  36          2HZ       LYS  36 -27.096 -27.490   0.204
  270   2HZ   LYS  36          1HZ       LYS  36 -26.143 -28.892   0.307
  271   3HZ   LYS  36          3HZ       LYS  36 -26.582 -28.061   1.720
  272    H    THR  37           H        THR  37 -20.363 -23.714  -2.790
  273    HA   THR  37           HA       THR  37 -21.527 -22.841  -5.194
  274    HB   THR  37           HB       THR  37 -19.871 -21.585  -3.711
  275    HG1  THR  37           HG1      THR  37 -20.250 -20.480  -5.482
  276   1HG2  THR  37          1HG2      THR  37 -18.217 -23.609  -3.973
  277   2HG2  THR  37          3HG2      THR  37 -17.739 -22.779  -5.454
  278   3HG2  THR  37          2HG2      THR  37 -17.579 -21.966  -3.897
  279    H    LEU  38           H        LEU  38 -19.255 -25.404  -4.630
  280    HA   LEU  38           HA       LEU  38 -18.138 -25.616  -7.253
  281   1HB   LEU  38          2HB       LEU  38 -18.664 -27.709  -5.126
  282   2HB   LEU  38          1HB       LEU  38 -17.770 -28.034  -6.612
  283    HG   LEU  38           HG       LEU  38 -17.042 -26.073  -4.421
  284   1HD1  LEU  38          2HD1      LEU  38 -15.797 -28.591  -5.545
  285   2HD1  LEU  38          1HD1      LEU  38 -14.905 -27.465  -4.522
  286   3HD1  LEU  38          3HD1      LEU  38 -16.327 -28.295  -3.890
  287   1HD2  LEU  38          1HD2      LEU  38 -15.945 -26.427  -7.218
  288   2HD2  LEU  38          3HD2      LEU  38 -16.533 -24.943  -6.465
  289   3HD2  LEU  38          2HD2      LEU  38 -15.016 -25.665  -5.928
  290    H    GLY  39           H        GLY  39 -21.191 -26.685  -5.877
  291   1HA   GLY  39          1HA       GLY  39 -22.392 -26.969  -8.481
  292   2HA   GLY  39          2HA       GLY  39 -23.135 -27.446  -6.954
  293    H    SER  40           H        SER  40 -20.291 -28.984  -6.806
  294    HA   SER  40           HA       SER  40 -21.471 -31.519  -7.715
  295   1HB   SER  40          2HB       SER  40 -19.434 -30.062  -9.252
  296   2HB   SER  40          1HB       SER  40 -18.975 -31.723  -8.874
  297    HG   SER  40           HG       SER  40 -21.035 -30.750 -10.458
  298    H    ILE  41           H        ILE  41 -21.000 -30.986  -5.135
  299    HA   ILE  41           HA       ILE  41 -18.607 -32.651  -4.553
  300    HB   ILE  41           HB       ILE  41 -18.217 -30.082  -4.272
  301   1HG1  ILE  41          2HG1      ILE  41 -17.675 -31.789  -1.839
  302   2HG1  ILE  41          1HG1      ILE  41 -16.840 -32.055  -3.369
  303   1HG2  ILE  41          3HG2      ILE  41 -20.496 -30.125  -2.851
  304   2HG2  ILE  41          2HG2      ILE  41 -19.360 -30.464  -1.543
  305   3HG2  ILE  41          1HG2      ILE  41 -19.195 -28.988  -2.496
  306   1HD1  ILE  41          3HD1      ILE  41 -16.932 -29.250  -2.384
  307   2HD1  ILE  41          2HD1      ILE  41 -15.915 -30.367  -1.473
  308   3HD1  ILE  41          1HD1      ILE  41 -15.627 -30.116  -3.195
  309    H    THR  42           H        THR  42 -18.689 -33.319  -2.142
  310    HA   THR  42           HA       THR  42 -21.537 -33.702  -1.311
  311    HB   THR  42           HB       THR  42 -21.276 -35.957  -1.193
  312    HG1  THR  42           HG1      THR  42 -19.047 -36.719  -0.443
  313   1HG2  THR  42          2HG2      THR  42 -20.186 -35.426  -3.390
  314   2HG2  THR  42          1HG2      THR  42 -18.624 -35.466  -2.571
  315   3HG2  THR  42          3HG2      THR  42 -19.609 -36.927  -2.666
  316    HA   PRO  43           HA       PRO  43 -20.321 -32.294   2.708
  317   1HB   PRO  43          2HB       PRO  43 -21.553 -34.026   4.384
  318   2HB   PRO  43          1HB       PRO  43 -22.428 -32.788   3.480
  319   1HG   PRO  43          2HG       PRO  43 -22.091 -35.702   2.866
  320   2HG   PRO  43          1HG       PRO  43 -23.548 -34.708   2.763
  321   1HD   PRO  43          1HD       PRO  43 -22.093 -35.331   0.576
  322   2HD   PRO  43          2HD       PRO  43 -22.927 -33.783   0.730
  323    H    ASP  44           H        ASP  44 -19.965 -35.754   2.088
  324    HA   ASP  44           HA       ASP  44 -18.172 -36.317   4.241
  325   1HB   ASP  44          2HB       ASP  44 -18.460 -37.660   1.537
  326   2HB   ASP  44          1HB       ASP  44 -17.565 -38.326   2.903
  327    H    GLU  45           H        GLU  45 -17.656 -34.797   1.112
  328    HA   GLU  45           HA       GLU  45 -14.753 -35.190   1.232
  329   1HB   GLU  45          2HB       GLU  45 -16.454 -33.409  -0.543
  330   2HB   GLU  45          1HB       GLU  45 -14.731 -33.718  -0.759
  331   1HG   GLU  45          2HG       GLU  45 -15.247 -36.158  -0.968
  332   2HG   GLU  45          1HG       GLU  45 -16.965 -35.767  -0.889
  333    H    VAL  46           H        VAL  46 -17.117 -32.653   1.871
  334    HA   VAL  46           HA       VAL  46 -15.220 -30.577   2.449
  335    HB   VAL  46           HB       VAL  46 -18.088 -31.033   3.291
  336   1HG1  VAL  46          1HG1      VAL  46 -16.838 -29.706   5.012
  337   2HG1  VAL  46          3HG1      VAL  46 -16.402 -28.553   3.751
  338   3HG1  VAL  46          2HG1      VAL  46 -18.095 -28.773   4.198
  339   1HG2  VAL  46          3HG2      VAL  46 -16.744 -29.933   0.987
  340   2HG2  VAL  46          2HG2      VAL  46 -18.474 -30.171   1.246
  341   3HG2  VAL  46          1HG2      VAL  46 -17.700 -28.675   1.771
  342    H    LYS  47           H        LYS  47 -16.709 -33.122   4.370
  343    HA   LYS  47           HA       LYS  47 -15.752 -32.219   6.929
  344   1HB   LYS  47          2HB       LYS  47 -16.526 -34.969   5.918
  345   2HB   LYS  47          1HB       LYS  47 -16.107 -34.636   7.599
  346   1HG   LYS  47          2HG       LYS  47 -17.920 -32.955   7.708
  347   2HG   LYS  47          1HG       LYS  47 -18.348 -33.316   6.036
  348   1HD   LYS  47          2HD       LYS  47 -18.739 -35.699   6.709
  349   2HD   LYS  47          1HD       LYS  47 -18.452 -35.232   8.385
  350   1HE   LYS  47          2HE       LYS  47 -20.440 -34.077   8.547
  351   2HE   LYS  47          1HE       LYS  47 -20.441 -33.633   6.840
  352   1HZ   LYS  47          3HZ       LYS  47 -20.650 -36.469   7.364
  353   2HZ   LYS  47          2HZ       LYS  47 -21.977 -35.551   7.900
  354   3HZ   LYS  47          1HZ       LYS  47 -21.509 -35.500   6.267
  355    H    HIS  48           H        HIS  48 -14.406 -34.341   4.439
  356    HA   HIS  48           HA       HIS  48 -12.091 -35.145   5.945
  357   1HB   HIS  48          2HB       HIS  48 -12.783 -36.381   3.953
  358   2HB   HIS  48          1HB       HIS  48 -12.532 -34.953   2.950
  359    HD1  HIS  48           HD1      HIS  48 -10.901 -37.962   3.541
  360    HD2  HIS  48           HD2      HIS  48  -9.575 -34.012   3.676
  361    HE1  HIS  48           HE1      HIS  48  -8.382 -38.043   3.298
  362    H    MET  49           H        MET  49 -12.717 -32.470   3.679
  363    HA   MET  49           HA       MET  49 -10.063 -31.454   3.580
  364   1HB   MET  49          2HB       MET  49 -12.791 -30.232   3.226
  365   2HB   MET  49          1HB       MET  49 -11.350 -29.221   3.192
  366   1HG   MET  49          2HG       MET  49 -10.438 -30.957   1.485
  367   2HG   MET  49          1HG       MET  49 -12.121 -31.460   1.328
  368   1HE   MET  49          3HE       MET  49 -13.954 -30.252   0.419
  369   2HE   MET  49          2HE       MET  49 -13.878 -28.951   1.604
  370   3HE   MET  49          1HE       MET  49 -14.002 -28.565  -0.111
  371    H    MET  50           H        MET  50 -12.764 -30.743   5.772
  372    HA   MET  50           HA       MET  50 -11.413 -28.778   7.340
  373   1HB   MET  50          2HB       MET  50 -13.793 -30.532   7.687
  374   2HB   MET  50          1HB       MET  50 -13.091 -29.843   9.151
  375   1HG   MET  50          2HG       MET  50 -13.122 -27.594   7.894
  376   2HG   MET  50          1HG       MET  50 -14.197 -28.391   6.745
  377   1HE   MET  50          1HE       MET  50 -13.379 -27.011   9.909
  378   2HE   MET  50          3HE       MET  50 -14.880 -26.726  10.800
  379   3HE   MET  50          2HE       MET  50 -14.038 -28.267  10.954
  380    H    ALA  51           H        ALA  51 -11.750 -32.290   7.789
  381    HA   ALA  51           HA       ALA  51 -10.224 -32.469  10.190
  382   1HB   ALA  51          1HB       ALA  51 -11.542 -34.365   9.442
  383   2HB   ALA  51          2HB       ALA  51  -9.849 -34.857   9.489
  384   3HB   ALA  51          3HB       ALA  51 -10.613 -34.473   7.947
  385    H    GLU  52           H        GLU  52  -9.297 -31.844   6.939
  386    HA   GLU  52           HA       GLU  52  -6.463 -32.557   7.468
  387   1HB   GLU  52          2HB       GLU  52  -8.043 -31.835   5.015
  388   2HB   GLU  52          1HB       GLU  52  -6.290 -31.646   5.008
  389   1HG   GLU  52          2HG       GLU  52  -6.241 -34.074   5.927
  390   2HG   GLU  52          1HG       GLU  52  -7.909 -34.165   5.363
  391    H    ILE  53           H        ILE  53  -8.555 -29.783   6.857
  392    HA   ILE  53           HA       ILE  53  -6.336 -27.879   6.926
  393    HB   ILE  53           HB       ILE  53  -9.336 -27.466   7.042
  394   1HG1  ILE  53          2HG1      ILE  53  -7.389 -27.204   4.736
  395   2HG1  ILE  53          1HG1      ILE  53  -8.483 -28.564   4.973
  396   1HG2  ILE  53          3HG2      ILE  53  -7.025 -25.553   6.623
  397   2HG2  ILE  53          2HG2      ILE  53  -8.715 -25.140   6.328
  398   3HG2  ILE  53          1HG2      ILE  53  -8.176 -25.548   7.959
  399   1HD1  ILE  53          1HD1      ILE  53  -9.443 -25.700   4.800
  400   2HD1  ILE  53          3HD1      ILE  53  -9.327 -26.758   3.394
  401   3HD1  ILE  53          2HD1      ILE  53 -10.414 -27.171   4.720
  402    H    ASP  54           H        ASP  54  -8.746 -29.152   9.151
  403    HA   ASP  54           HA       ASP  54  -8.481 -27.255  11.248
  404   1HB   ASP  54          2HB       ASP  54 -10.116 -29.286  10.893
  405   2HB   ASP  54          1HB       ASP  54  -8.882 -30.187  11.764
  406    H    THR  55           H        THR  55  -6.371 -26.701  11.766
  407    HA   THR  55           HA       THR  55  -4.189 -28.552  11.888
  408    HB   THR  55           HB       THR  55  -3.000 -26.710  13.050
  409    HG1  THR  55           HG1      THR  55  -4.119 -24.893  13.609
  410   1HG2  THR  55          3HG2      THR  55  -3.295 -26.738  10.566
  411   2HG2  THR  55          2HG2      THR  55  -4.732 -25.736  10.764
  412   3HG2  THR  55          1HG2      THR  55  -3.149 -25.109  11.225
  413    H    ASP  56           H        ASP  56  -6.192 -27.128  14.473
  414    HA   ASP  56           HA       ASP  56  -4.861 -28.856  16.457
  415   1HB   ASP  56          2HB       ASP  56  -5.995 -27.609  18.111
  416   2HB   ASP  56          1HB       ASP  56  -5.648 -26.423  16.855
  417    H    GLY  57           H        GLY  57  -8.037 -28.518  14.939
  418   1HA   GLY  57          1HA       GLY  57  -8.603 -31.324  15.766
  419   2HA   GLY  57          2HA       GLY  57  -9.350 -30.508  14.397
  420    H    ASP  58           H        ASP  58  -9.849 -28.030  16.038
  421    HA   ASP  58           HA       ASP  58 -11.633 -28.923  18.184
  422   1HB   ASP  58          2HB       ASP  58 -12.112 -26.590  18.538
  423   2HB   ASP  58          1HB       ASP  58 -10.384 -26.716  18.219
  424    H    GLY  59           H        GLY  59 -11.872 -28.938  14.874
  425   1HA   GLY  59          1HA       GLY  59 -14.837 -28.974  15.052
  426   2HA   GLY  59          2HA       GLY  59 -13.883 -29.735  13.780
  427    H    PHE  60           H        PHE  60 -12.571 -26.717  14.377
  428    HA   PHE  60           HA       PHE  60 -14.073 -25.601  12.061
  429   1HB   PHE  60          2HB       PHE  60 -13.289 -23.953  14.470
  430   2HB   PHE  60          1HB       PHE  60 -14.296 -23.461  13.108
  431    HD1  PHE  60           HD1      PHE  60 -16.579 -24.309  12.851
  432    HD2  PHE  60           HD2      PHE  60 -14.157 -25.396  16.225
  433    HE1  PHE  60           HE1      PHE  60 -18.592 -25.152  14.023
  434    HE2  PHE  60           HE2      PHE  60 -16.171 -26.237  17.400
  435    HZ   PHE  60           HZ       PHE  60 -18.391 -26.117  16.299
  436    H    ILE  61           H        ILE  61 -12.947 -23.972  10.864
  437    HA   ILE  61           HA       ILE  61  -9.990 -24.147  11.142
  438    HB   ILE  61           HB       ILE  61 -11.567 -23.298   8.705
  439   1HG1  ILE  61          2HG1      ILE  61 -12.202 -25.598   9.304
  440   2HG1  ILE  61          1HG1      ILE  61 -11.185 -25.599   7.863
  441   1HG2  ILE  61          2HG2      ILE  61  -8.713 -24.217   9.161
  442   2HG2  ILE  61          1HG2      ILE  61  -9.424 -23.939   7.571
  443   3HG2  ILE  61          3HG2      ILE  61  -9.238 -22.598   8.700
  444   1HD1  ILE  61          3HD1      ILE  61  -9.206 -25.942   9.477
  445   2HD1  ILE  61          2HD1      ILE  61 -10.422 -26.335  10.692
  446   3HD1  ILE  61          1HD1      ILE  61 -10.284 -27.318   9.233
  447    H    SER  62           H        SER  62  -8.932 -22.241  11.613
  448    HA   SER  62           HA       SER  62 -10.574 -19.770  11.737
  449   1HB   SER  62          2HB       SER  62  -7.792 -20.230  12.851
  450   2HB   SER  62          1HB       SER  62  -8.894 -18.911  13.244
  451    HG   SER  62           HG       SER  62  -9.635 -21.597  13.637
  452    H    PHE  63           H        PHE  63  -9.320 -17.727  11.095
  453    HA   PHE  63           HA       PHE  63  -8.567 -17.867   8.376
  454   1HB   PHE  63          2HB       PHE  63  -9.173 -15.741   9.508
  455   2HB   PHE  63          1HB       PHE  63  -7.656 -15.805  10.410
  456    HD1  PHE  63           HD1      PHE  63  -8.651 -16.436   6.852
  457    HD2  PHE  63           HD2      PHE  63  -6.054 -14.343   9.554
  458    HE1  PHE  63           HE1      PHE  63  -7.468 -15.423   4.927
  459    HE2  PHE  63           HE2      PHE  63  -4.862 -13.335   7.629
  460    HZ   PHE  63           HZ       PHE  63  -5.576 -13.871   5.312
  461    H    GLN  64           H        GLN  64  -6.564 -17.873  11.300
  462    HA   GLN  64           HA       GLN  64  -4.028 -17.930  10.022
  463   1HB   GLN  64          2HB       GLN  64  -4.475 -17.600  12.488
  464   2HB   GLN  64          1HB       GLN  64  -4.786 -19.331  12.603
  465   1HG   GLN  64          2HG       GLN  64  -2.465 -18.917  13.211
  466   2HG   GLN  64          1HG       GLN  64  -2.500 -19.747  11.655
  467   1HE2  GLN  64          1HE2      GLN  64  -1.013 -18.829  10.240
  468   2HE2  GLN  64          2HE2      GLN  64  -0.645 -17.176  10.144
  469    H    GLU  65           H        GLU  65  -6.096 -20.632  11.156
  470    HA   GLU  65           HA       GLU  65  -4.430 -22.739  10.245
  471   1HB   GLU  65          2HB       GLU  65  -7.418 -22.516  10.624
  472   2HB   GLU  65          1HB       GLU  65  -6.652 -24.014  10.114
  473   1HG   GLU  65          2HG       GLU  65  -5.224 -23.964  12.139
  474   2HG   GLU  65          1HG       GLU  65  -6.031 -22.484  12.657
  475    H    PHE  66           H        PHE  66  -7.114 -21.054   8.621
  476    HA   PHE  66           HA       PHE  66  -6.941 -22.505   6.162
  477   1HB   PHE  66          2HB       PHE  66  -8.882 -21.102   6.737
  478   2HB   PHE  66          1HB       PHE  66  -7.870 -19.660   6.660
  479    HD1  PHE  66           HD1      PHE  66  -6.991 -18.842   4.513
  480    HD2  PHE  66           HD2      PHE  66  -9.563 -22.276   4.716
  481    HE1  PHE  66           HE1      PHE  66  -7.371 -18.701   2.067
  482    HE2  PHE  66           HE2      PHE  66  -9.945 -22.135   2.269
  483    HZ   PHE  66           HZ       PHE  66  -8.848 -20.348   0.945
  484    H    THR  67           H        THR  67  -5.212 -19.705   7.411
  485    HA   THR  67           HA       THR  67  -3.971 -18.944   4.928
  486    HB   THR  67           HB       THR  67  -3.045 -18.541   7.791
  487    HG1  THR  67           HG1      THR  67  -4.590 -17.023   5.975
  488   1HG2  THR  67          1HG2      THR  67  -1.331 -18.334   5.859
  489   2HG2  THR  67          3HG2      THR  67  -2.244 -16.898   5.396
  490   3HG2  THR  67          2HG2      THR  67  -1.475 -16.981   6.981
  491    H    ASP  68           H        ASP  68  -2.825 -20.940   7.667
  492    HA   ASP  68           HA       ASP  68  -0.311 -21.634   6.540
  493   1HB   ASP  68          2HB       ASP  68  -2.067 -23.330   8.341
  494   2HB   ASP  68          1HB       ASP  68  -0.331 -23.521   8.104
  495    H    PHE  69           H        PHE  69  -3.528 -23.048   6.123
  496    HA   PHE  69           HA       PHE  69  -2.537 -25.241   4.477
  497   1HB   PHE  69          2HB       PHE  69  -4.504 -25.913   5.467
  498   2HB   PHE  69          1HB       PHE  69  -5.158 -24.279   5.512
  499    HD1  PHE  69           HD1      PHE  69  -5.852 -23.225   3.265
  500    HD2  PHE  69           HD2      PHE  69  -5.236 -27.432   3.833
  501    HE1  PHE  69           HE1      PHE  69  -7.202 -23.695   1.233
  502    HE2  PHE  69           HE2      PHE  69  -6.580 -27.908   1.807
  503    HZ   PHE  69           HZ       PHE  69  -7.566 -26.040   0.504
  504    H    GLY  70           H        GLY  70  -4.026 -22.073   3.974
  505   1HA   GLY  70          1HA       GLY  70  -4.194 -20.760   2.035
  506   2HA   GLY  70          2HA       GLY  70  -4.442 -22.272   1.161
  507    H    ARG  71           H        ARG  71  -1.573 -21.576   3.074
  508    HA   ARG  71           HA       ARG  71   0.072 -20.643   0.908
  509   1HB   ARG  71          2HB       ARG  71   0.747 -21.952   3.555
  510   2HB   ARG  71          1HB       ARG  71   1.973 -21.351   2.439
  511   1HG   ARG  71          2HG       ARG  71   0.827 -19.107   2.514
  512   2HG   ARG  71          1HG       ARG  71  -0.215 -19.743   3.786
  513   1HD   ARG  71          2HD       ARG  71   2.814 -19.613   3.902
  514   2HD   ARG  71          1HD       ARG  71   1.713 -18.513   4.734
  515    HE   ARG  71           HE       ARG  71   1.178 -21.292   5.389
  516   1HH1  ARG  71          1HH1      ARG  71   3.711 -19.041   5.779
  517   2HH1  ARG  71          2HH1      ARG  71   3.880 -19.299   7.483
  518   1HH2  ARG  71          1HH2      ARG  71   1.149 -21.425   7.698
  519   2HH2  ARG  71          2HH2      ARG  71   2.429 -20.649   8.570
  520    H    ALA  72           H        ALA  72  -0.662 -23.839   2.211
  521    HA   ALA  72           HA       ALA  72   1.267 -25.289   0.652
  522   1HB   ALA  72          2HB       ALA  72   0.473 -26.959   1.938
  523   2HB   ALA  72          3HB       ALA  72  -1.069 -26.884   1.086
  524   3HB   ALA  72          1HB       ALA  72  -0.807 -25.895   2.523
  525    H    ASN  73           H        ASN  73  -1.734 -23.783  -0.123
  526    HA   ASN  73           HA       ASN  73  -1.484 -24.768  -2.907
  527   1HB   ASN  73          2HB       ASN  73  -4.215 -24.741  -1.650
  528   2HB   ASN  73          1HB       ASN  73  -3.650 -25.635  -3.062
  529   1HD2  ASN  73          1HD2      ASN  73  -4.415 -25.994   0.204
  530   2HD2  ASN  73          2HD2      ASN  73  -3.559 -27.426   0.513
  531    H    ARG  74           H        ARG  74  -0.726 -22.296  -2.278
  532    HA   ARG  74           HA       ARG  74  -2.581 -20.222  -1.996
  533   1HB   ARG  74          2HB       ARG  74  -0.976 -18.814  -3.269
  534   2HB   ARG  74          1HB       ARG  74  -0.160 -19.815  -2.069
  535   1HG   ARG  74          2HG       ARG  74   0.161 -21.528  -3.959
  536   2HG   ARG  74          1HG       ARG  74  -0.304 -20.230  -5.059
  537   1HD   ARG  74          2HD       ARG  74   2.093 -20.183  -4.920
  538   2HD   ARG  74          1HD       ARG  74   1.508 -18.815  -3.973
  539    HE   ARG  74           HE       ARG  74   2.012 -20.096  -1.939
  540   1HH1  ARG  74          1HH1      ARG  74   4.253 -20.284  -4.265
  541   2HH1  ARG  74          2HH1      ARG  74   4.886 -21.845  -3.857
  542   1HH2  ARG  74          1HH2      ARG  74   2.292 -22.623  -1.690
  543   2HH2  ARG  74          2HH2      ARG  74   3.774 -23.170  -2.400
  544    H    GLY  75           H        GLY  75  -1.774 -22.124  -4.843
  545   1HA   GLY  75          1HA       GLY  75  -2.790 -22.253  -6.938
  546   2HA   GLY  75          2HA       GLY  75  -3.244 -20.560  -6.743
  547    H    LEU  76           H        LEU  76  -4.181 -22.968  -4.383
  548    HA   LEU  76           HA       LEU  76  -6.749 -23.612  -5.514
  549   1HB   LEU  76          2HB       LEU  76  -5.498 -23.876  -2.797
  550   2HB   LEU  76          1HB       LEU  76  -7.228 -24.161  -2.988
  551    HG   LEU  76           HG       LEU  76  -5.013 -25.555  -4.524
  552   1HD1  LEU  76          1HD1      LEU  76  -5.681 -26.080  -1.987
  553   2HD1  LEU  76          3HD1      LEU  76  -6.986 -26.963  -2.778
  554   3HD1  LEU  76          2HD1      LEU  76  -5.307 -27.372  -3.128
  555   1HD2  LEU  76          1HD2      LEU  76  -8.001 -25.501  -4.775
  556   2HD2  LEU  76          3HD2      LEU  76  -6.775 -25.552  -6.042
  557   3HD2  LEU  76          2HD2      LEU  76  -7.147 -27.006  -5.115
  558    H    LEU  77           H        LEU  77  -5.743 -21.284  -3.017
  559    HA   LEU  77           HA       LEU  77  -8.341 -20.233  -2.507
  560   1HB   LEU  77          2HB       LEU  77  -5.698 -18.763  -2.311
  561   2HB   LEU  77          1HB       LEU  77  -7.188 -18.370  -1.458
  562    HG   LEU  77           HG       LEU  77  -6.122 -19.562   0.194
  563   1HD1  LEU  77          3HD1      LEU  77  -8.209 -20.848  -0.746
  564   2HD1  LEU  77          2HD1      LEU  77  -7.007 -22.043  -1.234
  565   3HD1  LEU  77          1HD1      LEU  77  -7.184 -21.615   0.467
  566   1HD2  LEU  77          2HD2      LEU  77  -4.466 -20.403  -1.975
  567   2HD2  LEU  77          1HD2      LEU  77  -4.113 -20.435  -0.247
  568   3HD2  LEU  77          3HD2      LEU  77  -4.897 -21.817  -1.012
  569    H    LYS  78           H        LYS  78  -5.805 -19.241  -4.796
  570    HA   LYS  78           HA       LYS  78  -7.152 -16.933  -5.796
  571   1HB   LYS  78          2HB       LYS  78  -5.198 -18.815  -7.153
  572   2HB   LYS  78          1HB       LYS  78  -5.710 -17.265  -7.821
  573   1HG   LYS  78          2HG       LYS  78  -4.911 -16.191  -5.666
  574   2HG   LYS  78          1HG       LYS  78  -4.197 -17.747  -5.241
  575   1HD   LYS  78          2HD       LYS  78  -3.599 -16.345  -7.855
  576   2HD   LYS  78          1HD       LYS  78  -2.637 -16.085  -6.399
  577   1HE   LYS  78          2HE       LYS  78  -2.660 -18.775  -6.407
  578   2HE   LYS  78          1HE       LYS  78  -2.833 -18.496  -8.140
  579   1HZ   LYS  78          2HZ       LYS  78  -0.804 -17.001  -6.629
  580   2HZ   LYS  78          1HZ       LYS  78  -0.488 -18.609  -7.076
  581   3HZ   LYS  78          3HZ       LYS  78  -0.814 -17.447  -8.268
  582    H    ASP  79           H        ASP  79  -7.470 -20.356  -6.527
  583    HA   ASP  79           HA       ASP  79  -9.120 -19.942  -8.888
  584   1HB   ASP  79          2HB       ASP  79  -7.784 -22.022  -8.484
  585   2HB   ASP  79          1HB       ASP  79  -8.870 -22.414  -7.151
  586    H    VAL  80           H        VAL  80  -9.702 -20.566  -5.457
  587    HA   VAL  80           HA       VAL  80 -12.574 -20.835  -5.751
  588    HB   VAL  80           HB       VAL  80 -10.960 -20.117  -3.286
  589   1HG1  VAL  80          1HG1      VAL  80 -13.771 -20.320  -3.785
  590   2HG1  VAL  80          3HG1      VAL  80 -13.295 -21.676  -2.762
  591   3HG1  VAL  80          2HG1      VAL  80 -12.955 -20.022  -2.251
  592   1HG2  VAL  80          2HG2      VAL  80 -11.318 -22.620  -4.794
  593   2HG2  VAL  80          1HG2      VAL  80 -10.101 -22.198  -3.588
  594   3HG2  VAL  80          3HG2      VAL  80 -11.692 -22.763  -3.077
  595    H    ALA  81           H        ALA  81 -10.376 -18.184  -4.937
  596    HA   ALA  81           HA       ALA  81 -12.203 -16.222  -4.136
  597   1HB   ALA  81          3HB       ALA  81 -10.114 -15.325  -6.043
  598   2HB   ALA  81          1HB       ALA  81  -9.544 -16.214  -4.631
  599   3HB   ALA  81          2HB       ALA  81 -10.484 -14.737  -4.422
  600    H    LYS  82           H        LYS  82 -11.306 -17.126  -7.461
  601    HA   LYS  82           HA       LYS  82 -12.963 -15.161  -8.738
  602   1HB   LYS  82          2HB       LYS  82 -12.032 -17.866  -9.750
  603   2HB   LYS  82          1HB       LYS  82 -12.718 -16.587 -10.751
  604   1HG   LYS  82          2HG       LYS  82 -10.874 -15.073 -10.003
  605   2HG   LYS  82          1HG       LYS  82 -10.161 -16.428  -9.126
  606   1HD   LYS  82          2HD       LYS  82 -10.161 -17.697 -11.336
  607   2HD   LYS  82          1HD       LYS  82 -10.568 -16.168 -12.115
  608   1HE   LYS  82          2HE       LYS  82  -8.317 -15.866 -12.217
  609   2HE   LYS  82          1HE       LYS  82  -8.462 -15.432 -10.514
  610   1HZ   LYS  82          3HZ       LYS  82  -8.365 -18.096 -10.371
  611   2HZ   LYS  82          2HZ       LYS  82  -7.381 -17.827 -11.729
  612   3HZ   LYS  82          1HZ       LYS  82  -7.002 -17.094 -10.243
  613    H    ILE  83           H        ILE  83 -13.624 -18.286  -7.334
  614    HA   ILE  83           HA       ILE  83 -16.116 -18.805  -8.651
  615    HB   ILE  83           HB       ILE  83 -15.325 -19.620  -5.845
  616   1HG1  ILE  83          2HG1      ILE  83 -14.596 -20.767  -8.548
  617   2HG1  ILE  83          1HG1      ILE  83 -13.508 -20.271  -7.254
  618   1HG2  ILE  83          3HG2      ILE  83 -17.659 -20.033  -7.361
  619   2HG2  ILE  83          2HG2      ILE  83 -16.766 -21.551  -7.455
  620   3HG2  ILE  83          1HG2      ILE  83 -17.196 -20.876  -5.884
  621   1HD1  ILE  83          3HD1      ILE  83 -14.865 -22.081  -5.867
  622   2HD1  ILE  83          2HD1      ILE  83 -15.200 -22.734  -7.470
  623   3HD1  ILE  83          1HD1      ILE  83 -13.534 -22.569  -6.917
  624    H    PHE  84           H        PHE  84 -15.370 -17.261  -5.532
  625    HA   PHE  84           HA       PHE  84 -18.173 -16.507  -5.134
  626   1HB   PHE  84          2HB       PHE  84 -15.629 -15.835  -3.631
  627   2HB   PHE  84          1HB       PHE  84 -17.225 -15.260  -3.150
  628    HD1  PHE  84           HD1      PHE  84 -15.149 -18.293  -3.685
  629    HD2  PHE  84           HD2      PHE  84 -18.809 -16.712  -2.085
  630    HE1  PHE  84           HE1      PHE  84 -15.582 -20.450  -2.542
  631    HE2  PHE  84           HE2      PHE  84 -19.241 -18.870  -0.942
  632    HZ   PHE  84           HZ       PHE  84 -17.628 -20.739  -1.171

  No H/Q in entry =         632
  Start of MODEL   20
    1    H1   ALA   1          1H        ALA   1   9.747 -12.871   3.325
    2    H2   ALA   1          3H        ALA   1  10.299 -14.231   4.176
    3    H3   ALA   1          2H        ALA   1  11.394 -13.287   3.282
    4    HA   ALA   1           HA       ALA   1  11.116 -14.909   1.759
    5   1HB   ALA   1          1HB       ALA   1   8.750 -16.029   1.601
    6   2HB   ALA   1          3HB       ALA   1   9.816 -16.460   2.939
    7   3HB   ALA   1          2HB       ALA   1   8.501 -15.311   3.192
    8    H    ASP   2           H        ASP   2   9.254 -15.252  -0.147
    9    HA   ASP   2           HA       ASP   2   8.951 -12.537  -1.237
   10   1HB   ASP   2          2HB       ASP   2   8.248 -13.691  -3.294
   11   2HB   ASP   2          1HB       ASP   2   9.748 -14.385  -2.679
   12    H    ASP   3           H        ASP   3   7.214 -13.963   0.993
   13    HA   ASP   3           HA       ASP   3   4.539 -13.951  -0.143
   14   1HB   ASP   3          2HB       ASP   3   5.498 -13.886   2.735
   15   2HB   ASP   3          1HB       ASP   3   3.819 -14.103   2.245
   16    H    HIS   4           H        HIS   4   3.198 -12.208  -0.375
   17    HA   HIS   4           HA       HIS   4   4.120  -9.614   0.787
   18   1HB   HIS   4          2HB       HIS   4   3.516 -10.281  -1.841
   19   2HB   HIS   4          1HB       HIS   4   2.038  -9.504  -1.276
   20    HD1  HIS   4           HD1      HIS   4   2.209  -7.178  -2.189
   21    HD2  HIS   4           HD2      HIS   4   5.760  -8.398  -0.380
   22    HE1  HIS   4           HE1      HIS   4   3.729  -5.156  -2.164
   23    HA   PRO   5           HA       PRO   5   0.485  -9.487   3.353
   24   1HB   PRO   5          2HB       PRO   5  -0.113  -6.843   3.274
   25   2HB   PRO   5          1HB       PRO   5   1.225  -7.497   4.224
   26   1HG   PRO   5          2HG       PRO   5   1.269  -6.235   1.499
   27   2HG   PRO   5          1HG       PRO   5   2.344  -5.941   2.872
   28   1HD   PRO   5          1HD       PRO   5   3.104  -7.532   0.862
   29   2HD   PRO   5          2HD       PRO   5   3.528  -7.925   2.528
   30    H    GLN   6           H        GLN   6   0.511  -8.325   0.106
   31    HA   GLN   6           HA       GLN   6  -2.230  -7.689  -0.286
   32   1HB   GLN   6          2HB       GLN   6   0.046  -8.566  -2.012
   33   2HB   GLN   6          1HB       GLN   6  -1.581  -8.675  -2.690
   34   1HG   GLN   6          2HG       GLN   6  -1.926  -6.372  -2.585
   35   2HG   GLN   6          1HG       GLN   6  -0.750  -6.153  -1.290
   36   1HE2  GLN   6          1HE2      GLN   6   1.043  -5.038  -2.066
   37   2HE2  GLN   6          2HE2      GLN   6   1.736  -5.249  -3.601
   38    H    ASP   7           H        ASP   7  -0.488 -10.764  -0.371
   39    HA   ASP   7           HA       ASP   7  -2.582 -12.407  -1.353
   40   1HB   ASP   7          2HB       ASP   7  -0.351 -13.041   0.597
   41   2HB   ASP   7          1HB       ASP   7  -1.379 -14.256  -0.160
   42    H    LYS   8           H        LYS   8  -1.671 -11.726   2.030
   43    HA   LYS   8           HA       LYS   8  -3.636 -13.156   3.370
   44   1HB   LYS   8          2HB       LYS   8  -2.347 -10.501   3.911
   45   2HB   LYS   8          1HB       LYS   8  -3.653 -11.055   4.959
   46   1HG   LYS   8          2HG       LYS   8  -2.338 -13.272   5.105
   47   2HG   LYS   8          1HG       LYS   8  -0.980 -12.360   4.447
   48   1HD   LYS   8          2HD       LYS   8  -1.262 -10.703   6.307
   49   2HD   LYS   8          1HD       LYS   8  -2.504 -11.748   6.997
   50   1HE   LYS   8          2HE       LYS   8  -0.404 -12.247   8.101
   51   2HE   LYS   8          1HE       LYS   8  -0.808 -13.607   7.052
   52   1HZ   LYS   8          3HZ       LYS   8   0.755 -11.493   5.827
   53   2HZ   LYS   8          2HZ       LYS   8   1.553 -12.381   7.035
   54   3HZ   LYS   8          1HZ       LYS   8   0.901 -13.176   5.682
   55    H    ALA   9           H        ALA   9  -3.993 -10.099   1.644
   56    HA   ALA   9           HA       ALA   9  -6.649  -9.489   2.485
   57   1HB   ALA   9          1HB       ALA   9  -5.485  -8.932  -0.256
   58   2HB   ALA   9          3HB       ALA   9  -6.760  -8.031   0.567
   59   3HB   ALA   9          2HB       ALA   9  -5.104  -7.967   1.169
   60    H    GLU  10           H        GLU  10  -5.444 -11.362  -0.283
   61    HA   GLU  10           HA       GLU  10  -8.071 -12.074  -1.243
   62   1HB   GLU  10          2HB       GLU  10  -5.484 -13.599  -1.658
   63   2HB   GLU  10          1HB       GLU  10  -6.923 -13.651  -2.676
   64   1HG   GLU  10          2HG       GLU  10  -6.621 -11.213  -3.146
   65   2HG   GLU  10          1HG       GLU  10  -5.116 -11.255  -2.226
   66    H    ARG  11           H        ARG  11  -5.768 -13.554   0.988
   67    HA   ARG  11           HA       ARG  11  -7.243 -16.014   1.324
   68   1HB   ARG  11          2HB       ARG  11  -5.157 -14.614   3.012
   69   2HB   ARG  11          1HB       ARG  11  -5.836 -16.184   3.434
   70   1HG   ARG  11          2HG       ARG  11  -5.131 -17.015   1.170
   71   2HG   ARG  11          1HG       ARG  11  -4.309 -15.480   0.911
   72   1HD   ARG  11          2HD       ARG  11  -3.665 -17.666   2.877
   73   2HD   ARG  11          1HD       ARG  11  -2.591 -16.843   1.746
   74    HE   ARG  11           HE       ARG  11  -3.753 -15.318   4.020
   75   1HH1  ARG  11          1HH1      ARG  11  -1.310 -15.457   1.754
   76   2HH1  ARG  11          2HH1      ARG  11  -0.017 -15.105   2.851
   77   1HH2  ARG  11          1HH2      ARG  11  -1.993 -15.370   5.687
   78   2HH2  ARG  11          2HH2      ARG  11  -0.404 -15.053   5.076
   79    H    GLU  12           H        GLU  12  -7.149 -12.927   3.050
   80    HA   GLU  12           HA       GLU  12  -8.939 -13.698   5.159
   81   1HB   GLU  12          2HB       GLU  12  -7.979 -11.088   4.024
   82   2HB   GLU  12          1HB       GLU  12  -9.315 -11.093   5.172
   83   1HG   GLU  12          2HG       GLU  12  -7.818 -12.544   6.670
   84   2HG   GLU  12          1HG       GLU  12  -6.495 -12.095   5.592
   85    H    ARG  13           H        ARG  13  -9.429 -12.177   1.991
   86    HA   ARG  13           HA       ARG  13 -12.247 -11.742   2.304
   87   1HB   ARG  13          2HB       ARG  13 -10.473 -12.055  -0.125
   88   2HB   ARG  13          1HB       ARG  13 -12.206 -11.755  -0.260
   89   1HG   ARG  13          2HG       ARG  13 -12.022  -9.656   0.878
   90   2HG   ARG  13          1HG       ARG  13 -10.369 -10.001   1.387
   91   1HD   ARG  13          2HD       ARG  13  -9.733  -8.844  -0.455
   92   2HD   ARG  13          1HD       ARG  13 -10.235 -10.269  -1.366
   93    HE   ARG  13           HE       ARG  13 -12.370  -8.323  -0.788
   94   1HH1  ARG  13          1HH1      ARG  13  -9.810  -7.682  -2.637
   95   2HH1  ARG  13          2HH1      ARG  13 -10.588  -7.805  -4.180
   96   1HH2  ARG  13          1HH2      ARG  13 -13.458  -9.282  -2.913
   97   2HH2  ARG  13          2HH2      ARG  13 -12.652  -8.712  -4.336
   98    H    ILE  14           H        ILE  14 -10.365 -14.453   0.996
   99    HA   ILE  14           HA       ILE  14 -12.679 -15.997   0.218
  100    HB   ILE  14           HB       ILE  14  -9.895 -16.974   0.923
  101   1HG1  ILE  14          2HG1      ILE  14 -10.869 -16.469  -1.867
  102   2HG1  ILE  14          1HG1      ILE  14 -10.268 -15.116  -0.912
  103   1HG2  ILE  14          3HG2      ILE  14 -11.675 -18.715   0.781
  104   2HG2  ILE  14          2HG2      ILE  14 -12.047 -18.164  -0.853
  105   3HG2  ILE  14          1HG2      ILE  14 -10.472 -18.876  -0.499
  106   1HD1  ILE  14          3HD1      ILE  14  -8.406 -17.178  -0.502
  107   2HD1  ILE  14          2HD1      ILE  14  -8.779 -17.236  -2.225
  108   3HD1  ILE  14          1HD1      ILE  14  -8.183 -15.742  -1.502
  109    H    PHE  15           H        PHE  15 -10.554 -16.028   3.094
  110    HA   PHE  15           HA       PHE  15 -11.975 -18.133   4.429
  111   1HB   PHE  15          2HB       PHE  15  -9.694 -17.435   5.086
  112   2HB   PHE  15          1HB       PHE  15 -10.327 -15.877   5.626
  113    HD1  PHE  15           HD1      PHE  15 -10.191 -19.501   6.293
  114    HD2  PHE  15           HD2      PHE  15 -11.713 -15.721   7.648
  115    HE1  PHE  15           HE1      PHE  15 -10.788 -20.525   8.469
  116    HE2  PHE  15           HE2      PHE  15 -12.312 -16.745   9.828
  117    HZ   PHE  15           HZ       PHE  15 -11.853 -19.151  10.238
  118    H    LYS  16           H        LYS  16 -12.367 -14.624   4.342
  119    HA   LYS  16           HA       LYS  16 -14.296 -14.459   6.462
  120   1HB   LYS  16          2HB       LYS  16 -13.553 -12.705   4.136
  121   2HB   LYS  16          1HB       LYS  16 -14.992 -12.332   5.084
  122   1HG   LYS  16          2HG       LYS  16 -13.643 -12.279   7.138
  123   2HG   LYS  16          1HG       LYS  16 -12.201 -12.701   6.216
  124   1HD   LYS  16          2HD       LYS  16 -12.536 -10.621   4.853
  125   2HD   LYS  16          1HD       LYS  16 -13.864 -10.182   5.927
  126   1HE   LYS  16          2HE       LYS  16 -11.368 -10.915   7.318
  127   2HE   LYS  16          1HE       LYS  16 -11.248  -9.460   6.327
  128   1HZ   LYS  16          1HZ       LYS  16 -13.680  -9.547   7.817
  129   2HZ   LYS  16          3HZ       LYS  16 -12.325  -9.629   8.834
  130   3HZ   LYS  16          2HZ       LYS  16 -12.496  -8.330   7.751
  131    H    ARG  17           H        ARG  17 -14.546 -15.185   3.024
  132    HA   ARG  17           HA       ARG  17 -17.424 -14.999   2.892
  133   1HB   ARG  17          2HB       ARG  17 -15.362 -16.396   1.177
  134   2HB   ARG  17          1HB       ARG  17 -17.088 -16.453   0.817
  135   1HG   ARG  17          2HG       ARG  17 -17.058 -13.904   0.926
  136   2HG   ARG  17          1HG       ARG  17 -15.299 -14.016   0.937
  137   1HD   ARG  17          2HD       ARG  17 -15.484 -15.412  -1.175
  138   2HD   ARG  17          1HD       ARG  17 -17.191 -14.975  -1.222
  139    HE   ARG  17           HE       ARG  17 -16.432 -12.582  -1.388
  140   1HH1  ARG  17          1HH1      ARG  17 -13.601 -14.177  -0.943
  141   2HH1  ARG  17          2HH1      ARG  17 -12.835 -13.667  -2.412
  142   1HH2  ARG  17          1HH2      ARG  17 -15.733 -12.338  -3.773
  143   2HH2  ARG  17          2HH2      ARG  17 -14.042 -12.626  -4.013
  144    H    PHE  18           H        PHE  18 -15.145 -17.568   3.696
  145    HA   PHE  18           HA       PHE  18 -17.103 -19.689   3.711
  146   1HB   PHE  18          2HB       PHE  18 -14.339 -19.362   4.853
  147   2HB   PHE  18          1HB       PHE  18 -15.312 -20.775   5.261
  148    HD1  PHE  18           HD1      PHE  18 -16.419 -22.034   3.244
  149    HD2  PHE  18           HD2      PHE  18 -13.072 -19.364   2.882
  150    HE1  PHE  18           HE1      PHE  18 -15.826 -23.071   1.070
  151    HE2  PHE  18           HE2      PHE  18 -12.480 -20.403   0.709
  152    HZ   PHE  18           HZ       PHE  18 -13.856 -22.256  -0.197
  153    H    ASP  19           H        ASP  19 -15.687 -17.687   6.305
  154    HA   ASP  19           HA       ASP  19 -17.155 -18.847   8.448
  155   1HB   ASP  19          2HB       ASP  19 -15.227 -17.076   8.485
  156   2HB   ASP  19          1HB       ASP  19 -16.538 -15.897   8.369
  157    H    ALA  20           H        ALA  20 -19.351 -19.141   8.167
  158    HA   ALA  20           HA       ALA  20 -21.048 -17.362   6.713
  159   1HB   ALA  20          3HB       ALA  20 -21.473 -19.806   7.274
  160   2HB   ALA  20          2HB       ALA  20 -21.939 -19.263   8.885
  161   3HB   ALA  20          1HB       ALA  20 -22.852 -18.727   7.475
  162    H    ASN  21           H        ASN  21 -20.750 -17.807  10.285
  163    HA   ASN  21           HA       ASN  21 -22.406 -15.394  10.641
  164   1HB   ASN  21          2HB       ASN  21 -22.344 -15.887  13.008
  165   2HB   ASN  21          1HB       ASN  21 -22.669 -17.383  12.140
  166   1HD2  ASN  21          1HD2      ASN  21 -21.435 -17.026  14.818
  167   2HD2  ASN  21          2HD2      ASN  21 -19.916 -17.773  14.734
  168    H    GLY  22           H        GLY  22 -19.069 -16.258  10.551
  169   1HA   GLY  22          1HA       GLY  22 -18.342 -13.431  10.809
  170   2HA   GLY  22          2HA       GLY  22 -17.240 -14.748  10.417
  171    H    ASP  23           H        ASP  23 -17.674 -16.428  12.629
  172    HA   ASP  23           HA       ASP  23 -17.056 -14.694  14.967
  173   1HB   ASP  23          2HB       ASP  23 -17.401 -16.700  16.345
  174   2HB   ASP  23          1HB       ASP  23 -18.801 -16.400  15.320
  175    H    GLY  24           H        GLY  24 -15.366 -15.926  12.533
  176   1HA   GLY  24          1HA       GLY  24 -12.932 -16.178  14.199
  177   2HA   GLY  24          2HA       GLY  24 -12.964 -15.920  12.456
  178    H    LYS  25           H        LYS  25 -15.144 -18.363  13.409
  179    HA   LYS  25           HA       LYS  25 -13.133 -20.423  12.610
  180   1HB   LYS  25          2HB       LYS  25 -14.020 -21.957  14.224
  181   2HB   LYS  25          1HB       LYS  25 -13.765 -20.438  15.081
  182   1HG   LYS  25          2HG       LYS  25 -16.109 -19.880  14.913
  183   2HG   LYS  25          1HG       LYS  25 -16.412 -21.255  13.852
  184   1HD   LYS  25          2HD       LYS  25 -15.616 -22.753  15.735
  185   2HD   LYS  25          1HD       LYS  25 -15.614 -21.328  16.775
  186   1HE   LYS  25          2HE       LYS  25 -17.742 -22.770  16.804
  187   2HE   LYS  25          1HE       LYS  25 -17.966 -21.038  16.557
  188   1HZ   LYS  25          3HZ       LYS  25 -17.685 -22.914  14.289
  189   2HZ   LYS  25          2HZ       LYS  25 -19.194 -22.591  15.001
  190   3HZ   LYS  25          1HZ       LYS  25 -18.305 -21.336  14.280
  191    H    ILE  26           H        ILE  26 -13.837 -21.947  11.154
  192    HA   ILE  26           HA       ILE  26 -16.627 -21.602  10.131
  193    HB   ILE  26           HB       ILE  26 -14.364 -22.824   8.560
  194   1HG1  ILE  26          2HG1      ILE  26 -15.071 -19.888   8.834
  195   2HG1  ILE  26          1HG1      ILE  26 -13.534 -20.646   9.253
  196   1HG2  ILE  26          3HG2      ILE  26 -16.904 -21.347   7.801
  197   2HG2  ILE  26          2HG2      ILE  26 -15.745 -22.036   6.666
  198   3HG2  ILE  26          1HG2      ILE  26 -16.671 -23.094   7.731
  199   1HD1  ILE  26          3HD1      ILE  26 -14.132 -21.375   6.569
  200   2HD1  ILE  26          2HD1      ILE  26 -14.390 -19.636   6.706
  201   3HD1  ILE  26          1HD1      ILE  26 -12.830 -20.334   7.138
  202    H    SER  27           H        SER  27 -17.924 -23.386  10.142
  203    HA   SER  27           HA       SER  27 -16.711 -25.942  11.087
  204   1HB   SER  27          2HB       SER  27 -18.789 -26.480  12.058
  205   2HB   SER  27          1HB       SER  27 -18.663 -24.742  12.335
  206    HG   SER  27           HG       SER  27 -20.675 -25.208  11.472
  207    H    ALA  28           H        ALA  28 -17.866 -27.938  10.128
  208    HA   ALA  28           HA       ALA  28 -17.536 -28.035   7.349
  209   1HB   ALA  28          3HB       ALA  28 -19.495 -29.913   7.728
  210   2HB   ALA  28          1HB       ALA  28 -18.878 -29.722   9.369
  211   3HB   ALA  28          2HB       ALA  28 -17.786 -30.187   8.064
  212    H    ALA  29           H        ALA  29 -20.537 -27.452   9.175
  213    HA   ALA  29           HA       ALA  29 -22.275 -27.207   6.960
  214   1HB   ALA  29          3HB       ALA  29 -22.498 -26.895   9.710
  215   2HB   ALA  29          1HB       ALA  29 -23.797 -26.657   8.540
  216   3HB   ALA  29          2HB       ALA  29 -22.840 -25.281   9.087
  217    H    GLU  30           H        GLU  30 -20.134 -24.811   8.465
  218    HA   GLU  30           HA       GLU  30 -21.062 -22.658   6.748
  219   1HB   GLU  30          2HB       GLU  30 -18.577 -22.917   8.464
  220   2HB   GLU  30          1HB       GLU  30 -19.071 -21.437   7.644
  221   1HG   GLU  30          2HG       GLU  30 -21.230 -21.506   8.885
  222   2HG   GLU  30          1HG       GLU  30 -20.665 -22.935   9.750
  223    H    LEU  31           H        LEU  31 -18.019 -24.541   6.871
  224    HA   LEU  31           HA       LEU  31 -16.977 -23.471   4.435
  225   1HB   LEU  31          2HB       LEU  31 -15.537 -24.682   5.996
  226   2HB   LEU  31          1HB       LEU  31 -16.480 -26.154   5.765
  227    HG   LEU  31           HG       LEU  31 -15.903 -25.773   3.222
  228   1HD1  LEU  31          2HD1      LEU  31 -14.758 -23.524   4.049
  229   2HD1  LEU  31          1HD1      LEU  31 -13.395 -24.598   4.365
  230   3HD1  LEU  31          3HD1      LEU  31 -14.051 -24.463   2.733
  231   1HD2  LEU  31          2HD2      LEU  31 -14.090 -26.842   5.385
  232   2HD2  LEU  31          1HD2      LEU  31 -15.124 -27.744   4.276
  233   3HD2  LEU  31          3HD2      LEU  31 -13.655 -26.970   3.681
  234    H    GLY  32           H        GLY  32 -18.961 -26.337   5.115
  235   1HA   GLY  32          1HA       GLY  32 -20.232 -27.679   3.668
  236   2HA   GLY  32          2HA       GLY  32 -19.017 -27.336   2.439
  237    H    GLU  33           H        GLU  33 -21.174 -25.098   4.178
  238    HA   GLU  33           HA       GLU  33 -23.075 -24.725   2.123
  239   1HB   GLU  33          2HB       GLU  33 -22.156 -23.166   4.477
  240   2HB   GLU  33          1HB       GLU  33 -23.025 -22.263   3.239
  241   1HG   GLU  33          2HG       GLU  33 -24.816 -24.051   3.331
  242   2HG   GLU  33          1HG       GLU  33 -23.987 -24.711   4.740
  243    H    ALA  34           H        ALA  34 -20.000 -23.016   2.690
  244    HA   ALA  34           HA       ALA  34 -20.334 -21.306   0.371
  245   1HB   ALA  34          1HB       ALA  34 -18.812 -20.387   1.878
  246   2HB   ALA  34          2HB       ALA  34 -17.712 -21.156   0.734
  247   3HB   ALA  34          3HB       ALA  34 -18.094 -21.952   2.261
  248    H    LEU  35           H        LEU  35 -18.700 -24.362   1.052
  249    HA   LEU  35           HA       LEU  35 -17.357 -24.681  -1.422
  250   1HB   LEU  35          2HB       LEU  35 -18.357 -26.522   0.707
  251   2HB   LEU  35          1HB       LEU  35 -17.899 -27.231  -0.840
  252    HG   LEU  35           HG       LEU  35 -16.156 -25.458   0.899
  253   1HD1  LEU  35          2HD1      LEU  35 -16.371 -28.408   0.426
  254   2HD1  LEU  35          1HD1      LEU  35 -14.772 -27.715   0.697
  255   3HD1  LEU  35          3HD1      LEU  35 -16.029 -27.537   1.921
  256   1HD2  LEU  35          3HD2      LEU  35 -15.928 -26.468  -1.905
  257   2HD2  LEU  35          2HD2      LEU  35 -15.354 -24.952  -1.208
  258   3HD2  LEU  35          1HD2      LEU  35 -14.464 -26.448  -0.921
  259    H    LYS  36           H        LYS  36 -20.733 -25.260  -0.525
  260    HA   LYS  36           HA       LYS  36 -21.653 -26.828  -2.614
  261   1HB   LYS  36          2HB       LYS  36 -22.795 -24.796  -0.873
  262   2HB   LYS  36          1HB       LYS  36 -23.548 -24.771  -2.468
  263   1HG   LYS  36          2HG       LYS  36 -24.027 -27.162  -2.319
  264   2HG   LYS  36          1HG       LYS  36 -23.179 -27.262  -0.777
  265   1HD   LYS  36          2HD       LYS  36 -25.035 -25.175  -0.460
  266   2HD   LYS  36          1HD       LYS  36 -25.912 -26.447  -1.309
  267   1HE   LYS  36          2HE       LYS  36 -24.185 -27.338   0.936
  268   2HE   LYS  36          1HE       LYS  36 -25.611 -26.403   1.385
  269   1HZ   LYS  36          1HZ       LYS  36 -26.964 -27.925   0.068
  270   2HZ   LYS  36          3HZ       LYS  36 -25.587 -28.839  -0.315
  271   3HZ   LYS  36          2HZ       LYS  36 -26.125 -28.749   1.294
  272    H    THR  37           H        THR  37 -20.405 -23.574  -2.797
  273    HA   THR  37           HA       THR  37 -21.486 -22.666  -5.221
  274    HB   THR  37           HB       THR  37 -19.855 -21.455  -3.666
  275    HG1  THR  37           HG1      THR  37 -20.383 -20.470  -5.556
  276   1HG2  THR  37          1HG2      THR  37 -18.151 -23.277  -3.671
  277   2HG2  THR  37          3HG2      THR  37 -17.830 -22.930  -5.370
  278   3HG2  THR  37          2HG2      THR  37 -17.478 -21.716  -4.141
  279    H    LEU  38           H        LEU  38 -19.205 -25.227  -4.631
  280    HA   LEU  38           HA       LEU  38 -18.048 -25.413  -7.238
  281   1HB   LEU  38          2HB       LEU  38 -18.620 -27.570  -5.183
  282   2HB   LEU  38          1HB       LEU  38 -17.625 -27.805  -6.621
  283    HG   LEU  38           HG       LEU  38 -17.104 -25.882  -4.335
  284   1HD1  LEU  38          1HD1      LEU  38 -16.505 -28.295  -4.005
  285   2HD1  LEU  38          3HD1      LEU  38 -15.467 -28.190  -5.427
  286   3HD1  LEU  38          2HD1      LEU  38 -15.103 -27.225  -3.997
  287   1HD2  LEU  38          1HD2      LEU  38 -15.703 -26.227  -7.002
  288   2HD2  LEU  38          3HD2      LEU  38 -16.497 -24.772  -6.401
  289   3HD2  LEU  38          2HD2      LEU  38 -15.015 -25.346  -5.638
  290    H    GLY  39           H        GLY  39 -21.117 -26.505  -5.922
  291   1HA   GLY  39          1HA       GLY  39 -22.278 -26.763  -8.547
  292   2HA   GLY  39          2HA       GLY  39 -23.042 -27.263  -7.037
  293    H    SER  40           H        SER  40 -20.199 -28.796  -6.860
  294    HA   SER  40           HA       SER  40 -21.356 -31.322  -7.815
  295   1HB   SER  40          2HB       SER  40 -19.335 -29.832  -9.329
  296   2HB   SER  40          1HB       SER  40 -18.838 -31.482  -8.954
  297    HG   SER  40           HG       SER  40 -20.147 -31.102 -10.929
  298    H    ILE  41           H        ILE  41 -20.922 -30.860  -5.229
  299    HA   ILE  41           HA       ILE  41 -18.515 -32.504  -4.654
  300    HB   ILE  41           HB       ILE  41 -18.121 -29.954  -4.327
  301   1HG1  ILE  41          2HG1      ILE  41 -17.650 -31.619  -1.859
  302   2HG1  ILE  41          1HG1      ILE  41 -16.820 -31.982  -3.372
  303   1HG2  ILE  41          2HG2      ILE  41 -20.444 -30.037  -2.942
  304   2HG2  ILE  41          1HG2      ILE  41 -19.305 -30.304  -1.623
  305   3HG2  ILE  41          3HG2      ILE  41 -19.180 -28.851  -2.617
  306   1HD1  ILE  41          3HD1      ILE  41 -16.830 -29.175  -2.284
  307   2HD1  ILE  41          2HD1      ILE  41 -15.677 -30.360  -1.670
  308   3HD1  ILE  41          1HD1      ILE  41 -15.676 -29.932  -3.381
  309    H    THR  42           H        THR  42 -18.607 -33.185  -2.233
  310    HA   THR  42           HA       THR  42 -21.461 -33.640  -1.456
  311    HB   THR  42           HB       THR  42 -21.142 -35.885  -1.378
  312    HG1  THR  42           HG1      THR  42 -18.518 -35.639  -0.400
  313   1HG2  THR  42          2HG2      THR  42 -19.927 -35.329  -3.495
  314   2HG2  THR  42          1HG2      THR  42 -18.420 -35.309  -2.577
  315   3HG2  THR  42          3HG2      THR  42 -19.341 -36.806  -2.728
  316    HA   PRO  43           HA       PRO  43 -20.356 -32.236   2.596
  317   1HB   PRO  43          2HB       PRO  43 -21.576 -34.008   4.235
  318   2HB   PRO  43          1HB       PRO  43 -22.467 -32.790   3.318
  319   1HG   PRO  43          2HG       PRO  43 -22.047 -35.693   2.708
  320   2HG   PRO  43          1HG       PRO  43 -23.521 -34.729   2.565
  321   1HD   PRO  43          1HD       PRO  43 -21.981 -35.325   0.422
  322   2HD   PRO  43          2HD       PRO  43 -22.877 -33.810   0.541
  323    H    ASP  44           H        ASP  44 -19.915 -35.683   1.955
  324    HA   ASP  44           HA       ASP  44 -18.157 -36.251   4.127
  325   1HB   ASP  44          2HB       ASP  44 -18.437 -37.509   1.389
  326   2HB   ASP  44          1HB       ASP  44 -17.396 -38.162   2.652
  327    H    GLU  45           H        GLU  45 -17.602 -34.642   1.051
  328    HA   GLU  45           HA       GLU  45 -14.694 -34.942   1.221
  329   1HB   GLU  45          2HB       GLU  45 -16.479 -33.216  -0.521
  330   2HB   GLU  45          1HB       GLU  45 -14.724 -33.281  -0.671
  331   1HG   GLU  45          2HG       GLU  45 -14.956 -35.796  -0.956
  332   2HG   GLU  45          1HG       GLU  45 -16.696 -35.541  -1.086
  333    H    VAL  46           H        VAL  46 -17.145 -32.521   1.961
  334    HA   VAL  46           HA       VAL  46 -15.333 -30.402   2.633
  335    HB   VAL  46           HB       VAL  46 -18.165 -31.008   3.513
  336   1HG1  VAL  46          3HG1      VAL  46 -16.273 -29.242   4.721
  337   2HG1  VAL  46          2HG1      VAL  46 -17.454 -28.256   3.860
  338   3HG1  VAL  46          1HG1      VAL  46 -17.991 -29.406   5.085
  339   1HG2  VAL  46          3HG2      VAL  46 -17.056 -30.006   1.135
  340   2HG2  VAL  46          2HG2      VAL  46 -18.753 -29.944   1.614
  341   3HG2  VAL  46          1HG2      VAL  46 -17.684 -28.591   1.980
  342    H    LYS  47           H        LYS  47 -16.704 -33.087   4.457
  343    HA   LYS  47           HA       LYS  47 -15.707 -32.248   7.031
  344   1HB   LYS  47          2HB       LYS  47 -16.492 -34.969   5.952
  345   2HB   LYS  47          1HB       LYS  47 -16.036 -34.686   7.631
  346   1HG   LYS  47          2HG       LYS  47 -17.849 -32.961   7.776
  347   2HG   LYS  47          1HG       LYS  47 -18.349 -33.407   6.143
  348   1HD   LYS  47          2HD       LYS  47 -18.566 -35.799   6.999
  349   2HD   LYS  47          1HD       LYS  47 -18.372 -35.142   8.624
  350   1HE   LYS  47          2HE       LYS  47 -20.292 -33.546   8.043
  351   2HE   LYS  47          1HE       LYS  47 -20.579 -34.574   6.637
  352   1HZ   LYS  47          2HZ       LYS  47 -20.268 -36.197   8.905
  353   2HZ   LYS  47          1HZ       LYS  47 -21.409 -34.991   9.266
  354   3HZ   LYS  47          3HZ       LYS  47 -21.642 -36.002   7.926
  355    H    HIS  48           H        HIS  48 -14.427 -34.269   4.429
  356    HA   HIS  48           HA       HIS  48 -12.063 -35.117   5.830
  357   1HB   HIS  48          2HB       HIS  48 -12.898 -36.217   3.762
  358   2HB   HIS  48          1HB       HIS  48 -12.490 -34.766   2.846
  359    HD1  HIS  48           HD1      HIS  48 -10.785 -36.353   1.506
  360    HD2  HIS  48           HD2      HIS  48  -9.851 -35.696   5.516
  361    HE1  HIS  48           HE1      HIS  48  -8.369 -37.052   1.802
  362    H    MET  49           H        MET  49 -12.778 -32.350   3.701
  363    HA   MET  49           HA       MET  49 -10.129 -31.313   3.579
  364   1HB   MET  49          2HB       MET  49 -12.870 -30.090   3.337
  365   2HB   MET  49          1HB       MET  49 -11.430 -29.077   3.304
  366   1HG   MET  49          2HG       MET  49 -10.561 -30.738   1.509
  367   2HG   MET  49          1HG       MET  49 -12.243 -31.251   1.380
  368   1HE   MET  49          2HE       MET  49 -13.171 -30.808  -0.383
  369   2HE   MET  49          1HE       MET  49 -13.485 -29.284  -1.210
  370   3HE   MET  49          3HE       MET  49 -11.972 -30.154  -1.496
  371    H    MET  50           H        MET  50 -12.795 -30.680   5.842
  372    HA   MET  50           HA       MET  50 -11.407 -28.791   7.465
  373   1HB   MET  50          2HB       MET  50 -13.745 -30.627   7.879
  374   2HB   MET  50          1HB       MET  50 -13.059 -29.780   9.262
  375   1HG   MET  50          2HG       MET  50 -13.238 -27.651   7.815
  376   2HG   MET  50          1HG       MET  50 -14.294 -28.603   6.772
  377   1HE   MET  50          3HE       MET  50 -13.465 -26.984   9.862
  378   2HE   MET  50          2HE       MET  50 -14.936 -26.782  10.810
  379   3HE   MET  50          1HE       MET  50 -14.015 -28.279  10.934
  380    H    ALA  51           H        ALA  51 -11.794 -32.311   7.795
  381    HA   ALA  51           HA       ALA  51 -10.244 -32.637  10.148
  382   1HB   ALA  51          3HB       ALA  51 -11.352 -34.592   9.555
  383   2HB   ALA  51          1HB       ALA  51  -9.730 -34.960   8.971
  384   3HB   ALA  51          2HB       ALA  51 -10.969 -34.412   7.843
  385    H    GLU  52           H        GLU  52  -9.309 -31.849   6.921
  386    HA   GLU  52           HA       GLU  52  -6.473 -32.562   7.451
  387   1HB   GLU  52          2HB       GLU  52  -8.026 -31.760   5.000
  388   2HB   GLU  52          1HB       GLU  52  -6.268 -31.611   5.021
  389   1HG   GLU  52          2HG       GLU  52  -6.229 -34.048   5.824
  390   2HG   GLU  52          1HG       GLU  52  -7.931 -34.112   5.365
  391    H    ILE  53           H        ILE  53  -8.583 -29.792   6.917
  392    HA   ILE  53           HA       ILE  53  -6.380 -27.868   7.045
  393    HB   ILE  53           HB       ILE  53  -9.386 -27.501   7.136
  394   1HG1  ILE  53          2HG1      ILE  53  -7.409 -27.151   4.868
  395   2HG1  ILE  53          1HG1      ILE  53  -8.492 -28.529   5.050
  396   1HG2  ILE  53          1HG2      ILE  53  -7.805 -25.680   8.096
  397   2HG2  ILE  53          3HG2      ILE  53  -7.339 -25.413   6.416
  398   3HG2  ILE  53          2HG2      ILE  53  -9.018 -25.190   6.913
  399   1HD1  ILE  53          1HD1      ILE  53  -9.606 -25.738   5.076
  400   2HD1  ILE  53          3HD1      ILE  53  -9.236 -26.524   3.540
  401   3HD1  ILE  53          2HD1      ILE  53 -10.405 -27.249   4.645
  402    H    ASP  54           H        ASP  54  -8.757 -29.250   9.230
  403    HA   ASP  54           HA       ASP  54  -8.580 -27.374  11.352
  404   1HB   ASP  54          2HB       ASP  54 -10.126 -29.473  10.930
  405   2HB   ASP  54          1HB       ASP  54  -8.886 -30.315  11.848
  406    H    THR  55           H        THR  55  -6.505 -26.758  11.942
  407    HA   THR  55           HA       THR  55  -4.305 -28.628  12.130
  408    HB   THR  55           HB       THR  55  -3.073 -26.735  13.110
  409    HG1  THR  55           HG1      THR  55  -4.196 -24.808  13.476
  410   1HG2  THR  55          1HG2      THR  55  -4.851 -26.134  10.739
  411   2HG2  THR  55          3HG2      THR  55  -3.526 -25.079  11.234
  412   3HG2  THR  55          2HG2      THR  55  -3.193 -26.733  10.718
  413    H    ASP  56           H        ASP  56  -6.268 -26.953  14.603
  414    HA   ASP  56           HA       ASP  56  -4.946 -28.518  16.712
  415   1HB   ASP  56          2HB       ASP  56  -6.244 -27.229  18.277
  416   2HB   ASP  56          1HB       ASP  56  -5.657 -26.122  17.038
  417    H    GLY  57           H        GLY  57  -7.940 -28.623  14.892
  418   1HA   GLY  57          1HA       GLY  57  -8.472 -31.271  16.084
  419   2HA   GLY  57          2HA       GLY  57  -9.255 -30.611  14.653
  420    H    ASP  58           H        ASP  58  -9.846 -28.028  16.114
  421    HA   ASP  58           HA       ASP  58 -11.637 -28.876  18.285
  422   1HB   ASP  58          2HB       ASP  58 -12.085 -26.550  18.624
  423   2HB   ASP  58          1HB       ASP  58 -10.367 -26.667  18.252
  424    H    GLY  59           H        GLY  59 -11.842 -28.908  14.958
  425   1HA   GLY  59          1HA       GLY  59 -14.809 -28.995  15.124
  426   2HA   GLY  59          2HA       GLY  59 -13.837 -29.745  13.861
  427    H    PHE  60           H        PHE  60 -12.675 -26.643  14.514
  428    HA   PHE  60           HA       PHE  60 -14.187 -25.600  12.157
  429   1HB   PHE  60          2HB       PHE  60 -13.382 -23.918  14.538
  430   2HB   PHE  60          1HB       PHE  60 -14.401 -23.441  13.181
  431    HD1  PHE  60           HD1      PHE  60 -16.603 -24.697  12.824
  432    HD2  PHE  60           HD2      PHE  60 -14.317 -24.930  16.449
  433    HE1  PHE  60           HE1      PHE  60 -18.604 -25.516  14.033
  434    HE2  PHE  60           HE2      PHE  60 -16.318 -25.746  17.659
  435    HZ   PHE  60           HZ       PHE  60 -18.465 -26.042  16.453
  436    H    ILE  61           H        ILE  61 -13.060 -24.050  10.863
  437    HA   ILE  61           HA       ILE  61 -10.109 -24.207  11.156
  438    HB   ILE  61           HB       ILE  61 -11.725 -23.362   8.737
  439   1HG1  ILE  61          2HG1      ILE  61 -12.267 -25.680   9.263
  440   2HG1  ILE  61          1HG1      ILE  61 -11.183 -25.648   7.873
  441   1HG2  ILE  61          1HG2      ILE  61  -9.276 -22.662   9.009
  442   2HG2  ILE  61          3HG2      ILE  61  -8.879 -24.375   8.886
  443   3HG2  ILE  61          2HG2      ILE  61  -9.670 -23.554   7.540
  444   1HD1  ILE  61          1HD1      ILE  61  -9.259 -26.047   9.420
  445   2HD1  ILE  61          3HD1      ILE  61 -10.403 -26.194  10.755
  446   3HD1  ILE  61          2HD1      ILE  61 -10.431 -27.368   9.436
  447    H    SER  62           H        SER  62  -9.049 -22.327  11.687
  448    HA   SER  62           HA       SER  62 -10.665 -19.847  11.856
  449   1HB   SER  62          2HB       SER  62  -8.211 -19.245  12.945
  450   2HB   SER  62          1HB       SER  62  -9.595 -19.836  13.865
  451    HG   SER  62           HG       SER  62  -7.264 -21.106  13.160
  452    H    PHE  63           H        PHE  63  -9.483 -17.803  11.189
  453    HA   PHE  63           HA       PHE  63  -8.726 -17.908   8.475
  454   1HB   PHE  63          2HB       PHE  63  -9.354 -15.800   9.611
  455   2HB   PHE  63          1HB       PHE  63  -7.851 -15.858  10.537
  456    HD1  PHE  63           HD1      PHE  63  -8.778 -16.465   6.956
  457    HD2  PHE  63           HD2      PHE  63  -6.256 -14.362   9.722
  458    HE1  PHE  63           HE1      PHE  63  -7.572 -15.423   5.063
  459    HE2  PHE  63           HE2      PHE  63  -5.045 -13.321   7.826
  460    HZ   PHE  63           HZ       PHE  63  -5.709 -13.849   5.493
  461    H    GLN  64           H        GLN  64  -6.728 -17.953  11.398
  462    HA   GLN  64           HA       GLN  64  -4.186 -17.951  10.124
  463   1HB   GLN  64          2HB       GLN  64  -4.640 -17.671  12.591
  464   2HB   GLN  64          1HB       GLN  64  -4.940 -19.407  12.674
  465   1HG   GLN  64          2HG       GLN  64  -2.636 -19.065  13.291
  466   2HG   GLN  64          1HG       GLN  64  -2.636 -19.748  11.665
  467   1HE2  GLN  64          1HE2      GLN  64  -1.107 -18.693  10.396
  468   2HE2  GLN  64          2HE2      GLN  64  -0.772 -17.030  10.448
  469    H    GLU  65           H        GLU  65  -6.251 -20.687  11.167
  470    HA   GLU  65           HA       GLU  65  -4.546 -22.765  10.237
  471   1HB   GLU  65          2HB       GLU  65  -7.504 -22.536  10.725
  472   2HB   GLU  65          1HB       GLU  65  -6.843 -23.994   9.994
  473   1HG   GLU  65          2HG       GLU  65  -5.320 -24.279  11.909
  474   2HG   GLU  65          1HG       GLU  65  -5.955 -22.803  12.638
  475    H    PHE  66           H        PHE  66  -7.248 -21.089   8.640
  476    HA   PHE  66           HA       PHE  66  -7.070 -22.494   6.160
  477   1HB   PHE  66          2HB       PHE  66  -9.000 -21.071   6.832
  478   2HB   PHE  66          1HB       PHE  66  -7.985 -19.643   6.639
  479    HD1  PHE  66           HD1      PHE  66  -7.164 -18.969   4.410
  480    HD2  PHE  66           HD2      PHE  66  -9.836 -22.293   4.916
  481    HE1  PHE  66           HE1      PHE  66  -7.671 -18.932   1.981
  482    HE2  PHE  66           HE2      PHE  66 -10.343 -22.256   2.489
  483    HZ   PHE  66           HZ       PHE  66  -9.261 -20.576   1.022
  484    H    THR  67           H        THR  67  -5.401 -19.649   7.410
  485    HA   THR  67           HA       THR  67  -4.142 -18.901   4.932
  486    HB   THR  67           HB       THR  67  -3.436 -18.394   7.833
  487    HG1  THR  67           HG1      THR  67  -4.627 -16.701   7.529
  488   1HG2  THR  67          2HG2      THR  67  -2.089 -17.328   5.335
  489   2HG2  THR  67          1HG2      THR  67  -1.789 -16.752   6.974
  490   3HG2  THR  67          3HG2      THR  67  -1.360 -18.403   6.528
  491    H    ASP  68           H        ASP  68  -3.008 -20.843   7.714
  492    HA   ASP  68           HA       ASP  68  -0.459 -21.494   6.628
  493   1HB   ASP  68          2HB       ASP  68  -2.197 -23.179   8.456
  494   2HB   ASP  68          1HB       ASP  68  -0.458 -23.359   8.225
  495    H    PHE  69           H        PHE  69  -3.634 -23.017   6.241
  496    HA   PHE  69           HA       PHE  69  -2.587 -25.216   4.650
  497   1HB   PHE  69          2HB       PHE  69  -4.563 -25.900   5.602
  498   2HB   PHE  69          1HB       PHE  69  -5.236 -24.273   5.618
  499    HD1  PHE  69           HD1      PHE  69  -5.938 -23.254   3.373
  500    HD2  PHE  69           HD2      PHE  69  -5.216 -27.443   3.950
  501    HE1  PHE  69           HE1      PHE  69  -7.250 -23.762   1.325
  502    HE2  PHE  69           HE2      PHE  69  -6.521 -27.955   1.908
  503    HZ   PHE  69           HZ       PHE  69  -7.543 -26.115   0.593
  504    H    GLY  70           H        GLY  70  -4.123 -22.090   4.030
  505   1HA   GLY  70          1HA       GLY  70  -4.232 -20.818   2.060
  506   2HA   GLY  70          2HA       GLY  70  -4.492 -22.351   1.226
  507    H    ARG  71           H        ARG  71  -1.619 -21.797   3.140
  508    HA   ARG  71           HA       ARG  71   0.048 -20.900   0.943
  509   1HB   ARG  71          2HB       ARG  71   0.727 -22.107   3.641
  510   2HB   ARG  71          1HB       ARG  71   1.930 -21.483   2.513
  511   1HG   ARG  71          2HG       ARG  71   0.738 -19.277   2.552
  512   2HG   ARG  71          1HG       ARG  71  -0.330 -19.920   3.800
  513   1HD   ARG  71          2HD       ARG  71   2.684 -19.622   3.988
  514   2HD   ARG  71          1HD       ARG  71   1.482 -18.667   4.857
  515    HE   ARG  71           HE       ARG  71   1.239 -21.533   5.350
  516   1HH1  ARG  71          1HH1      ARG  71   1.289 -18.633   6.871
  517   2HH1  ARG  71          2HH1      ARG  71   2.318 -19.096   8.186
  518   1HH2  ARG  71          1HH2      ARG  71   3.220 -22.125   6.761
  519   2HH2  ARG  71          2HH2      ARG  71   3.410 -21.074   8.124
  520    H    ALA  72           H        ALA  72  -0.857 -24.011   2.299
  521    HA   ALA  72           HA       ALA  72   1.142 -25.576   0.936
  522   1HB   ALA  72          1HB       ALA  72   0.228 -27.144   2.266
  523   2HB   ALA  72          2HB       ALA  72  -1.231 -27.113   1.276
  524   3HB   ALA  72          3HB       ALA  72  -1.091 -26.047   2.675
  525    H    ASN  73           H        ASN  73  -1.785 -24.048  -0.078
  526    HA   ASN  73           HA       ASN  73  -1.354 -25.075  -2.814
  527   1HB   ASN  73          2HB       ASN  73  -4.151 -25.187  -1.717
  528   2HB   ASN  73          1HB       ASN  73  -3.462 -26.049  -3.093
  529   1HD2  ASN  73          1HD2      ASN  73  -4.289 -26.370   0.200
  530   2HD2  ASN  73          2HD2      ASN  73  -3.417 -27.788   0.528
  531    H    ARG  74           H        ARG  74  -0.754 -22.573  -2.216
  532    HA   ARG  74           HA       ARG  74  -2.715 -20.585  -2.042
  533   1HB   ARG  74          2HB       ARG  74  -0.118 -20.617  -3.601
  534   2HB   ARG  74          1HB       ARG  74  -1.107 -19.170  -3.410
  535   1HG   ARG  74          2HG       ARG  74  -0.936 -19.396  -0.946
  536   2HG   ARG  74          1HG       ARG  74   0.087 -20.816  -1.158
  537   1HD   ARG  74          2HD       ARG  74   1.676 -19.377  -2.483
  538   2HD   ARG  74          1HD       ARG  74   0.697 -17.980  -2.038
  539    HE   ARG  74           HE       ARG  74   1.218 -18.778   0.400
  540   1HH1  ARG  74          1HH1      ARG  74   3.292 -17.521  -1.775
  541   2HH1  ARG  74          2HH1      ARG  74   4.742 -18.217  -1.132
  542   1HH2  ARG  74          1HH2      ARG  74   3.072 -20.388   0.995
  543   2HH2  ARG  74          2HH2      ARG  74   4.617 -19.841   0.436
  544    H    GLY  75           H        GLY  75  -1.633 -22.408  -4.860
  545   1HA   GLY  75          1HA       GLY  75  -2.623 -22.702  -6.949
  546   2HA   GLY  75          2HA       GLY  75  -3.052 -20.994  -6.865
  547    H    LEU  76           H        LEU  76  -4.185 -23.004  -4.310
  548    HA   LEU  76           HA       LEU  76  -6.723 -23.700  -5.587
  549   1HB   LEU  76          2HB       LEU  76  -5.693 -23.913  -2.750
  550   2HB   LEU  76          1HB       LEU  76  -7.334 -24.373  -3.198
  551    HG   LEU  76           HG       LEU  76  -4.786 -25.521  -4.377
  552   1HD1  LEU  76          1HD1      LEU  76  -6.038 -26.108  -1.962
  553   2HD1  LEU  76          3HD1      LEU  76  -6.679 -27.325  -3.066
  554   3HD1  LEU  76          2HD1      LEU  76  -4.937 -27.173  -2.837
  555   1HD2  LEU  76          3HD2      LEU  76  -7.509 -25.434  -5.338
  556   2HD2  LEU  76          2HD2      LEU  76  -6.091 -26.151  -6.103
  557   3HD2  LEU  76          1HD2      LEU  76  -7.057 -27.100  -4.973
  558    H    LEU  77           H        LEU  77  -5.633 -21.375  -3.138
  559    HA   LEU  77           HA       LEU  77  -8.255 -20.234  -2.727
  560   1HB   LEU  77          2HB       LEU  77  -5.683 -18.736  -2.261
  561   2HB   LEU  77          1HB       LEU  77  -7.184 -18.665  -1.337
  562    HG   LEU  77           HG       LEU  77  -5.142 -20.898  -1.399
  563   1HD1  LEU  77          2HD1      LEU  77  -5.992 -18.788   0.477
  564   2HD1  LEU  77          1HD1      LEU  77  -5.852 -20.388   1.204
  565   3HD1  LEU  77          3HD1      LEU  77  -4.464 -19.666   0.389
  566   1HD2  LEU  77          2HD2      LEU  77  -7.962 -20.913  -0.282
  567   2HD2  LEU  77          1HD2      LEU  77  -7.343 -21.935  -1.579
  568   3HD2  LEU  77          3HD2      LEU  77  -6.744 -22.139   0.067
  569    H    LYS  78           H        LYS  78  -5.939 -19.921  -5.237
  570    HA   LYS  78           HA       LYS  78  -6.737 -17.222  -6.036
  571   1HB   LYS  78          2HB       LYS  78  -5.169 -19.369  -7.498
  572   2HB   LYS  78          1HB       LYS  78  -5.384 -17.713  -8.069
  573   1HG   LYS  78          2HG       LYS  78  -4.334 -16.898  -5.950
  574   2HG   LYS  78          1HG       LYS  78  -4.024 -18.573  -5.497
  575   1HD   LYS  78          2HD       LYS  78  -2.084 -17.365  -6.626
  576   2HD   LYS  78          1HD       LYS  78  -2.553 -18.898  -7.360
  577   1HE   LYS  78          2HE       LYS  78  -3.804 -17.757  -9.091
  578   2HE   LYS  78          1HE       LYS  78  -3.568 -16.200  -8.297
  579   1HZ   LYS  78          1HZ       LYS  78  -1.046 -17.148  -8.573
  580   2HZ   LYS  78          3HZ       LYS  78  -1.790 -17.669 -10.006
  581   3HZ   LYS  78          2HZ       LYS  78  -1.791 -16.019  -9.602
  582